*HEADER    RNA                                     22-MAR-07   2P89              
*TITLE     SOLUTION STRUCTURE OF THE 3' PSEUDOURIDYATION POCKET OF U65           
*TITLE    2 SNORNA WITH BOUND SUBSTRATE                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: U65 H/ACA SNORNA;                                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: 3' PSEUDOURIDYLATION POCKET;                               
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES;                                                       
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: 28S RRNA;                                                  
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 FRAGMENT: FRAGMENT 4423-4436;                                        
*COMPND  11 ENGINEERED: YES;                                                     
*COMPND  12 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS;             
*SOURCE   4 MOL_ID: 2;                                                           
*SOURCE   5 SYNTHETIC: YES;                                                      
*SOURCE   6 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HUMANS              
*KEYWDS    RNA-RNA COMPLEX, THREE-WAY JUNCTIONS, DOUBLE HELIX                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.WU, J.FEIGON                                                        
*REVDAT   1   03-APR-07 2P89    0                                                
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! NOE restraints
assign (resid  10 and name H1')  (resid  11 and name H1')  5.5 3.7 0.0
assign (resid  10 and name H2)   (resid  10 and name H1')  5.5 3.7 0.0
assign (resid  10 and name H2)   (resid  11 and name H1')  4.5 2.7 0.0
assign (resid  10 and name H2')  (resid  11 and name H1')  5.5 3.7 0.0
assign (resid  10 and name H2)   (resid  44 and name H3)   3.5 1.7 0.0
assign (resid  10 and name H2)   (resid  45 and name H1')  5.5 3.7 0.0
assign (resid  10 and name H2)   (resid  45 and name H6)   6.5 4.7 0.0
assign (resid  10 and name H2)   (resid   9 and name H1)   5.5 3.7 0.0
assign (resid  10 and name H8)   (resid  10 and name H1')  4.5 2.7 0.0
assign (resid  10 and name H8)   (resid  10 and name H2')  4.5 2.7 0.0
assign (resid  10 and name H8)   (resid  10 and name H3')  3.5 1.7 0.0
assign (resid  10 and name H8)   (resid  10 and name H5'') 4.5 2.7 0.0
assign (resid  10 and name H8)   (resid  10 and name H5')  5.5 3.7 0.0
assign (resid  10 and name H8)   (resid  11 and name H8)   5.5 3.7 0.0
assign (resid  10 and name H8)   (resid   9 and name H1')  4.5 2.7 0.0
assign (resid  10 and name H8)   (resid   9 and name H2')  2.5 0.7 0.0
assign (resid  10 and name H8)   (resid   9 and name H3')  3.5 1.7 0.0
assign (resid  11 and name H2)   (resid  10 and name H2)   5.5 3.7 0.0
assign (resid  11 and name H2)   (resid  11 and name H1')  5.5 3.7 0.0
assign (resid  11 and name H2)   (resid  12 and name H1')  5.5 3.7 0.0
assign (resid  11 and name H2)   (resid  12 and name H2)   5.5 3.7 0.0
assign (resid  11 and name H2)   (resid  12 and name H8)   5.5 3.7 0.0
assign (resid  11 and name H2)   (resid  43 and name H3)   3.5 1.7 0.0
assign (resid  11 and name H2)   (resid  44 and name H1')  4.5 2.7 0.0
assign (resid  11 and name H8)   (resid  10 and name H1')  5.5 3.7 0.0
assign (resid  11 and name H8)   (resid  10 and name H2')  3.5 1.7 0.0
assign (resid  11 and name H8)   (resid  10 and name H3')  3.5 1.7 0.0
assign (resid  11 and name H8)   (resid  11 and name H1')  5.5 3.7 0.0
assign (resid  11 and name H8)   (resid  11 and name H2')  5.5 3.7 0.0
assign (resid  11 and name H8)   (resid  11 and name H3')  4.5 2.7 0.0
assign (resid  12 and name H1')  (resid  13 and name H1')  6.5 4.7 0.0
assign (resid  12 and name H1')  (resid  13 and name H5'*) 4.5 2.7 1.0
assign (resid  12 and name H2)   (resid  13 and name H1')  4.5 2.7 0.0
assign (resid  12 and name H2)   (resid  13 and name H2')  6.5 4.7 0.0
assign (resid  12 and name H2)   (resid  23 and name H2')  6.5 4.7 0.0
assign (resid  12 and name H2)   (resid  43 and name H5)   6.5 4.7 0.0
assign (resid  12 and name H8)   (resid  11 and name H1')  4.5 2.7 0.0
assign (resid  12 and name H8)   (resid  11 and name H2')  3.5 1.7 0.0
assign (resid  12 and name H8)   (resid  11 and name H3')  4.5 2.7 0.0
assign (resid  12 and name H8)   (resid  11 and name H8)   5.5 3.7 0.0
assign (resid  12 and name H8)   (resid  12 and name H1')  5.5 3.7 0.0
assign (resid  12 and name H8)   (resid  12 and name H2')  4.5 2.7 0.0
assign (resid  12 and name H8)   (resid  12 and name H3')  5.5 3.7 0.0
assign (resid  12 and name H8)   (resid  12 and name H5'*) 5.5 3.7 0.0
assign (resid  12 and name H8)   (resid  13 and name H5)   5.5 3.7 0.0
assign (resid  12 and name H8)   (resid  13 and name H6)   5.5 3.7 0.0
assign (resid  13 and name H1')  (resid  12 and name H2')  4.5 2.7 0.0
assign (resid  13 and name H1')  (resid  14 and name H5'*) 5.5 3.7 0.0
assign (resid  13 and name H41)  (resid  12 and name H2)   5.0 3.2 0.0
assign (resid  13 and name H5)   (resid  12 and name H1')  6.5 4.7 0.0
assign (resid  13 and name H5)   (resid  12 and name H2')  3.5 1.7 0.0
assign (resid  13 and name H5)   (resid  12 and name H3')  3.5 1.7 0.0
assign (resid  13 and name H5)   (resid  13 and name H3')  5.5 3.7 0.0
assign (resid  13 and name H5)   (resid  13 and name H4')  6.5 4.7 0.0
assign (resid  13 and name H5)   (resid  14 and name H8)   6.5 4.7 0.0
assign (resid  13 and name H6)   (resid  12 and name H1')  4.5 2.7 0.0
assign (resid  13 and name H6)   (resid  12 and name H2')  2.5 0.7 0.0
assign (resid  13 and name H6)   (resid  12 and name H3')  3.5 1.7 0.0
assign (resid  13 and name H6)   (resid  12 and name H4')  5.5 3.7 0.0
assign (resid  13 and name H6)   (resid  13 and name H1')  5.5 3.7 0.0
assign (resid  13 and name H6)   (resid  13 and name H3')  3.5 1.7 0.0
assign (resid  13 and name H6)   (resid  14 and name H8)   5.5 3.7 0.0
assign (resid  14 and name H1')  (resid  13 and name H1')  6.5 4.7 0.0
assign (resid  14 and name H1')  (resid  13 and name H2')  4.5 2.7 0.0
assign (resid  14 and name H1')  (resid  15 and name H1')  6.5 4.7 0.0
assign (resid  14 and name H1')  (resid  15 and name H5'') 6.5 4.7 0.0
assign (resid  14 and name H2)   (resid  14 and name H1')  5.5 3.7 0.0
assign (resid  14 and name H2')  (resid  15 and name H1')  4.5 2.7 0.0
assign (resid  14 and name H2)   (resid  15 and name H1')  4.5 2.7 0.0
assign (resid  14 and name H2)   (resid  15 and name H2')  6.5 4.7 0.0
assign (resid  14 and name H2')  (resid  15 and name H3')  3.5 1.7 1.0
assign (resid  14 and name H2')  (resid  15 and name H4')  5.5 3.7 0.0
assign (resid  14 and name H2')  (resid  15 and name H5'*) 4.5 2.7 0.0
assign (resid  14 and name H2)   (resid  22 and name H1')  4.5 2.7 0.0
assign (resid  14 and name H2)   (resid  22 and name H8)   6.5 4.7 0.0
assign (resid  14 and name H8)   (resid  13 and name H1')  4.5 2.7 0.0
assign (resid  14 and name H8)   (resid  13 and name H2')  2.5 0.7 0.0
assign (resid  14 and name H8)   (resid  13 and name H3')  3.5 1.7 0.0
assign (resid  14 and name H8)   (resid  14 and name H1')  4.5 2.7 0.0
assign (resid  14 and name H8)   (resid  14 and name H2')  4.5 2.7 0.0
assign (resid  14 and name H8)   (resid  14 and name H3')  5.5 3.7 0.0
assign (resid  14 and name H8)   (resid  14 and name H4')  4.5 2.7 0.0
assign (resid  14 and name H8)   (resid  14 and name H5')  5.5 3.7 0.0
assign (resid  14 and name H8)   (resid  15 and name H8)   5.5 3.7 0.0
assign (resid  15 and name H1)   (resid  15 and name H2')  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  16 and name H1')  5.0 3.2 0.0
assign (resid  15 and name H1)   (resid  16 and name H2')  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  16 and name H3)   5.5 3.7 0.0
assign (resid  15 and name H1)   (resid  16 and name H5)   5.5 3.7 0.0
assign (resid  15 and name H1')  (resid  16 and name H5'*) 6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  19 and name H1)   5.5 3.7 0.0
assign (resid  15 and name H1)   (resid  19 and name H21)  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H1')  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H2')  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H3')  6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H41)  3.5 1.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H41)  3.5 1.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H42)  5.0 3.2 0.0
assign (resid  15 and name H1)   (resid  20 and name H5)   6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  20 and name H6)   6.5 4.7 0.0
assign (resid  15 and name H1)   (resid  21 and name H3)   5.0 3.2 0.0
assign (resid  15 and name H1)   (resid  21 and name H6)   6.5 4.7 0.0
assign (resid  15 and name H2')  (resid  16 and name H2')  4.5 2.7 1.0
assign (resid  15 and name H2')  (resid  16 and name H4')  3.5 1.7 0.0
assign (resid  15 and name H2')  (resid  16 and name H5'*) 3.5 1.7 0.0
assign (resid  15 and name H8)   (resid  14 and name H1')  4.5 2.7 0.0
assign (resid  15 and name H8)   (resid  14 and name H2')  2.5 0.7 0.0
assign (resid  15 and name H8)   (resid  14 and name H3')  4.5 2.7 0.0
assign (resid  15 and name H8)   (resid  14 and name H5')  6.5 4.7 0.0
assign (resid  15 and name H8)   (resid  15 and name H1')  4.5 2.7 0.0
assign (resid  15 and name H8)   (resid  15 and name H2')  4.5 2.7 0.0
assign (resid  15 and name H8)   (resid  15 and name H3')  3.5 1.7 0.0
assign (resid  15 and name H8)   (resid  15 and name H4')  5.5 3.7 0.0
assign (resid  15 and name H8)   (resid  15 and name H5'') 3.5 1.7 0.0
assign (resid  15 and name H8)   (resid  16 and name H5)   4.5 2.7 0.0
assign (resid  16 and name H1')  (resid  15 and name H2')  3.5 1.7 0.0
assign (resid  16 and name H2')  (resid  17 and name H2')  5.5 3.7 0.0
assign (resid  16 and name H3)   (resid  15 and name H1)   5.0 3.2 0.0
assign (resid  16 and name H3)   (resid  16 and name H1')  6.5 4.7 0.0
assign (resid  16 and name H3)   (resid  18 and name H1')  6.5 4.7 0.0
assign (resid  16 and name H3)   (resid  19 and name H1)   5.0 3.2 0.0
assign (resid  16 and name H3)   (resid  19 and name H21)  5.5 3.7 0.0
assign (resid  16 and name H3)   (resid  19 and name H21)  6.5 4.7 0.0
assign (resid  16 and name H3)   (resid  20 and name H41)  6.5 4.7 0.0
assign (resid  16 and name H3)   (resid  20 and name H42)  6.5 4.7 0.0
assign (resid  16 and name H5)   (resid  15 and name H2')  3.5 1.7 1.0
assign (resid  16 and name H5)   (resid  15 and name H3')  3.5 1.7 0.0
assign (resid  16 and name H5)   (resid  16 and name H3')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  15 and name H1')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  15 and name H2')  2.5 0.7 0.0
assign (resid  16 and name H6)   (resid  15 and name H3')  3.5 1.7 0.0
assign (resid  16 and name H6)   (resid  15 and name H8)   5.5 3.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H1')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H2')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H3')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H4')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H5'') 4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  16 and name H5')  4.5 2.7 0.0
assign (resid  16 and name H6)   (resid  18 and name H42)  5.0 3.2 0.0
assign (resid  17 and name H1')  (resid  16 and name H2')  6.5 4.7 0.0
assign (resid  17 and name H2')  (resid  18 and name H5'') 6.5 4.7 0.0
assign (resid  17 and name H3')  (resid  18 and name H2')  4.5 2.7 0.0
assign (resid  17 and name H3')  (resid  18 and name H4')  6.5 4.7 0.0
assign (resid  17 and name H3')  (resid  18 and name H5'') 4.5 2.7 0.0
assign (resid  17 and name H3')  (resid  18 and name H5')  5.5 3.7 0.0
assign (resid  17 and name H4')  (resid  18 and name H5'') 6.5 4.7 0.0
assign (resid  17 and name H5)   (resid  16 and name H3')  5.5 3.7 0.0
assign (resid  17 and name H5)   (resid  16 and name H4')  3.5 1.7 0.0
assign (resid  17 and name H5)   (resid  16 and name H5'') 5.5 3.7 0.0
assign (resid  17 and name H5)   (resid  17 and name H2')  4.5 2.7 0.0
assign (resid  17 and name H5)   (resid  17 and name H5'') 4.5 2.7 1.0
assign (resid  17 and name H6)   (resid  16 and name H1')  5.5 3.7 0.0
assign (resid  17 and name H6)   (resid  16 and name H2')  5.5 3.7 0.0
assign (resid  17 and name H6)   (resid  16 and name H3')  4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  16 and name H4')  4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  17 and name H1')  4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  17 and name H2')  3.5 1.7 0.0
assign (resid  17 and name H6)   (resid  17 and name H3')  4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  17 and name H5'') 4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  17 and name H5')  4.5 2.7 0.0
assign (resid  17 and name H6)   (resid  18 and name H5)   6.5 4.7 0.0
assign (resid  17 and name H6)   (resid  18 and name H6)   6.5 4.7 0.0
assign (resid  18 and name H1')  (resid  19 and name H3')  6.5 4.7 0.0
assign (resid  18 and name H1')  (resid  19 and name H5'*) 4.5 2.7 0.0
assign (resid  18 and name H3')  (resid  19 and name H5'*) 3.5 1.7 1.0
assign (resid  18 and name H42)  (resid  16 and name H1')  6.5 4.7 0.0
assign (resid  18 and name H42)  (resid  16 and name H2')  6.5 4.7 0.0
assign (resid  18 and name H42)  (resid  16 and name H3')  6.5 4.7 0.0
assign (resid  18 and name H42)  (resid  17 and name H2')  6.5 4.7 0.0
assign (resid  18 and name H4')  (resid  19 and name H1')  6.5 4.7 0.0
assign (resid  18 and name H4')  (resid  19 and name H2')  5.5 3.7 0.0
assign (resid  18 and name H4')  (resid  19 and name H3')  3.5 1.7 0.0
assign (resid  18 and name H4')  (resid  19 and name H4')  4.5 2.7 0.0
assign (resid  18 and name H4')  (resid  19 and name H5'*) 3.5 1.7 0.0
assign (resid  18 and name H5)   (resid  16 and name H1')  6.5 4.7 0.0
assign (resid  18 and name H5)   (resid  16 and name H2')  3.5 1.7 0.0
assign (resid  18 and name H5)   (resid  16 and name H3')  5.5 3.7 0.0
assign (resid  18 and name H5)   (resid  16 and name H6)   6.5 4.7 0.0
assign (resid  18 and name H5)   (resid  17 and name H2')  3.5 1.7 0.0
assign (resid  18 and name H5)   (resid  17 and name H3')  3.5 1.7 0.0
assign (resid  18 and name H5)   (resid  17 and name H4')  5.5 3.7 0.0
assign (resid  18 and name H5)   (resid  17 and name H5')  3.5 1.7 0.0
assign (resid  18 and name H6)   (resid  16 and name H2')  4.5 2.7 0.0
assign (resid  18 and name H6)   (resid  17 and name H1')  5.5 3.7 1.0
assign (resid  18 and name H6)   (resid  17 and name H3')  2.5 0.7 0.0
assign (resid  18 and name H6)   (resid  17 and name H4')  5.5 3.7 0.0
assign (resid  18 and name H6)   (resid  17 and name H5')  4.5 2.7 0.0
assign (resid  18 and name H6)   (resid  17 and name H5'') 5.5 3.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H1')  4.5 2.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H2')  3.5 1.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H3')  5.5 3.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H4')  5.5 3.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H5'') 4.5 2.7 0.0
assign (resid  18 and name H6)   (resid  18 and name H5')  5.5 3.7 0.0
assign (resid  19 and name H1)   (resid  15 and name H1)   5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  16 and name H1')  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  16 and name H2')  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  16 and name H6)   6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  16 and name H6)   6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  17 and name H2')  6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  17 and name H3')  6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  18 and name H1')  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  18 and name H42)  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  18 and name H5)   5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  18 and name H5'') 6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  18 and name H6)   5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  19 and name H2')  6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  19 and name H5')  6.5 4.7 0.0
assign (resid  19 and name H1)   (resid  20 and name H1')  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  20 and name H41)  5.0 3.2 0.0
assign (resid  19 and name H1)   (resid  20 and name H42)  5.0 3.2 0.0
assign (resid  19 and name H1')  (resid  20 and name H5'*) 4.5 2.7 0.0
assign (resid  19 and name H1)   (resid  20 and name H6)   6.5 4.7 0.0
assign (resid  19 and name H22)  (resid  19 and name H3')  5.0 3.2 0.0
assign (resid  19 and name H22)  (resid  19 and name H5'*) 5.5 3.7 0.0
assign (resid  19 and name H2')  (resid  20 and name H3')  4.5 2.7 0.0
assign (resid  19 and name H2')  (resid  20 and name H4')  4.5 2.7 0.0
assign (resid  19 and name H2')  (resid  20 and name H5'*) 2.5 0.7 0.0
assign (resid  19 and name H3')  (resid  20 and name H5'*) 3.5 1.7 0.0
assign (resid  19 and name H8)   (resid  18 and name H4')  5.5 3.7 0.0
assign (resid  19 and name H8)   (resid  18 and name H5'') 5.5 3.7 0.0
assign (resid  19 and name H8)   (resid  18 and name H5')  5.5 3.7 0.0
assign (resid  19 and name H8)   (resid  19 and name H1')  2.5 0.7 0.0
assign (resid  19 and name H8)   (resid  19 and name H2')  4.5 2.7 0.0
assign (resid  19 and name H8)   (resid  19 and name H3')  5.5 3.7 0.0
assign (resid  19 and name H8)   (resid  19 and name H4')  6.5 4.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H1')  4.5 2.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H2')  4.5 2.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H3')  3.5 1.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H4')  5.5 3.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H5'') 3.5 1.7 0.0
assign (resid   1 and name H8)   (resid   1 and name H5')  4.5 2.7 0.0
assign (resid   1 and name H8)   (resid   2 and name H8)   5.5 3.7 0.0
assign (resid  20 and name H2')  (resid  21 and name H2')  5.5 3.7 0.0
assign (resid  20 and name H2')  (resid  21 and name H3')  4.5 2.7 0.0
assign (resid  20 and name H2')  (resid  21 and name H4')  4.5 2.7 0.0
assign (resid  20 and name H2')  (resid  21 and name H5'*) 3.5 1.7 0.0
assign (resid  20 and name H42)  (resid  19 and name H3')  5.0 3.2 0.0
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assign (resid  20 and name H5)   (resid  20 and name H1')  5.5 3.7 0.0
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assign (resid   8 and name H1)   (resid  47 and name H1')  6.5 4.7 0.0
assign (resid   8 and name H1)   (resid   8 and name H1')  6.5 4.7 0.0
assign (resid   8 and name H1)   (resid   9 and name H1')  6.5 4.7 0.0
assign (resid   8 and name H8)   (resid   7 and name H1')  5.5 3.7 0.0
assign (resid   8 and name H8)   (resid   7 and name H2')  3.5 1.7 0.0
assign (resid   8 and name H8)   (resid   7 and name H3')  4.5 2.7 0.0
assign (resid   8 and name H8)   (resid   8 and name H1')  4.5 2.7 0.0
assign (resid   8 and name H8)   (resid   8 and name H2')  4.5 2.7 0.0
assign (resid   8 and name H8)   (resid   8 and name H3')  3.5 1.7 0.0
assign (resid   9 and name H1)   (resid  10 and name H1')  6.5 4.7 0.0
assign (resid   9 and name H1)   (resid  45 and name H1')  5.5 3.7 0.0
assign (resid   9 and name H1)   (resid  45 and name H41)  3.5 1.7 0.0
assign (resid   9 and name H1)   (resid  45 and name H42)  4.5 2.7 0.0
assign (resid   9 and name H1)   (resid  45 and name H5)   5.5 3.7 0.0
assign (resid   9 and name H1)   (resid  46 and name H1')  6.5 4.7 0.0
assign (resid   9 and name H1)   (resid   9 and name H1')  6.5 4.7 0.0
assign (resid   9 and name H8)   (resid   8 and name H1')  4.5 2.7 0.0
assign (resid   9 and name H8)   (resid   8 and name H2')  3.5 1.7 0.0
assign (resid   9 and name H8)   (resid   8 and name H3')  4.5 2.7 0.0
assign (resid   9 and name H8)   (resid   9 and name H1')  5.5 3.7 0.0
assign (resid   9 and name H8)   (resid   9 and name H2')  5.5 3.7 0.0
assign (resid   9 and name H8)   (resid   9 and name H3')  4.5 2.7 0.0
assign (resid   9 and name H8)   (resid   9 and name H4')  5.5 3.7 0.0

!{* hydrogen bond restraints in the stem *}
assign (resid   1 and name H1)   (resid  34 and name N3)   2.00 0.20 0.20
assign (resid   1 and name N1)   (resid  34 and name N3)   2.90 0.30 0.30
assign (resid   1 and name O6)   (resid  34 and name H41)  2.00 0.20 0.20
assign (resid   1 and name O6)   (resid  34 and name N4)   2.90 0.30 0.30
assign (resid   1 and name H21)  (resid  34 and name O2)   2.00 0.20 0.20
assign (resid   1 and name N2)   (resid  34 and name O2)   2.90 0.30 0.30
assign (resid   2 and name H1)   (resid  33 and name O2)   2.00 0.20 0.20
assign (resid   2 and name N1)   (resid  33 and name O2)   2.90 0.30 0.30
assign (resid   2 and name O6)   (resid  33 and name H3)   2.00 0.20 0.20
assign (resid   2 and name O6)   (resid  33 and name N3)   2.90 0.30 0.30
assign (resid   3 and name N3)   (resid  32 and name H1)   2.00 0.20 0.20
assign (resid   3 and name N3)   (resid  32 and name N1)   2.90 0.30 0.30
assign (resid   3 and name H41)  (resid  32 and name O6)   2.00 0.20 0.20
assign (resid   3 and name N4)   (resid  32 and name O6)   2.90 0.30 0.30
assign (resid   3 and name O2)   (resid  32 and name H21)  2.00 0.20 0.20
assign (resid   3 and name O2)   (resid  32 and name N2)   2.90 0.30 0.30
assign (resid   4 and name N3)   (resid  31 and name H1)   2.00 0.20 0.20
assign (resid   4 and name N3)   (resid  31 and name N1)   2.90 0.30 0.30
assign (resid   4 and name H41)  (resid  31 and name O6)   2.00 0.20 0.20
assign (resid   4 and name N4)   (resid  31 and name O6)   2.90 0.30 0.30
assign (resid   4 and name O2)   (resid  31 and name H21)  2.00 0.20 0.20
assign (resid   4 and name O2)   (resid  31 and name N2)   2.90 0.30 0.30
assign (resid   5 and name H3)   (resid  30 and name N1)   2.00 0.20 0.20
assign (resid   5 and name N3)   (resid  30 and name N1)   2.90 0.30 0.30
assign (resid   5 and name O4)   (resid  30 and name H61)  2.00 0.20 0.20
assign (resid   5 and name O4)   (resid  30 and name N6)   2.90 0.30 0.30
assign (resid  23 and name H3)   (resid  12 and name N1)   2.00 0.20 0.20
assign (resid  23 and name N3)   (resid  12 and name N1)   2.90 0.30 0.30
assign (resid  23 and name O4)   (resid  12 and name H61)  2.00 0.20 0.20
assign (resid  23 and name O4)   (resid  12 and name N6)   2.90 0.30 0.30
assign (resid  13 and name N3)   (resid  22 and name H1)   2.00 0.20 0.20
assign (resid  13 and name N3)   (resid  22 and name N1)   2.90 0.30 0.30
assign (resid  13 and name H41)  (resid  22 and name O6)   2.00 0.20 0.20
assign (resid  13 and name N4)   (resid  22 and name O6)   2.90 0.30 0.30
assign (resid  13 and name O2)   (resid  22 and name H21)  2.00 0.20 0.20
assign (resid  13 and name O2)   (resid  22 and name N2)   2.90 0.30 0.30
assign (resid  21 and name H3)   (resid  14 and name N1)   2.00 0.20 0.20
assign (resid  21 and name N3)   (resid  14 and name N1)   2.90 0.30 0.30
assign (resid  21 and name O4)   (resid  14 and name H61)  2.00 0.20 0.20
assign (resid  21 and name O4)   (resid  14 and name N6)   2.90 0.30 0.30
assign (resid  15 and name H1)   (resid  20 and name N3)   2.00 0.20 0.20
assign (resid  15 and name N1)   (resid  20 and name N3)   2.90 0.30 0.30
assign (resid  15 and name O6)   (resid  20 and name H41)  2.00 0.20 0.20
assign (resid  15 and name O6)   (resid  20 and name N4)   2.90 0.30 0.30
assign (resid  15 and name H21)  (resid  20 and name O2)   2.00 0.20 0.20
assign (resid  15 and name N2)   (resid  20 and name O2)   2.90 0.30 0.30
assign (resid  35 and name H3)   (resid  29 and name N1)   2.00 0.20 0.20
assign (resid  35 and name N3)   (resid  29 and name N1)   2.90 0.30 0.30
assign (resid  35 and name O4)   (resid  29 and name H61)  2.00 0.20 0.20
assign (resid  35 and name O4)   (resid  29 and name N6)   2.90 0.30 0.30
assign (resid  36 and name H3)   (resid  28 and name N1)   2.00 0.20 0.20
assign (resid  36 and name N3)   (resid  28 and name N1)   2.90 0.30 0.30
assign (resid  36 and name O4)   (resid  28 and name H61)  2.00 0.20 0.20
assign (resid  36 and name O4)   (resid  28 and name N6)   2.90 0.30 0.30
assign (resid  27 and name H1)   (resid  37 and name N3)   2.00 0.20 0.20
assign (resid  27 and name N1)   (resid  37 and name N3)   2.90 0.30 0.30
assign (resid  27 and name O6)   (resid  37 and name H41)  2.00 0.20 0.20
assign (resid  27 and name O6)   (resid  37 and name N4)   2.90 0.30 0.30
assign (resid  27 and name H21)  (resid  37 and name O2)   2.00 0.20 0.20
assign (resid  27 and name N2)   (resid  37 and name O2)   2.90 0.30 0.30
assign (resid  38 and name H1)   (resid  26 and name N3)   2.00 0.20 0.20
assign (resid  38 and name N1)   (resid  26 and name N3)   2.90 0.30 0.30
assign (resid  38 and name O6)   (resid  26 and name H41)  2.00 0.20 0.20
assign (resid  38 and name O6)   (resid  26 and name N4)   2.90 0.30 0.30
assign (resid  38 and name H21)  (resid  26 and name O2)   2.00 0.20 0.20
assign (resid  38 and name N2)   (resid  26 and name O2)   2.90 0.30 0.30
assign (resid  39 and name H1)   (resid  25 and name N3)   2.00 0.20 0.20
assign (resid  39 and name N1)   (resid  25 and name N3)   2.90 0.30 0.30
assign (resid  39 and name O6)   (resid  25 and name H41)  2.00 0.20 0.20
assign (resid  39 and name O6)   (resid  25 and name N4)   2.90 0.30 0.30
assign (resid  39 and name H21)  (resid  25 and name O2)   2.00 0.20 0.20
assign (resid  39 and name N2)   (resid  25 and name O2)   2.90 0.30 0.30
assign (resid  24 and name H1)   (resid  40 and name N3)   2.00 0.20 0.20
assign (resid  24 and name N1)   (resid  40 and name N3)   2.90 0.30 0.30
assign (resid  24 and name O6)   (resid  40 and name H41)  2.00 0.20 0.20
assign (resid  24 and name O6)   (resid  40 and name N4)   2.90 0.30 0.30
assign (resid  24 and name H21)  (resid  40 and name O2)   2.00 0.20 0.20
assign (resid  24 and name N2)   (resid  40 and name O2)   2.90 0.30 0.30
assign (resid  43 and name H3)   (resid  11 and name N1)   2.00 0.20 0.20
assign (resid  43 and name N3)   (resid  11 and name N1)   2.90 0.30 0.30
assign (resid  43 and name O4)   (resid  11 and name H61)  2.00 0.20 0.20
assign (resid  43 and name O4)   (resid  11 and name N6)   2.90 0.30 0.30
assign (resid  44 and name H3)   (resid  10 and name N1)   2.00 0.20 0.20
assign (resid  44 and name N3)   (resid  10 and name N1)   2.90 0.30 0.30
assign (resid  44 and name O4)   (resid  10 and name H61)  2.00 0.20 0.20
assign (resid  44 and name O4)   (resid  10 and name N6)   2.90 0.30 0.30
assign (resid   9 and name H1)   (resid  45 and name N3)   2.00 0.20 0.20
assign (resid   9 and name N1)   (resid  45 and name N3)   2.90 0.30 0.30
assign (resid   9 and name O6)   (resid  45 and name H41)  2.00 0.20 0.20
assign (resid   9 and name O6)   (resid  45 and name N4)   2.90 0.30 0.30
assign (resid   9 and name H21)  (resid  45 and name O2)   2.00 0.20 0.20
assign (resid   9 and name N2)   (resid  45 and name O2)   2.90 0.30 0.30
assign (resid   8 and name H1)   (resid  46 and name N3)   2.00 0.20 0.20
assign (resid   8 and name N1)   (resid  46 and name N3)   2.90 0.30 0.30
assign (resid   8 and name O6)   (resid  46 and name H41)  2.00 0.20 0.20
assign (resid   8 and name O6)   (resid  46 and name N4)   2.90 0.30 0.30
assign (resid   8 and name H21)  (resid  46 and name O2)   2.00 0.20 0.20
assign (resid   8 and name N2)   (resid  46 and name O2)   2.90 0.30 0.30
assign (resid  47 and name H3)   (resid   7 and name N1)   2.00 0.20 0.20
assign (resid  47 and name N3)   (resid   7 and name N1)   2.90 0.30 0.30
assign (resid  47 and name O4)   (resid   7 and name H61)  2.00 0.20 0.20
assign (resid  47 and name O4)   (resid   7 and name N6)   2.90 0.30 0.30
assign (resid   6 and name H3)   (resid  48 and name N1)   2.00 0.20 0.20
assign (resid   6 and name N3)   (resid  48 and name N1)   2.90 0.30 0.30
assign (resid   6 and name O4)   (resid  48 and name H61)  2.00 0.20 0.20
assign (resid   6 and name O4)   (resid  48 and name N6)   2.90 0.30 0.30

! REMARKS restraints  dihedral
 assign ( resi  1 and name O4' )
        ( resi  1 and name C1' )
        ( resi  1 and name N9  )
        ( resi  1 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  2 and name O4' )
        ( resi  2 and name C1' )
        ( resi  2 and name N9  )
        ( resi  2 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  3 and name O4' )
        ( resi  3 and name C1' )
        ( resi  3 and name N9  )
        ( resi  3 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  4 and name O4' )
        ( resi  4 and name C1' )
        ( resi  4 and name N9  )
        ( resi  4 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  5 and name O4' )
        ( resi  5 and name C1' )
        ( resi  5 and name N9  )
        ( resi  5 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  6 and name O4' )
        ( resi  6 and name C1' )
        ( resi  6 and name N9  )
        ( resi  6 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  7 and name O4' )
        ( resi  7 and name C1' )
        ( resi  7 and name N9  )
        ( resi  7 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  8 and name O4' )
        ( resi  8 and name C1' )
        ( resi  8 and name N9  )
        ( resi  8 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  9 and name O4' )
        ( resi  9 and name C1' )
        ( resi  9 and name N9  )
        ( resi  9 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 10 and name O4' )
        ( resi 10 and name C1' )
        ( resi 10 and name N9  )
        ( resi 10 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 11 and name O4' )
        ( resi 11 and name C1' )
        ( resi 11 and name N9  )
        ( resi 11 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 12 and name O4' )
        ( resi 12 and name C1' )
        ( resi 12 and name N9  )
        ( resi 12 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 13 and name O4' )
        ( resi 13 and name C1' )
        ( resi 13 and name N9  )
        ( resi 13 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 14 and name O4' )
        ( resi 14 and name C1' )
        ( resi 14 and name N9  )
        ( resi 14 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 15 and name O4' )
        ( resi 15 and name C1' )
        ( resi 15 and name N9  )
        ( resi 15 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 16 and name O4' )
        ( resi 16 and name C1' )
        ( resi 16 and name N9  )
        ( resi 16 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 17 and name O4' )
        ( resi 17 and name C1' )
        ( resi 17 and name N9  )
        ( resi 17 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 18 and name O4' )
        ( resi 18 and name C1' )
        ( resi 18 and name N9  )
        ( resi 18 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 19 and name O4' )
        ( resi 19 and name C1' )
        ( resi 19 and name N9  )
        ( resi 19 and name C4  )   3.0    60.0    30.0   2      {*chi--syn*}

 assign ( resi 20 and name O4' )
        ( resi 20 and name C1' )
        ( resi 20 and name N9  )
        ( resi 20 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 21 and name O4' )
        ( resi 21 and name C1' )
        ( resi 21 and name N9  )
        ( resi 21 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 22 and name O4' )
        ( resi 22 and name C1' )
        ( resi 22 and name N9  )
        ( resi 22 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 23 and name O4' )
        ( resi 23 and name C1' )
        ( resi 23 and name N9  )
        ( resi 23 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 24 and name O4' )
        ( resi 24 and name C1' )
        ( resi 24 and name N9  )
        ( resi 24 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 25 and name O4' )
        ( resi 25 and name C1' )
        ( resi 25 and name N9  )
        ( resi 25 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 26 and name O4' )
        ( resi 26 and name C1' )
        ( resi 26 and name N9  )
        ( resi 26 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 27 and name O4' )
        ( resi 27 and name C1' )
        ( resi 27 and name N9  )
        ( resi 27 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 28 and name O4' )
        ( resi 28 and name C1' )
        ( resi 28 and name N9  )
        ( resi 28 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 29 and name O4' )
        ( resi 29 and name C1' )
        ( resi 29 and name N9  )
        ( resi 29 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 30 and name O4' )
        ( resi 30 and name C1' )
        ( resi 30 and name N9  )
        ( resi 30 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 31 and name O4' )
        ( resi 31 and name C1' )
        ( resi 31 and name N9  )
        ( resi 31 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 32 and name O4' )
        ( resi 32 and name C1' )
        ( resi 32 and name N9  )
        ( resi 32 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 33 and name O4' )
        ( resi 33 and name C1' )
        ( resi 33 and name N9  )
        ( resi 33 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 34 and name O4' )
        ( resi 34 and name C1' )
        ( resi 34 and name N9  )
        ( resi 34 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 35 and name O4' )
        ( resi 35 and name C1' )
        ( resi 35 and name N9  )
        ( resi 35 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 36 and name O4' )
        ( resi 36 and name C1' )
        ( resi 36 and name N9  )
        ( resi 36 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 37 and name O4' )
        ( resi 37 and name C1' )
        ( resi 37 and name N9  )
        ( resi 37 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 38 and name O4' )
        ( resi 38 and name C1' )
        ( resi 38 and name N9  )
        ( resi 38 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 39 and name O4' )
        ( resi 39 and name C1' )
        ( resi 39 and name N9  )
        ( resi 39 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 40 and name O4' )
        ( resi 40 and name C1' )
        ( resi 40 and name N9  )
        ( resi 40 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 41 and name O4' )
        ( resi 41 and name C1' )
        ( resi 41 and name N9  )
        ( resi 41 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 42 and name O4' )
        ( resi 42 and name C1' )
        ( resi 42 and name N9  )
        ( resi 42 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 43 and name O4' )
        ( resi 43 and name C1' )
        ( resi 43 and name N9  )
        ( resi 43 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 44 and name O4' )
        ( resi 44 and name C1' )
        ( resi 44 and name N9  )
        ( resi 44 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 45 and name O4' )
        ( resi 45 and name C1' )
        ( resi 45 and name N9  )
        ( resi 45 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 46 and name O4' )
        ( resi 46 and name C1' )
        ( resi 46 and name N9  )
        ( resi 46 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 47 and name O4' )
        ( resi 47 and name C1' )
        ( resi 47 and name N9  )
        ( resi 47 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi 48 and name O4' )
        ( resi 48 and name C1' )
        ( resi 48 and name N9  )
        ( resi 48 and name C4  )   3.0   160.0    30.0   2      {*chi--anti*}

 assign ( resi  1 and name C5' )
        ( resi  1 and name C4' )
        ( resi  1 and name C3' )
        ( resi  1 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  2 and name C5' )
        ( resi  2 and name C4' )
        ( resi  2 and name C3' )
        ( resi  2 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  3 and name C5' )
        ( resi  3 and name C4' )
        ( resi  3 and name C3' )
        ( resi  3 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  4 and name C5' )
        ( resi  4 and name C4' )
        ( resi  4 and name C3' )
        ( resi  4 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  5 and name C5' )
        ( resi  5 and name C4' )
        ( resi  5 and name C3' )
        ( resi  5 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi  6 and name C5' )
        ( resi  6 and name C4' )
        ( resi  6 and name C3' )
        ( resi  6 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi  7 and name C5' )
        ( resi  7 and name C4' )
        ( resi  7 and name C3' )
        ( resi  7 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  8 and name C5' )
        ( resi  8 and name C4' )
        ( resi  8 and name C3' )
        ( resi  8 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  9 and name C5' )
        ( resi  9 and name C4' )
        ( resi  9 and name C3' )
        ( resi  9 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 10 and name C5' )
        ( resi 10 and name C4' )
        ( resi 10 and name C3' )
        ( resi 10 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 11 and name C5' )
        ( resi 11 and name C4' )
        ( resi 11 and name C3' )
        ( resi 11 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 12 and name C5' )
        ( resi 12 and name C4' )
        ( resi 12 and name C3' )
        ( resi 12 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 13 and name C5' )
        ( resi 13 and name C4' )
        ( resi 13 and name C3' )
        ( resi 13 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 14 and name C5' )
        ( resi 14 and name C4' )
        ( resi 14 and name C3' )
        ( resi 14 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 15 and name C5' )
        ( resi 15 and name C4' )
        ( resi 15 and name C3' )
        ( resi 15 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 16 and name C5' )
        ( resi 16 and name C4' )
        ( resi 16 and name C3' )
        ( resi 16 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 17 and name C5' )
        ( resi 17 and name C4' )
        ( resi 17 and name C3' )
        ( resi 17 and name O3' )   3.0   145.0    30.0   2      {*sugar--N*}

 assign ( resi 18 and name C5' )
        ( resi 18 and name C4' )
        ( resi 18 and name C3' )
        ( resi 18 and name O3' )   3.0   145.0    30.0   2      {*sugar--N*}

 assign ( resi 19 and name C5' )
        ( resi 19 and name C4' )
        ( resi 19 and name C3' )
        ( resi 19 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 20 and name C5' )
        ( resi 20 and name C4' )
        ( resi 20 and name C3' )
        ( resi 20 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 21 and name C5' )
        ( resi 21 and name C4' )
        ( resi 21 and name C3' )
        ( resi 21 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 22 and name C5' )
        ( resi 22 and name C4' )
        ( resi 22 and name C3' )
        ( resi 22 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 23 and name C5' )
        ( resi 23 and name C4' )
        ( resi 23 and name C3' )
        ( resi 23 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 24 and name C5' )
        ( resi 24 and name C4' )
        ( resi 24 and name C3' )
        ( resi 24 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 25 and name C5' )
        ( resi 25 and name C4' )
        ( resi 25 and name C3' )
        ( resi 25 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 26 and name C5' )
        ( resi 26 and name C4' )
        ( resi 26 and name C3' )
        ( resi 26 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 27 and name C5' )
        ( resi 27 and name C4' )
        ( resi 27 and name C3' )
        ( resi 27 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 28 and name C5' )
        ( resi 28 and name C4' )
        ( resi 28 and name C3' )
        ( resi 28 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 29 and name C5' )
        ( resi 29 and name C4' )
        ( resi 29 and name C3' )
        ( resi 29 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 30 and name C5' )
        ( resi 30 and name C4' )
        ( resi 30 and name C3' )
        ( resi 30 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 31 and name C5' )
        ( resi 31 and name C4' )
        ( resi 31 and name C3' )
        ( resi 31 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 32 and name C5' )
        ( resi 32 and name C4' )
        ( resi 32 and name C3' )
        ( resi 32 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 33 and name C5' )
        ( resi 33 and name C4' )
        ( resi 33 and name C3' )
        ( resi 33 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 34 and name C5' )
        ( resi 34 and name C4' )
        ( resi 34 and name C3' )
        ( resi 34 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 35 and name C5' )
        ( resi 35 and name C4' )
        ( resi 35 and name C3' )
        ( resi 35 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 36 and name C5' )
        ( resi 36 and name C4' )
        ( resi 36 and name C3' )
        ( resi 36 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 37 and name C5' )
        ( resi 37 and name C4' )
        ( resi 37 and name C3' )
        ( resi 37 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 38 and name C5' )
        ( resi 38 and name C4' )
        ( resi 38 and name C3' )
        ( resi 38 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 39 and name C5' )
        ( resi 39 and name C4' )
        ( resi 39 and name C3' )
        ( resi 39 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 40 and name C5' )
        ( resi 40 and name C4' )
        ( resi 40 and name C3' )
        ( resi 40 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 41 and name C5' )
        ( resi 41 and name C4' )
        ( resi 41 and name C3' )
        ( resi 41 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 42 and name C5' )
        ( resi 42 and name C4' )
        ( resi 42 and name C3' )
        ( resi 42 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 43 and name C5' )
        ( resi 43 and name C4' )
        ( resi 43 and name C3' )
        ( resi 43 and name O3' )   3.0   120.0    60.0   2      {*sugar--Inter*}

 assign ( resi 44 and name C5' )
        ( resi 44 and name C4' )
        ( resi 44 and name C3' )
        ( resi 44 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 45 and name C5' )
        ( resi 45 and name C4' )
        ( resi 45 and name C3' )
        ( resi 45 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 46 and name C5' )
        ( resi 46 and name C4' )
        ( resi 46 and name C3' )
        ( resi 46 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 47 and name C5' )
        ( resi 47 and name C4' )
        ( resi 47 and name C3' )
        ( resi 47 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi 48 and name C5' )
        ( resi 48 and name C4' )
        ( resi 48 and name C3' )
        ( resi 48 and name O3' )   3.0    85.0    30.0   2      {*sugar--S*}

 assign ( resi  1 and name O3' )
        ( resi  2 and name P   )
        ( resi  2 and name O5' )
        ( resi  2 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  2 and name O3' )
        ( resi  3 and name P   )
        ( resi  3 and name O5' )
        ( resi  3 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  3 and name O3' )
        ( resi  4 and name P   )
        ( resi  4 and name O5' )
        ( resi  4 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  4 and name O3' )
        ( resi  5 and name P   )
        ( resi  5 and name O5' )
        ( resi  5 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  5 and name O3' )
        ( resi  6 and name P   )
        ( resi  6 and name O5' )
        ( resi  6 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi  6 and name O3' )
        ( resi  7 and name P   )
        ( resi  7 and name O5' )
        ( resi  7 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  7 and name O3' )
        ( resi  8 and name P   )
        ( resi  8 and name O5' )
        ( resi  8 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  8 and name O3' )
        ( resi  9 and name P   )
        ( resi  9 and name O5' )
        ( resi  9 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  9 and name O3' )
        ( resi 10 and name P   )
        ( resi 10 and name O5' )
        ( resi 10 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 10 and name O3' )
        ( resi 11 and name P   )
        ( resi 11 and name O5' )
        ( resi 11 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 11 and name O3' )
        ( resi 12 and name P   )
        ( resi 12 and name O5' )
        ( resi 12 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 12 and name O3' )
        ( resi 13 and name P   )
        ( resi 13 and name O5' )
        ( resi 13 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 13 and name O3' )
        ( resi 14 and name P   )
        ( resi 14 and name O5' )
        ( resi 14 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 14 and name O3' )
        ( resi 15 and name P   )
        ( resi 15 and name O5' )
        ( resi 15 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 15 and name O3' )
        ( resi 16 and name P   )
        ( resi 16 and name O5' )
        ( resi 16 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 16 and name O3' )
        ( resi 17 and name P   )
        ( resi 17 and name O5' )
        ( resi 17 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 17 and name O3' )
        ( resi 18 and name P   )
        ( resi 18 and name O5' )
        ( resi 18 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 18 and name O3' )
        ( resi 19 and name P   )
        ( resi 19 and name O5' )
        ( resi 19 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 19 and name O3' )
        ( resi 20 and name P   )
        ( resi 20 and name O5' )
        ( resi 20 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 20 and name O3' )
        ( resi 21 and name P   )
        ( resi 21 and name O5' )
        ( resi 21 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 21 and name O3' )
        ( resi 22 and name P   )
        ( resi 22 and name O5' )
        ( resi 22 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 22 and name O3' )
        ( resi 23 and name P   )
        ( resi 23 and name O5' )
        ( resi 23 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 23 and name O3' )
        ( resi 24 and name P   )
        ( resi 24 and name O5' )
        ( resi 24 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 24 and name O3' )
        ( resi 25 and name P   )
        ( resi 25 and name O5' )
        ( resi 25 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 25 and name O3' )
        ( resi 26 and name P   )
        ( resi 26 and name O5' )
        ( resi 26 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 26 and name O3' )
        ( resi 27 and name P   )
        ( resi 27 and name O5' )
        ( resi 27 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 27 and name O3' )
        ( resi 28 and name P   )
        ( resi 28 and name O5' )
        ( resi 28 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 28 and name O3' )
        ( resi 29 and name P   )
        ( resi 29 and name O5' )
        ( resi 29 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 29 and name O3' )
        ( resi 30 and name P   )
        ( resi 30 and name O5' )
        ( resi 30 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 30 and name O3' )
        ( resi 31 and name P   )
        ( resi 31 and name O5' )
        ( resi 31 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 31 and name O3' )
        ( resi 32 and name P   )
        ( resi 32 and name O5' )
        ( resi 32 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 32 and name O3' )
        ( resi 33 and name P   )
        ( resi 33 and name O5' )
        ( resi 33 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 33 and name O3' )
        ( resi 34 and name P   )
        ( resi 34 and name O5' )
        ( resi 34 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 35 and name O3' )
        ( resi 36 and name P   )
        ( resi 36 and name O5' )
        ( resi 36 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 36 and name O3' )
        ( resi 37 and name P   )
        ( resi 37 and name O5' )
        ( resi 37 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 37 and name O3' )
        ( resi 38 and name P   )
        ( resi 38 and name O5' )
        ( resi 38 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 38 and name O3' )
        ( resi 39 and name P   )
        ( resi 39 and name O5' )
        ( resi 39 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 39 and name O3' )
        ( resi 40 and name P   )
        ( resi 40 and name O5' )
        ( resi 40 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 40 and name O3' )
        ( resi 41 and name P   )
        ( resi 41 and name O5' )
        ( resi 41 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 41 and name O3' )
        ( resi 42 and name P   )
        ( resi 42 and name O5' )
        ( resi 42 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 42 and name O3' )
        ( resi 43 and name P   )
        ( resi 43 and name O5' )
        ( resi 43 and name C5' )   3.0     0.0   120.0   2      {*alpha*}

 assign ( resi 43 and name O3' )
        ( resi 44 and name P   )
        ( resi 44 and name O5' )
        ( resi 44 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 44 and name O3' )
        ( resi 45 and name P   )
        ( resi 45 and name O5' )
        ( resi 45 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 45 and name O3' )
        ( resi 46 and name P   )
        ( resi 46 and name O5' )
        ( resi 46 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 46 and name O3' )
        ( resi 47 and name P   )
        ( resi 47 and name O5' )
        ( resi 47 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi 47 and name O3' )
        ( resi 48 and name P   )
        ( resi 48 and name O5' )
        ( resi 48 and name C5' )   3.0   -62.1    30.0   2      {*alpha*}

 assign ( resi  2 and name P   )
        ( resi  2 and name O5' )
        ( resi  2 and name C5' )
        ( resi  2 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  3 and name P   )
        ( resi  3 and name O5' )
        ( resi  3 and name C5' )
        ( resi  3 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  4 and name P   )
        ( resi  4 and name O5' )
        ( resi  4 and name C5' )
        ( resi  4 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  5 and name P   )
        ( resi  5 and name O5' )
        ( resi  5 and name C5' )
        ( resi  5 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  7 and name P   )
        ( resi  7 and name O5' )
        ( resi  7 and name C5' )
        ( resi  7 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  8 and name P   )
        ( resi  8 and name O5' )
        ( resi  8 and name C5' )
        ( resi  8 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  9 and name P   )
        ( resi  9 and name O5' )
        ( resi  9 and name C5' )
        ( resi  9 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 10 and name P   )
        ( resi 10 and name O5' )
        ( resi 10 and name C5' )
        ( resi 10 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 11 and name P   )
        ( resi 11 and name O5' )
        ( resi 11 and name C5' )
        ( resi 11 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 12 and name P   )
        ( resi 12 and name O5' )
        ( resi 12 and name C5' )
        ( resi 12 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 13 and name P   )
        ( resi 13 and name O5' )
        ( resi 13 and name C5' )
        ( resi 13 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 14 and name P   )
        ( resi 14 and name O5' )
        ( resi 14 and name C5' )
        ( resi 14 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 15 and name P   )
        ( resi 15 and name O5' )
        ( resi 15 and name C5' )
        ( resi 15 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 21 and name P   )
        ( resi 21 and name O5' )
        ( resi 21 and name C5' )
        ( resi 21 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 22 and name P   )
        ( resi 22 and name O5' )
        ( resi 22 and name C5' )
        ( resi 22 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 23 and name P   )
        ( resi 23 and name O5' )
        ( resi 23 and name C5' )
        ( resi 23 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 25 and name P   )
        ( resi 25 and name O5' )
        ( resi 25 and name C5' )
        ( resi 25 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 26 and name P   )
        ( resi 26 and name O5' )
        ( resi 26 and name C5' )
        ( resi 26 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 27 and name P   )
        ( resi 27 and name O5' )
        ( resi 27 and name C5' )
        ( resi 27 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 28 and name P   )
        ( resi 28 and name O5' )
        ( resi 28 and name C5' )
        ( resi 28 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 29 and name P   )
        ( resi 29 and name O5' )
        ( resi 29 and name C5' )
        ( resi 29 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 30 and name P   )
        ( resi 30 and name O5' )
        ( resi 30 and name C5' )
        ( resi 30 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 31 and name P   )
        ( resi 31 and name O5' )
        ( resi 31 and name C5' )
        ( resi 31 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 32 and name P   )
        ( resi 32 and name O5' )
        ( resi 32 and name C5' )
        ( resi 32 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 33 and name P   )
        ( resi 33 and name O5' )
        ( resi 33 and name C5' )
        ( resi 33 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 34 and name P   )
        ( resi 34 and name O5' )
        ( resi 34 and name C5' )
        ( resi 34 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 36 and name P   )
        ( resi 36 and name O5' )
        ( resi 36 and name C5' )
        ( resi 36 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 37 and name P   )
        ( resi 37 and name O5' )
        ( resi 37 and name C5' )
        ( resi 37 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 38 and name P   )
        ( resi 38 and name O5' )
        ( resi 38 and name C5' )
        ( resi 38 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 39 and name P   )
        ( resi 39 and name O5' )
        ( resi 39 and name C5' )
        ( resi 39 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 40 and name P   )
        ( resi 40 and name O5' )
        ( resi 40 and name C5' )
        ( resi 40 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 44 and name P   )
        ( resi 44 and name O5' )
        ( resi 44 and name C5' )
        ( resi 44 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 45 and name P   )
        ( resi 45 and name O5' )
        ( resi 45 and name C5' )
        ( resi 45 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 46 and name P   )
        ( resi 46 and name O5' )
        ( resi 46 and name C5' )
        ( resi 46 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 47 and name P   )
        ( resi 47 and name O5' )
        ( resi 47 and name C5' )
        ( resi 47 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi 48 and name P   )
        ( resi 48 and name O5' )
        ( resi 48 and name C5' )
        ( resi 48 and name C4' )   3.0  -179.0    30.0   2      {*beta*}

 assign ( resi  1 and name O5' )
        ( resi  1 and name C5' )
        ( resi  1 and name C4' )
        ( resi  1 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  2 and name O5' )
        ( resi  2 and name C5' )
        ( resi  2 and name C4' )
        ( resi  2 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  3 and name O5' )
        ( resi  3 and name C5' )
        ( resi  3 and name C4' )
        ( resi  3 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  4 and name O5' )
        ( resi  4 and name C5' )
        ( resi  4 and name C4' )
        ( resi  4 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  5 and name O5' )
        ( resi  5 and name C5' )
        ( resi  5 and name C4' )
        ( resi  5 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  7 and name O5' )
        ( resi  7 and name C5' )
        ( resi  7 and name C4' )
        ( resi  7 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  8 and name O5' )
        ( resi  8 and name C5' )
        ( resi  8 and name C4' )
        ( resi  8 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  9 and name O5' )
        ( resi  9 and name C5' )
        ( resi  9 and name C4' )
        ( resi  9 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 10 and name O5' )
        ( resi 10 and name C5' )
        ( resi 10 and name C4' )
        ( resi 10 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 11 and name O5' )
        ( resi 11 and name C5' )
        ( resi 11 and name C4' )
        ( resi 11 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 12 and name O5' )
        ( resi 12 and name C5' )
        ( resi 12 and name C4' )
        ( resi 12 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 13 and name O5' )
        ( resi 13 and name C5' )
        ( resi 13 and name C4' )
        ( resi 13 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 14 and name O5' )
        ( resi 14 and name C5' )
        ( resi 14 and name C4' )
        ( resi 14 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 15 and name O5' )
        ( resi 15 and name C5' )
        ( resi 15 and name C4' )
        ( resi 15 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 20 and name O5' )
        ( resi 20 and name C5' )
        ( resi 20 and name C4' )
        ( resi 20 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 21 and name O5' )
        ( resi 21 and name C5' )
        ( resi 21 and name C4' )
        ( resi 21 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 22 and name O5' )
        ( resi 22 and name C5' )
        ( resi 22 and name C4' )
        ( resi 22 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 23 and name O5' )
        ( resi 23 and name C5' )
        ( resi 23 and name C4' )
        ( resi 23 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 25 and name O5' )
        ( resi 25 and name C5' )
        ( resi 25 and name C4' )
        ( resi 25 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 26 and name O5' )
        ( resi 26 and name C5' )
        ( resi 26 and name C4' )
        ( resi 26 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 27 and name O5' )
        ( resi 27 and name C5' )
        ( resi 27 and name C4' )
        ( resi 27 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 28 and name O5' )
        ( resi 28 and name C5' )
        ( resi 28 and name C4' )
        ( resi 28 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 29 and name O5' )
        ( resi 29 and name C5' )
        ( resi 29 and name C4' )
        ( resi 29 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 30 and name O5' )
        ( resi 30 and name C5' )
        ( resi 30 and name C4' )
        ( resi 30 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 31 and name O5' )
        ( resi 31 and name C5' )
        ( resi 31 and name C4' )
        ( resi 31 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 32 and name O5' )
        ( resi 32 and name C5' )
        ( resi 32 and name C4' )
        ( resi 32 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 33 and name O5' )
        ( resi 33 and name C5' )
        ( resi 33 and name C4' )
        ( resi 33 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 34 and name O5' )
        ( resi 34 and name C5' )
        ( resi 34 and name C4' )
        ( resi 34 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 35 and name O5' )
        ( resi 35 and name C5' )
        ( resi 35 and name C4' )
        ( resi 35 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 36 and name O5' )
        ( resi 36 and name C5' )
        ( resi 36 and name C4' )
        ( resi 36 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 37 and name O5' )
        ( resi 37 and name C5' )
        ( resi 37 and name C4' )
        ( resi 37 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 38 and name O5' )
        ( resi 38 and name C5' )
        ( resi 38 and name C4' )
        ( resi 38 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 39 and name O5' )
        ( resi 39 and name C5' )
        ( resi 39 and name C4' )
        ( resi 39 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 40 and name O5' )
        ( resi 40 and name C5' )
        ( resi 40 and name C4' )
        ( resi 40 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 43 and name O5' )
        ( resi 43 and name C5' )
        ( resi 43 and name C4' )
        ( resi 43 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 44 and name O5' )
        ( resi 44 and name C5' )
        ( resi 44 and name C4' )
        ( resi 44 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 45 and name O5' )
        ( resi 45 and name C5' )
        ( resi 45 and name C4' )
        ( resi 45 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 46 and name O5' )
        ( resi 46 and name C5' )
        ( resi 46 and name C4' )
        ( resi 46 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 47 and name O5' )
        ( resi 47 and name C5' )
        ( resi 47 and name C4' )
        ( resi 47 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi 48 and name O5' )
        ( resi 48 and name C5' )
        ( resi 48 and name C4' )
        ( resi 48 and name C3' )   3.0    54.0    30.0   2      {*gamma*}

 assign ( resi  1 and name C3' )
        ( resi  1 and name O3' )
        ( resi  2 and name P   )
        ( resi  2 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  2 and name C3' )
        ( resi  2 and name O3' )
        ( resi  3 and name P   )
        ( resi  3 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  3 and name C3' )
        ( resi  3 and name O3' )
        ( resi  4 and name P   )
        ( resi  4 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  4 and name C3' )
        ( resi  4 and name O3' )
        ( resi  5 and name P   )
        ( resi  5 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  6 and name C3' )
        ( resi  6 and name O3' )
        ( resi  7 and name P   )
        ( resi  7 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  7 and name C3' )
        ( resi  7 and name O3' )
        ( resi  8 and name P   )
        ( resi  8 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  8 and name C3' )
        ( resi  8 and name O3' )
        ( resi  9 and name P   )
        ( resi  9 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  9 and name C3' )
        ( resi  9 and name O3' )
        ( resi 10 and name P   )
        ( resi 10 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 10 and name C3' )
        ( resi 10 and name O3' )
        ( resi 11 and name P   )
        ( resi 11 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 11 and name C3' )
        ( resi 11 and name O3' )
        ( resi 12 and name P   )
        ( resi 12 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 12 and name C3' )
        ( resi 12 and name O3' )
        ( resi 13 and name P   )
        ( resi 13 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 13 and name C3' )
        ( resi 13 and name O3' )
        ( resi 14 and name P   )
        ( resi 14 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 14 and name C3' )
        ( resi 14 and name O3' )
        ( resi 15 and name P   )
        ( resi 15 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 15 and name C3' )
        ( resi 15 and name O3' )
        ( resi 16 and name P   )
        ( resi 16 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 16 and name C3' )
        ( resi 16 and name O3' )
        ( resi 17 and name P   )
        ( resi 17 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 17 and name C3' )
        ( resi 17 and name O3' )
        ( resi 18 and name P   )
        ( resi 18 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 18 and name C3' )
        ( resi 18 and name O3' )
        ( resi 19 and name P   )
        ( resi 19 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 19 and name C3' )
        ( resi 19 and name O3' )
        ( resi 20 and name P   )
        ( resi 20 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 20 and name C3' )
        ( resi 20 and name O3' )
        ( resi 21 and name P   )
        ( resi 21 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 21 and name C3' )
        ( resi 21 and name O3' )
        ( resi 22 and name P   )
        ( resi 22 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 22 and name C3' )
        ( resi 22 and name O3' )
        ( resi 23 and name P   )
        ( resi 23 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 24 and name C3' )
        ( resi 24 and name O3' )
        ( resi 25 and name P   )
        ( resi 25 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 25 and name C3' )
        ( resi 25 and name O3' )
        ( resi 26 and name P   )
        ( resi 26 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 26 and name C3' )
        ( resi 26 and name O3' )
        ( resi 27 and name P   )
        ( resi 27 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 27 and name C3' )
        ( resi 27 and name O3' )
        ( resi 28 and name P   )
        ( resi 28 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 28 and name C3' )
        ( resi 28 and name O3' )
        ( resi 29 and name P   )
        ( resi 29 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 29 and name C3' )
        ( resi 29 and name O3' )
        ( resi 30 and name P   )
        ( resi 30 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 30 and name C3' )
        ( resi 30 and name O3' )
        ( resi 31 and name P   )
        ( resi 31 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 31 and name C3' )
        ( resi 31 and name O3' )
        ( resi 32 and name P   )
        ( resi 32 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 32 and name C3' )
        ( resi 32 and name O3' )
        ( resi 33 and name P   )
        ( resi 33 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 33 and name C3' )
        ( resi 33 and name O3' )
        ( resi 34 and name P   )
        ( resi 34 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 35 and name C3' )
        ( resi 35 and name O3' )
        ( resi 36 and name P   )
        ( resi 36 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 36 and name C3' )
        ( resi 36 and name O3' )
        ( resi 37 and name P   )
        ( resi 37 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 37 and name C3' )
        ( resi 37 and name O3' )
        ( resi 38 and name P   )
        ( resi 38 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 38 and name C3' )
        ( resi 38 and name O3' )
        ( resi 39 and name P   )
        ( resi 39 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 39 and name C3' )
        ( resi 39 and name O3' )
        ( resi 40 and name P   )
        ( resi 40 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 40 and name C3' )
        ( resi 40 and name O3' )
        ( resi 41 and name P   )
        ( resi 41 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 41 and name C3' )
        ( resi 41 and name O3' )
        ( resi 42 and name P   )
        ( resi 42 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 42 and name C3' )
        ( resi 42 and name O3' )
        ( resi 43 and name P   )
        ( resi 43 and name O5' )   3.0     0.0   120.0   2      {*zeta*}

 assign ( resi 43 and name C3' )
        ( resi 43 and name O3' )
        ( resi 44 and name P   )
        ( resi 44 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 44 and name C3' )
        ( resi 44 and name O3' )
        ( resi 45 and name P   )
        ( resi 45 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 45 and name C3' )
        ( resi 45 and name O3' )
        ( resi 46 and name P   )
        ( resi 46 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 46 and name C3' )
        ( resi 46 and name O3' )
        ( resi 47 and name P   )
        ( resi 47 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi 47 and name C3' )
        ( resi 47 and name O3' )
        ( resi 48 and name P   )
        ( resi 48 and name O5' )   3.0   -73.6    30.0   2      {*zeta*}

 assign ( resi  1 and name C1' )
        ( resi  1 and name C2' )
        ( resi  1 and name C3' )
        ( resi  1 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  2 and name C1' )
        ( resi  2 and name C2' )
        ( resi  2 and name C3' )
        ( resi  2 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  3 and name C1' )
        ( resi  3 and name C2' )
        ( resi  3 and name C3' )
        ( resi  3 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  4 and name C1' )
        ( resi  4 and name C2' )
        ( resi  4 and name C3' )
        ( resi  4 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  5 and name C1' )
        ( resi  5 and name C2' )
        ( resi  5 and name C3' )
        ( resi  5 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  6 and name C1' )
        ( resi  6 and name C2' )
        ( resi  6 and name C3' )
        ( resi  6 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  7 and name C1' )
        ( resi  7 and name C2' )
        ( resi  7 and name C3' )
        ( resi  7 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  8 and name C1' )
        ( resi  8 and name C2' )
        ( resi  8 and name C3' )
        ( resi  8 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi  9 and name C1' )
        ( resi  9 and name C2' )
        ( resi  9 and name C3' )
        ( resi  9 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 10 and name C1' )
        ( resi 10 and name C2' )
        ( resi 10 and name C3' )
        ( resi 10 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 11 and name C1' )
        ( resi 11 and name C2' )
        ( resi 11 and name C3' )
        ( resi 11 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 12 and name C1' )
        ( resi 12 and name C2' )
        ( resi 12 and name C3' )
        ( resi 12 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 13 and name C1' )
        ( resi 13 and name C2' )
        ( resi 13 and name C3' )
        ( resi 13 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 14 and name C1' )
        ( resi 14 and name C2' )
        ( resi 14 and name C3' )
        ( resi 14 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 15 and name C1' )
        ( resi 15 and name C2' )
        ( resi 15 and name C3' )
        ( resi 15 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 20 and name C1' )
        ( resi 20 and name C2' )
        ( resi 20 and name C3' )
        ( resi 20 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 21 and name C1' )
        ( resi 21 and name C2' )
        ( resi 21 and name C3' )
        ( resi 21 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 22 and name C1' )
        ( resi 22 and name C2' )
        ( resi 22 and name C3' )
        ( resi 22 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 23 and name C1' )
        ( resi 23 and name C2' )
        ( resi 23 and name C3' )
        ( resi 23 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 24 and name C1' )
        ( resi 24 and name C2' )
        ( resi 24 and name C3' )
        ( resi 24 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 25 and name C1' )
        ( resi 25 and name C2' )
        ( resi 25 and name C3' )
        ( resi 25 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 26 and name C1' )
        ( resi 26 and name C2' )
        ( resi 26 and name C3' )
        ( resi 26 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 27 and name C1' )
        ( resi 27 and name C2' )
        ( resi 27 and name C3' )
        ( resi 27 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 28 and name C1' )
        ( resi 28 and name C2' )
        ( resi 28 and name C3' )
        ( resi 28 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 29 and name C1' )
        ( resi 29 and name C2' )
        ( resi 29 and name C3' )
        ( resi 29 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 30 and name C1' )
        ( resi 30 and name C2' )
        ( resi 30 and name C3' )
        ( resi 30 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 31 and name C1' )
        ( resi 31 and name C2' )
        ( resi 31 and name C3' )
        ( resi 31 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 32 and name C1' )
        ( resi 32 and name C2' )
        ( resi 32 and name C3' )
        ( resi 32 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 33 and name C1' )
        ( resi 33 and name C2' )
        ( resi 33 and name C3' )
        ( resi 33 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 34 and name C1' )
        ( resi 34 and name C2' )
        ( resi 34 and name C3' )
        ( resi 34 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 35 and name C1' )
        ( resi 35 and name C2' )
        ( resi 35 and name C3' )
        ( resi 35 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 36 and name C1' )
        ( resi 36 and name C2' )
        ( resi 36 and name C3' )
        ( resi 36 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 37 and name C1' )
        ( resi 37 and name C2' )
        ( resi 37 and name C3' )
        ( resi 37 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 38 and name C1' )
        ( resi 38 and name C2' )
        ( resi 38 and name C3' )
        ( resi 38 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 39 and name C1' )
        ( resi 39 and name C2' )
        ( resi 39 and name C3' )
        ( resi 39 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 40 and name C1' )
        ( resi 40 and name C2' )
        ( resi 40 and name C3' )
        ( resi 40 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 43 and name C1' )
        ( resi 43 and name C2' )
        ( resi 43 and name C3' )
        ( resi 43 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 44 and name C1' )
        ( resi 44 and name C2' )
        ( resi 44 and name C3' )
        ( resi 44 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 45 and name C1' )
        ( resi 45 and name C2' )
        ( resi 45 and name C3' )
        ( resi 45 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 46 and name C1' )
        ( resi 46 and name C2' )
        ( resi 46 and name C3' )
        ( resi 46 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 47 and name C1' )
        ( resi 47 and name C2' )
        ( resi 47 and name C3' )
        ( resi 47 and name C4' )   3.0    37.3    30.0   2      {*nu*}

 assign ( resi 48 and name C1' )
        ( resi 48 and name C2' )
        ( resi 48 and name C3' )
        ( resi 48 and name C4' )   3.0    37.3    30.0   2      {*nu*}

assign  ( resi  1 and name C4' )
        ( resi  1 and name C3' )
        ( resi  1 and name O3' )
        ( resi  2 and name  P  )   3.0   240.0    30.0   2      {*epsilon*}

assign  ( resi  2 and name C4' )
        ( resi  2 and name C3' )
        ( resi  2 and name O3' )
        ( resi  3 and name  P  )   3.0   241.0    30.0   2      {*epsilon*}

assign  ( resi  3 and name C4' )
        ( resi  3 and name C3' )
        ( resi  3 and name O3' )
        ( resi  4 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi  4 and name C4' )
        ( resi  4 and name C3' )
        ( resi  4 and name O3' )
        ( resi  5 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi  5 and name C4' )
        ( resi  5 and name C3' )
        ( resi  5 and name O3' )
        ( resi  6 and name  P  )   3.0   250.0    30.0   2      {*epsilon*}

assign  ( resi  6 and name C4' )
        ( resi  6 and name C3' )
        ( resi  6 and name O3' )
        ( resi  7 and name  P  )   3.0   229.0    30.0   2      {*epsilon*}

assign  ( resi  7 and name C4' )
        ( resi  7 and name C3' )
        ( resi  7 and name O3' )
        ( resi  8 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi  8 and name C4' )
        ( resi  8 and name C3' )
        ( resi  8 and name O3' )
        ( resi  9 and name  P  )   3.0   234.0    30.0   2      {*epsilon*}

assign  ( resi  9 and name C4' )
        ( resi  9 and name C3' )
        ( resi  9 and name O3' )
        ( resi 10 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 10 and name C4' )
        ( resi 10 and name C3' )
        ( resi 10 and name O3' )
        ( resi 11 and name  P  )   3.0   253.0    30.0   2      {*epsilon*}

assign  ( resi 11 and name C4' )
        ( resi 11 and name C3' )
        ( resi 11 and name O3' )
        ( resi 12 and name  P  )   3.0   242.0    30.0   2      {*epsilon*}

assign  ( resi 12 and name C4' )
        ( resi 12 and name C3' )
        ( resi 12 and name O3' )
        ( resi 13 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 13 and name C4' )
        ( resi 13 and name C3' )
        ( resi 13 and name O3' )
        ( resi 14 and name  P  )   3.0   225.0    30.0   2      {*epsilon*}

assign  ( resi 14 and name C4' )
        ( resi 14 and name C3' )
        ( resi 14 and name O3' )
        ( resi 15 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 15 and name C4' )
        ( resi 15 and name C3' )
        ( resi 15 and name O3' )
        ( resi 16 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 16 and name C4' )
        ( resi 16 and name C3' )
        ( resi 16 and name O3' )
        ( resi 17 and name  P  )   3.0   240.0    30.0   2      {*epsilon*}

assign  ( resi 17 and name C4' )
        ( resi 17 and name C3' )
        ( resi 17 and name O3' )
        ( resi 18 and name  P  )   3.0   257.0    30.0   2      {*epsilon*}

assign  ( resi 18 and name C4' )
        ( resi 18 and name C3' )
        ( resi 18 and name O3' )
        ( resi 19 and name  P  )   3.0   252.0    30.0   2      {*epsilon*}

assign  ( resi 19 and name C4' )
        ( resi 19 and name C3' )
        ( resi 19 and name O3' )
        ( resi 20 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 20 and name C4' )
        ( resi 20 and name C3' )
        ( resi 20 and name O3' )
        ( resi 21 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 21 and name C4' )
        ( resi 21 and name C3' )
        ( resi 21 and name O3' )
        ( resi 22 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 22 and name C4' )
        ( resi 22 and name C3' )
        ( resi 22 and name O3' )
        ( resi 23 and name  P  )   3.0   246.0    30.0   2      {*epsilon*}

assign  ( resi 23 and name C4' )
        ( resi 23 and name C3' )
        ( resi 23 and name O3' )
        ( resi 24 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 24 and name C4' )
        ( resi 24 and name C3' )
        ( resi 24 and name O3' )
        ( resi 25 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 25 and name C4' )
        ( resi 25 and name C3' )
        ( resi 25 and name O3' )
        ( resi 26 and name  P  )   3.0   253.0    30.0   2      {*epsilon*}

assign  ( resi 26 and name C4' )
        ( resi 26 and name C3' )
        ( resi 26 and name O3' )
        ( resi 27 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 27 and name C4' )
        ( resi 27 and name C3' )
        ( resi 27 and name O3' )
        ( resi 28 and name  P  )   3.0   236.0    30.0   2      {*epsilon*}

assign  ( resi 28 and name C4' )
        ( resi 28 and name C3' )
        ( resi 28 and name O3' )
        ( resi 29 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 29 and name C4' )
        ( resi 29 and name C3' )
        ( resi 29 and name O3' )
        ( resi 30 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 30 and name C4' )
        ( resi 30 and name C3' )
        ( resi 30 and name O3' )
        ( resi 31 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 31 and name C4' )
        ( resi 31 and name C3' )
        ( resi 31 and name O3' )
        ( resi 32 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 32 and name C4' )
        ( resi 32 and name C3' )
        ( resi 32 and name O3' )
        ( resi 33 and name  P  )   3.0   251.0    30.0   2      {*epsilon*}

assign  ( resi 33 and name C4' )
        ( resi 33 and name C3' )
        ( resi 33 and name O3' )
        ( resi 34 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 35 and name C4' )
        ( resi 35 and name C3' )
        ( resi 35 and name O3' )
        ( resi 36 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 36 and name C4' )
        ( resi 36 and name C3' )
        ( resi 36 and name O3' )
        ( resi 37 and name  P  )   3.0   210.0    30.0   2      {*epsilon*}

assign  ( resi 37 and name C4' )
        ( resi 37 and name C3' )
        ( resi 37 and name O3' )
        ( resi 38 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 38 and name C4' )
        ( resi 38 and name C3' )
        ( resi 38 and name O3' )
        ( resi 39 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 39 and name C4' )
        ( resi 39 and name C3' )
        ( resi 39 and name O3' )
        ( resi 40 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 40 and name C4' )
        ( resi 40 and name C3' )
        ( resi 40 and name O3' )
        ( resi 41 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 41 and name C4' )
        ( resi 41 and name C3' )
        ( resi 41 and name O3' )
        ( resi 42 and name  P  )   3.0   250.0    30.0   2      {*epsilon*}

assign  ( resi 42 and name C4' )
        ( resi 42 and name C3' )
        ( resi 42 and name O3' )
        ( resi 43 and name  P  )   3.0   246.0    30.0   2      {*epsilon*}

assign  ( resi 43 and name C4' )
        ( resi 43 and name C3' )
        ( resi 43 and name O3' )
        ( resi 44 and name  P  )   3.0   215.0    30.0   2      {*epsilon*}

assign  ( resi 44 and name C4' )
        ( resi 44 and name C3' )
        ( resi 44 and name O3' )
        ( resi 45 and name  P  )   3.0   198.0    30.0   2      {*epsilon*}

assign  ( resi 45 and name C4' )
        ( resi 45 and name C3' )
        ( resi 45 and name O3' )
        ( resi 46 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 46 and name C4' )
        ( resi 46 and name C3' )
        ( resi 46 and name O3' )
        ( resi 47 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

assign  ( resi 47 and name C4' )
        ( resi 47 and name C3' )
        ( resi 47 and name O3' )
        ( resi 48 and name  P  )   3.0   220.0    30.0   2      {*epsilon*}

! Residual dipolar coupling restraints
assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 16  and name H1' )
        ( resid 16  and name C1' )	-3.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 17  and name H1' )
        ( resid 17  and name C1' )	28.6	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 17  and name H5  )
        ( resid 17  and name C5  )	16.0	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 17  and name H6  )
        ( resid 17  and name C6  )	-0.6	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 21  and name H1' )
        ( resid 21  and name C1' )	8.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 23  and name H1' )
        ( resid 23  and name C1' )	13.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 33  and name H1' )
        ( resid 33  and name C1' )	-56.6	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 6   and name H5  )
        ( resid 6   and name C5  )	4.4	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 6   and name H6  )
        ( resid 6   and name C6  )	-5.6	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 6   and name H1' )
        ( resid 6   and name C1' )	-2.7	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 5   and name H1' )
        ( resid 5   and name C1' )	2.1	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 10  and name H8  )
        ( resid 10  and name C8 )	6.1	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 11  and name H8  )
        ( resid 11  and name C8 )	5.5	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 11  and name H2  )
        ( resid 11  and name C2 )	6.2	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 12  and name H2  )
        ( resid 12  and name C2 )	-5.8	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 12  and name H8  )
        ( resid 12  and name C8 )	-0.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 30  and name H8  )
        ( resid 30  and name C8 )	1.8	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 29  and name H2  )
        ( resid 29  and name C2 )	-2.5	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  2  and name H8  )
        ( resid  2  and name C8 )	10.6	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  8  and name H8  )
        ( resid  8  and name C8 )	4.9	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  9  and name H8  )
        ( resid  9  and name C8 )	-3.8	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  1  and name H8  )
        ( resid  1  and name C8 )	20.4	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  3  and name H6  )
        ( resid  3  and name C6 )	-50.0	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid  4  and name H6  )
        ( resid  4  and name C6 )	-49.0	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 36  and name H6  )
        ( resid 36  and name C6 )	12.5	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 43  and name H6  )
        ( resid 43  and name C6 )	6.7	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 45  and name H6  )
        ( resid 45  and name C6 )	-4.4	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 46  and name H5  )
        ( resid 46  and name C5 )	7.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 47  and name H6  )
        ( resid 47  and name C6 )	-4.0	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 38  and name H8  )
        ( resid 38  and name C8 )	12.2	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 25  and name H6  )
        ( resid 25  and name C6 )	4.3	2.0	2.0

assign  ( resid 500 and name OO  )
        ( resid 500 and name Z   )
        ( resid 500 and name X   )
        ( resid 500 and name Y   )
        ( resid 26  and name H8  )
        ( resid 26  and name C8 )	12.2	2.0	2.0

----------------
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1   9.985 -31.100   4.188
    2   2H5*    G   1          2H5*        G   1  10.050 -30.254   2.628
    3    H4*    G   1           H4*        G   1  10.268 -32.485   1.973
    4    H3*    G   1           H3*        G   1   7.444 -31.484   1.782
    5    H2*    G   1           H2*        G   1   6.521 -33.642   1.436
    6   2HO*    G   1          2HO*        G   1   8.840 -35.122   1.436
    7    H1*    G   1           H1*        G   1   7.815 -34.987   3.321
    8    H8     G   1           H8         G   1   7.822 -31.954   5.230
    9    H1     G   1           H1         G   1   1.779 -33.699   4.188
   10   1H2     G   1          1H2         G   1   1.691 -35.218   2.579
   11   2H2     G   1          2H2         G   1   3.123 -35.805   1.760
   12    H5T    G   1           H5T        G   1   8.232 -29.942   4.361
   13   1H5*    G   2          1H5*        G   2   6.993 -33.690  -1.396
   14   2H5*    G   2          2H5*        G   2   7.175 -32.717  -2.868
   15    H4*    G   2           H4*        G   2   5.159 -33.842  -3.258
   16    H3*    G   2           H3*        G   2   4.604 -31.130  -2.000
   17    H2*    G   2           H2*        G   2   2.276 -31.605  -2.119
   18   2HO*    G   2          2HO*        G   2   3.124 -33.333  -4.124
   19    H1*    G   2           H1*        G   2   2.401 -34.208  -1.320
   20    H8     G   2           H8         G   2   4.825 -32.489   0.887
   21    H1     G   2           H1         G   2  -1.173 -30.945   2.385
   22   1H2     G   2          1H2         G   2  -2.554 -31.619   0.781
   23   2H2     G   2          2H2         G   2  -1.993 -32.448  -0.653
   24   1H5*    C   3          1H5*        C   3   1.445 -30.873  -4.761
   25   2H5*    C   3          2H5*        C   3   1.890 -29.446  -5.719
   26    H4*    C   3           H4*        C   3  -0.318 -29.076  -4.796
   27    H3*    C   3           H3*        C   3   1.940 -27.506  -3.509
   28    H2*    C   3           H2*        C   3   0.404 -26.494  -2.042
   29   2HO*    C   3          2HO*        C   3  -1.411 -27.088  -4.114
   30    H1*    C   3           H1*        C   3  -1.359 -28.654  -1.763
   31   1H4     C   3          1H4         C   3   1.985 -28.105   3.637
   32   2H4     C   3          2H4         C   3   3.329 -28.950   2.904
   33    H5     C   3           H5         C   3   3.369 -29.609   0.583
   34    H6     C   3           H6         C   3   2.130 -29.594  -1.525
   35   1H5*    C   4          1H5*        C   4  -1.209 -24.720  -5.755
   36   2H5*    C   4          2H5*        C   4  -0.611 -23.049  -5.736
   37    H4*    C   4           H4*        C   4  -2.888 -23.660  -4.547
   38    H3*    C   4           H3*        C   4  -0.685 -21.796  -3.636
   39    H2*    C   4           H2*        C   4  -1.760 -21.438  -1.566
   40   2HO*    C   4          2HO*        C   4  -3.860 -21.222  -1.654
   41    H1*    C   4           H1*        C   4  -2.557 -23.960  -1.040
   42   1H4     C   4          1H4         C   4   3.097 -23.130   1.778
   43   2H4     C   4          2H4         C   4   3.904 -23.670   0.321
   44    H5     C   4           H5         C   4   2.737 -24.141  -1.736
   45    H6     C   4           H6         C   4   0.548 -24.196  -2.838
   46   1H5*    U   5          1H5*        U   5  -4.709 -19.632  -2.739
   47   2H5*    U   5          2H5*        U   5  -4.258 -17.933  -2.987
   48    H4*    U   5           H4*        U   5  -5.150 -18.716  -0.637
   49    H3*    U   5           H3*        U   5  -2.810 -16.885  -1.238
   50    H2*    U   5           H2*        U   5  -2.241 -16.784   1.022
   51   2HO*    U   5          2HO*        U   5  -4.199 -16.029   1.796
   52    H1*    U   5           H1*        U   5  -3.353 -19.284   1.839
   53    H3     U   5           H3         U   5   0.917 -19.001   3.456
   54    H5     U   5           H5         U   5   1.315 -20.028  -0.614
   55    H6     U   5           H6         U   5  -1.055 -19.611  -0.880
   56   1H5*    U   6          1H5*        U   6  -6.100 -13.716   1.153
   57   2H5*    U   6          2H5*        U   6  -6.823 -14.854  -0.002
   58    H4*    U   6           H4*        U   6  -7.691 -13.015  -1.347
   59    H3*    U   6           H3*        U   6  -5.935 -11.351   0.474
   60    H2*    U   6           H2*        U   6  -7.567  -9.715   0.674
   61   2HO*    U   6          2HO*        U   6  -7.540  -9.676  -1.794
   62    H1*    U   6           H1*        U   6  -9.849 -11.308  -0.040
   63    H3     U   6           H3         U   6 -11.036  -8.739   3.532
   64    H5     U   6           H5         U   6  -8.402 -11.626   5.112
   65    H6     U   6           H6         U   6  -7.945 -12.352   2.843
   66   1H5*    A   7          1H5*        A   7  -5.912  -9.425  -4.187
   67   2H5*    A   7          2H5*        A   7  -4.851  -8.012  -4.012
   68    H4*    A   7           H4*        A   7  -7.279  -7.682  -4.939
   69    H3*    A   7           H3*        A   7  -5.772  -6.019  -2.918
   70    H2*    A   7           H2*        A   7  -7.660  -4.680  -2.463
   71   2HO*    A   7          2HO*        A   7  -9.326  -4.430  -3.882
   72    H1*    A   7           H1*        A   7  -9.598  -6.605  -2.509
   73    H8     A   7           H8         A   7  -6.804  -8.260  -0.742
   74   1H6     A   7          1H6         A   7  -8.112  -4.907   4.256
   75   2H6     A   7          2H6         A   7  -7.201  -6.267   3.639
   76    H2     A   7           H2         A   7 -10.404  -3.193   0.790
   77   1H5*    G   8          1H5*        G   8  -7.009  -3.031  -6.216
   78   2H5*    G   8          2H5*        G   8  -5.896  -1.654  -6.078
   79    H4*    G   8           H4*        G   8  -8.459  -1.343  -5.530
   80    H3*    G   8           H3*        G   8  -6.022  -0.217  -4.165
   81    H2*    G   8           H2*        G   8  -7.248   0.616  -2.356
   82   2HO*    G   8          2HO*        G   8  -9.160   0.905  -4.298
   83    H1*    G   8           H1*        G   8  -9.211  -1.307  -2.150
   84    H8     G   8           H8         G   8  -6.033  -3.180  -2.438
   85    H1     G   8           H1         G   8  -6.502  -0.265   3.215
   86   1H2     G   8          1H2         G   8  -8.177   1.192   3.179
   87   2H2     G   8          2H2         G   8  -9.174   1.442   1.764
   88   1H5*    G   9          1H5*        G   9  -9.356   3.274  -5.441
   89   2H5*    G   9          2H5*        G   9  -8.383   4.749  -5.270
   90    H4*    G   9           H4*        G   9 -10.689   4.531  -4.007
   91    H3*    G   9           H3*        G   9  -8.082   5.742  -3.116
   92    H2*    G   9           H2*        G   9  -8.807   5.993  -0.871
   93   2HO*    G   9          2HO*        G   9 -11.439   5.161  -1.533
   94    H1*    G   9           H1*        G   9  -9.989   3.615  -0.517
   95    H8     G   9           H8         G   9  -7.259   2.734  -2.843
   96    H1     G   9           H1         G   9  -4.971   4.073   2.951
   97   1H2     G   9          1H2         G   9  -6.545   5.030   4.187
   98   2H2     G   9          2H2         G   9  -8.159   5.338   3.584
   99   1H5*    A  10          1H5*        A  10 -10.364   9.364  -2.163
  100   2H5*    A  10          2H5*        A  10  -9.202  10.655  -2.526
  101    H4*    A  10           H4*        A  10  -9.715  10.122  -0.031
  102    H3*    A  10           H3*        A  10  -6.963  10.434  -1.277
  103    H2*    A  10           H2*        A  10  -5.973  10.054   0.829
  104   2HO*    A  10          2HO*        A  10  -7.779   9.911   2.653
  105    H1*    A  10           H1*        A  10  -7.770   8.148   1.758
  106    H8     A  10           H8         A  10  -6.997   6.922  -1.588
  107   1H6     A  10          1H6         A  10  -1.379   5.272   0.321
  108   2H6     A  10          2H6         A  10  -2.559   5.120  -0.961
  109    H2     A  10           H2         A  10  -3.194   7.930   3.456
  110   1H5*    A  11          1H5*        A  11  -7.310  14.065   1.645
  111   2H5*    A  11          2H5*        A  11  -6.072  15.214   1.096
  112    H4*    A  11           H4*        A  11  -5.802  14.103   3.443
  113    H3*    A  11           H3*        A  11  -3.709  14.479   1.296
  114    H2*    A  11           H2*        A  11  -2.092  13.298   2.569
  115   2HO*    A  11          2HO*        A  11  -2.156  13.813   4.634
  116    H1*    A  11           H1*        A  11  -3.664  11.271   3.443
  117    H8     A  11           H8         A  11  -4.906  11.785  -0.001
  118   1H6     A  11          1H6         A  11   0.183   9.045  -2.133
  119   2H6     A  11          2H6         A  11  -1.415   9.628  -2.549
  120    H2     A  11           H2         A  11   0.786   9.903   2.236
  121   1H5*    A  12          1H5*        A  12  -1.027  15.425   4.324
  122   2H5*    A  12          2H5*        A  12  -0.111  16.782   3.640
  123    H4*    A  12           H4*        A  12   1.219  14.648   3.918
  124    H3*    A  12           H3*        A  12   0.860  16.012   1.232
  125    H2*    A  12           H2*        A  12   2.190  14.351   0.216
  126   2HO*    A  12          2HO*        A  12   3.191  12.757   1.913
  127    H1*    A  12           H1*        A  12   1.289  12.182   1.597
  128    H8     A  12           H8         A  12  -1.629  14.288   0.689
  129   1H6     A  12          1H6         A  12  -1.148  12.257  -5.102
  130   2H6     A  12          2H6         A  12  -2.148  13.152  -3.979
  131    H2     A  12           H2         A  12   2.492  10.922  -2.832
  132   1H5*    C  13          1H5*        C  13   5.281  16.127   2.824
  133   2H5*    C  13          2H5*        C  13   6.277  17.249   1.874
  134    H4*    C  13           H4*        C  13   7.056  14.799   1.983
  135    H3*    C  13           H3*        C  13   6.661  16.391  -0.575
  136    H2*    C  13           H2*        C  13   7.438  14.496  -1.819
  137   2HO*    C  13          2HO*        C  13   7.909  12.564  -0.198
  138    H1*    C  13           H1*        C  13   5.905  12.671  -0.598
  139   1H4     C  13          1H4         C  13   2.520  15.254  -5.380
  140   2H4     C  13          2H4         C  13   1.699  16.257  -4.209
  141    H5     C  13           H5         C  13   2.327  16.360  -1.891
  142    H6     C  13           H6         C  13   3.870  15.521  -0.187
  143   1H5*    A  14          1H5*        A  14  11.070  15.194  -0.975
  144   2H5*    A  14          2H5*        A  14  11.666  16.398  -2.134
  145    H4*    A  14           H4*        A  14  11.511  13.849  -2.815
  146    H3*    A  14           H3*        A  14  10.673  16.237  -4.517
  147    H2*    A  14           H2*        A  14  10.301  14.658  -6.293
  148   2HO*    A  14          2HO*        A  14  10.962  12.359  -4.953
  149    H1*    A  14           H1*        A  14   8.992  12.835  -4.759
  150    H8     A  14           H8         A  14   7.615  15.918  -3.361
  151   1H6     A  14          1H6         A  14   4.283  16.722  -8.467
  152   2H6     A  14          2H6         A  14   4.515  17.230  -6.810
  153    H2     A  14           H2         A  14   7.369  13.564  -9.302
  154   1H5*    G  15          1H5*        G  15  13.603  14.678  -6.759
  155   2H5*    G  15          2H5*        G  15  14.881  15.757  -7.350
  156    H4*    G  15           H4*        G  15  13.817  14.895  -9.301
  157    H3*    G  15           H3*        G  15  12.815  17.683  -8.600
  158    H2*    G  15           H2*        G  15  11.599  17.629 -10.683
  159   2HO*    G  15          2HO*        G  15  12.626  15.057 -11.296
  160    H1*    G  15           H1*        G  15  10.580  15.133 -10.303
  161    H8     G  15           H8         G  15  10.662  16.596  -6.880
  162    H1     G  15           H1         G  15   6.140  19.302 -10.449
  163   1H2     G  15          1H2         G  15   6.397  18.722 -12.575
  164   2H2     G  15          2H2         G  15   7.687  17.670 -13.112
  165   1H5*    U  16          1H5*        U  16  13.594  17.859 -11.947
  166   2H5*    U  16          2H5*        U  16  14.542  19.061 -12.842
  167    H4*    U  16           H4*        U  16  12.379  19.326 -13.713
  168    H3*    U  16           H3*        U  16  12.775  21.307 -11.426
  169    H2*    U  16           H2*        U  16  10.654  22.199 -11.996
  170   2HO*    U  16          2HO*        U  16  11.396  21.578 -14.454
  171    H1*    U  16           H1*        U  16   9.457  19.747 -12.606
  172    H3     U  16           H3         U  16   7.255  21.609  -9.071
  173    H5     U  16           H5         U  16  10.782  19.978  -7.449
  174    H6     U  16           H6         U  16  11.546  19.540  -9.690
  175   1H5*    U  17          1H5*        U  17  12.097  24.920 -12.362
  176   2H5*    U  17          2H5*        U  17  11.217  23.788 -13.404
  177    H4*    U  17           H4*        U  17  11.983  26.665 -14.036
  178    H3*    U  17           H3*        U  17   9.778  25.896 -12.700
  179    H2*    U  17           H2*        U  17   9.100  24.125 -14.166
  180   2HO*    U  17          2HO*        U  17   7.206  24.883 -14.758
  181    H1*    U  17           H1*        U  17   9.532  25.719 -16.659
  182    H3     U  17           H3         U  17   8.176  21.644 -18.223
  183    H5     U  17           H5         U  17  11.745  20.862 -16.123
  184    H6     U  17           H6         U  17  11.771  23.166 -15.424
  185   1H5*    C  18          1H5*        C  18   5.956  26.522 -14.512
  186   2H5*    C  18          2H5*        C  18   5.843  28.196 -13.931
  187    H4*    C  18           H4*        C  18   4.044  26.533 -13.106
  188    H3*    C  18           H3*        C  18   5.025  28.813 -11.933
  189    H2*    C  18           H2*        C  18   6.773  27.741 -10.685
  190   2HO*    C  18          2HO*        C  18   5.712  27.297  -8.507
  191    H1*    C  18           H1*        C  18   4.868  25.526  -9.908
  192   1H4     C  18          1H4         C  18  10.432  23.332  -7.728
  193   2H4     C  18          2H4         C  18  11.069  23.290  -9.358
  194    H5     C  18           H5         C  18   9.869  24.124 -11.267
  195    H6     C  18           H6         C  18   7.794  25.179 -12.034
  196   1H5*    G  19          1H5*        G  19   0.668  25.914 -11.443
  197   2H5*    G  19          2H5*        G  19   2.405  26.113 -11.739
  198    H4*    G  19           H4*        G  19   0.367  26.114 -13.991
  199    H3*    G  19           H3*        G  19   1.800  23.776 -12.661
  200    H2*    G  19           H2*        G  19   1.923  22.765 -14.801
  201   2HO*    G  19          2HO*        G  19   0.462  24.515 -16.297
  202    H1*    G  19           H1*        G  19   2.312  25.134 -16.248
  203    H8     G  19           H8         G  19   4.521  24.314 -17.210
  204    H1     G  19           H1         G  19   6.713  22.219 -11.601
  205   1H2     G  19          1H2         G  19   5.215  22.597 -10.011
  206   2H2     G  19          2H2         G  19   3.675  23.363 -10.333
  207   1H5*    C  20          1H5*        C  20  -0.521  22.296 -15.029
  208   2H5*    C  20          2H5*        C  20  -1.239  20.692 -14.774
  209    H4*    C  20           H4*        C  20   0.535  20.701 -16.535
  210    H3*    C  20           H3*        C  20   0.729  19.021 -14.035
  211    H2*    C  20           H2*        C  20   2.901  18.262 -14.601
  212   2HO*    C  20          2HO*        C  20   1.979  18.616 -17.109
  213    H1*    C  20           H1*        C  20   3.960  20.598 -15.467
  214   1H4     C  20          1H4         C  20   5.112  20.076  -9.197
  215   2H4     C  20          2H4         C  20   3.677  21.026  -8.881
  216    H5     C  20           H5         C  20   2.134  21.694 -10.592
  217    H6     C  20           H6         C  20   1.623  21.605 -12.984
  218   1H5*    U  21          1H5*        U  21   2.383  16.853 -16.667
  219   2H5*    U  21          2H5*        U  21   1.401  15.513 -17.295
  220    H4*    U  21           H4*        U  21   3.482  14.495 -17.005
  221    H3*    U  21           H3*        U  21   1.733  14.085 -14.570
  222    H2*    U  21           H2*        U  21   3.496  12.961 -13.446
  223   2HO*    U  21          2HO*        U  21   5.527  12.604 -14.787
  224    H1*    U  21           H1*        U  21   5.534  14.621 -14.150
  225    H3     U  21           H3         U  21   4.811  15.657  -9.815
  226    H5     U  21           H5         U  21   1.544  17.400 -11.830
  227    H6     U  21           H6         U  21   2.295  16.302 -13.860
  228   1H5*    G  22          1H5*        G  22   3.513  10.417 -15.257
  229   2H5*    G  22          2H5*        G  22   2.602   9.081 -14.525
  230    H4*    G  22           H4*        G  22   4.832   9.826 -13.401
  231    H3*    G  22           H3*        G  22   2.177   9.313 -12.033
  232    H2*    G  22           H2*        G  22   2.992  10.144 -10.031
  233   2HO*    G  22          2HO*        G  22   5.527   9.152 -10.892
  234    H1*    G  22           H1*        G  22   5.300  11.527 -11.095
  235    H8     G  22           H8         G  22   2.060  13.184 -11.831
  236    H1     G  22           H1         G  22   3.828  14.116  -5.783
  237   1H2     G  22          1H2         G  22   5.535  12.795  -5.280
  238   2H2     G  22          2H2         G  22   6.237  11.687  -6.437
  239   1H5*    U  23          1H5*        U  23   5.298   6.017 -10.250
  240   2H5*    U  23          2H5*        U  23   4.178   4.897  -9.448
  241    H4*    U  23           H4*        U  23   6.008   6.163  -8.036
  242    H3*    U  23           H3*        U  23   3.101   5.651  -7.361
  243    H2*    U  23           H2*        U  23   3.282   6.899  -5.382
  244   2HO*    U  23          2HO*        U  23   6.108   7.014  -5.523
  245    H1*    U  23           H1*        U  23   5.129   8.805  -6.239
  246    H3     U  23           H3         U  23   1.181  10.700  -4.832
  247    H5     U  23           H5         U  23   0.631   9.721  -8.898
  248    H6     U  23           H6         U  23   2.725   8.497  -8.815
  249   1H5*    G  24          1H5*        G  24   4.904   0.523  -6.086
  250   2H5*    G  24          2H5*        G  24   5.685   0.922  -4.543
  251    H4*    G  24           H4*        G  24   6.543   1.609  -7.353
  252    H3*    G  24           H3*        G  24   7.683   0.181  -4.965
  253    H2*    G  24           H2*        G  24   9.818   1.169  -5.192
  254   2HO*    G  24          2HO*        G  24   9.607   2.675  -7.400
  255    H1*    G  24           H1*        G  24   9.113   3.697  -5.690
  256    H8     G  24           H8         G  24   6.352   2.804  -3.458
  257    H1     G  24           H1         G  24  11.861   2.873  -0.251
  258   1H2     G  24          1H2         G  24  13.566   2.918  -1.670
  259   2H2     G  24          2H2         G  24  13.344   2.931  -3.406
  260   1H5*    C  25          1H5*        C  25  11.100   0.201  -6.751
  261   2H5*    C  25          2H5*        C  25  11.260  -1.384  -7.535
  262    H4*    C  25           H4*        C  25  13.307  -1.201  -6.436
  263    H3*    C  25           H3*        C  25  11.317  -2.637  -4.653
  264    H2*    C  25           H2*        C  25  12.908  -2.746  -2.923
  265   2HO*    C  25          2HO*        C  25  14.991  -1.891  -4.657
  266    H1*    C  25           H1*        C  25  14.144  -0.296  -3.339
  267   1H4     C  25          1H4         C  25  10.231   0.408   1.632
  268   2H4     C  25          2H4         C  25   8.870   0.603   0.552
  269    H5     C  25           H5         C  25   9.036   0.346  -1.842
  270    H6     C  25           H6         C  25  10.543  -0.157  -3.702
  271   1H5*    C  26          1H5*        C  26  14.864  -3.980  -4.508
  272   2H5*    C  26          2H5*        C  26  15.314  -5.498  -5.309
  273    H4*    C  26           H4*        C  26  16.660  -5.630  -3.436
  274    H3*    C  26           H3*        C  26  13.979  -6.891  -2.797
  275    H2*    C  26           H2*        C  26  14.653  -7.238  -0.544
  276   2HO*    C  26          2HO*        C  26  16.679  -7.679  -0.130
  277    H1*    C  26           H1*        C  26  15.801  -4.830  -0.109
  278   1H4     C  26          1H4         C  26   9.742  -4.003   1.629
  279   2H4     C  26          2H4         C  26   9.216  -4.032  -0.039
  280    H5     C  26           H5         C  26  10.706  -4.438  -1.886
  281    H6     C  26           H6         C  26  13.022  -4.905  -2.539
  282   1H5*    G  27          1H5*        G  27  16.905  -9.874  -1.157
  283   2H5*    G  27          2H5*        G  27  15.969 -11.379  -1.073
  284    H4*    G  27           H4*        G  27  16.693 -10.129   1.145
  285    H3*    G  27           H3*        G  27  13.986 -11.380   0.527
  286    H2*    G  27           H2*        G  27  13.267 -10.769   2.687
  287   2HO*    G  27          2HO*        G  27  15.211 -11.637   3.696
  288    H1*    G  27           H1*        G  27  14.728  -8.372   2.881
  289    H8     G  27           H8         G  27  12.810  -8.299  -0.297
  290    H1     G  27           H1         G  27   8.968  -7.577   4.737
  291   1H2     G  27          1H2         G  27  10.071  -8.035   6.606
  292   2H2     G  27          2H2         G  27  11.752  -8.518   6.610
  293   1H5*    A  28          1H5*        A  28  15.522 -14.421   3.820
  294   2H5*    A  28          2H5*        A  28  14.451 -15.798   3.495
  295    H4*    A  28           H4*        A  28  14.239 -14.448   5.758
  296    H3*    A  28           H3*        A  28  12.013 -15.488   3.971
  297    H2*    A  28           H2*        A  28  10.410 -14.582   5.454
  298   2HO*    A  28          2HO*        A  28  10.976 -15.107   7.463
  299    H1*    A  28           H1*        A  28  11.758 -12.249   6.094
  300    H8     A  28           H8         A  28  12.027 -12.589   2.413
  301   1H6     A  28          1H6         A  28   6.140 -10.841   1.920
  302   2H6     A  28          2H6         A  28   7.622 -11.149   1.043
  303    H2     A  28           H2         A  28   6.993 -11.660   6.255
  304   1H5*    A  29          1H5*        A  29  12.076 -17.746   8.251
  305   2H5*    A  29          2H5*        A  29  10.845 -19.023   8.184
  306    H4*    A  29           H4*        A  29  10.652 -17.086   9.968
  307    H3*    A  29           H3*        A  29   8.517 -18.433   8.316
  308    H2*    A  29           H2*        A  29   6.849 -16.907   9.037
  309   2HO*    A  29          2HO*        A  29   7.258 -15.434  10.766
  310    H1*    A  29           H1*        A  29   8.239 -14.622   8.769
  311    H8     A  29           H8         A  29   9.662 -16.576   5.991
  312   1H6     A  29          1H6         A  29   4.387 -15.909   2.875
  313   2H6     A  29          2H6         A  29   6.060 -16.408   2.770
  314    H2     A  29           H2         A  29   3.681 -14.592   7.112
  315   1H5*    A  30          1H5*        A  30   6.817 -19.617  12.554
  316   2H5*    A  30          2H5*        A  30   5.908 -21.070  12.090
  317    H4*    A  30           H4*        A  30   4.629 -18.894  12.870
  318    H3*    A  30           H3*        A  30   3.952 -20.786  10.599
  319    H2*    A  30           H2*        A  30   2.075 -19.434  10.029
  320   2HO*    A  30          2HO*        A  30   2.039 -17.421  11.695
  321    H1*    A  30           H1*        A  30   3.304 -17.034  10.168
  322    H8     A  30           H8         A  30   6.091 -18.947   8.822
  323   1H6     A  30          1H6         A  30   3.156 -19.505   3.439
  324   2H6     A  30          2H6         A  30   4.688 -19.687   4.263
  325    H2     A  30           H2         A  30   0.199 -18.039   6.490
  326   1H5*    G  31          1H5*        G  31   0.626 -19.875  11.756
  327   2H5*    G  31          2H5*        G  31  -0.310 -21.071  12.672
  328    H4*    G  31           H4*        G  31  -1.865 -20.246  11.113
  329    H3*    G  31           H3*        G  31  -0.555 -22.781  10.067
  330    H2*    G  31           H2*        G  31  -1.871 -22.617   8.110
  331   2HO*    G  31          2HO*        G  31  -3.530 -21.055   9.780
  332    H1*    G  31           H1*        G  31  -1.841 -19.843   7.868
  333    H8     G  31           H8         G  31   1.649 -20.900   8.503
  334    H1     G  31           H1         G  31  -0.210 -22.504   2.618
  335   1H2     G  31          1H2         G  31  -2.405 -22.257   2.424
  336   2H2     G  31          2H2         G  31  -3.407 -21.697   3.743
  337   1H5*    G  32          1H5*        G  32  -5.141 -23.666  10.777
  338   2H5*    G  32          2H5*        G  32  -5.340 -25.426  10.654
  339    H4*    G  32           H4*        G  32  -6.497 -23.834   8.895
  340    H3*    G  32           H3*        G  32  -5.091 -26.478   8.460
  341    H2*    G  32           H2*        G  32  -5.348 -26.298   6.117
  342   2HO*    G  32          2HO*        G  32  -7.043 -25.334   5.258
  343    H1*    G  32           H1*        G  32  -4.839 -23.622   5.842
  344    H8     G  32           H8         G  32  -2.329 -24.742   8.322
  345    H1     G  32           H1         G  32  -0.998 -26.997   2.510
  346   1H2     G  32          1H2         G  32  -2.732 -26.694   1.161
  347   2H2     G  32          2H2         G  32  -4.216 -25.935   1.696
  348   1H5*    U  33          1H5*        U  33  -7.990 -27.615   6.010
  349   2H5*    U  33          2H5*        U  33  -8.456 -29.264   6.480
  350    H4*    U  33           H4*        U  33  -7.287 -29.141   4.259
  351    H3*    U  33           H3*        U  33  -6.252 -30.768   6.585
  352    H2*    U  33           H2*        U  33  -4.240 -31.173   5.559
  353   2HO*    U  33          2HO*        U  33  -4.121 -31.788   3.456
  354    H1*    U  33           H1*        U  33  -4.357 -29.141   3.519
  355    H3     U  33           H3         U  33  -0.036 -29.558   4.958
  356    H5     U  33           H5         U  33  -2.045 -27.533   8.064
  357    H6     U  33           H6         U  33  -4.131 -27.953   6.899
  358   1H5*    C  34          1H5*        C  34  -6.468 -33.259   3.113
  359   2H5*    C  34          2H5*        C  34  -7.446 -34.724   3.331
  360    H4*    C  34           H4*        C  34  -5.550 -35.721   2.509
  361    H3*    C  34           H3*        C  34  -5.022 -35.289   5.465
  362    H2*    C  34           H2*        C  34  -2.889 -36.211   5.213
  363   2HO*    C  34          2HO*        C  34  -3.145 -37.051   2.577
  364    H1*    C  34           H1*        C  34  -2.386 -35.191   2.653
  365   1H4     C  34          1H4         C  34   1.049 -31.530   6.524
  366   2H4     C  34          2H4         C  34  -0.385 -30.972   7.355
  367    H5     C  34           H5         C  34  -2.597 -31.767   6.852
  368    H6     C  34           H6         C  34  -3.927 -33.261   5.428
  369    H3T    C  34           H3T        C  34  -5.021 -37.822   4.628
  370   1H5*    U  35          1H5*        U  35  -4.484 -14.226   3.697
  371   2H5*    U  35          2H5*        U  35  -4.727 -12.498   3.366
  372    H4*    U  35           H4*        U  35  -3.884 -12.606   5.591
  373    H3*    U  35           H3*        U  35  -1.885 -11.783   3.489
  374    H2*    U  35           H2*        U  35  -0.097 -11.794   5.016
  375   2HO*    U  35          2HO*        U  35  -2.069 -11.862   7.091
  376    H1*    U  35           H1*        U  35  -0.775 -13.985   6.513
  377    H3     U  35           H3         U  35   2.910 -15.260   4.227
  378    H5     U  35           H5         U  35  -0.114 -15.159   1.291
  379    H6     U  35           H6         U  35  -1.609 -14.224   2.959
  380    H5T    U  35           H5T        U  35  -3.635 -13.093   1.642
  381   1H5*    U  36          1H5*        U  36  -2.096  -8.813   7.141
  382   2H5*    U  36          2H5*        U  36  -1.169  -7.353   6.745
  383    H4*    U  36           H4*        U  36  -0.419  -8.898   8.752
  384    H3*    U  36           H3*        U  36   1.290  -7.524   6.660
  385    H2*    U  36           H2*        U  36   3.248  -8.499   7.587
  386   2HO*    U  36          2HO*        U  36   2.958  -8.252   9.767
  387    H1*    U  36           H1*        U  36   2.280 -11.009   7.962
  388    H3     U  36           H3         U  36   5.189 -10.880   4.416
  389    H5     U  36           H5         U  36   1.445  -9.779   2.825
  390    H6     U  36           H6         U  36   0.579  -9.701   5.091
  391   1H5*    C  37          1H5*        C  37   2.910  -5.728  10.806
  392   2H5*    C  37          2H5*        C  37   3.526  -4.164  10.239
  393    H4*    C  37           H4*        C  37   5.185  -5.791  11.402
  394    H3*    C  37           H3*        C  37   5.633  -4.323   8.783
  395    H2*    C  37           H2*        C  37   7.791  -5.299   8.611
  396   2HO*    C  37          2HO*        C  37   8.424  -5.015  10.795
  397    H1*    C  37           H1*        C  37   7.105  -7.830   9.358
  398   1H4     C  37          1H4         C  37   6.797  -7.324   2.983
  399   2H4     C  37          2H4         C  37   5.098  -6.927   3.112
  400    H5     C  37           H5         C  37   3.979  -6.589   5.217
  401    H6     C  37           H6         C  37   4.248  -6.548   7.656
  402   1H5*    G  38          1H5*        G  38   8.478  -1.974  12.082
  403   2H5*    G  38          2H5*        G  38   8.919  -0.518  11.169
  404    H4*    G  38           H4*        G  38  10.812  -2.109  12.022
  405    H3*    G  38           H3*        G  38  10.529  -0.756   9.342
  406    H2*    G  38           H2*        G  38  12.385  -1.914   8.439
  407   2HO*    G  38          2HO*        G  38  14.021  -2.080   9.783
  408    H1*    G  38           H1*        G  38  11.880  -4.381   9.419
  409    H8     G  38           H8         G  38   8.467  -3.160   8.751
  410    H1     G  38           H1         G  38  11.645  -4.133   3.305
  411   1H2     G  38          1H2         G  38  13.803  -4.416   3.728
  412   2H2     G  38          2H2         G  38  14.457  -4.363   5.349
  413   1H5*    G  39          1H5*        G  39  14.734   0.939  10.817
  414   2H5*    G  39          2H5*        G  39  14.815   2.451   9.888
  415    H4*    G  39           H4*        G  39  16.577   0.549   9.449
  416    H3*    G  39           H3*        G  39  15.163   2.379   7.531
  417    H2*    G  39           H2*        G  39  15.874   1.196   5.620
  418   2HO*    G  39          2HO*        G  39  17.970   0.540   7.288
  419    H1*    G  39           H1*        G  39  15.599  -1.349   6.503
  420    H8     G  39           H8         G  39  12.671   0.226   8.060
  421    H1     G  39           H1         G  39  11.995  -0.019   1.727
  422   1H2     G  39          1H2         G  39  13.936  -0.511   0.777
  423   2H2     G  39          2H2         G  39  15.396  -0.779   1.704
  424   1H5*    C  40          1H5*        C  40  18.010   1.563   5.001
  425   2H5*    C  40          2H5*        C  40  19.232   2.814   5.309
  426    H4*    C  40           H4*        C  40  19.194   2.943   3.017
  427    H3*    C  40           H3*        C  40  16.992   4.733   4.066
  428    H2*    C  40           H2*        C  40  16.192   5.139   1.885
  429   2HO*    C  40          2HO*        C  40  18.819   4.409   1.179
  430    H1*    C  40           H1*        C  40  16.554   2.630   0.818
  431   1H4     C  40          1H4         C  40  10.442   2.829   2.539
  432   2H4     C  40          2H4         C  40  10.874   2.840   4.234
  433    H5     C  40           H5         C  40  13.151   2.901   5.015
  434    H6     C  40           H6         C  40  15.506   2.963   4.342
  435   1H5*    U  41          1H5*        U  41  16.227   7.868   3.838
  436   2H5*    U  41          2H5*        U  41  15.553   7.322   2.290
  437    H4*    U  41           H4*        U  41  15.711   9.947   3.094
  438    H3*    U  41           H3*        U  41  15.405   8.542   0.448
  439    H2*    U  41           H2*        U  41  15.899  10.480  -0.795
  440   2HO*    U  41          2HO*        U  41  15.742  12.550   0.079
  441    H1*    U  41           H1*        U  41  17.880  11.541   0.751
  442    H3     U  41           H3         U  41  19.521   9.931  -3.235
  443    H5     U  41           H5         U  41  19.606   6.680  -0.553
  444    H6     U  41           H6         U  41  18.332   8.025   1.014
  445   1H5*    C  42          1H5*        C  42  12.336  10.466  -1.972
  446   2H5*    C  42          2H5*        C  42  11.073   9.663  -1.018
  447    H4*    C  42           H4*        C  42  10.974   9.063  -3.436
  448    H3*    C  42           H3*        C  42  11.487   6.992  -1.293
  449    H2*    C  42           H2*        C  42  11.755   5.292  -2.890
  450   2HO*    C  42          2HO*        C  42   9.808   6.561  -4.102
  451    H1*    C  42           H1*        C  42  12.971   6.757  -4.907
  452   1H4     C  42          1H4         C  42  17.808   3.682  -2.193
  453   2H4     C  42          2H4         C  42  17.453   4.381  -0.629
  454    H5     C  42           H5         C  42  15.597   5.864  -0.237
  455    H6     C  42           H6         C  42  13.681   7.001  -1.259
  456   1H5*    U  43          1H5*        U  43   9.374   7.409   1.318
  457   2H5*    U  43          2H5*        U  43   8.868   5.709   1.230
  458    H4*    U  43           H4*        U  43   7.699   7.338   2.942
  459    H3*    U  43           H3*        U  43   6.434   5.250   1.148
  460    H2*    U  43           H2*        U  43   4.291   5.892   1.818
  461   2HO*    U  43          2HO*        U  43   4.050   7.162   3.831
  462    H1*    U  43           H1*        U  43   4.809   8.611   2.377
  463    H3     U  43           H3         U  43   1.456   8.928  -0.593
  464    H5     U  43           H5         U  43   4.530   7.073  -2.802
  465    H6     U  43           H6         U  43   5.852   6.993  -0.768
  466   1H5*    U  44          1H5*        U  44   5.855   4.985   6.136
  467   2H5*    U  44          2H5*        U  44   4.799   3.579   6.385
  468    H4*    U  44           H4*        U  44   4.141   5.928   7.394
  469    H3*    U  44           H3*        U  44   2.403   3.838   6.074
  470    H2*    U  44           H2*        U  44   0.506   5.248   6.158
  471   2HO*    U  44          2HO*        U  44   0.607   7.250   7.398
  472    H1*    U  44           H1*        U  44   1.684   7.587   5.438
  473    H3     U  44           H3         U  44  -0.900   6.014   2.002
  474    H5     U  44           H5         U  44   2.797   4.029   1.603
  475    H6     U  44           H6         U  44   3.451   4.958   3.747
  476   1H5*    C  45          1H5*        C  45   0.138   4.913  10.112
  477   2H5*    C  45          2H5*        C  45  -0.408   3.288  10.570
  478    H4*    C  45           H4*        C  45  -2.238   5.044  10.428
  479    H3*    C  45           H3*        C  45  -2.259   2.437   8.893
  480    H2*    C  45           H2*        C  45  -4.284   3.011   7.829
  481   2HO*    C  45          2HO*        C  45  -4.637   5.280   9.501
  482    H1*    C  45           H1*        C  45  -3.815   5.693   7.437
  483   1H4     C  45          1H4         C  45  -2.401   2.726   1.980
  484   2H4     C  45          2H4         C  45  -0.823   2.304   2.602
  485    H5     C  45           H5         C  45  -0.129   2.760   4.861
  486    H6     C  45           H6         C  45  -0.799   3.718   7.014
  487   1H5*    C  46          1H5*        C  46  -6.124   2.759  11.497
  488   2H5*    C  46          2H5*        C  46  -6.907   1.166  11.481
  489    H4*    C  46           H4*        C  46  -8.090   3.237  10.351
  490    H3*    C  46           H3*        C  46  -7.915   0.365   9.436
  491    H2*    C  46           H2*        C  46  -8.953   0.861   7.370
  492   2HO*    C  46          2HO*        C  46 -10.009   2.952   8.845
  493    H1*    C  46           H1*        C  46  -7.689   3.196   6.802
  494   1H4     C  46          1H4         C  46  -4.354  -1.550   4.128
  495   2H4     C  46          2H4         C  46  -3.418  -1.716   5.596
  496    H5     C  46           H5         C  46  -3.893  -0.486   7.611
  497    H6     C  46           H6         C  46  -5.368   1.169   8.655
  498   1H5*    U  47          1H5*        U  47 -12.338   1.680   9.194
  499   2H5*    U  47          2H5*        U  47 -13.305   0.193   9.272
  500    H4*    U  47           H4*        U  47 -13.412   1.704   7.123
  501    H3*    U  47           H3*        U  47 -13.281  -1.304   7.346
  502    H2*    U  47           H2*        U  47 -13.079  -1.562   5.008
  503   2HO*    U  47          2HO*        U  47 -14.790   0.028   4.591
  504    H1*    U  47           H1*        U  47 -11.392   0.516   4.479
  505    H3     U  47           H3         U  47  -9.237  -3.503   3.962
  506    H5     U  47           H5         U  47  -8.894  -2.556   8.055
  507    H6     U  47           H6         U  47 -10.445  -0.725   7.693
  508   1H5*    A  48          1H5*        A  48 -17.408  -0.589   5.029
  509   2H5*    A  48          2H5*        A  48 -18.197  -2.168   5.221
  510    H4*    A  48           H4*        A  48 -17.451  -1.343   2.829
  511    H3*    A  48           H3*        A  48 -17.258  -4.068   4.091
  512    H2*    A  48           H2*        A  48 -16.038  -4.964   2.294
  513   2HO*    A  48          2HO*        A  48 -16.133  -4.169   0.296
  514    H1*    A  48           H1*        A  48 -14.303  -2.928   1.944
  515    H8     A  48           H8         A  48 -14.838  -2.893   5.614
  516   1H6     A  48          1H6         A  48 -11.247  -7.873   6.080
  517   2H6     A  48          2H6         A  48 -12.087  -6.621   6.969
  518    H2     A  48           H2         A  48 -12.198  -7.242   1.732
  519    H3T    A  48           H3T        A  48 -18.508  -4.099   1.796
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1   9.794 -29.473   5.949
    2   2H5*    G   1          2H5*        G   1  10.092 -28.536   4.471
    3    H4*    G   1           H4*        G   1  10.171 -30.657   3.577
    4    H3*    G   1           H3*        G   1   7.371 -29.592   3.465
    5    H2*    G   1           H2*        G   1   6.384 -31.703   2.999
    6   2HO*    G   1          2HO*        G   1   8.569 -33.307   2.851
    7    H1*    G   1           H1*        G   1   7.667 -33.209   4.745
    8    H8     G   1           H8         G   1   7.770 -30.288   6.845
    9    H1     G   1           H1         G   1   1.687 -31.906   5.834
   10   1H2     G   1          1H2         G   1   1.552 -33.339   4.147
   11   2H2     G   1          2H2         G   1   2.961 -33.895   3.271
   12    H5T    G   1           H5T        G   1   8.080 -28.280   6.057
   13   1H5*    G   2          1H5*        G   2   7.845 -31.171  -0.223
   14   2H5*    G   2          2H5*        G   2   7.677 -30.160  -1.673
   15    H4*    G   2           H4*        G   2   6.022 -31.888  -1.838
   16    H3*    G   2           H3*        G   2   4.935 -29.177  -1.004
   17    H2*    G   2           H2*        G   2   2.741 -30.102  -0.969
   18   2HO*    G   2          2HO*        G   2   3.751 -32.513  -2.104
   19    H1*    G   2           H1*        G   2   3.366 -32.472   0.215
   20    H8     G   2           H8         G   2   5.441 -30.072   2.098
   21    H1     G   2           H1         G   2  -0.746 -29.363   3.475
   22   1H2     G   2          1H2         G   2  -1.983 -30.454   1.993
   23   2H2     G   2          2H2         G   2  -1.284 -31.355   0.666
   24   1H5*    C   3          1H5*        C   3   2.511 -29.245  -4.436
   25   2H5*    C   3          2H5*        C   3   2.702 -27.653  -5.198
   26    H4*    C   3           H4*        C   3   0.401 -28.004  -4.319
   27    H3*    C   3           H3*        C   3   2.171 -25.847  -3.116
   28    H2*    C   3           H2*        C   3   0.452 -25.254  -1.640
   29   2HO*    C   3          2HO*        C   3  -1.440 -24.983  -2.527
   30    H1*    C   3           H1*        C   3  -0.782 -27.801  -1.441
   31   1H4     C   3          1H4         C   3   1.801 -26.259   4.193
   32   2H4     C   3          2H4         C   3   3.334 -26.907   3.656
   33    H5     C   3           H5         C   3   3.725 -27.685   1.409
   34    H6     C   3           H6         C   3   2.736 -28.003  -0.804
   35   1H5*    C   4          1H5*        C   4  -1.222 -23.478  -5.827
   36   2H5*    C   4          2H5*        C   4  -0.603 -21.815  -5.765
   37    H4*    C   4           H4*        C   4  -2.992 -22.329  -4.820
   38    H3*    C   4           H3*        C   4  -0.815 -20.598  -3.635
   39    H2*    C   4           H2*        C   4  -2.079 -20.221  -1.676
   40   2HO*    C   4          2HO*        C   4  -4.309 -20.804  -1.565
   41    H1*    C   4           H1*        C   4  -3.000 -22.720  -1.269
   42   1H4     C   4          1H4         C   4   2.513 -22.092   1.898
   43   2H4     C   4          2H4         C   4   3.380 -22.669   0.493
   44    H5     C   4           H5         C   4   2.319 -23.109  -1.625
   45    H6     C   4           H6         C   4   0.197 -23.090  -2.852
   46   1H5*    U   5          1H5*        U   5  -4.657 -18.162  -2.980
   47   2H5*    U   5          2H5*        U   5  -4.092 -16.532  -3.400
   48    H4*    U   5           H4*        U   5  -5.097 -16.858  -1.047
   49    H3*    U   5           H3*        U   5  -2.393 -15.596  -1.620
   50    H2*    U   5           H2*        U   5  -2.048 -15.292   0.676
   51   2HO*    U   5          2HO*        U   5  -4.304 -15.700   1.927
   52    H1*    U   5           H1*        U   5  -3.632 -17.481   1.588
   53    H3     U   5           H3         U   5   0.501 -17.663   3.569
   54    H5     U   5           H5         U   5   1.028 -19.224  -0.314
   55    H6     U   5           H6         U   5  -1.220 -18.495  -0.840
   56   1H5*    U   6          1H5*        U   6  -6.679 -12.486  -0.782
   57   2H5*    U   6          2H5*        U   6  -6.172 -13.958  -1.635
   58    H4*    U   6           H4*        U   6  -6.876 -12.986  -3.779
   59    H3*    U   6           H3*        U   6  -7.175 -10.507  -2.098
   60    H2*    U   6           H2*        U   6  -9.256  -9.930  -3.088
   61   2HO*    U   6          2HO*        U   6  -8.171 -11.013  -5.234
   62    H1*    U   6           H1*        U   6 -10.401 -12.342  -3.177
   63    H3     U   6           H3         U   6 -11.714  -9.285   0.174
   64    H5     U   6           H5         U   6  -9.336 -12.282   1.941
   65    H6     U   6           H6         U   6  -8.742 -13.035  -0.289
   66   1H5*    A   7          1H5*        A   7  -7.223  -9.103  -5.968
   67   2H5*    A   7          2H5*        A   7  -6.175  -7.741  -6.414
   68    H4*    A   7           H4*        A   7  -8.509  -7.101  -6.716
   69    H3*    A   7           H3*        A   7  -6.881  -5.803  -4.537
   70    H2*    A   7           H2*        A   7  -8.740  -4.631  -3.676
   71   2HO*    A   7          2HO*        A   7 -10.621  -5.328  -5.570
   72    H1*    A   7           H1*        A   7 -10.646  -6.559  -3.906
   73    H8     A   7           H8         A   7  -7.730  -8.519  -2.804
   74   1H6     A   7          1H6         A   7  -8.390  -6.177   2.858
   75   2H6     A   7          2H6         A   7  -7.593  -7.404   1.898
   76    H2     A   7           H2         A   7 -10.979  -3.803   0.051
   77   1H5*    G   8          1H5*        G   8  -8.172  -2.252  -7.314
   78   2H5*    G   8          2H5*        G   8  -6.983  -0.968  -7.015
   79    H4*    G   8           H4*        G   8  -9.481  -0.572  -6.346
   80    H3*    G   8           H3*        G   8  -6.958   0.114  -4.864
   81    H2*    G   8           H2*        G   8  -8.070   0.651  -2.875
   82   2HO*    G   8          2HO*        G   8 -10.667   0.604  -3.895
   83    H1*    G   8           H1*        G   8 -10.122  -1.163  -2.919
   84    H8     G   8           H8         G   8  -7.145  -3.140  -3.858
   85    H1     G   8           H1         G   8  -6.947  -1.445   2.285
   86   1H2     G   8          1H2         G   8  -8.483   0.102   2.694
   87   2H2     G   8          2H2         G   8  -9.554   0.714   1.454
   88   1H5*    G   9          1H5*        G   9 -10.098   3.915  -5.301
   89   2H5*    G   9          2H5*        G   9  -9.082   5.305  -4.869
   90    H4*    G   9           H4*        G   9 -11.344   4.869  -3.585
   91    H3*    G   9           H3*        G   9  -8.676   5.825  -2.576
   92    H2*    G   9           H2*        G   9  -9.310   5.626  -0.301
   93   2HO*    G   9          2HO*        G   9 -11.730   4.899  -0.067
   94    H1*    G   9           H1*        G   9 -10.542   3.244  -0.391
   95    H8     G   9           H8         G   9  -7.908   2.814  -2.947
   96    H1     G   9           H1         G   9  -5.411   2.929   2.916
   97   1H2     G   9          1H2         G   9  -6.926   3.634   4.373
   98   2H2     G   9          2H2         G   9  -8.552   4.075   3.900
   99   1H5*    A  10          1H5*        A  10 -10.691   8.723  -0.435
  100   2H5*    A  10          2H5*        A  10  -9.949  10.287  -0.828
  101    H4*    A  10           H4*        A  10  -9.609   9.682   1.553
  102    H3*    A  10           H3*        A  10  -7.194   9.816  -0.293
  103    H2*    A  10           H2*        A  10  -5.806   9.370   1.565
  104   2HO*    A  10          2HO*        A  10  -8.032   9.880   3.285
  105    H1*    A  10           H1*        A  10  -7.532   7.618   2.890
  106    H8     A  10           H8         A  10  -7.340   6.479  -0.630
  107   1H6     A  10          1H6         A  10  -1.770   4.129   0.536
  108   2H6     A  10          2H6         A  10  -3.085   4.195  -0.615
  109    H2     A  10           H2         A  10  -2.953   6.708   4.020
  110   1H5*    A  11          1H5*        A  11  -6.828  13.684   2.574
  111   2H5*    A  11          2H5*        A  11  -5.509  14.604   1.820
  112    H4*    A  11           H4*        A  11  -5.219  13.614   4.253
  113    H3*    A  11           H3*        A  11  -3.233  13.731   1.972
  114    H2*    A  11           H2*        A  11  -1.633  12.510   3.247
  115   2HO*    A  11          2HO*        A  11  -3.021  13.599   5.326
  116    H1*    A  11           H1*        A  11  -3.278  10.612   4.207
  117    H8     A  11           H8         A  11  -4.741  11.140   0.861
  118   1H6     A  11          1H6         A  11   0.040   8.135  -1.603
  119   2H6     A  11          2H6         A  11  -1.557   8.781  -1.907
  120    H2     A  11           H2         A  11   1.020   9.036   2.688
  121   1H5*    A  12          1H5*        A  12  -0.521  14.739   4.958
  122   2H5*    A  12          2H5*        A  12   0.525  15.992   4.260
  123    H4*    A  12           H4*        A  12   1.684  13.791   4.730
  124    H3*    A  12           H3*        A  12   1.587  15.059   1.976
  125    H2*    A  12           H2*        A  12   2.834  13.253   1.094
  126   2HO*    A  12          2HO*        A  12   3.318  12.313   3.741
  127    H1*    A  12           H1*        A  12   1.641  11.226   2.412
  128    H8     A  12           H8         A  12  -1.081  13.552   1.448
  129   1H6     A  12          1H6         A  12  -0.598  11.502  -4.337
  130   2H6     A  12          2H6         A  12  -1.566  12.451  -3.230
  131    H2     A  12           H2         A  12   2.914   9.957  -1.998
  132   1H5*    C  13          1H5*        C  13   6.015  14.764   3.514
  133   2H5*    C  13          2H5*        C  13   6.981  15.961   2.627
  134    H4*    C  13           H4*        C  13   7.773  13.530   2.483
  135    H3*    C  13           H3*        C  13   7.211  15.294   0.074
  136    H2*    C  13           H2*        C  13   7.897  13.500  -1.351
  137   2HO*    C  13          2HO*        C  13   9.624  12.555  -0.434
  138    H1*    C  13           H1*        C  13   6.490  11.563  -0.146
  139   1H4     C  13          1H4         C  13   2.740  14.303  -4.539
  140   2H4     C  13          2H4         C  13   2.005  15.259  -3.273
  141    H5     C  13           H5         C  13   2.799  15.277  -1.006
  142    H6     C  13           H6         C  13   4.465  14.383   0.547
  143   1H5*    A  14          1H5*        A  14  11.590  14.039  -0.734
  144   2H5*    A  14          2H5*        A  14  12.112  15.350  -1.809
  145    H4*    A  14           H4*        A  14  11.938  12.875  -2.713
  146    H3*    A  14           H3*        A  14  11.006  15.406  -4.131
  147    H2*    A  14           H2*        A  14  10.502  14.013  -6.023
  148   2HO*    A  14          2HO*        A  14  12.219  12.622  -6.118
  149    H1*    A  14           H1*        A  14   9.289  12.040  -4.608
  150    H8     A  14           H8         A  14   8.072  14.997  -2.812
  151   1H6     A  14          1H6         A  14   4.345  16.280  -7.530
  152   2H6     A  14          2H6         A  14   4.725  16.641  -5.862
  153    H2     A  14           H2         A  14   7.278  13.159  -8.889
  154   1H5*    G  15          1H5*        G  15  13.920  13.983  -6.572
  155   2H5*    G  15          2H5*        G  15  15.122  15.108  -7.233
  156    H4*    G  15           H4*        G  15  13.898  14.219  -9.098
  157    H3*    G  15           H3*        G  15  13.046  17.035  -8.317
  158    H2*    G  15           H2*        G  15  11.646  17.036 -10.279
  159   2HO*    G  15          2HO*        G  15  12.246  15.892 -11.960
  160    H1*    G  15           H1*        G  15  10.573  14.581  -9.817
  161    H8     G  15           H8         G  15  11.023  15.969  -6.395
  162    H1     G  15           H1         G  15   6.330  18.937  -9.517
  163   1H2     G  15          1H2         G  15   6.387  18.396 -11.665
  164   2H2     G  15          2H2         G  15   7.581  17.305 -12.329
  165   1H5*    U  16          1H5*        U  16  13.516  17.233 -11.700
  166   2H5*    U  16          2H5*        U  16  14.427  18.408 -12.670
  167    H4*    U  16           H4*        U  16  12.208  18.800 -13.318
  168    H3*    U  16           H3*        U  16  12.909  20.690 -11.027
  169    H2*    U  16           H2*        U  16  10.784  21.685 -11.360
  170   2HO*    U  16          2HO*        U  16   9.526  21.002 -13.292
  171    H1*    U  16           H1*        U  16   9.428  19.308 -11.925
  172    H3     U  16           H3         U  16   7.661  21.172  -8.150
  173    H5     U  16           H5         U  16  11.239  19.329  -6.913
  174    H6     U  16           H6         U  16  11.764  18.919  -9.227
  175   1H5*    U  17          1H5*        U  17  12.445  24.405 -11.741
  176   2H5*    U  17          2H5*        U  17  11.385  23.332 -12.674
  177    H4*    U  17           H4*        U  17  12.185  26.189 -13.328
  178    H3*    U  17           H3*        U  17  10.077  25.400 -11.843
  179    H2*    U  17           H2*        U  17   9.205  23.736 -13.312
  180   2HO*    U  17          2HO*        U  17   7.351  24.585 -14.124
  181    H1*    U  17           H1*        U  17   9.519  25.367 -15.791
  182    H3     U  17           H3         U  17   7.919  21.376 -17.310
  183    H5     U  17           H5         U  17  11.596  20.428 -15.488
  184    H6     U  17           H6         U  17  11.767  22.724 -14.770
  185   1H5*    C  18          1H5*        C  18   6.570  25.463 -12.750
  186   2H5*    C  18          2H5*        C  18   6.302  27.215 -12.861
  187    H4*    C  18           H4*        C  18   4.528  26.266 -11.517
  188    H3*    C  18           H3*        C  18   5.988  28.394 -10.647
  189    H2*    C  18           H2*        C  18   7.628  27.149  -9.417
  190   2HO*    C  18          2HO*        C  18   6.312  26.998  -7.151
  191    H1*    C  18           H1*        C  18   5.508  25.374  -8.218
  192   1H4     C  18          1H4         C  18  10.805  22.226  -6.671
  193   2H4     C  18          2H4         C  18  11.344  22.242  -8.335
  194    H5     C  18           H5         C  18  10.160  23.364 -10.099
  195    H6     C  18           H6         C  18   8.192  24.710 -10.659
  196   1H5*    G  19          1H5*        G  19   1.135  26.556 -10.893
  197   2H5*    G  19          2H5*        G  19   2.570  25.520 -10.754
  198    H4*    G  19           H4*        G  19   0.835  26.075 -13.145
  199    H3*    G  19           H3*        G  19   2.165  23.663 -11.849
  200    H2*    G  19           H2*        G  19   2.174  22.591 -13.947
  201   2HO*    G  19          2HO*        G  19   0.793  24.185 -15.570
  202    H1*    G  19           H1*        G  19   2.598  24.866 -15.523
  203    H8     G  19           H8         G  19   4.744  23.949 -16.532
  204    H1     G  19           H1         G  19   7.055  21.929 -10.943
  205   1H2     G  19          1H2         G  19   5.623  22.409  -9.317
  206   2H2     G  19          2H2         G  19   4.105  23.226  -9.610
  207   1H5*    C  20          1H5*        C  20  -0.298  22.249 -14.145
  208   2H5*    C  20          2H5*        C  20  -1.069  20.692 -13.786
  209    H4*    C  20           H4*        C  20   0.638  20.557 -15.613
  210    H3*    C  20           H3*        C  20   0.848  18.960 -13.056
  211    H2*    C  20           H2*        C  20   2.944  18.054 -13.704
  212   2HO*    C  20          2HO*        C  20   3.739  18.504 -15.903
  213    H1*    C  20           H1*        C  20   4.094  20.313 -14.635
  214   1H4     C  20          1H4         C  20   5.335  19.899  -8.373
  215   2H4     C  20          2H4         C  20   3.917  20.872  -8.049
  216    H5     C  20           H5         C  20   2.357  21.538  -9.743
  217    H6     C  20           H6         C  20   1.810  21.432 -12.127
  218   1H5*    U  21          1H5*        U  21   2.174  16.723 -15.638
  219   2H5*    U  21          2H5*        U  21   1.127  15.486 -16.360
  220    H4*    U  21           H4*        U  21   3.106  14.300 -16.182
  221    H3*    U  21           H3*        U  21   1.490  13.924 -13.653
  222    H2*    U  21           H2*        U  21   3.250  12.647 -12.687
  223   2HO*    U  21          2HO*        U  21   4.760  11.630 -13.872
  224    H1*    U  21           H1*        U  21   5.324  14.223 -13.441
  225    H3     U  21           H3         U  21   4.821  15.130  -9.033
  226    H5     U  21           H5         U  21   1.651  17.208 -10.878
  227    H6     U  21           H6         U  21   2.246  16.125 -12.967
  228   1H5*    G  22          1H5*        G  22   2.890  10.048 -14.686
  229   2H5*    G  22          2H5*        G  22   1.915   8.809 -13.868
  230    H4*    G  22           H4*        G  22   4.352   9.321 -13.016
  231    H3*    G  22           H3*        G  22   1.835   8.901 -11.380
  232    H2*    G  22           H2*        G  22   2.941   9.499  -9.436
  233   2HO*    G  22          2HO*        G  22   5.551   9.188 -10.000
  234    H1*    G  22           H1*        G  22   5.129  10.929 -10.616
  235    H8     G  22           H8         G  22   1.853  12.627 -11.041
  236    H1     G  22           H1         G  22   4.016  13.201  -5.077
  237   1H2     G  22          1H2         G  22   5.750  11.860  -4.764
  238   2H2     G  22          2H2         G  22   6.377  10.826  -6.029
  239   1H5*    U  23          1H5*        U  23   4.878   5.275 -10.189
  240   2H5*    U  23          2H5*        U  23   3.783   4.194  -9.303
  241    H4*    U  23           H4*        U  23   5.883   5.240  -8.091
  242    H3*    U  23           H3*        U  23   3.062   4.879  -7.049
  243    H2*    U  23           H2*        U  23   3.611   5.969  -5.041
  244   2HO*    U  23          2HO*        U  23   6.080   4.887  -5.592
  245    H1*    U  23           H1*        U  23   5.425   7.827  -6.045
  246    H3     U  23           H3         U  23   1.790   9.825  -4.035
  247    H5     U  23           H5         U  23   0.690   9.128  -8.049
  248    H6     U  23           H6         U  23   2.702   7.797  -8.299
  249   1H5*    G  24          1H5*        G  24   5.289  -0.469  -6.399
  250   2H5*    G  24          2H5*        G  24   5.938   0.298  -4.936
  251    H4*    G  24           H4*        G  24   6.424   1.064  -7.830
  252    H3*    G  24           H3*        G  24   8.020  -0.139  -5.593
  253    H2*    G  24           H2*        G  24   9.869   1.312  -5.882
  254   2HO*    G  24          2HO*        G  24   8.770   2.445  -8.237
  255    H1*    G  24           H1*        G  24   8.598   3.631  -6.230
  256    H8     G  24           H8         G  24   6.192   2.224  -3.912
  257    H1     G  24           H1         G  24  11.783   3.053  -0.965
  258   1H2     G  24          1H2         G  24  13.386   3.403  -2.458
  259   2H2     G  24          2H2         G  24  13.075   3.432  -4.179
  260   1H5*    C  25          1H5*        C  25  10.779  -2.123  -8.419
  261   2H5*    C  25          2H5*        C  25  10.816  -3.736  -7.676
  262    H4*    C  25           H4*        C  25  12.893  -2.187  -7.388
  263    H3*    C  25           H3*        C  25  11.480  -3.735  -5.187
  264    H2*    C  25           H2*        C  25  12.992  -2.877  -3.613
  265   2HO*    C  25          2HO*        C  25  14.968  -1.717  -4.709
  266    H1*    C  25           H1*        C  25  13.490  -0.394  -4.871
  267   1H4     C  25          1H4         C  25  10.173   0.340   0.574
  268   2H4     C  25          2H4         C  25   8.731   0.508  -0.402
  269    H5     C  25           H5         C  25   8.695   0.136  -2.783
  270    H6     C  25           H6         C  25  10.033  -0.480  -4.738
  271   1H5*    C  26          1H5*        C  26  15.678  -5.336  -5.618
  272   2H5*    C  26          2H5*        C  26  15.599  -7.099  -5.812
  273    H4*    C  26           H4*        C  26  17.296  -6.604  -4.161
  274    H3*    C  26           H3*        C  26  14.696  -7.777  -3.137
  275    H2*    C  26           H2*        C  26  15.516  -7.699  -0.906
  276   2HO*    C  26          2HO*        C  26  18.018  -6.695  -1.322
  277    H1*    C  26           H1*        C  26  16.634  -5.232  -1.000
  278   1H4     C  26          1H4         C  26  10.688  -4.297   1.056
  279   2H4     C  26          2H4         C  26  10.072  -4.441  -0.575
  280    H5     C  26           H5         C  26  11.455  -5.009  -2.464
  281    H6     C  26           H6         C  26  13.728  -5.558  -3.199
  282   1H5*    G  27          1H5*        G  27  17.426 -10.731  -1.318
  283   2H5*    G  27          2H5*        G  27  16.359 -12.121  -1.037
  284    H4*    G  27           H4*        G  27  17.158 -10.621   0.989
  285    H3*    G  27           H3*        G  27  14.368 -11.722   0.481
  286    H2*    G  27           H2*        G  27  13.658 -10.735   2.502
  287   2HO*    G  27          2HO*        G  27  15.606 -11.593   3.621
  288    H1*    G  27           H1*        G  27  15.278  -8.451   2.376
  289    H8     G  27           H8         G  27  13.556  -8.602  -0.873
  290    H1     G  27           H1         G  27   9.457  -7.176   3.799
  291   1H2     G  27          1H2         G  27  10.400  -7.544   5.772
  292   2H2     G  27          2H2         G  27  12.037  -8.139   5.935
  293   1H5*    A  28          1H5*        A  28  15.622 -14.291   4.261
  294   2H5*    A  28          2H5*        A  28  14.491 -15.653   4.119
  295    H4*    A  28           H4*        A  28  14.300 -13.971   6.150
  296    H3*    A  28           H3*        A  28  12.076 -15.180   4.477
  297    H2*    A  28           H2*        A  28  10.474 -13.968   5.706
  298   2HO*    A  28          2HO*        A  28  12.428 -14.139   7.678
  299    H1*    A  28           H1*        A  28  11.961 -11.649   6.131
  300    H8     A  28           H8         A  28  12.254 -12.410   2.520
  301   1H6     A  28          1H6         A  28   6.531 -10.287   1.712
  302   2H6     A  28          2H6         A  28   8.002 -10.789   0.908
  303    H2     A  28           H2         A  28   7.240 -10.737   6.128
  304   1H5*    A  29          1H5*        A  29  11.831 -16.946   9.022
  305   2H5*    A  29          2H5*        A  29  10.607 -18.228   8.937
  306    H4*    A  29           H4*        A  29  10.243 -16.181  10.549
  307    H3*    A  29           H3*        A  29   8.279 -17.622   8.775
  308    H2*    A  29           H2*        A  29   6.569 -16.035   9.166
  309   2HO*    A  29          2HO*        A  29   7.082 -14.305  10.824
  310    H1*    A  29           H1*        A  29   8.019 -13.768   8.980
  311    H8     A  29           H8         A  29   9.684 -15.882   6.459
  312   1H6     A  29          1H6         A  29   4.854 -15.111   2.718
  313   2H6     A  29          2H6         A  29   6.504 -15.679   2.831
  314    H2     A  29           H2         A  29   3.704 -13.630   6.804
  315   1H5*    A  30          1H5*        A  30   6.106 -18.313  12.935
  316   2H5*    A  30          2H5*        A  30   5.133 -19.737  12.515
  317    H4*    A  30           H4*        A  30   3.960 -17.421  12.998
  318    H3*    A  30           H3*        A  30   3.336 -19.451  10.833
  319    H2*    A  30           H2*        A  30   1.612 -18.031   9.999
  320   2HO*    A  30          2HO*        A  30   1.841 -16.887  12.553
  321    H1*    A  30           H1*        A  30   3.008 -15.722  10.039
  322    H8     A  30           H8         A  30   5.701 -18.046   9.150
  323   1H6     A  30          1H6         A  30   3.240 -18.735   3.546
  324   2H6     A  30          2H6         A  30   4.651 -19.028   4.539
  325    H2     A  30           H2         A  30   0.227 -16.644   6.143
  326   1H5*    G  31          1H5*        G  31   0.096 -18.402  11.727
  327   2H5*    G  31          2H5*        G  31  -1.004 -19.338  12.758
  328    H4*    G  31           H4*        G  31  -2.449 -18.701  11.057
  329    H3*    G  31           H3*        G  31  -1.158 -21.330  10.238
  330    H2*    G  31           H2*        G  31  -2.371 -21.256   8.215
  331   2HO*    G  31          2HO*        G  31  -4.009 -19.242   9.421
  332    H1*    G  31           H1*        G  31  -2.314 -18.482   7.849
  333    H8     G  31           H8         G  31   1.157 -19.571   8.554
  334    H1     G  31           H1         G  31  -0.697 -21.379   2.730
  335   1H2     G  31          1H2         G  31  -2.886 -21.105   2.512
  336   2H2     G  31          2H2         G  31  -3.889 -20.479   3.802
  337   1H5*    G  32          1H5*        G  32  -5.795 -22.363  10.935
  338   2H5*    G  32          2H5*        G  32  -5.823 -24.138  10.924
  339    H4*    G  32           H4*        G  32  -7.076 -22.776   9.039
  340    H3*    G  32           H3*        G  32  -5.416 -25.296   8.794
  341    H2*    G  32           H2*        G  32  -5.671 -25.287   6.440
  342   2HO*    G  32          2HO*        G  32  -7.890 -24.886   6.325
  343    H1*    G  32           H1*        G  32  -5.409 -22.593   6.013
  344    H8     G  32           H8         G  32  -2.832 -23.364   8.559
  345    H1     G  32           H1         G  32  -1.233 -25.744   2.866
  346   1H2     G  32          1H2         G  32  -2.971 -25.659   1.492
  347   2H2     G  32          2H2         G  32  -4.524 -25.018   1.979
  348   1H5*    U  33          1H5*        U  33  -8.284 -26.708   6.864
  349   2H5*    U  33          2H5*        U  33  -8.838 -28.341   7.287
  350    H4*    U  33           H4*        U  33  -7.658 -28.399   5.145
  351    H3*    U  33           H3*        U  33  -6.375 -29.712   7.550
  352    H2*    U  33           H2*        U  33  -4.398 -30.061   6.418
  353   2HO*    U  33          2HO*        U  33  -5.630 -31.418   4.899
  354    H1*    U  33           H1*        U  33  -4.850 -28.217   4.227
  355    H3     U  33           H3         U  33  -0.404 -28.183   5.298
  356    H5     U  33           H5         U  33  -2.309 -26.096   8.424
  357    H6     U  33           H6         U  33  -4.441 -26.768   7.481
  358   1H5*    C  34          1H5*        C  34  -7.200 -32.884   4.270
  359   2H5*    C  34          2H5*        C  34  -7.566 -34.430   5.061
  360    H4*    C  34           H4*        C  34  -5.759 -34.765   3.463
  361    H3*    C  34           H3*        C  34  -4.974 -34.782   6.391
  362    H2*    C  34           H2*        C  34  -2.777 -35.282   5.801
  363   2HO*    C  34          2HO*        C  34  -2.507 -36.772   4.336
  364    H1*    C  34           H1*        C  34  -2.752 -33.856   3.366
  365   1H4     C  34          1H4         C  34   0.890 -30.616   7.453
  366   2H4     C  34          2H4         C  34  -0.526 -30.041   8.302
  367    H5     C  34           H5         C  34  -2.765 -30.751   7.765
  368    H6     C  34           H6         C  34  -4.127 -32.165   6.299
  369    H3T    C  34           H3T        C  34  -5.899 -36.560   4.449
  370   1H5*    U  35          1H5*        U  35  -3.751 -12.825   2.486
  371   2H5*    U  35          2H5*        U  35  -4.061 -11.083   2.333
  372    H4*    U  35           H4*        U  35  -3.296 -11.235   4.531
  373    H3*    U  35           H3*        U  35  -1.049 -10.581   2.624
  374    H2*    U  35           H2*        U  35   0.574 -10.774   4.313
  375   2HO*    U  35          2HO*        U  35  -0.335  -9.541   5.925
  376    H1*    U  35           H1*        U  35  -0.463 -12.896   5.708
  377    H3     U  35           H3         U  35   3.359 -14.429   3.822
  378    H5     U  35           H5         U  35   0.668 -14.139   0.590
  379    H6     U  35           H6         U  35  -0.920 -13.090   2.096
  380    H5T    U  35           H5T        U  35  -2.681 -12.399   0.705
  381   1H5*    U  36          1H5*        U  36  -1.398  -7.374   6.118
  382   2H5*    U  36          2H5*        U  36  -0.299  -6.031   5.744
  383    H4*    U  36           H4*        U  36   0.095  -7.510   7.897
  384    H3*    U  36           H3*        U  36   2.091  -6.372   5.934
  385    H2*    U  36           H2*        U  36   3.889  -7.518   6.971
  386   2HO*    U  36          2HO*        U  36   2.417  -8.675   9.031
  387    H1*    U  36           H1*        U  36   2.707  -9.921   7.298
  388    H3     U  36           H3         U  36   5.682  -9.975   3.795
  389    H5     U  36           H5         U  36   2.015  -8.714   2.145
  390    H6     U  36           H6         U  36   1.134  -8.548   4.401
  391   1H5*    C  37          1H5*        C  37   3.605  -4.336   9.976
  392   2H5*    C  37          2H5*        C  37   4.456  -2.933   9.302
  393    H4*    C  37           H4*        C  37   5.823  -4.734  10.613
  394    H3*    C  37           H3*        C  37   6.535  -3.446   7.962
  395    H2*    C  37           H2*        C  37   8.513  -4.752   7.846
  396   2HO*    C  37          2HO*        C  37   9.209  -5.997   9.684
  397    H1*    C  37           H1*        C  37   7.456  -7.121   8.665
  398   1H4     C  37          1H4         C  37   7.256  -6.777   2.275
  399   2H4     C  37          2H4         C  37   5.617  -6.176   2.381
  400    H5     C  37           H5         C  37   4.543  -5.633   4.466
  401    H6     C  37           H6         C  37   4.812  -5.537   6.903
  402   1H5*    G  38          1H5*        G  38   9.794  -1.663  11.194
  403   2H5*    G  38          2H5*        G  38  10.280  -0.174  10.358
  404    H4*    G  38           H4*        G  38  12.145  -1.837  10.996
  405    H3*    G  38           H3*        G  38  11.712  -0.540   8.305
  406    H2*    G  38           H2*        G  38  13.457  -1.794   7.313
  407   2HO*    G  38          2HO*        G  38  14.875  -3.087   8.696
  408    H1*    G  38           H1*        G  38  12.937  -4.209   8.429
  409    H8     G  38           H8         G  38   9.547  -2.831   7.869
  410    H1     G  38           H1         G  38  12.363  -4.361   2.355
  411   1H2     G  38          1H2         G  38  14.523  -4.743   2.687
  412   2H2     G  38          2H2         G  38  15.267  -4.619   4.264
  413   1H5*    G  39          1H5*        G  39  16.149   0.821   9.346
  414   2H5*    G  39          2H5*        G  39  16.191   2.394   8.528
  415    H4*    G  39           H4*        G  39  17.896   0.575   7.793
  416    H3*    G  39           H3*        G  39  16.197   2.355   6.050
  417    H2*    G  39           H2*        G  39  16.862   1.242   4.073
  418   2HO*    G  39          2HO*        G  39  18.822   0.448   3.892
  419    H1*    G  39           H1*        G  39  16.768  -1.321   4.956
  420    H8     G  39           H8         G  39  13.896   0.262   6.678
  421    H1     G  39           H1         G  39  12.786  -0.360   0.428
  422   1H2     G  39          1H2         G  39  14.664  -0.894  -0.625
  423   2H2     G  39          2H2         G  39  16.187  -1.095   0.212
  424   1H5*    C  40          1H5*        C  40  18.996   2.571   3.613
  425   2H5*    C  40          2H5*        C  40  20.008   4.004   3.888
  426    H4*    C  40           H4*        C  40  19.674   4.190   1.608
  427    H3*    C  40           H3*        C  40  17.413   5.623   3.026
  428    H2*    C  40           H2*        C  40  16.332   6.039   0.982
  429   2HO*    C  40          2HO*        C  40  17.908   5.363  -0.970
  430    H1*    C  40           H1*        C  40  17.067   3.711  -0.371
  431   1H4     C  40          1H4         C  40  10.989   2.837   1.231
  432   2H4     C  40          2H4         C  40  11.385   2.846   2.935
  433    H5     C  40           H5         C  40  13.610   3.236   3.771
  434    H6     C  40           H6         C  40  15.937   3.698   3.154
  435   1H5*    U  41          1H5*        U  41  16.494   8.471   3.584
  436   2H5*    U  41          2H5*        U  41  15.459   7.371   2.648
  437    H4*    U  41           H4*        U  41  14.595   9.775   3.052
  438    H3*    U  41           H3*        U  41  14.684   8.291   0.422
  439    H2*    U  41           H2*        U  41  13.901  10.172  -0.760
  440   2HO*    U  41          2HO*        U  41  12.796  10.782   1.719
  441    H1*    U  41           H1*        U  41  15.251  12.140   0.601
  442    H3     U  41           H3         U  41  16.843  11.852  -3.680
  443    H5     U  41           H5         U  41  18.888   8.858  -1.529
  444    H6     U  41           H6         U  41  17.408   9.286   0.346
  445   1H5*    C  42          1H5*        C  42  10.637  10.014  -0.988
  446   2H5*    C  42          2H5*        C  42   9.831   8.567  -0.350
  447    H4*    C  42           H4*        C  42   9.407   9.079  -2.813
  448    H3*    C  42           H3*        C  42  10.365   6.456  -1.685
  449    H2*    C  42           H2*        C  42  10.749   5.523  -3.808
  450   2HO*    C  42          2HO*        C  42   9.897   6.878  -5.707
  451    H1*    C  42           H1*        C  42  11.695   7.721  -5.140
  452   1H4     C  42          1H4         C  42  16.761   4.365  -3.229
  453   2H4     C  42          2H4         C  42  16.689   5.127  -1.656
  454    H5     C  42           H5         C  42  14.923   6.628  -0.998
  455    H6     C  42           H6         C  42  12.845   7.721  -1.704
  456   1H5*    U  43          1H5*        U  43   8.949   5.587   0.629
  457   2H5*    U  43          2H5*        U  43   8.024   4.077   0.495
  458    H4*    U  43           H4*        U  43   7.811   5.578   2.658
  459    H3*    U  43           H3*        U  43   5.693   4.059   1.136
  460    H2*    U  43           H2*        U  43   3.957   4.975   2.446
  461   2HO*    U  43          2HO*        U  43   6.062   5.584   4.261
  462    H1*    U  43           H1*        U  43   4.866   7.536   2.661
  463    H3     U  43           H3         U  43   1.382   7.975  -0.153
  464    H5     U  43           H5         U  43   4.221   5.871  -2.444
  465    H6     U  43           H6         U  43   5.629   5.756  -0.470
  466   1H5*    U  44          1H5*        U  44   5.704   3.072   5.867
  467   2H5*    U  44          2H5*        U  44   4.638   1.665   6.054
  468    H4*    U  44           H4*        U  44   4.085   3.921   7.306
  469    H3*    U  44           H3*        U  44   2.241   1.974   5.918
  470    H2*    U  44           H2*        U  44   0.374   3.393   6.200
  471   2HO*    U  44          2HO*        U  44   1.449   5.433   7.649
  472    H1*    U  44           H1*        U  44   1.553   5.784   5.651
  473    H3     U  44           H3         U  44  -1.159   4.737   2.146
  474    H5     U  44           H5         U  44   2.340   2.478   1.498
  475    H6     U  44           H6         U  44   3.117   3.177   3.688
  476   1H5*    C  45          1H5*        C  45  -0.053   3.065   9.834
  477   2H5*    C  45          2H5*        C  45  -0.368   1.419  10.417
  478    H4*    C  45           H4*        C  45  -2.442   2.757  10.362
  479    H3*    C  45           H3*        C  45  -2.122   0.373   8.523
  480    H2*    C  45           H2*        C  45  -4.230   0.770   7.555
  481   2HO*    C  45          2HO*        C  45  -5.595   2.487   8.715
  482    H1*    C  45           H1*        C  45  -4.218   3.543   7.611
  483   1H4     C  45          1H4         C  45  -2.858   1.892   1.626
  484   2H4     C  45          2H4         C  45  -1.256   1.372   2.096
  485    H5     C  45           H5         C  45  -0.488   1.360   4.380
  486    H6     C  45           H6         C  45  -1.092   1.843   6.708
  487   1H5*    C  46          1H5*        C  46  -6.072   0.708  10.961
  488   2H5*    C  46          2H5*        C  46  -6.903  -0.860  10.918
  489    H4*    C  46           H4*        C  46  -8.067   1.287   9.915
  490    H3*    C  46           H3*        C  46  -8.013  -1.547   8.869
  491    H2*    C  46           H2*        C  46  -9.123  -0.925   6.879
  492   2HO*    C  46          2HO*        C  46  -9.595   1.733   7.595
  493    H1*    C  46           H1*        C  46  -7.859   1.442   6.395
  494   1H4     C  46          1H4         C  46  -4.773  -3.056   3.096
  495   2H4     C  46          2H4         C  46  -3.841  -3.479   4.516
  496    H5     C  46           H5         C  46  -4.228  -2.505   6.686
  497    H6     C  46           H6         C  46  -5.591  -0.917   7.963
  498   1H5*    U  47          1H5*        U  47 -12.613  -0.304   9.171
  499   2H5*    U  47          2H5*        U  47 -13.448  -1.869   9.096
  500    H4*    U  47           H4*        U  47 -13.820  -0.072   7.197
  501    H3*    U  47           H3*        U  47 -13.505  -3.071   6.982
  502    H2*    U  47           H2*        U  47 -13.510  -2.979   4.619
  503   2HO*    U  47          2HO*        U  47 -15.174  -0.974   5.006
  504    H1*    U  47           H1*        U  47 -11.952  -0.775   4.275
  505    H3     U  47           H3         U  47  -9.671  -4.561   3.059
  506    H5     U  47           H5         U  47  -9.107  -4.205   7.221
  507    H6     U  47           H6         U  47 -10.742  -2.410   7.223
  508   1H5*    A  48          1H5*        A  48 -17.907  -2.095   5.118
  509   2H5*    A  48          2H5*        A  48 -18.628  -3.717   5.079
  510    H4*    A  48           H4*        A  48 -18.259  -2.375   2.838
  511    H3*    A  48           H3*        A  48 -17.822  -5.291   3.444
  512    H2*    A  48           H2*        A  48 -16.885  -5.720   1.330
  513   2HO*    A  48          2HO*        A  48 -17.506  -3.064   0.496
  514    H1*    A  48           H1*        A  48 -15.254  -3.577   1.192
  515    H8     A  48           H8         A  48 -15.256  -4.365   4.819
  516   1H6     A  48          1H6         A  48 -11.561  -9.153   3.685
  517   2H6     A  48          2H6         A  48 -12.313  -8.185   4.932
  518    H2     A  48           H2         A  48 -13.112  -7.629  -0.252
  519    H3T    A  48           H3T        A  48 -19.598  -5.430   2.037
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  10.790 -30.326   5.155
    2   2H5*    G   1          2H5*        G   1   9.753 -29.388   4.060
    3    H4*    G   1           H4*        G   1  10.387 -31.773   3.321
    4    H3*    G   1           H3*        G   1   7.641 -30.532   3.347
    5    H2*    G   1           H2*        G   1   6.584 -32.592   2.772
    6   2HO*    G   1          2HO*        G   1   8.291 -34.447   2.499
    7    H1*    G   1           H1*        G   1   7.814 -34.169   4.511
    8    H8     G   1           H8         G   1   7.986 -31.265   6.638
    9    H1     G   1           H1         G   1   1.870 -32.752   5.631
   10   1H2     G   1          1H2         G   1   1.699 -34.166   3.935
   11   2H2     G   1          2H2         G   1   3.093 -34.746   3.051
   12    H5T    G   1           H5T        G   1   9.240 -29.505   6.431
   13   1H5*    G   2          1H5*        G   2   7.697 -32.027  -0.218
   14   2H5*    G   2          2H5*        G   2   7.571 -31.034  -1.683
   15    H4*    G   2           H4*        G   2   5.725 -32.543  -1.755
   16    H3*    G   2           H3*        G   2   4.979 -29.745  -0.840
   17    H2*    G   2           H2*        G   2   2.715 -30.434  -0.640
   18   2HO*    G   2          2HO*        G   2   3.535 -32.673  -2.206
   19    H1*    G   2           H1*        G   2   3.165 -32.913   0.421
   20    H8     G   2           H8         G   2   5.538 -30.817   2.292
   21    H1     G   2           H1         G   2  -0.481 -29.538   3.964
   22   1H2     G   2          1H2         G   2  -1.883 -30.427   2.489
   23   2H2     G   2          2H2         G   2  -1.331 -31.332   1.098
   24   1H5*    C   3          1H5*        C   3   2.346 -29.305  -4.174
   25   2H5*    C   3          2H5*        C   3   2.735 -27.672  -4.751
   26    H4*    C   3           H4*        C   3   0.443 -27.887  -3.713
   27    H3*    C   3           H3*        C   3   2.546 -25.989  -2.624
   28    H2*    C   3           H2*        C   3   1.092 -25.319  -0.921
   29   2HO*    C   3          2HO*        C   3  -1.063 -26.276  -2.543
   30    H1*    C   3           H1*        C   3  -0.458 -27.707  -0.765
   31   1H4     C   3          1H4         C   3   2.651 -26.825   4.740
   32   2H4     C   3          2H4         C   3   4.056 -27.618   4.064
   33    H5     C   3           H5         C   3   4.202 -28.300   1.756
   34    H6     C   3           H6         C   3   3.039 -28.363  -0.394
   35   1H5*    C   4          1H5*        C   4  -1.385 -23.705  -4.603
   36   2H5*    C   4          2H5*        C   4  -0.919 -21.992  -4.594
   37    H4*    C   4           H4*        C   4  -3.164 -22.760  -3.439
   38    H3*    C   4           H3*        C   4  -1.120 -20.723  -2.555
   39    H2*    C   4           H2*        C   4  -2.175 -20.424  -0.468
   40   2HO*    C   4          2HO*        C   4  -4.389 -22.021  -1.236
   41    H1*    C   4           H1*        C   4  -2.787 -22.986   0.106
   42   1H4     C   4          1H4         C   4   2.875 -21.699   2.749
   43   2H4     C   4          2H4         C   4   3.678 -22.197   1.276
   44    H5     C   4           H5         C   4   2.492 -22.790  -0.740
   45    H6     C   4           H6         C   4   0.281 -23.032  -1.775
   46   1H5*    U   5          1H5*        U   5  -5.178 -18.655  -1.695
   47   2H5*    U   5          2H5*        U   5  -4.770 -16.959  -2.019
   48    H4*    U   5           H4*        U   5  -5.574 -17.673   0.385
   49    H3*    U   5           H3*        U   5  -3.296 -15.814  -0.354
   50    H2*    U   5           H2*        U   5  -2.673 -15.613   1.886
   51   2HO*    U   5          2HO*        U   5  -5.199 -16.547   2.791
   52    H1*    U   5           H1*        U   5  -3.733 -18.100   2.824
   53    H3     U   5           H3         U   5   0.561 -17.613   4.369
   54    H5     U   5           H5         U   5   0.910 -18.917   0.373
   55    H6     U   5           H6         U   5  -1.468 -18.555   0.119
   56   1H5*    U   6          1H5*        U   6  -7.544 -14.857  -0.812
   57   2H5*    U   6          2H5*        U   6  -7.365 -15.414  -2.488
   58    H4*    U   6           H4*        U   6  -8.524 -13.644  -3.312
   59    H3*    U   6           H3*        U   6  -6.779 -12.055  -1.423
   60    H2*    U   6           H2*        U   6  -8.400 -10.433  -1.136
   61   2HO*    U   6          2HO*        U   6  -9.120 -11.022  -3.835
   62    H1*    U   6           H1*        U   6 -10.655 -11.934  -2.195
   63    H3     U   6           H3         U   6 -12.240  -9.346   1.212
   64    H5     U   6           H5         U   6  -9.897 -12.298   3.100
   65    H6     U   6           H6         U   6  -9.167 -13.028   0.906
   66   1H5*    A   7          1H5*        A   7  -6.889  -9.883  -5.961
   67   2H5*    A   7          2H5*        A   7  -5.860  -8.455  -5.724
   68    H4*    A   7           H4*        A   7  -8.342  -8.154  -6.543
   69    H3*    A   7           H3*        A   7  -6.794  -6.543  -4.507
   70    H2*    A   7           H2*        A   7  -8.701  -5.262  -3.956
   71   2HO*    A   7          2HO*        A   7  -9.314  -5.734  -6.538
   72    H1*    A   7           H1*        A   7 -10.579  -7.245  -3.992
   73    H8     A   7           H8         A   7  -7.649  -8.845  -2.393
   74   1H6     A   7          1H6         A   7  -8.877  -5.705   2.760
   75   2H6     A   7          2H6         A   7  -7.938  -7.006   2.062
   76    H2     A   7           H2         A   7 -11.382  -3.984  -0.551
   77   1H5*    G   8          1H5*        G   8  -7.966  -3.288  -7.643
   78   2H5*    G   8          2H5*        G   8  -6.761  -2.012  -7.376
   79    H4*    G   8           H4*        G   8  -9.301  -1.576  -6.807
   80    H3*    G   8           H3*        G   8  -6.806  -0.752  -5.326
   81    H2*    G   8           H2*        G   8  -8.010   0.017  -3.467
   82   2HO*    G   8          2HO*        G   8 -10.504   0.097  -3.881
   83    H1*    G   8           H1*        G   8 -10.065  -1.811  -3.424
   84    H8     G   8           H8         G   8  -7.026  -3.851  -3.912
   85    H1     G   8           H1         G   8  -7.266  -1.431   1.981
   86   1H2     G   8          1H2         G   8  -8.825   0.144   2.090
   87   2H2     G   8          2H2         G   8  -9.803   0.595   0.712
   88   1H5*    G   9          1H5*        G   9  -9.980   2.975  -6.320
   89   2H5*    G   9          2H5*        G   9  -8.973   4.400  -5.991
   90    H4*    G   9           H4*        G   9 -11.319   4.132  -4.812
   91    H3*    G   9           H3*        G   9  -8.709   5.188  -3.746
   92    H2*    G   9           H2*        G   9  -9.500   5.260  -1.509
   93   2HO*    G   9          2HO*        G   9 -11.782   4.889  -1.077
   94    H1*    G   9           H1*        G   9 -10.738   2.889  -1.405
   95    H8     G   9           H8         G   9  -7.944   2.170  -3.723
   96    H1     G   9           H1         G   9  -5.843   2.946   2.245
   97   1H2     G   9          1H2         G   9  -7.447   3.812   3.508
   98   2H2     G   9          2H2         G   9  -9.033   4.197   2.879
   99   1H5*    A  10          1H5*        A  10 -10.833   8.994  -2.681
  100   2H5*    A  10          2H5*        A  10  -9.513  10.145  -2.973
  101    H4*    A  10           H4*        A  10 -10.219   9.600  -0.506
  102    H3*    A  10           H3*        A  10  -7.399   9.753  -1.622
  103    H2*    A  10           H2*        A  10  -6.535   9.258   0.519
  104   2HO*    A  10          2HO*        A  10  -9.051  10.221   1.370
  105    H1*    A  10           H1*        A  10  -8.485   7.444   1.303
  106    H8     A  10           H8         A  10  -7.664   6.256  -2.041
  107   1H6     A  10          1H6         A  10  -2.226   4.222   0.011
  108   2H6     A  10          2H6         A  10  -3.368   4.174  -1.312
  109    H2     A  10           H2         A  10  -3.985   6.911   3.153
  110   1H5*    A  11          1H5*        A  11  -7.559  13.063   1.625
  111   2H5*    A  11          2H5*        A  11  -6.216  14.153   1.221
  112    H4*    A  11           H4*        A  11  -6.154  12.772   3.462
  113    H3*    A  11           H3*        A  11  -3.920  13.281   1.484
  114    H2*    A  11           H2*        A  11  -2.436  11.934   2.780
  115   2HO*    A  11          2HO*        A  11  -4.441  12.206   4.787
  116    H1*    A  11           H1*        A  11  -4.130   9.894   3.281
  117    H8     A  11           H8         A  11  -5.091  10.763  -0.166
  118   1H6     A  11          1H6         A  11   0.115   8.160  -2.184
  119   2H6     A  11          2H6         A  11  -1.444   8.801  -2.655
  120    H2     A  11           H2         A  11   0.416   8.602   2.277
  121   1H5*    A  12          1H5*        A  12  -1.472  14.243   4.874
  122   2H5*    A  12          2H5*        A  12  -0.468  15.557   4.229
  123    H4*    A  12           H4*        A  12   0.752  13.372   4.709
  124    H3*    A  12           H3*        A  12   0.773  14.772   2.021
  125    H2*    A  12           H2*        A  12   2.158  13.063   1.139
  126   2HO*    A  12          2HO*        A  12   2.523  12.217   3.844
  127    H1*    A  12           H1*        A  12   0.924  10.934   2.213
  128    H8     A  12           H8         A  12  -1.762  13.325   1.302
  129   1H6     A  12          1H6         A  12  -0.963  11.781  -4.603
  130   2H6     A  12          2H6         A  12  -1.991  12.635  -3.474
  131    H2     A  12           H2         A  12   2.418  10.029  -2.220
  132   1H5*    C  13          1H5*        C  13   4.981  14.566   3.982
  133   2H5*    C  13          2H5*        C  13   6.078  15.771   3.277
  134    H4*    C  13           H4*        C  13   6.867  13.345   3.168
  135    H3*    C  13           H3*        C  13   6.636  15.183   0.766
  136    H2*    C  13           H2*        C  13   7.433  13.426  -0.643
  137   2HO*    C  13          2HO*        C  13   8.091  11.386   0.378
  138    H1*    C  13           H1*        C  13   5.860  11.486   0.296
  139   1H4     C  13          1H4         C  13   2.677  14.604  -4.296
  140   2H4     C  13          2H4         C  13   1.825  15.497  -3.057
  141    H5     C  13           H5         C  13   2.365  15.345  -0.721
  142    H6     C  13           H6         C  13   3.826  14.303   0.942
  143   1H5*    A  14          1H5*        A  14  11.086  13.877   0.479
  144   2H5*    A  14          2H5*        A  14  11.770  15.257  -0.401
  145    H4*    A  14           H4*        A  14  11.801  12.901  -1.526
  146    H3*    A  14           H3*        A  14  10.876  15.481  -2.861
  147    H2*    A  14           H2*        A  14  10.694  14.207  -4.893
  148   2HO*    A  14          2HO*        A  14  11.530  11.807  -3.726
  149    H1*    A  14           H1*        A  14   9.391  12.117  -3.784
  150    H8     A  14           H8         A  14   7.988  14.976  -1.906
  151   1H6     A  14          1H6         A  14   4.599  16.435  -6.830
  152   2H6     A  14          2H6         A  14   4.853  16.728  -5.124
  153    H2     A  14           H2         A  14   7.655  13.392  -8.097
  154   1H5*    G  15          1H5*        G  15  13.751  14.215  -5.262
  155   2H5*    G  15          2H5*        G  15  15.040  15.346  -5.719
  156    H4*    G  15           H4*        G  15  14.017  14.581  -7.755
  157    H3*    G  15           H3*        G  15  13.162  17.384  -6.932
  158    H2*    G  15           H2*        G  15  11.949  17.521  -9.004
  159   2HO*    G  15          2HO*        G  15  12.894  14.959  -9.787
  160    H1*    G  15           H1*        G  15  10.814  15.050  -8.829
  161    H8     G  15           H8         G  15  10.865  16.237  -5.311
  162    H1     G  15           H1         G  15   6.559  19.417  -8.760
  163   1H2     G  15          1H2         G  15   6.852  19.000 -10.919
  164   2H2     G  15          2H2         G  15   8.113  17.939 -11.507
  165   1H5*    U  16          1H5*        U  16  13.964  17.705 -10.261
  166   2H5*    U  16          2H5*        U  16  14.976  18.917 -11.067
  167    H4*    U  16           H4*        U  16  12.832  19.361 -11.915
  168    H3*    U  16           H3*        U  16  13.314  21.138  -9.480
  169    H2*    U  16           H2*        U  16  11.251  22.181  -9.992
  170   2HO*    U  16          2HO*        U  16  11.007  20.794 -12.450
  171    H1*    U  16           H1*        U  16   9.943  19.845 -10.817
  172    H3     U  16           H3         U  16   7.738  21.546  -7.206
  173    H5     U  16           H5         U  16  11.162  19.671  -5.627
  174    H6     U  16           H6         U  16  11.956  19.351  -7.877
  175   1H5*    U  17          1H5*        U  17  12.728  24.988 -10.320
  176   2H5*    U  17          2H5*        U  17  11.753  23.923 -11.347
  177    H4*    U  17           H4*        U  17  12.702  26.743 -11.961
  178    H3*    U  17           H3*        U  17  10.421  26.059 -10.703
  179    H2*    U  17           H2*        U  17   9.678  24.370 -12.221
  180   2HO*    U  17          2HO*        U  17   7.870  25.501 -12.406
  181    H1*    U  17           H1*        U  17  10.294  25.951 -14.679
  182    H3     U  17           H3         U  17   8.790  21.997 -16.366
  183    H5     U  17           H5         U  17  12.179  20.962 -14.088
  184    H6     U  17           H6         U  17  12.317  23.252 -13.357
  185   1H5*    C  18          1H5*        C  18   6.724  26.849 -12.588
  186   2H5*    C  18          2H5*        C  18   6.621  28.510 -11.969
  187    H4*    C  18           H4*        C  18   4.760  26.916 -11.234
  188    H3*    C  18           H3*        C  18   5.866  29.053  -9.901
  189    H2*    C  18           H2*        C  18   7.470  27.815  -8.634
  190   2HO*    C  18          2HO*        C  18   5.826  27.111  -6.672
  191    H1*    C  18           H1*        C  18   5.451  25.633  -8.103
  192   1H4     C  18          1H4         C  18  10.880  23.082  -5.966
  193   2H4     C  18          2H4         C  18  11.554  23.131  -7.579
  194    H5     C  18           H5         C  18  10.428  24.143  -9.451
  195    H6     C  18           H6         C  18   8.411  25.324 -10.184
  196   1H5*    G  19          1H5*        G  19   1.314  26.431  -9.674
  197   2H5*    G  19          2H5*        G  19   3.067  26.512  -9.937
  198    H4*    G  19           H4*        G  19   1.045  26.647 -12.205
  199    H3*    G  19           H3*        G  19   2.414  24.250 -10.916
  200    H2*    G  19           H2*        G  19   2.581  23.292 -13.060
  201   2HO*    G  19          2HO*        G  19   0.358  24.958 -13.612
  202    H1*    G  19           H1*        G  19   2.786  25.738 -14.493
  203    H8     G  19           H8         G  19   4.919  25.073 -15.711
  204    H1     G  19           H1         G  19   7.585  22.435 -10.554
  205   1H2     G  19          1H2         G  19   6.227  22.640  -8.811
  206   2H2     G  19          2H2         G  19   4.668  23.426  -8.920
  207   1H5*    C  20          1H5*        C  20   0.075  22.893 -13.376
  208   2H5*    C  20          2H5*        C  20  -0.678  21.304 -13.146
  209    H4*    C  20           H4*        C  20   1.077  21.325 -14.934
  210    H3*    C  20           H3*        C  20   1.232  19.547 -12.498
  211    H2*    C  20           H2*        C  20   3.367  18.724 -13.127
  212   2HO*    C  20          2HO*        C  20   2.446  19.308 -15.618
  213    H1*    C  20           H1*        C  20   4.514  21.057 -13.858
  214   1H4     C  20          1H4         C  20   5.491  20.251  -7.580
  215   2H4     C  20          2H4         C  20   4.045  21.184  -7.262
  216    H5     C  20           H5         C  20   2.557  21.939  -8.978
  217    H6     C  20           H6         C  20   2.119  21.979 -11.384
  218   1H5*    U  21          1H5*        U  21   2.636  17.425 -15.356
  219   2H5*    U  21          2H5*        U  21   1.614  16.116 -15.983
  220    H4*    U  21           H4*        U  21   3.758  15.143 -15.834
  221    H3*    U  21           H3*        U  21   1.997  14.472 -13.467
  222    H2*    U  21           H2*        U  21   3.761  13.259 -12.451
  223   2HO*    U  21          2HO*        U  21   5.340  13.510 -14.805
  224    H1*    U  21           H1*        U  21   5.818  14.958 -13.044
  225    H3     U  21           H3         U  21   5.195  15.396  -8.572
  226    H5     U  21           H5         U  21   2.065  17.638 -10.289
  227    H6     U  21           H6         U  21   2.711  16.755 -12.456
  228   1H5*    G  22          1H5*        G  22   3.663  10.760 -14.591
  229   2H5*    G  22          2H5*        G  22   2.665   9.428 -13.975
  230    H4*    G  22           H4*        G  22   4.964   9.981 -12.814
  231    H3*    G  22           H3*        G  22   2.306   9.281 -11.562
  232    H2*    G  22           H2*        G  22   2.995   9.972  -9.475
  233   2HO*    G  22          2HO*        G  22   4.508   8.670  -8.791
  234    H1*    G  22           H1*        G  22   5.424  11.355 -10.290
  235    H8     G  22           H8         G  22   2.262  13.206 -10.895
  236    H1     G  22           H1         G  22   3.926  13.432  -4.753
  237   1H2     G  22          1H2         G  22   5.574  12.002  -4.355
  238   2H2     G  22          2H2         G  22   6.265  10.996  -5.610
  239   1H5*    U  23          1H5*        U  23   5.339   5.748 -10.103
  240   2H5*    U  23          2H5*        U  23   4.186   4.584  -9.421
  241    H4*    U  23           H4*        U  23   5.992   5.722  -7.869
  242    H3*    U  23           H3*        U  23   3.057   5.217  -7.288
  243    H2*    U  23           H2*        U  23   3.277   6.255  -5.187
  244   2HO*    U  23          2HO*        U  23   6.119   6.185  -5.431
  245    H1*    U  23           H1*        U  23   5.149   8.201  -5.894
  246    H3     U  23           H3         U  23   1.238  10.042  -4.309
  247    H5     U  23           H5         U  23   0.674   9.440  -8.445
  248    H6     U  23           H6         U  23   2.734   8.161  -8.470
  249   1H5*    G  24          1H5*        G  24   4.526   1.152  -7.397
  250   2H5*    G  24          2H5*        G  24   5.141  -0.066  -6.263
  251    H4*    G  24           H4*        G  24   6.638   1.093  -8.239
  252    H3*    G  24           H3*        G  24   7.271  -0.279  -5.634
  253    H2*    G  24           H2*        G  24   9.487   0.483  -5.604
  254   2HO*    G  24          2HO*        G  24   9.102   0.977  -8.387
  255    H1*    G  24           H1*        G  24   9.175   2.986  -6.590
  256    H8     G  24           H8         G  24   6.301   2.612  -4.300
  257    H1     G  24           H1         G  24  11.792   2.869  -1.069
  258   1H2     G  24          1H2         G  24  13.502   2.648  -2.461
  259   2H2     G  24          2H2         G  24  13.290   2.436  -4.184
  260   1H5*    C  25          1H5*        C  25  10.687  -1.511  -8.823
  261   2H5*    C  25          2H5*        C  25  10.505  -3.263  -8.610
  262    H4*    C  25           H4*        C  25  12.884  -2.578  -8.565
  263    H3*    C  25           H3*        C  25  11.567  -3.810  -6.141
  264    H2*    C  25           H2*        C  25  13.525  -3.548  -4.841
  265   2HO*    C  25          2HO*        C  25  15.533  -2.889  -5.907
  266    H1*    C  25           H1*        C  25  14.253  -1.059  -5.661
  267   1H4     C  25          1H4         C  25  10.639  -0.383  -0.447
  268   2H4     C  25          2H4         C  25   9.198  -0.394  -1.439
  269    H5     C  25           H5         C  25   9.232  -0.803  -3.813
  270    H6     C  25           H6         C  25  10.654  -1.291  -5.749
  271   1H5*    C  26          1H5*        C  26  15.395  -5.431  -6.370
  272   2H5*    C  26          2H5*        C  26  15.269  -7.110  -6.933
  273    H4*    C  26           H4*        C  26  16.917  -7.209  -5.252
  274    H3*    C  26           H3*        C  26  14.179  -8.036  -4.272
  275    H2*    C  26           H2*        C  26  14.983  -8.286  -2.052
  276   2HO*    C  26          2HO*        C  26  17.040  -8.722  -1.610
  277    H1*    C  26           H1*        C  26  16.460  -6.037  -1.901
  278   1H4     C  26          1H4         C  26  10.676  -4.247   0.031
  279   2H4     C  26          2H4         C  26  10.054  -4.344  -1.601
  280    H5     C  26           H5         C  26  11.369  -5.100  -3.471
  281    H6     C  26           H6         C  26  13.563  -5.928  -4.182
  282   1H5*    G  27          1H5*        G  27  16.857 -11.114  -2.576
  283   2H5*    G  27          2H5*        G  27  15.815 -12.504  -2.208
  284    H4*    G  27           H4*        G  27  16.835 -11.042  -0.252
  285    H3*    G  27           H3*        G  27  14.001 -12.128  -0.474
  286    H2*    G  27           H2*        G  27  13.509 -11.162   1.616
  287   2HO*    G  27          2HO*        G  27  14.950 -11.367   3.143
  288    H1*    G  27           H1*        G  27  15.175  -8.906   1.373
  289    H8     G  27           H8         G  27  13.013  -9.032  -1.634
  290    H1     G  27           H1         G  27   9.685  -7.343   3.534
  291   1H2     G  27          1H2         G  27  10.890  -7.701   5.363
  292   2H2     G  27          2H2         G  27  12.511  -8.355   5.306
  293   1H5*    A  28          1H5*        A  28  15.501 -14.293   3.284
  294   2H5*    A  28          2H5*        A  28  14.405 -15.684   3.421
  295    H4*    A  28           H4*        A  28  14.309 -13.729   5.200
  296    H3*    A  28           H3*        A  28  11.999 -15.204   3.891
  297    H2*    A  28           H2*        A  28  10.467 -13.853   5.057
  298   2HO*    A  28          2HO*        A  28  11.525 -12.440   6.837
  299    H1*    A  28           H1*        A  28  11.971 -11.490   5.105
  300    H8     A  28           H8         A  28  11.883 -12.632   1.586
  301   1H6     A  28          1H6         A  28   6.092 -10.581   1.166
  302   2H6     A  28          2H6         A  28   7.473 -11.174   0.271
  303    H2     A  28           H2         A  28   7.270 -10.551   5.505
  304   1H5*    A  29          1H5*        A  29  12.115 -16.666   8.643
  305   2H5*    A  29          2H5*        A  29  10.844 -17.906   8.661
  306    H4*    A  29           H4*        A  29  10.626 -15.752  10.178
  307    H3*    A  29           H3*        A  29   8.528 -17.242   8.602
  308    H2*    A  29           H2*        A  29   6.883 -15.583   9.022
  309   2HO*    A  29          2HO*        A  29   8.088 -13.756  10.519
  310    H1*    A  29           H1*        A  29   8.362 -13.400   8.524
  311    H8     A  29           H8         A  29   9.863 -15.756   6.120
  312   1H6     A  29          1H6         A  29   4.743 -15.447   2.697
  313   2H6     A  29          2H6         A  29   6.406 -15.991   2.740
  314    H2     A  29           H2         A  29   3.894 -13.513   6.660
  315   1H5*    A  30          1H5*        A  30   6.855 -17.706  13.128
  316   2H5*    A  30          2H5*        A  30   5.971 -19.235  12.960
  317    H4*    A  30           H4*        A  30   4.631 -17.124  13.651
  318    H3*    A  30           H3*        A  30   3.897 -19.108  11.482
  319    H2*    A  30           H2*        A  30   1.950 -17.841  10.953
  320   2HO*    A  30          2HO*        A  30   1.693 -15.815  12.409
  321    H1*    A  30           H1*        A  30   3.101 -15.403  10.922
  322    H8     A  30           H8         A  30   5.879 -17.423   9.631
  323   1H6     A  30          1H6         A  30   2.870 -18.154   4.315
  324   2H6     A  30          2H6         A  30   4.403 -18.344   5.133
  325    H2     A  30           H2         A  30  -0.009 -16.445   7.313
  326   1H5*    G  31          1H5*        G  31   0.697 -18.460  12.766
  327   2H5*    G  31          2H5*        G  31  -0.168 -19.589  13.825
  328    H4*    G  31           H4*        G  31  -1.827 -19.046  12.284
  329    H3*    G  31           H3*        G  31  -0.328 -21.490  11.279
  330    H2*    G  31           H2*        G  31  -1.674 -21.499   9.344
  331   2HO*    G  31          2HO*        G  31  -3.460 -19.880  10.874
  332    H1*    G  31           H1*        G  31  -1.989 -18.731   9.076
  333    H8     G  31           H8         G  31   1.631 -19.404   9.477
  334    H1     G  31           H1         G  31  -0.447 -21.269   3.743
  335   1H2     G  31          1H2         G  31  -2.664 -21.257   3.702
  336   2H2     G  31          2H2         G  31  -3.627 -20.789   5.085
  337   1H5*    G  32          1H5*        G  32  -4.802 -22.498  11.815
  338   2H5*    G  32          2H5*        G  32  -5.013 -24.258  11.706
  339    H4*    G  32           H4*        G  32  -6.045 -22.676   9.857
  340    H3*    G  32           H3*        G  32  -4.628 -25.335   9.509
  341    H2*    G  32           H2*        G  32  -4.850 -25.163   7.155
  342   2HO*    G  32          2HO*        G  32  -6.619 -24.324   6.362
  343    H1*    G  32           H1*        G  32  -4.327 -22.481   6.906
  344    H8     G  32           H8         G  32  -1.843 -23.674   9.379
  345    H1     G  32           H1         G  32  -0.481 -25.811   3.527
  346   1H2     G  32          1H2         G  32  -2.206 -25.460   2.172
  347   2H2     G  32          2H2         G  32  -3.687 -24.701   2.713
  348   1H5*    U  33          1H5*        U  33  -7.697 -26.507   7.514
  349   2H5*    U  33          2H5*        U  33  -8.282 -28.127   7.947
  350    H4*    U  33           H4*        U  33  -7.163 -28.148   5.747
  351    H3*    U  33           H3*        U  33  -5.970 -29.650   8.083
  352    H2*    U  33           H2*        U  33  -4.016 -30.077   6.946
  353   2HO*    U  33          2HO*        U  33  -5.436 -29.995   4.474
  354    H1*    U  33           H1*        U  33  -4.342 -28.137   4.815
  355    H3     U  33           H3         U  33   0.099 -28.441   5.865
  356    H5     U  33           H5         U  33  -1.655 -26.356   9.080
  357    H6     U  33           H6         U  33  -3.829 -26.837   8.118
  358   1H5*    C  34          1H5*        C  34  -6.563 -32.137   4.690
  359   2H5*    C  34          2H5*        C  34  -7.489 -33.636   4.905
  360    H4*    C  34           H4*        C  34  -5.638 -34.465   3.790
  361    H3*    C  34           H3*        C  34  -4.990 -34.442   6.750
  362    H2*    C  34           H2*        C  34  -2.858 -35.272   6.307
  363   2HO*    C  34          2HO*        C  34  -4.151 -36.412   4.143
  364    H1*    C  34           H1*        C  34  -2.480 -33.970   3.847
  365   1H4     C  34          1H4         C  34   1.209 -30.857   7.970
  366   2H4     C  34          2H4         C  34  -0.189 -30.251   8.830
  367    H5     C  34           H5         C  34  -2.450 -30.868   8.274
  368    H6     C  34           H6         C  34  -3.860 -32.196   6.772
  369    H3T    C  34           H3T        C  34  -5.814 -36.400   6.604
  370   1H5*    U  35          1H5*        U  35  -4.228 -12.865   3.645
  371   2H5*    U  35          2H5*        U  35  -4.712 -11.166   3.474
  372    H4*    U  35           H4*        U  35  -3.548 -11.020   5.458
  373    H3*    U  35           H3*        U  35  -1.596 -10.647   3.176
  374    H2*    U  35           H2*        U  35   0.232 -10.629   4.653
  375   2HO*    U  35          2HO*        U  35  -1.673  -9.627   6.379
  376    H1*    U  35           H1*        U  35  -0.656 -12.506   6.477
  377    H3     U  35           H3         U  35   3.021 -14.289   4.527
  378    H5     U  35           H5         U  35   0.054 -14.557   1.549
  379    H6     U  35           H6         U  35  -1.419 -13.287   3.003
  380    H5T    U  35           H5T        U  35  -3.836 -11.733   1.557
  381   1H5*    U  36          1H5*        U  36  -1.444  -7.065   6.230
  382   2H5*    U  36          2H5*        U  36  -0.422  -5.783   5.550
  383    H4*    U  36           H4*        U  36   0.306  -7.027   7.763
  384    H3*    U  36           H3*        U  36   1.991  -6.168   5.400
  385    H2*    U  36           H2*        U  36   3.920  -7.173   6.353
  386   2HO*    U  36          2HO*        U  36   3.411  -8.197   8.617
  387    H1*    U  36           H1*        U  36   2.794  -9.498   7.150
  388    H3     U  36           H3         U  36   5.378 -10.068   3.393
  389    H5     U  36           H5         U  36   1.561  -8.970   1.983
  390    H6     U  36           H6         U  36   0.924  -8.500   4.276
  391   1H5*    C  37          1H5*        C  37   3.932  -3.749   9.102
  392   2H5*    C  37          2H5*        C  37   4.831  -2.497   8.224
  393    H4*    C  37           H4*        C  37   6.116  -4.232   9.738
  394    H3*    C  37           H3*        C  37   6.863  -3.189   6.991
  395    H2*    C  37           H2*        C  37   8.787  -4.575   6.968
  396   2HO*    C  37          2HO*        C  37   9.256  -4.080   9.268
  397    H1*    C  37           H1*        C  37   7.644  -6.833   7.967
  398   1H4     C  37          1H4         C  37   7.343  -6.974   1.576
  399   2H4     C  37          2H4         C  37   5.721  -6.325   1.663
  400    H5     C  37           H5         C  37   4.702  -5.594   3.718
  401    H6     C  37           H6         C  37   5.022  -5.310   6.133
  402   1H5*    G  38          1H5*        G  38  10.012  -1.249  10.138
  403   2H5*    G  38          2H5*        G  38  10.707   0.130   9.265
  404    H4*    G  38           H4*        G  38  12.334  -1.695  10.085
  405    H3*    G  38           H3*        G  38  12.193  -0.494   7.319
  406    H2*    G  38           H2*        G  38  13.835  -1.981   6.486
  407   2HO*    G  38          2HO*        G  38  15.419  -2.040   7.976
  408    H1*    G  38           H1*        G  38  12.983  -4.266   7.669
  409    H8     G  38           H8         G  38   9.787  -2.600   6.881
  410    H1     G  38           H1         G  38  12.724  -4.534   1.560
  411   1H2     G  38          1H2         G  38  14.818  -5.102   2.011
  412   2H2     G  38          2H2         G  38  15.492  -5.003   3.623
  413   1H5*    G  39          1H5*        G  39  16.607   0.760   8.477
  414   2H5*    G  39          2H5*        G  39  16.652   2.376   7.746
  415    H4*    G  39           H4*        G  39  18.369   0.678   6.883
  416    H3*    G  39           H3*        G  39  16.513   2.367   5.214
  417    H2*    G  39           H2*        G  39  17.144   1.296   3.209
  418   2HO*    G  39          2HO*        G  39  19.159   0.710   2.936
  419    H1*    G  39           H1*        G  39  17.295  -1.276   4.092
  420    H8     G  39           H8         G  39  14.344   0.068   5.875
  421    H1     G  39           H1         G  39  13.133  -0.674  -0.341
  422   1H2     G  39          1H2         G  39  15.019  -1.046  -1.443
  423   2H2     G  39          2H2         G  39  16.576  -1.109  -0.648
  424   1H5*    C  40          1H5*        C  40  19.515   2.484   3.159
  425   2H5*    C  40          2H5*        C  40  20.453   3.968   2.898
  426    H4*    C  40           H4*        C  40  19.974   3.204   0.713
  427    H3*    C  40           H3*        C  40  18.041   5.349   1.641
  428    H2*    C  40           H2*        C  40  16.824   5.166  -0.355
  429   2HO*    C  40          2HO*        C  40  18.006   3.806  -2.116
  430    H1*    C  40           H1*        C  40  17.253   2.434  -0.858
  431   1H4     C  40          1H4         C  40  11.169   3.116   0.880
  432   2H4     C  40          2H4         C  40  11.643   3.312   2.551
  433    H5     C  40           H5         C  40  13.940   3.407   3.270
  434    H6     C  40           H6         C  40  16.279   3.338   2.539
  435   1H5*    U  41          1H5*        U  41  17.636   8.157   1.630
  436   2H5*    U  41          2H5*        U  41  16.221   7.364   0.909
  437    H4*    U  41           H4*        U  41  16.273   9.961   0.981
  438    H3*    U  41           H3*        U  41  15.490   8.155  -1.292
  439    H2*    U  41           H2*        U  41  15.383   9.907  -2.858
  440   2HO*    U  41          2HO*        U  41  15.029  12.008  -2.288
  441    H1*    U  41           H1*        U  41  17.521  11.396  -2.071
  442    H3     U  41           H3         U  41  19.203   9.623  -5.830
  443    H5     U  41           H5         U  41  18.612   6.249  -3.375
  444    H6     U  41           H6         U  41  17.604   7.711  -1.720
  445   1H5*    C  42          1H5*        C  42  11.132   9.468  -1.011
  446   2H5*    C  42          2H5*        C  42  10.484   7.998  -0.254
  447    H4*    C  42           H4*        C  42   9.567   8.546  -2.567
  448    H3*    C  42           H3*        C  42  10.735   5.928  -1.680
  449    H2*    C  42           H2*        C  42  10.798   5.014  -3.842
  450   2HO*    C  42          2HO*        C  42   9.094   5.339  -5.045
  451    H1*    C  42           H1*        C  42  11.487   7.213  -5.303
  452   1H4     C  42          1H4         C  42  17.036   4.342  -4.176
  453   2H4     C  42          2H4         C  42  16.907   4.653  -2.460
  454    H5     C  42           H5         C  42  15.000   5.725  -1.452
  455    H6     C  42           H6         C  42  12.804   6.730  -1.870
  456   1H5*    U  43          1H5*        U  43   8.884   5.081   1.179
  457   2H5*    U  43          2H5*        U  43   7.877   3.660   0.831
  458    H4*    U  43           H4*        U  43   7.502   5.044   3.050
  459    H3*    U  43           H3*        U  43   5.468   3.817   1.179
  460    H2*    U  43           H2*        U  43   3.678   4.766   2.393
  461   2HO*    U  43          2HO*        U  43   3.951   5.598   4.491
  462    H1*    U  43           H1*        U  43   4.756   7.221   2.896
  463    H3     U  43           H3         U  43   1.476   7.931  -0.142
  464    H5     U  43           H5         U  43   4.571   6.158  -2.386
  465    H6     U  43           H6         U  43   5.780   5.802  -0.310
  466   1H5*    U  44          1H5*        U  44   4.974   2.784   5.699
  467   2H5*    U  44          2H5*        U  44   3.766   1.503   5.927
  468    H4*    U  44           H4*        U  44   3.373   3.899   6.967
  469    H3*    U  44           H3*        U  44   1.407   2.047   5.602
  470    H2*    U  44           H2*        U  44  -0.310   3.669   5.742
  471   2HO*    U  44          2HO*        U  44  -0.334   5.239   7.244
  472    H1*    U  44           H1*        U  44   1.150   5.881   5.108
  473    H3     U  44           H3         U  44  -1.676   4.843   1.661
  474    H5     U  44           H5         U  44   1.720   2.416   1.078
  475    H6     U  44           H6         U  44   2.523   3.131   3.254
  476   1H5*    C  45          1H5*        C  45  -0.903   3.705   9.260
  477   2H5*    C  45          2H5*        C  45  -1.291   2.159  10.042
  478    H4*    C  45           H4*        C  45  -3.308   3.534   9.879
  479    H3*    C  45           H3*        C  45  -3.104   1.023   8.206
  480    H2*    C  45           H2*        C  45  -5.194   1.445   7.194
  481   2HO*    C  45          2HO*        C  45  -6.774   2.477   8.214
  482    H1*    C  45           H1*        C  45  -4.998   4.166   6.914
  483   1H4     C  45          1H4         C  45  -3.252   1.694   1.317
  484   2H4     C  45          2H4         C  45  -1.696   1.235   1.972
  485    H5     C  45           H5         C  45  -1.100   1.524   4.286
  486    H6     C  45           H6         C  45  -1.866   2.316   6.476
  487   1H5*    C  46          1H5*        C  46  -7.028   1.559  10.442
  488   2H5*    C  46          2H5*        C  46  -7.936   0.034  10.475
  489    H4*    C  46           H4*        C  46  -8.908   2.129   9.195
  490    H3*    C  46           H3*        C  46  -8.919  -0.789   8.409
  491    H2*    C  46           H2*        C  46  -9.850  -0.302   6.296
  492   2HO*    C  46          2HO*        C  46 -10.479   2.108   6.016
  493    H1*    C  46           H1*        C  46  -8.454   1.973   5.716
  494   1H4     C  46          1H4         C  46  -5.365  -2.880   2.970
  495   2H4     C  46          2H4         C  46  -4.538  -3.221   4.473
  496    H5     C  46           H5         C  46  -5.018  -2.068   6.534
  497    H6     C  46           H6         C  46  -6.394  -0.342   7.599
  498   1H5*    U  47          1H5*        U  47 -13.504   0.779   8.227
  499   2H5*    U  47          2H5*        U  47 -14.383  -0.761   8.301
  500    H4*    U  47           H4*        U  47 -14.693   0.831   6.225
  501    H3*    U  47           H3*        U  47 -14.415  -2.179   6.306
  502    H2*    U  47           H2*        U  47 -14.390  -2.313   3.949
  503   2HO*    U  47          2HO*        U  47 -16.127  -0.428   4.050
  504    H1*    U  47           H1*        U  47 -12.836  -0.134   3.408
  505    H3     U  47           H3         U  47 -10.525  -3.970   2.461
  506    H5     U  47           H5         U  47  -9.996  -3.348   6.596
  507    H6     U  47           H6         U  47 -11.641  -1.568   6.472
  508   1H5*    A  48          1H5*        A  48 -18.658  -1.303   4.254
  509   2H5*    A  48          2H5*        A  48 -19.452  -2.892   4.247
  510    H4*    A  48           H4*        A  48 -18.808  -1.719   1.971
  511    H3*    A  48           H3*        A  48 -18.585  -4.604   2.797
  512    H2*    A  48           H2*        A  48 -17.461  -5.220   0.826
  513   2HO*    A  48          2HO*        A  48 -18.899  -3.750  -0.482
  514    H1*    A  48           H1*        A  48 -15.712  -3.172   0.723
  515    H8     A  48           H8         A  48 -16.142  -3.703   4.375
  516   1H6     A  48          1H6         A  48 -12.596  -8.717   3.956
  517   2H6     A  48          2H6         A  48 -13.417  -7.630   5.053
  518    H2     A  48           H2         A  48 -13.642  -7.398  -0.211
  519    H3T    A  48           H3T        A  48 -19.993  -4.467   0.707
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  10.983 -29.680   4.992
    2   2H5*    G   1          2H5*        G   1  10.390 -28.665   3.662
    3    H4*    G   1           H4*        G   1  11.045 -30.843   2.784
    4    H3*    G   1           H3*        G   1   8.164 -30.004   2.766
    5    H2*    G   1           H2*        G   1   7.363 -32.149   2.130
    6   2HO*    G   1          2HO*        G   1   9.216 -32.389   0.582
    7    H1*    G   1           H1*        G   1   8.780 -33.659   3.787
    8    H8     G   1           H8         G   1   8.638 -30.935   6.109
    9    H1     G   1           H1         G   1   2.693 -32.886   4.891
   10   1H2     G   1          1H2         G   1   2.669 -34.169   3.083
   11   2H2     G   1          2H2         G   1   4.119 -34.545   2.178
   12    H5T    G   1           H5T        G   1   9.146 -28.845   5.757
   13   1H5*    G   2          1H5*        G   2   8.347 -31.378  -0.753
   14   2H5*    G   2          2H5*        G   2   8.110 -30.382  -2.204
   15    H4*    G   2           H4*        G   2   6.375 -32.008  -2.269
   16    H3*    G   2           H3*        G   2   5.444 -29.311  -1.222
   17    H2*    G   2           H2*        G   2   3.242 -30.189  -1.010
   18   2HO*    G   2          2HO*        G   2   3.035 -32.531  -1.855
   19    H1*    G   2           H1*        G   2   3.920 -32.637  -0.018
   20    H8     G   2           H8         G   2   6.193 -30.397   1.816
   21    H1     G   2           H1         G   2   0.163 -29.624   3.734
   22   1H2     G   2          1H2         G   2  -1.222 -30.594   2.299
   23   2H2     G   2          2H2         G   2  -0.659 -31.430   0.870
   24   1H5*    C   3          1H5*        C   3   2.935 -29.024  -4.651
   25   2H5*    C   3          2H5*        C   3   3.095 -27.350  -5.222
   26    H4*    C   3           H4*        C   3   0.848 -27.869  -4.214
   27    H3*    C   3           H3*        C   3   2.666 -25.742  -3.027
   28    H2*    C   3           H2*        C   3   1.068 -25.297  -1.378
   29   2HO*    C   3          2HO*        C   3  -1.034 -26.649  -2.665
   30    H1*    C   3           H1*        C   3  -0.143 -27.882  -1.323
   31   1H4     C   3          1H4         C   3   2.590 -26.663   4.322
   32   2H4     C   3          2H4         C   3   4.109 -27.273   3.703
   33    H5     C   3           H5         C   3   4.436 -27.911   1.401
   34    H6     C   3           H6         C   3   3.384 -28.097  -0.799
   35   1H5*    C   4          1H5*        C   4  -1.166 -23.510  -5.316
   36   2H5*    C   4          2H5*        C   4  -0.707 -21.802  -5.180
   37    H4*    C   4           H4*        C   4  -3.011 -22.586  -4.216
   38    H3*    C   4           H3*        C   4  -0.980 -20.719  -2.978
   39    H2*    C   4           H2*        C   4  -2.255 -20.561  -0.984
   40   2HO*    C   4          2HO*        C   4  -4.413 -21.727  -1.022
   41    H1*    C   4           H1*        C   4  -2.891 -23.146  -0.686
   42   1H4     C   4          1H4         C   4   2.618 -22.162   2.389
   43   2H4     C   4          2H4         C   4   3.493 -22.646   0.954
   44    H5     C   4           H5         C   4   2.418 -23.110  -1.154
   45    H6     C   4           H6         C   4   0.275 -23.206  -2.338
   46   1H5*    U   5          1H5*        U   5  -4.917 -18.303  -2.495
   47   2H5*    U   5          2H5*        U   5  -4.305 -16.646  -2.668
   48    H4*    U   5           H4*        U   5  -5.434 -17.401  -0.408
   49    H3*    U   5           H3*        U   5  -2.936 -15.737  -0.817
   50    H2*    U   5           H2*        U   5  -2.502 -15.708   1.479
   51   2HO*    U   5          2HO*        U   5  -4.100 -15.710   2.992
   52    H1*    U   5           H1*        U   5  -3.734 -18.160   2.183
   53    H3     U   5           H3         U   5   0.567 -17.989   3.791
   54    H5     U   5           H5         U   5   0.876 -19.230  -0.224
   55    H6     U   5           H6         U   5  -1.474 -18.700  -0.498
   56   1H5*    U   6          1H5*        U   6  -7.176 -13.950  -0.087
   57   2H5*    U   6          2H5*        U   6  -8.139 -15.083  -1.055
   58    H4*    U   6           H4*        U   6  -8.887 -13.178  -2.486
   59    H3*    U   6           H3*        U   6  -7.020 -11.666  -0.649
   60    H2*    U   6           H2*        U   6  -8.590 -10.012  -0.270
   61   2HO*    U   6          2HO*        U   6  -9.414 -10.543  -2.950
   62    H1*    U   6           H1*        U   6 -10.918 -11.457  -1.256
   63    H3     U   6           H3         U   6 -12.390  -8.928   2.226
   64    H5     U   6           H5         U   6  -9.906 -11.827   4.009
   65    H6     U   6           H6         U   6  -9.271 -12.558   1.780
   66   1H5*    A   7          1H5*        A   7  -7.420  -9.468  -5.173
   67   2H5*    A   7          2H5*        A   7  -6.355  -8.058  -5.007
   68    H4*    A   7           H4*        A   7  -8.849  -7.706  -5.735
   69    H3*    A   7           H3*        A   7  -7.196  -6.121  -3.770
   70    H2*    A   7           H2*        A   7  -9.049  -4.823  -3.095
   71   2HO*    A   7          2HO*        A   7 -10.103  -4.200  -4.872
   72    H1*    A   7           H1*        A   7 -10.953  -6.764  -3.018
   73    H8     A   7           H8         A   7  -7.951  -8.475  -1.693
   74   1H6     A   7          1H6         A   7  -8.676  -5.426   3.608
   75   2H6     A   7          2H6         A   7  -7.833  -6.734   2.809
   76    H2     A   7           H2         A   7 -11.389  -3.563   0.545
   77   1H5*    G   8          1H5*        G   8  -8.490  -2.882  -6.963
   78   2H5*    G   8          2H5*        G   8  -7.281  -1.600  -6.750
   79    H4*    G   8           H4*        G   8  -9.813  -1.140  -6.171
   80    H3*    G   8           H3*        G   8  -7.298  -0.267  -4.766
   81    H2*    G   8           H2*        G   8  -8.446   0.534  -2.886
   82   2HO*    G   8          2HO*        G   8 -10.423   0.968  -4.773
   83    H1*    G   8           H1*        G   8 -10.495  -1.287  -2.732
   84    H8     G   8           H8         G   8  -7.468  -3.326  -3.324
   85    H1     G   8           H1         G   8  -7.471  -0.849   2.551
   86   1H2     G   8          1H2         G   8  -9.039   0.711   2.715
   87   2H2     G   8          2H2         G   8 -10.083   1.139   1.378
   88   1H5*    G   9          1H5*        G   9 -10.532   3.414  -5.677
   89   2H5*    G   9          2H5*        G   9  -9.494   4.839  -5.467
   90    H4*    G   9           H4*        G   9 -11.761   4.640  -4.129
   91    H3*    G   9           H3*        G   9  -9.077   5.704  -3.279
   92    H2*    G   9           H2*        G   9  -9.714   5.867  -0.998
   93   2HO*    G   9          2HO*        G   9 -12.380   5.475  -1.956
   94    H1*    G   9           H1*        G   9 -10.968   3.517  -0.722
   95    H8     G   9           H8         G   9  -8.343   2.677  -3.191
   96    H1     G   9           H1         G   9  -5.835   3.638   2.590
   97   1H2     G   9          1H2         G   9  -7.340   4.571   3.926
   98   2H2     G   9          2H2         G   9  -8.960   4.957   3.391
   99   1H5*    A  10          1H5*        A  10 -11.135   9.415  -2.203
  100   2H5*    A  10          2H5*        A  10  -9.953  10.664  -2.646
  101    H4*    A  10           H4*        A  10 -10.295  10.220  -0.134
  102    H3*    A  10           H3*        A  10  -7.596  10.196  -1.533
  103    H2*    A  10           H2*        A  10  -6.559   9.815   0.560
  104   2HO*    A  10          2HO*        A  10  -7.813  11.466   1.653
  105    H1*    A  10           H1*        A  10  -8.490   8.122   1.617
  106    H8     A  10           H8         A  10  -7.919   6.785  -1.751
  107   1H6     A  10          1H6         A  10  -2.477   4.569   0.086
  108   2H6     A  10          2H6         A  10  -3.684   4.539  -1.179
  109    H2     A  10           H2         A  10  -3.968   7.398   3.244
  110   1H5*    A  11          1H5*        A  11  -7.580  14.014   1.261
  111   2H5*    A  11          2H5*        A  11  -6.186  14.971   0.719
  112    H4*    A  11           H4*        A  11  -6.200  13.927   3.136
  113    H3*    A  11           H3*        A  11  -3.953  14.122   1.132
  114    H2*    A  11           H2*        A  11  -2.514  12.796   2.470
  115   2HO*    A  11          2HO*        A  11  -4.341  13.502   4.514
  116    H1*    A  11           H1*        A  11  -4.274  10.892   3.234
  117    H8     A  11           H8         A  11  -5.406  11.486  -0.217
  118   1H6     A  11          1H6         A  11  -0.411   8.543  -2.294
  119   2H6     A  11          2H6         A  11  -1.977   9.191  -2.726
  120    H2     A  11           H2         A  11   0.179   9.372   2.084
  121   1H5*    A  12          1H5*        A  12  -1.719  14.571   4.255
  122   2H5*    A  12          2H5*        A  12  -0.599  15.936   4.077
  123    H4*    A  12           H4*        A  12   0.632  13.804   4.172
  124    H3*    A  12           H3*        A  12   0.616  15.374   1.576
  125    H2*    A  12           H2*        A  12   1.972  13.732   0.575
  126   2HO*    A  12          2HO*        A  12   3.429  13.682   2.461
  127    H1*    A  12           H1*        A  12   0.907  11.505   1.758
  128    H8     A  12           H8         A  12  -1.876  13.671   0.581
  129   1H6     A  12          1H6         A  12  -0.719  11.804  -5.170
  130   2H6     A  12          2H6         A  12  -1.843  12.669  -4.145
  131    H2     A  12           H2         A  12   2.633  10.395  -2.530
  132   1H5*    C  13          1H5*        C  13   4.940  15.217   3.440
  133   2H5*    C  13          2H5*        C  13   5.906  16.519   2.714
  134    H4*    C  13           H4*        C  13   6.847  14.155   2.474
  135    H3*    C  13           H3*        C  13   6.327  16.006   0.115
  136    H2*    C  13           H2*        C  13   7.280  14.338  -1.312
  137   2HO*    C  13          2HO*        C  13   8.419  12.590  -0.520
  138    H1*    C  13           H1*        C  13   5.944  12.244  -0.291
  139   1H4     C  13          1H4         C  13   2.414  14.785  -4.976
  140   2H4     C  13          2H4         C  13   1.497  15.664  -3.775
  141    H5     C  13           H5         C  13   2.077  15.698  -1.440
  142    H6     C  13           H6         C  13   3.654  14.894   0.250
  143   1H5*    A  14          1H5*        A  14  10.880  15.089  -0.199
  144   2H5*    A  14          2H5*        A  14  11.441  16.387  -1.272
  145    H4*    A  14           H4*        A  14  11.521  13.867  -2.066
  146    H3*    A  14           H3*        A  14  10.599  16.267  -3.706
  147    H2*    A  14           H2*        A  14  10.436  14.752  -5.571
  148   2HO*    A  14          2HO*        A  14  11.553  12.929  -5.654
  149    H1*    A  14           H1*        A  14   9.153  12.791  -4.208
  150    H8     A  14           H8         A  14   7.634  15.805  -2.737
  151   1H6     A  14          1H6         A  14   4.413  16.643  -7.911
  152   2H6     A  14          2H6         A  14   4.596  17.126  -6.239
  153    H2     A  14           H2         A  14   7.569  13.547  -8.721
  154   1H5*    G  15          1H5*        G  15  13.618  14.838  -5.765
  155   2H5*    G  15          2H5*        G  15  14.899  15.886  -6.404
  156    H4*    G  15           H4*        G  15  13.821  14.877  -8.296
  157    H3*    G  15           H3*        G  15  12.989  17.762  -7.803
  158    H2*    G  15           H2*        G  15  11.710  17.652  -9.837
  159   2HO*    G  15          2HO*        G  15  12.216  16.286 -11.401
  160    H1*    G  15           H1*        G  15  10.580  15.222  -9.324
  161    H8     G  15           H8         G  15  10.699  16.778  -5.963
  162    H1     G  15           H1         G  15   6.337  19.583  -9.659
  163   1H2     G  15          1H2         G  15   6.616  18.966 -11.767
  164   2H2     G  15          2H2         G  15   7.879  17.863 -12.266
  165   1H5*    U  16          1H5*        U  16  13.705  17.724 -11.114
  166   2H5*    U  16          2H5*        U  16  14.710  18.798 -12.105
  167    H4*    U  16           H4*        U  16  12.570  19.269 -12.902
  168    H3*    U  16           H3*        U  16  13.140  21.200 -10.607
  169    H2*    U  16           H2*        U  16  11.078  22.231 -11.135
  170   2HO*    U  16          2HO*        U  16  10.088  21.156 -13.263
  171    H1*    U  16           H1*        U  16   9.731  19.868 -11.814
  172    H3     U  16           H3         U  16   7.566  21.859  -8.319
  173    H5     U  16           H5         U  16  10.991  20.085  -6.630
  174    H6     U  16           H6         U  16  11.757  19.574  -8.854
  175   1H5*    U  17          1H5*        U  17  12.742  24.937 -11.498
  176   2H5*    U  17          2H5*        U  17  11.738  23.826 -12.446
  177    H4*    U  17           H4*        U  17  12.566  26.657 -13.140
  178    H3*    U  17           H3*        U  17  10.331  25.867 -11.867
  179    H2*    U  17           H2*        U  17   9.684  24.116 -13.358
  180   2HO*    U  17          2HO*        U  17   8.368  25.735 -15.054
  181    H1*    U  17           H1*        U  17  10.191  25.702 -15.839
  182    H3     U  17           H3         U  17   8.908  21.636 -17.462
  183    H5     U  17           H5         U  17  12.376  20.839 -15.204
  184    H6     U  17           H6         U  17  12.380  23.145 -14.506
  185   1H5*    C  18          1H5*        C  18   6.643  26.220 -13.217
  186   2H5*    C  18          2H5*        C  18   6.550  27.989 -13.099
  187    H4*    C  18           H4*        C  18   4.695  26.851 -11.884
  188    H3*    C  18           H3*        C  18   6.051  29.048 -11.012
  189    H2*    C  18           H2*        C  18   7.724  27.872  -9.756
  190   2HO*    C  18          2HO*        C  18   7.074  29.090  -8.109
  191    H1*    C  18           H1*        C  18   5.640  26.036  -8.578
  192   1H4     C  18          1H4         C  18  11.007  23.120  -6.833
  193   2H4     C  18          2H4         C  18  11.577  23.106  -8.487
  194    H5     C  18           H5         C  18  10.392  24.140 -10.303
  195    H6     C  18           H6         C  18   8.394  25.405 -10.937
  196   1H5*    G  19          1H5*        G  19   1.254  27.087 -11.481
  197   2H5*    G  19          2H5*        G  19   2.691  26.079 -11.213
  198    H4*    G  19           H4*        G  19   1.179  26.614 -13.759
  199    H3*    G  19           H3*        G  19   2.382  24.212 -12.329
  200    H2*    G  19           H2*        G  19   2.605  23.133 -14.409
  201   2HO*    G  19          2HO*        G  19   1.417  23.857 -16.260
  202    H1*    G  19           H1*        G  19   3.117  25.424 -15.956
  203    H8     G  19           H8         G  19   5.313  24.492 -16.834
  204    H1     G  19           H1         G  19   7.316  22.540 -11.104
  205   1H2     G  19          1H2         G  19   5.791  23.021  -9.566
  206   2H2     G  19          2H2         G  19   4.285  23.822  -9.952
  207   1H5*    C  20          1H5*        C  20   0.144  22.793 -14.843
  208   2H5*    C  20          2H5*        C  20  -0.658  21.236 -14.559
  209    H4*    C  20           H4*        C  20   1.210  21.099 -16.221
  210    H3*    C  20           H3*        C  20   1.191  19.505 -13.655
  211    H2*    C  20           H2*        C  20   3.338  18.603 -14.110
  212   2HO*    C  20          2HO*        C  20   2.959  19.655 -16.744
  213    H1*    C  20           H1*        C  20   4.565  20.863 -14.929
  214   1H4     C  20          1H4         C  20   5.218  20.472  -8.578
  215   2H4     C  20          2H4         C  20   3.762  21.422  -8.388
  216    H5     C  20           H5         C  20   2.357  22.067 -10.223
  217    H6     C  20           H6         C  20   2.039  21.955 -12.648
  218   1H5*    U  21          1H5*        U  21   2.569  17.126 -16.369
  219   2H5*    U  21          2H5*        U  21   1.584  15.739 -16.875
  220    H4*    U  21           H4*        U  21   3.760  14.851 -16.570
  221    H3*    U  21           H3*        U  21   1.930  14.339 -14.210
  222    H2*    U  21           H2*        U  21   3.695  13.208 -13.089
  223   2HO*    U  21          2HO*        U  21   5.433  12.371 -14.132
  224    H1*    U  21           H1*        U  21   5.711  14.936 -13.714
  225    H3     U  21           H3         U  21   4.864  15.598  -9.299
  226    H5     U  21           H5         U  21   1.801  17.701 -11.291
  227    H6     U  21           H6         U  21   2.560  16.705 -13.371
  228   1H5*    G  22          1H5*        G  22   3.813  10.729 -15.099
  229   2H5*    G  22          2H5*        G  22   2.945   9.317 -14.464
  230    H4*    G  22           H4*        G  22   5.157  10.037 -13.291
  231    H3*    G  22           H3*        G  22   2.517   9.377 -11.953
  232    H2*    G  22           H2*        G  22   3.341  10.052  -9.895
  233   2HO*    G  22          2HO*        G  22   5.764   9.011 -10.917
  234    H1*    G  22           H1*        G  22   5.547  11.638 -10.839
  235    H8     G  22           H8         G  22   2.210  13.128 -11.538
  236    H1     G  22           H1         G  22   3.804  13.765  -5.403
  237   1H2     G  22          1H2         G  22   5.592  12.535  -4.949
  238   2H2     G  22          2H2         G  22   6.392  11.561  -6.162
  239   1H5*    U  23          1H5*        U  23   5.659   5.954 -10.491
  240   2H5*    U  23          2H5*        U  23   4.561   4.759  -9.771
  241    H4*    U  23           H4*        U  23   6.388   5.909  -8.272
  242    H3*    U  23           H3*        U  23   3.474   5.393  -7.608
  243    H2*    U  23           H2*        U  23   3.736   6.450  -5.521
  244   2HO*    U  23          2HO*        U  23   6.391   6.907  -5.375
  245    H1*    U  23           H1*        U  23   5.562   8.413  -6.282
  246    H3     U  23           H3         U  23   1.645  10.210  -4.659
  247    H5     U  23           H5         U  23   1.021   9.542  -8.775
  248    H6     U  23           H6         U  23   3.108   8.304  -8.822
  249   1H5*    G  24          1H5*        G  24   5.046   0.254  -6.162
  250   2H5*    G  24          2H5*        G  24   5.491   0.746  -4.515
  251    H4*    G  24           H4*        G  24   6.877   1.432  -7.123
  252    H3*    G  24           H3*        G  24   7.505  -0.179  -4.658
  253    H2*    G  24           H2*        G  24   9.678   0.680  -4.473
  254   2HO*    G  24          2HO*        G  24   9.349   1.402  -7.210
  255    H1*    G  24           H1*        G  24   9.273   3.254  -5.227
  256    H8     G  24           H8         G  24   6.378   2.612  -3.053
  257    H1     G  24           H1         G  24  11.787   2.618   0.324
  258   1H2     G  24          1H2         G  24  13.532   2.546  -1.041
  259   2H2     G  24          2H2         G  24  13.362   2.494  -2.782
  260   1H5*    C  25          1H5*        C  25  11.009  -0.568  -7.512
  261   2H5*    C  25          2H5*        C  25  10.870  -2.280  -7.964
  262    H4*    C  25           H4*        C  25  13.200  -1.868  -7.624
  263    H3*    C  25           H3*        C  25  11.792  -3.373  -5.421
  264    H2*    C  25           H2*        C  25  13.721  -3.376  -4.052
  265   2HO*    C  25          2HO*        C  25  15.246  -2.340  -6.236
  266    H1*    C  25           H1*        C  25  14.551  -0.827  -4.470
  267   1H4     C  25          1H4         C  25  10.726  -0.706   0.629
  268   2H4     C  25          2H4         C  25   9.321  -0.599  -0.410
  269    H5     C  25           H5         C  25   9.443  -0.736  -2.813
  270    H6     C  25           H6         C  25  10.937  -1.004  -4.740
  271   1H5*    C  26          1H5*        C  26  15.670  -5.821  -6.260
  272   2H5*    C  26          2H5*        C  26  15.003  -7.462  -6.360
  273    H4*    C  26           H4*        C  26  16.938  -7.248  -4.772
  274    H3*    C  26           H3*        C  26  14.196  -8.186  -3.891
  275    H2*    C  26           H2*        C  26  14.965  -8.412  -1.652
  276   2HO*    C  26          2HO*        C  26  17.374  -8.732  -2.916
  277    H1*    C  26           H1*        C  26  16.366  -6.105  -1.488
  278   1H4     C  26          1H4         C  26  10.542  -4.542   0.510
  279   2H4     C  26          2H4         C  26   9.956  -4.494  -1.138
  280    H5     C  26           H5         C  26  11.304  -5.110  -3.037
  281    H6     C  26           H6         C  26  13.506  -5.904  -3.767
  282   1H5*    G  27          1H5*        G  27  16.847 -11.225  -2.250
  283   2H5*    G  27          2H5*        G  27  15.843 -12.639  -1.873
  284    H4*    G  27           H4*        G  27  16.753 -11.090   0.070
  285    H3*    G  27           H3*        G  27  13.972 -12.291  -0.214
  286    H2*    G  27           H2*        G  27  13.356 -11.273   1.819
  287   2HO*    G  27          2HO*        G  27  16.116 -11.441   2.308
  288    H1*    G  27           H1*        G  27  14.924  -8.955   1.565
  289    H8     G  27           H8         G  27  12.968  -9.172  -1.548
  290    H1     G  27           H1         G  27   9.206  -7.753   3.399
  291   1H2     G  27          1H2         G  27  10.297  -8.087   5.301
  292   2H2     G  27          2H2         G  27  11.949  -8.660   5.349
  293   1H5*    A  28          1H5*        A  28  15.395 -14.751   3.496
  294   2H5*    A  28          2H5*        A  28  14.316 -16.156   3.387
  295    H4*    A  28           H4*        A  28  14.045 -14.415   5.361
  296    H3*    A  28           H3*        A  28  11.871 -15.745   3.709
  297    H2*    A  28           H2*        A  28  10.232 -14.545   4.886
  298   2HO*    A  28          2HO*        A  28  11.764 -13.452   6.890
  299    H1*    A  28           H1*        A  28  11.725 -12.211   5.378
  300    H8     A  28           H8         A  28  11.853 -12.868   1.736
  301   1H6     A  28          1H6         A  28   6.101 -10.719   1.252
  302   2H6     A  28          2H6         A  28   7.531 -11.202   0.366
  303    H2     A  28           H2         A  28   7.018 -11.279   5.614
  304   1H5*    A  29          1H5*        A  29  11.785 -17.596   8.359
  305   2H5*    A  29          2H5*        A  29  10.496 -18.812   8.252
  306    H4*    A  29           H4*        A  29  10.325 -16.845  10.008
  307    H3*    A  29           H3*        A  29   8.196 -18.116   8.291
  308    H2*    A  29           H2*        A  29   6.576 -16.497   8.899
  309   2HO*    A  29          2HO*        A  29   6.650 -15.436  10.766
  310    H1*    A  29           H1*        A  29   8.085 -14.283   8.676
  311    H8     A  29           H8         A  29   9.535 -16.343   5.988
  312   1H6     A  29          1H6         A  29   4.446 -15.473   2.631
  313   2H6     A  29          2H6         A  29   6.096 -16.054   2.610
  314    H2     A  29           H2         A  29   3.617 -14.054   6.815
  315   1H5*    A  30          1H5*        A  30   6.456 -19.089  12.679
  316   2H5*    A  30          2H5*        A  30   5.388 -20.447  12.276
  317    H4*    A  30           H4*        A  30   4.357 -18.197  13.164
  318    H3*    A  30           H3*        A  30   3.386 -19.983  10.924
  319    H2*    A  30           H2*        A  30   1.647 -18.448  10.385
  320   2HO*    A  30          2HO*        A  30   1.613 -16.447  11.885
  321    H1*    A  30           H1*        A  30   3.103 -16.192  10.429
  322    H8     A  30           H8         A  30   5.686 -18.474   9.205
  323   1H6     A  30          1H6         A  30   2.810 -18.832   3.777
  324   2H6     A  30          2H6         A  30   4.288 -19.181   4.644
  325    H2     A  30           H2         A  30   0.005 -16.897   6.708
  326   1H5*    G  31          1H5*        G  31   0.251 -19.127  12.243
  327   2H5*    G  31          2H5*        G  31  -0.749 -20.207  13.234
  328    H4*    G  31           H4*        G  31  -2.289 -19.502  11.637
  329    H3*    G  31           H3*        G  31  -0.939 -22.035  10.635
  330    H2*    G  31           H2*        G  31  -2.211 -21.901   8.650
  331   2HO*    G  31          2HO*        G  31  -4.204 -21.490   9.882
  332    H1*    G  31           H1*        G  31  -2.251 -19.121   8.408
  333    H8     G  31           H8         G  31   1.274 -20.078   9.012
  334    H1     G  31           H1         G  31  -0.600 -21.748   3.154
  335   1H2     G  31          1H2         G  31  -2.805 -21.576   2.983
  336   2H2     G  31          2H2         G  31  -3.812 -21.050   4.315
  337   1H5*    G  32          1H5*        G  32  -5.483 -23.366  11.255
  338   2H5*    G  32          2H5*        G  32  -5.371 -25.136  11.160
  339    H4*    G  32           H4*        G  32  -6.671 -23.780   9.299
  340    H3*    G  32           H3*        G  32  -4.812 -26.152   8.994
  341    H2*    G  32           H2*        G  32  -5.002 -26.046   6.633
  342   2HO*    G  32          2HO*        G  32  -7.125 -24.158   6.971
  343    H1*    G  32           H1*        G  32  -4.905 -23.330   6.342
  344    H8     G  32           H8         G  32  -2.396 -24.055   8.973
  345    H1     G  32           H1         G  32  -0.394 -26.057   3.261
  346   1H2     G  32          1H2         G  32  -2.069 -26.010   1.810
  347   2H2     G  32          2H2         G  32  -3.679 -25.483   2.250
  348   1H5*    U  33          1H5*        U  33  -7.494 -27.650   6.896
  349   2H5*    U  33          2H5*        U  33  -7.983 -29.326   7.215
  350    H4*    U  33           H4*        U  33  -6.736 -29.244   5.122
  351    H3*    U  33           H3*        U  33  -5.434 -30.562   7.513
  352    H2*    U  33           H2*        U  33  -3.406 -30.735   6.438
  353   2HO*    U  33          2HO*        U  33  -5.063 -31.572   4.449
  354    H1*    U  33           H1*        U  33  -3.885 -28.830   4.315
  355    H3     U  33           H3         U  33   0.487 -28.521   5.607
  356    H5     U  33           H5         U  33  -1.710 -26.740   8.732
  357    H6     U  33           H6         U  33  -3.741 -27.515   7.652
  358   1H5*    C  34          1H5*        C  34  -5.897 -33.664   4.040
  359   2H5*    C  34          2H5*        C  34  -6.086 -35.263   4.788
  360    H4*    C  34           H4*        C  34  -4.245 -35.297   3.165
  361    H3*    C  34           H3*        C  34  -3.512 -35.457   6.104
  362    H2*    C  34           H2*        C  34  -1.269 -35.726   5.523
  363   2HO*    C  34          2HO*        C  34  -1.059 -37.212   4.005
  364    H1*    C  34           H1*        C  34  -1.320 -34.088   3.237
  365   1H4     C  34          1H4         C  34   1.841 -30.895   7.739
  366   2H4     C  34          2H4         C  34   0.345 -30.537   8.574
  367    H5     C  34           H5         C  34  -1.792 -31.407   7.882
  368    H6     C  34           H6         C  34  -2.959 -32.807   6.244
  369    H3T    C  34           H3T        C  34  -3.060 -37.694   5.070
  370   1H5*    U  35          1H5*        U  35  -4.560 -12.949   3.220
  371   2H5*    U  35          2H5*        U  35  -4.515 -11.240   2.740
  372    H4*    U  35           H4*        U  35  -3.986 -11.312   5.079
  373    H3*    U  35           H3*        U  35  -1.682 -10.805   3.196
  374    H2*    U  35           H2*        U  35  -0.109 -10.859   4.946
  375   2HO*    U  35          2HO*        U  35  -2.294 -10.719   6.790
  376    H1*    U  35           H1*        U  35  -1.149 -12.899   6.434
  377    H3     U  35           H3         U  35   2.687 -14.508   4.642
  378    H5     U  35           H5         U  35   0.005 -14.409   1.393
  379    H6     U  35           H6         U  35  -1.596 -13.298   2.839
  380    H5T    U  35           H5T        U  35  -3.424 -12.535   1.245
  381   1H5*    U  36          1H5*        U  36  -1.570  -7.779   6.594
  382   2H5*    U  36          2H5*        U  36  -0.528  -6.429   6.100
  383    H4*    U  36           H4*        U  36   0.198  -8.017   8.085
  384    H3*    U  36           H3*        U  36   1.896  -6.869   5.849
  385    H2*    U  36           H2*        U  36   3.799  -8.017   6.694
  386   2HO*    U  36          2HO*        U  36   2.296  -8.882   8.956
  387    H1*    U  36           H1*        U  36   2.607 -10.406   7.161
  388    H3     U  36           H3         U  36   5.295 -10.567   3.445
  389    H5     U  36           H5         U  36   1.567  -9.162   2.070
  390    H6     U  36           H6         U  36   0.859  -8.976   4.384
  391   1H5*    C  37          1H5*        C  37   3.775  -4.903   9.866
  392   2H5*    C  37          2H5*        C  37   4.639  -3.521   9.163
  393    H4*    C  37           H4*        C  37   5.986  -5.331  10.494
  394    H3*    C  37           H3*        C  37   6.707  -4.062   7.834
  395    H2*    C  37           H2*        C  37   8.679  -5.380   7.734
  396   2HO*    C  37          2HO*        C  37   9.607  -5.422   9.676
  397    H1*    C  37           H1*        C  37   7.595  -7.738   8.555
  398   1H4     C  37          1H4         C  37   7.412  -7.386   2.162
  399   2H4     C  37          2H4         C  37   5.769  -6.795   2.265
  400    H5     C  37           H5         C  37   4.688  -6.260   4.351
  401    H6     C  37           H6         C  37   4.950  -6.172   6.787
  402   1H5*    G  38          1H5*        G  38  10.038  -2.320  10.981
  403   2H5*    G  38          2H5*        G  38  10.768  -1.023  10.014
  404    H4*    G  38           H4*        G  38  12.240  -3.049  10.839
  405    H3*    G  38           H3*        G  38  12.250  -1.577   8.209
  406    H2*    G  38           H2*        G  38  13.734  -3.125   7.208
  407   2HO*    G  38          2HO*        G  38  14.365  -3.682   9.889
  408    H1*    G  38           H1*        G  38  12.662  -5.425   8.124
  409    H8     G  38           H8         G  38   9.630  -3.397   7.637
  410    H1     G  38           H1         G  38  12.304  -4.869   2.036
  411   1H2     G  38          1H2         G  38  14.349  -5.660   2.357
  412   2H2     G  38          2H2         G  38  15.053  -5.824   3.950
  413   1H5*    G  39          1H5*        G  39  16.598  -0.781   9.586
  414   2H5*    G  39          2H5*        G  39  16.854   0.930   9.187
  415    H4*    G  39           H4*        G  39  18.411  -0.647   7.992
  416    H3*    G  39           H3*        G  39  16.560   1.270   6.573
  417    H2*    G  39           H2*        G  39  17.189   0.446   4.451
  418   2HO*    G  39          2HO*        G  39  19.068  -1.336   4.796
  419    H1*    G  39           H1*        G  39  17.295  -2.218   5.031
  420    H8     G  39           H8         G  39  14.333  -1.043   6.910
  421    H1     G  39           H1         G  39  13.224  -1.050   0.631
  422   1H2     G  39          1H2         G  39  15.128  -1.314  -0.474
  423   2H2     G  39          2H2         G  39  16.668  -1.489   0.335
  424   1H5*    C  40          1H5*        C  40  19.375   1.442   4.302
  425   2H5*    C  40          2H5*        C  40  20.461   2.843   4.410
  426    H4*    C  40           H4*        C  40  20.126   2.722   2.113
  427    H3*    C  40           H3*        C  40  18.035   4.542   3.341
  428    H2*    C  40           H2*        C  40  17.011   4.830   1.236
  429   2HO*    C  40          2HO*        C  40  19.586   4.361   0.359
  430    H1*    C  40           H1*        C  40  17.377   2.264   0.250
  431   1H4     C  40          1H4         C  40  11.340   2.554   2.222
  432   2H4     C  40          2H4         C  40  11.846   2.585   3.897
  433    H5     C  40           H5         C  40  14.157   2.644   4.576
  434    H6     C  40           H6         C  40  16.481   2.686   3.797
  435   1H5*    U  41          1H5*        U  41  17.396   7.867   3.502
  436   2H5*    U  41          2H5*        U  41  16.422   6.726   2.553
  437    H4*    U  41           H4*        U  41  15.949   9.357   2.505
  438    H3*    U  41           H3*        U  41  15.678   7.218   0.404
  439    H2*    U  41           H2*        U  41  15.332   8.769  -1.335
  440   2HO*    U  41          2HO*        U  41  15.143  10.975   0.423
  441    H1*    U  41           H1*        U  41  17.107  10.702  -0.607
  442    H3     U  41           H3         U  41  18.963   8.774  -4.252
  443    H5     U  41           H5         U  41  19.551   5.934  -1.194
  444    H6     U  41           H6         U  41  18.197   7.322   0.264
  445   1H5*    C  42          1H5*        C  42  11.214   9.189  -0.648
  446   2H5*    C  42          2H5*        C  42  10.559   7.647  -0.061
  447    H4*    C  42           H4*        C  42  10.066   8.510  -2.533
  448    H3*    C  42           H3*        C  42  10.449   5.759  -1.398
  449    H2*    C  42           H2*        C  42  10.726   4.728  -3.480
  450   2HO*    C  42          2HO*        C  42   9.332   7.004  -4.474
  451    H1*    C  42           H1*        C  42  11.989   6.724  -4.897
  452   1H4     C  42          1H4         C  42  16.418   2.502  -3.114
  453   2H4     C  42          2H4         C  42  16.622   3.357  -1.601
  454    H5     C  42           H5         C  42  15.230   5.207  -0.932
  455    H6     C  42           H6         C  42  13.343   6.636  -1.571
  456   1H5*    U  43          1H5*        U  43   8.767   5.827   1.235
  457   2H5*    U  43          2H5*        U  43   7.894   4.285   1.113
  458    H4*    U  43           H4*        U  43   7.279   6.017   3.012
  459    H3*    U  43           H3*        U  43   5.427   4.340   1.293
  460    H2*    U  43           H2*        U  43   3.545   5.330   2.300
  461   2HO*    U  43          2HO*        U  43   4.679   6.825   4.270
  462    H1*    U  43           H1*        U  43   4.550   7.897   2.629
  463    H3     U  43           H3         U  43   1.094   8.428  -0.223
  464    H5     U  43           H5         U  43   3.969   6.365  -2.514
  465    H6     U  43           H6         U  43   5.328   6.172  -0.511
  466   1H5*    U  44          1H5*        U  44   5.033   3.793   6.032
  467   2H5*    U  44          2H5*        U  44   3.882   2.482   6.361
  468    H4*    U  44           H4*        U  44   3.415   4.917   7.269
  469    H3*    U  44           H3*        U  44   1.503   2.908   6.067
  470    H2*    U  44           H2*        U  44  -0.280   4.460   6.126
  471   2HO*    U  44          2HO*        U  44   1.064   6.517   7.423
  472    H1*    U  44           H1*        U  44   1.070   6.691   5.332
  473    H3     U  44           H3         U  44  -1.732   5.337   1.982
  474    H5     U  44           H5         U  44   1.735   2.983   1.535
  475    H6     U  44           H6         U  44   2.532   3.872   3.648
  476   1H5*    C  45          1H5*        C  45  -0.784   4.573   9.656
  477   2H5*    C  45          2H5*        C  45  -1.165   3.072  10.523
  478    H4*    C  45           H4*        C  45  -3.202   4.387  10.249
  479    H3*    C  45           H3*        C  45  -2.934   1.828   8.650
  480    H2*    C  45           H2*        C  45  -5.042   2.189   7.649
  481   2HO*    C  45          2HO*        C  45  -6.451   3.886   8.514
  482    H1*    C  45           H1*        C  45  -4.879   4.916   7.317
  483   1H4     C  45          1H4         C  45  -3.278   2.355   1.720
  484   2H4     C  45          2H4         C  45  -1.719   1.870   2.349
  485    H5     C  45           H5         C  45  -1.068   2.180   4.647
  486    H6     C  45           H6         C  45  -1.772   3.021   6.840
  487   1H5*    C  46          1H5*        C  46  -6.758   2.175  11.118
  488   2H5*    C  46          2H5*        C  46  -7.632   0.631  11.189
  489    H4*    C  46           H4*        C  46  -8.713   2.715   9.979
  490    H3*    C  46           H3*        C  46  -8.715  -0.200   9.182
  491    H2*    C  46           H2*        C  46  -9.774   0.278   7.125
  492   2HO*    C  46          2HO*        C  46 -10.348   2.852   8.240
  493    H1*    C  46           H1*        C  46  -8.453   2.578   6.477
  494   1H4     C  46          1H4         C  46  -5.445  -2.228   3.560
  495   2H4     C  46          2H4         C  46  -4.526  -2.550   5.013
  496    H5     C  46           H5         C  46  -4.904  -1.401   7.096
  497    H6     C  46           H6         C  46  -6.246   0.306   8.235
  498   1H5*    U  47          1H5*        U  47 -13.312   1.320   9.281
  499   2H5*    U  47          2H5*        U  47 -14.182  -0.223   9.401
  500    H4*    U  47           H4*        U  47 -14.623   1.382   7.358
  501    H3*    U  47           H3*        U  47 -14.342  -1.627   7.413
  502    H2*    U  47           H2*        U  47 -14.462  -1.760   5.060
  503   2HO*    U  47          2HO*        U  47 -15.876   0.600   5.391
  504    H1*    U  47           H1*        U  47 -12.977   0.453   4.424
  505    H3     U  47           H3         U  47 -10.707  -3.342   3.236
  506    H5     U  47           H5         U  47  -9.860  -2.771   7.326
  507    H6     U  47           H6         U  47 -11.530  -1.011   7.360
  508   1H5*    A  48          1H5*        A  48 -18.583  -0.864   5.505
  509   2H5*    A  48          2H5*        A  48 -19.373  -2.451   5.591
  510    H4*    A  48           H4*        A  48 -18.739  -1.413   3.249
  511    H3*    A  48           H3*        A  48 -18.502  -4.242   4.245
  512    H2*    A  48           H2*        A  48 -17.384  -4.971   2.312
  513   2HO*    A  48          2HO*        A  48 -18.415  -4.065   0.616
  514    H1*    A  48           H1*        A  48 -15.649  -2.921   2.069
  515    H8     A  48           H8         A  48 -16.019  -3.227   5.749
  516   1H6     A  48          1H6         A  48 -12.462  -8.251   5.584
  517   2H6     A  48          2H6         A  48 -13.249  -7.085   6.623
  518    H2     A  48           H2         A  48 -13.588  -7.201   1.361
  519    H3T    A  48           H3T        A  48 -19.996  -2.805   2.286
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  10.999 -29.040   4.028
    2   2H5*    G   1          2H5*        G   1  10.647 -28.367   2.423
    3    H4*    G   1           H4*        G   1  11.017 -30.678   2.042
    4    H3*    G   1           H3*        G   1   8.131 -29.827   2.064
    5    H2*    G   1           H2*        G   1   7.331 -32.060   1.980
    6   2HO*    G   1          2HO*        G   1  10.009 -32.664   1.231
    7    H1*    G   1           H1*        G   1   8.901 -33.150   3.833
    8    H8     G   1           H8         G   1   8.799 -29.983   5.503
    9    H1     G   1           H1         G   1   2.858 -32.265   5.105
   10   1H2     G   1          1H2         G   1   2.774 -33.914   3.627
   11   2H2     G   1          2H2         G   1   4.180 -34.453   2.738
   12    H5T    G   1           H5T        G   1   8.427 -29.277   3.744
   13   1H5*    G   2          1H5*        G   2   7.541 -32.540  -0.562
   14   2H5*    G   2          2H5*        G   2   7.624 -31.860  -2.199
   15    H4*    G   2           H4*        G   2   5.708 -33.162  -2.363
   16    H3*    G   2           H3*        G   2   4.912 -30.372  -1.464
   17    H2*    G   2           H2*        G   2   2.644 -31.076  -1.369
   18   2HO*    G   2          2HO*        G   2   2.615 -33.581  -2.190
   19    H1*    G   2           H1*        G   2   3.063 -33.544  -0.275
   20    H8     G   2           H8         G   2   5.372 -31.333   1.583
   21    H1     G   2           H1         G   2  -0.684 -30.223   3.208
   22   1H2     G   2          1H2         G   2  -2.052 -31.220   1.776
   23   2H2     G   2          2H2         G   2  -1.470 -32.160   0.421
   24   1H5*    C   3          1H5*        C   3   2.114 -30.472  -4.199
   25   2H5*    C   3          2H5*        C   3   2.309 -29.140  -5.356
   26    H4*    C   3           H4*        C   3   0.179 -28.810  -4.318
   27    H3*    C   3           H3*        C   3   2.383 -27.014  -3.265
   28    H2*    C   3           H2*        C   3   0.912 -26.058  -1.717
   29   2HO*    C   3          2HO*        C   3  -1.515 -26.937  -2.447
   30    H1*    C   3           H1*        C   3  -0.772 -28.287  -1.315
   31   1H4     C   3          1H4         C   3   2.550 -27.327   4.034
   32   2H4     C   3          2H4         C   3   3.941 -28.117   3.327
   33    H5     C   3           H5         C   3   4.013 -28.861   1.034
   34    H6     C   3           H6         C   3   2.772 -29.000  -1.069
   35   1H5*    C   4          1H5*        C   4  -1.047 -24.498  -5.575
   36   2H5*    C   4          2H5*        C   4  -0.511 -22.806  -5.612
   37    H4*    C   4           H4*        C   4  -2.747 -23.460  -4.372
   38    H3*    C   4           H3*        C   4  -0.588 -21.507  -3.548
   39    H2*    C   4           H2*        C   4  -1.642 -21.120  -1.477
   40   2HO*    C   4          2HO*        C   4  -3.793 -21.632  -1.090
   41    H1*    C   4           H1*        C   4  -2.408 -23.649  -0.884
   42   1H4     C   4          1H4         C   4   3.190 -22.493   1.952
   43   2H4     C   4          2H4         C   4   4.018 -23.161   0.562
   44    H5     C   4           H5         C   4   2.884 -23.821  -1.458
   45    H6     C   4           H6         C   4   0.710 -23.984  -2.582
   46   1H5*    U   5          1H5*        U   5  -4.622 -19.305  -2.782
   47   2H5*    U   5          2H5*        U   5  -4.159 -17.621  -3.100
   48    H4*    U   5           H4*        U   5  -5.049 -18.319  -0.713
   49    H3*    U   5           H3*        U   5  -2.729 -16.493  -1.402
   50    H2*    U   5           H2*        U   5  -2.153 -16.300   0.849
   51   2HO*    U   5          2HO*        U   5  -3.648 -16.037   2.365
   52    H1*    U   5           H1*        U   5  -3.311 -18.759   1.767
   53    H3     U   5           H3         U   5   0.915 -18.333   3.506
   54    H5     U   5           H5         U   5   1.424 -19.696  -0.452
   55    H6     U   5           H6         U   5  -0.932 -19.288  -0.824
   56   1H5*    U   6          1H5*        U   6  -5.223 -12.425  -1.150
   57   2H5*    U   6          2H5*        U   6  -6.326 -13.075   0.080
   58    H4*    U   6           H4*        U   6  -7.576 -12.237  -2.497
   59    H3*    U   6           H3*        U   6  -6.136 -10.335  -0.630
   60    H2*    U   6           H2*        U   6  -7.986  -8.943  -0.514
   61   2HO*    U   6          2HO*        U   6  -8.031  -9.521  -3.180
   62    H1*    U   6           H1*        U   6  -9.982 -10.847  -1.353
   63    H3     U   6           H3         U   6 -11.760  -8.376   2.039
   64    H5     U   6           H5         U   6  -8.888 -10.835   3.900
   65    H6     U   6           H6         U   6  -8.175 -11.559   1.695
   66   1H5*    A   7          1H5*        A   7  -6.278  -8.307  -5.217
   67   2H5*    A   7          2H5*        A   7  -5.452  -6.757  -4.965
   68    H4*    A   7           H4*        A   7  -7.933  -6.809  -5.868
   69    H3*    A   7           H3*        A   7  -6.663  -4.950  -3.849
   70    H2*    A   7           H2*        A   7  -8.737  -3.907  -3.401
   71   2HO*    A   7          2HO*        A   7  -9.648  -5.186  -5.793
   72    H1*    A   7           H1*        A   7 -10.344  -6.118  -3.427
   73    H8     A   7           H8         A   7  -7.291  -7.258  -1.670
   74   1H6     A   7          1H6         A   7  -9.125  -4.149   3.318
   75   2H6     A   7          2H6         A   7  -7.996  -5.333   2.701
   76    H2     A   7           H2         A   7 -11.709  -2.891  -0.140
   77   1H5*    G   8          1H5*        G   8  -8.002  -1.828  -6.983
   78   2H5*    G   8          2H5*        G   8  -6.893  -0.478  -6.668
   79    H4*    G   8           H4*        G   8  -9.458  -0.257  -6.075
   80    H3*    G   8           H3*        G   8  -7.028   0.682  -4.545
   81    H2*    G   8           H2*        G   8  -8.314   1.313  -2.688
   82   2HO*    G   8          2HO*        G   8 -10.603   1.643  -2.879
   83    H1*    G   8           H1*        G   8 -10.273  -0.636  -2.784
   84    H8     G   8           H8         G   8  -7.100  -2.482  -3.122
   85    H1     G   8           H1         G   8  -7.758  -0.111   2.760
   86   1H2     G   8          1H2         G   8  -9.418   1.361   2.800
   87   2H2     G   8          2H2         G   8 -10.358   1.757   1.378
   88   1H5*    G   9          1H5*        G   9 -10.341   4.315  -5.471
   89   2H5*    G   9          2H5*        G   9  -9.288   5.733  -5.291
   90    H4*    G   9           H4*        G   9 -11.547   5.677  -3.987
   91    H3*    G   9           H3*        G   9  -8.825   6.526  -3.019
   92    H2*    G   9           H2*        G   9  -9.543   6.717  -0.767
   93   2HO*    G   9          2HO*        G   9 -11.688   6.865  -0.192
   94    H1*    G   9           H1*        G   9 -10.978   4.458  -0.573
   95    H8     G   9           H8         G   9  -8.315   3.463  -2.941
   96    H1     G   9           H1         G   9  -5.992   4.185   2.952
   97   1H2     G   9          1H2         G   9  -7.488   5.197   4.238
   98   2H2     G   9          2H2         G   9  -9.057   5.692   3.645
   99   1H5*    A  10          1H5*        A  10 -10.807   9.768  -1.348
  100   2H5*    A  10          2H5*        A  10  -9.845  11.225  -1.668
  101    H4*    A  10           H4*        A  10  -9.943  10.563   0.765
  102    H3*    A  10           H3*        A  10  -7.318  10.748  -0.753
  103    H2*    A  10           H2*        A  10  -6.151  10.179   1.215
  104   2HO*    A  10          2HO*        A  10  -8.483  10.491   2.807
  105    H1*    A  10           H1*        A  10  -8.012   8.393   2.267
  106    H8     A  10           H8         A  10  -7.541   7.383  -1.252
  107   1H6     A  10          1H6         A  10  -2.135   4.873   0.288
  108   2H6     A  10          2H6         A  10  -3.355   4.997  -0.960
  109    H2     A  10           H2         A  10  -3.530   7.403   3.731
  110   1H5*    A  11          1H5*        A  11  -7.249  14.412   2.337
  111   2H5*    A  11          2H5*        A  11  -5.899  15.410   1.759
  112    H4*    A  11           H4*        A  11  -5.770  14.251   4.128
  113    H3*    A  11           H3*        A  11  -3.630  14.556   2.016
  114    H2*    A  11           H2*        A  11  -2.103  13.264   3.284
  115   2HO*    A  11          2HO*        A  11  -3.458  14.330   5.341
  116    H1*    A  11           H1*        A  11  -3.825  11.339   4.167
  117    H8     A  11           H8         A  11  -4.887  11.868   0.660
  118   1H6     A  11          1H6         A  11   0.081   8.739  -1.199
  119   2H6     A  11          2H6         A  11  -1.452   9.422  -1.694
  120    H2     A  11           H2         A  11   0.561   9.644   3.175
  121   1H5*    A  12          1H5*        A  12  -1.148  15.393   5.024
  122   2H5*    A  12          2H5*        A  12  -0.094  16.729   4.522
  123    H4*    A  12           H4*        A  12   1.140  14.576   4.722
  124    H3*    A  12           H3*        A  12   0.866  15.919   2.012
  125    H2*    A  12           H2*        A  12   2.162  14.207   1.058
  126   2HO*    A  12          2HO*        A  12   2.962  13.506   3.711
  127    H1*    A  12           H1*        A  12   1.254  12.092   2.585
  128    H8     A  12           H8         A  12  -1.614  14.085   1.320
  129   1H6     A  12          1H6         A  12  -0.782  11.543  -4.225
  130   2H6     A  12          2H6         A  12  -1.849  12.526  -3.248
  131    H2     A  12           H2         A  12   2.723  10.454  -1.630
  132   1H5*    C  13          1H5*        C  13   5.224  16.044   3.825
  133   2H5*    C  13          2H5*        C  13   6.290  17.111   2.887
  134    H4*    C  13           H4*        C  13   7.039  14.666   3.161
  135    H3*    C  13           H3*        C  13   6.828  16.155   0.527
  136    H2*    C  13           H2*        C  13   7.601  14.212  -0.622
  137   2HO*    C  13          2HO*        C  13   9.128  13.765   1.269
  138    H1*    C  13           H1*        C  13   6.031  12.417   0.637
  139   1H4     C  13          1H4         C  13   2.814  14.640  -4.426
  140   2H4     C  13          2H4         C  13   1.936  15.707  -3.354
  141    H5     C  13           H5         C  13   2.477  15.970  -1.029
  142    H6     C  13           H6         C  13   3.961  15.268   0.782
  143   1H5*    A  14          1H5*        A  14  10.969  14.679   0.155
  144   2H5*    A  14          2H5*        A  14  11.802  15.999  -0.691
  145    H4*    A  14           H4*        A  14  11.643  13.758  -1.932
  146    H3*    A  14           H3*        A  14  10.688  16.400  -3.103
  147    H2*    A  14           H2*        A  14  10.199  15.248  -5.114
  148   2HO*    A  14          2HO*        A  14  11.028  13.126  -5.499
  149    H1*    A  14           H1*        A  14   9.303  12.904  -3.983
  150    H8     A  14           H8         A  14   7.570  15.654  -2.197
  151   1H6     A  14          1H6         A  14   3.925  16.387  -7.104
  152   2H6     A  14          2H6         A  14   4.175  16.818  -5.427
  153    H2     A  14           H2         A  14   7.301  13.660  -8.269
  154   1H5*    G  15          1H5*        G  15  14.202  14.820  -5.797
  155   2H5*    G  15          2H5*        G  15  15.040  16.315  -6.263
  156    H4*    G  15           H4*        G  15  14.487  14.935  -8.242
  157    H3*    G  15           H3*        G  15  13.067  17.601  -7.886
  158    H2*    G  15           H2*        G  15  12.102  17.264 -10.078
  159   2HO*    G  15          2HO*        G  15  13.259  14.729 -10.409
  160    H1*    G  15           H1*        G  15  11.189  14.797  -9.531
  161    H8     G  15           H8         G  15  11.264  16.506  -6.220
  162    H1     G  15           H1         G  15   6.595  18.794  -9.899
  163   1H2     G  15          1H2         G  15   6.820  18.028 -11.972
  164   2H2     G  15          2H2         G  15   8.120  16.956 -12.440
  165   1H5*    U  16          1H5*        U  16  14.141  17.670 -11.146
  166   2H5*    U  16          2H5*        U  16  15.037  18.906 -12.051
  167    H4*    U  16           H4*        U  16  12.927  18.841 -13.108
  168    H3*    U  16           H3*        U  16  13.035  21.073 -11.037
  169    H2*    U  16           H2*        U  16  10.856  21.705 -11.713
  170   2HO*    U  16          2HO*        U  16  10.127  20.214 -13.704
  171    H1*    U  16           H1*        U  16   9.858  19.144 -12.077
  172    H3     U  16           H3         U  16   7.632  21.285  -8.690
  173    H5     U  16           H5         U  16  11.198  19.854  -6.969
  174    H6     U  16           H6         U  16  11.950  19.240  -9.177
  175   1H5*    U  17          1H5*        U  17  12.464  24.684 -12.110
  176   2H5*    U  17          2H5*        U  17  11.480  23.430 -12.883
  177    H4*    U  17           H4*        U  17  12.020  26.254 -13.821
  178    H3*    U  17           H3*        U  17   9.901  25.329 -12.448
  179    H2*    U  17           H2*        U  17   9.439  23.411 -13.805
  180   2HO*    U  17          2HO*        U  17   7.668  24.054 -15.233
  181    H1*    U  17           H1*        U  17   9.702  24.891 -16.390
  182    H3     U  17           H3         U  17   8.806  20.597 -17.684
  183    H5     U  17           H5         U  17  12.448  20.357 -15.576
  184    H6     U  17           H6         U  17  12.214  22.690 -15.022
  185   1H5*    C  18          1H5*        C  18   6.268  24.827 -13.616
  186   2H5*    C  18          2H5*        C  18   5.948  26.532 -13.992
  187    H4*    C  18           H4*        C  18   4.163  25.705 -12.570
  188    H3*    C  18           H3*        C  18   5.443  28.026 -12.022
  189    H2*    C  18           H2*        C  18   7.172  27.108 -10.639
  190   2HO*    C  18          2HO*        C  18   5.441  28.569  -9.449
  191    H1*    C  18           H1*        C  18   5.230  25.388  -9.117
  192   1H4     C  18          1H4         C  18  10.813  22.868  -7.441
  193   2H4     C  18          2H4         C  18  11.309  22.750  -9.115
  194    H5     C  18           H5         C  18   9.982  23.558 -10.946
  195    H6     C  18           H6         C  18   7.882  24.646 -11.581
  196   1H5*    G  19          1H5*        G  19   0.762  25.795 -12.032
  197   2H5*    G  19          2H5*        G  19   2.239  24.845 -11.772
  198    H4*    G  19           H4*        G  19   0.490  25.041 -14.195
  199    H3*    G  19           H3*        G  19   2.055  22.885 -12.722
  200    H2*    G  19           H2*        G  19   2.167  21.646 -14.722
  201   2HO*    G  19          2HO*        G  19  -0.140  23.127 -15.342
  202    H1*    G  19           H1*        G  19   2.405  23.795 -16.486
  203    H8     G  19           H8         G  19   4.649  22.997 -17.370
  204    H1     G  19           H1         G  19   7.028  21.787 -11.580
  205   1H2     G  19          1H2         G  19   5.526  22.287 -10.026
  206   2H2     G  19          2H2         G  19   3.942  22.920 -10.418
  207   1H5*    C  20          1H5*        C  20  -0.216  21.005 -14.890
  208   2H5*    C  20          2H5*        C  20  -0.806  19.418 -14.361
  209    H4*    C  20           H4*        C  20   0.923  19.312 -16.186
  210    H3*    C  20           H3*        C  20   1.229  17.955 -13.509
  211    H2*    C  20           H2*        C  20   3.426  17.234 -14.016
  212   2HO*    C  20          2HO*        C  20   2.532  17.599 -16.644
  213    H1*    C  20           H1*        C  20   4.371  19.498 -15.148
  214   1H4     C  20          1H4         C  20   5.508  19.788  -8.860
  215   2H4     C  20          2H4         C  20   4.007  20.664  -8.652
  216    H5     C  20           H5         C  20   2.434  21.026 -10.426
  217    H6     C  20           H6         C  20   1.949  20.639 -12.794
  218   1H5*    U  21          1H5*        U  21   2.672  15.491 -15.946
  219   2H5*    U  21          2H5*        U  21   1.787  14.012 -16.372
  220    H4*    U  21           H4*        U  21   3.967  13.228 -15.998
  221    H3*    U  21           H3*        U  21   2.236  12.929 -13.533
  222    H2*    U  21           H2*        U  21   4.078  12.046 -12.321
  223   2HO*    U  21          2HO*        U  21   5.966  12.056 -14.325
  224    H1*    U  21           H1*        U  21   5.981  13.788 -13.195
  225    H3     U  21           H3         U  21   5.087  14.978  -8.901
  226    H5     U  21           H5         U  21   1.887  16.585 -11.125
  227    H6     U  21           H6         U  21   2.725  15.393 -13.067
  228   1H5*    G  22          1H5*        G  22   4.229   9.487 -13.978
  229   2H5*    G  22          2H5*        G  22   3.470   8.016 -13.335
  230    H4*    G  22           H4*        G  22   5.509   8.854 -12.054
  231    H3*    G  22           H3*        G  22   2.793   8.389 -10.786
  232    H2*    G  22           H2*        G  22   3.534   9.283  -8.786
  233   2HO*    G  22          2HO*        G  22   5.262   7.530  -8.896
  234    H1*    G  22           H1*        G  22   5.854  10.671  -9.816
  235    H8     G  22           H8         G  22   2.592  12.192 -10.747
  236    H1     G  22           H1         G  22   4.096  13.445  -4.684
  237   1H2     G  22          1H2         G  22   5.832  12.212  -4.064
  238   2H2     G  22          2H2         G  22   6.618  11.085  -5.148
  239   1H5*    U  23          1H5*        U  23   5.941   5.287  -8.943
  240   2H5*    U  23          2H5*        U  23   4.967   4.071  -8.094
  241    H4*    U  23           H4*        U  23   6.695   5.447  -6.720
  242    H3*    U  23           H3*        U  23   3.798   4.921  -5.995
  243    H2*    U  23           H2*        U  23   4.024   6.209  -4.037
  244   2HO*    U  23          2HO*        U  23   6.451   5.145  -4.026
  245    H1*    U  23           H1*        U  23   5.771   8.142  -5.019
  246    H3     U  23           H3         U  23   1.776   9.977  -3.644
  247    H5     U  23           H5         U  23   1.211   8.783  -7.651
  248    H6     U  23           H6         U  23   3.340   7.630  -7.538
  249   1H5*    G  24          1H5*        G  24   5.646   0.849  -7.398
  250   2H5*    G  24          2H5*        G  24   6.632  -0.258  -6.423
  251    H4*    G  24           H4*        G  24   7.560   1.415  -8.449
  252    H3*    G  24           H3*        G  24   8.800  -0.248  -6.273
  253    H2*    G  24           H2*        G  24  10.862   0.913  -6.335
  254   2HO*    G  24          2HO*        G  24  10.573   2.709  -8.283
  255    H1*    G  24           H1*        G  24   9.975   3.420  -6.456
  256    H8     G  24           H8         G  24   7.282   1.828  -4.482
  257    H1     G  24           H1         G  24  12.650   2.313  -1.078
  258   1H2     G  24          1H2         G  24  14.348   2.838  -2.405
  259   2H2     G  24          2H2         G  24  14.156   3.067  -4.129
  260   1H5*    C  25          1H5*        C  25  11.771  -0.942  -8.706
  261   2H5*    C  25          2H5*        C  25  11.943  -2.650  -9.162
  262    H4*    C  25           H4*        C  25  13.969  -2.040  -8.034
  263    H3*    C  25           H3*        C  25  12.034  -3.648  -6.331
  264    H2*    C  25           H2*        C  25  13.538  -3.553  -4.531
  265   2HO*    C  25          2HO*        C  25  15.806  -2.607  -5.321
  266    H1*    C  25           H1*        C  25  14.670  -1.037  -5.100
  267   1H4     C  25          1H4         C  25  11.038  -0.560   0.125
  268   2H4     C  25          2H4         C  25   9.636  -0.284  -0.883
  269    H5     C  25           H5         C  25   9.689  -0.433  -3.289
  270    H6     C  25           H6         C  25  11.094  -0.884  -5.239
  271   1H5*    C  26          1H5*        C  26  15.787  -5.241  -6.027
  272   2H5*    C  26          2H5*        C  26  15.945  -6.757  -6.937
  273    H4*    C  26           H4*        C  26  17.181  -7.338  -5.088
  274    H3*    C  26           H3*        C  26  14.284  -7.969  -4.506
  275    H2*    C  26           H2*        C  26  14.775  -8.495  -2.249
  276   2HO*    C  26          2HO*        C  26  17.405  -8.747  -3.249
  277    H1*    C  26           H1*        C  26  16.463  -6.454  -1.700
  278   1H4     C  26          1H4         C  26  10.720  -4.209  -0.169
  279   2H4     C  26          2H4         C  26  10.275  -4.079  -1.856
  280    H5     C  26           H5         C  26  11.700  -4.800  -3.656
  281    H6     C  26           H6         C  26  13.860  -5.803  -4.232
  282   1H5*    G  27          1H5*        G  27  16.791 -10.919  -2.687
  283   2H5*    G  27          2H5*        G  27  15.876 -12.395  -2.325
  284    H4*    G  27           H4*        G  27  16.663 -10.795  -0.369
  285    H3*    G  27           H3*        G  27  13.953 -12.150  -0.676
  286    H2*    G  27           H2*        G  27  13.296 -11.190   1.369
  287   2HO*    G  27          2HO*        G  27  15.546 -11.891   2.222
  288    H1*    G  27           H1*        G  27  14.818  -8.818   1.151
  289    H8     G  27           H8         G  27  12.717  -9.028  -1.874
  290    H1     G  27           H1         G  27   9.191  -7.714   3.272
  291   1H2     G  27          1H2         G  27  10.383  -8.056   5.113
  292   2H2     G  27          2H2         G  27  12.042  -8.605   5.069
  293   1H5*    A  28          1H5*        A  28  15.438 -14.151   3.193
  294   2H5*    A  28          2H5*        A  28  14.455 -15.629   3.253
  295    H4*    A  28           H4*        A  28  14.086 -13.702   5.031
  296    H3*    A  28           H3*        A  28  11.984 -15.340   3.572
  297    H2*    A  28           H2*        A  28  10.290 -14.128   4.655
  298   2HO*    A  28          2HO*        A  28  12.157 -13.086   6.536
  299    H1*    A  28           H1*        A  28  11.666 -11.673   4.899
  300    H8     A  28           H8         A  28  11.694 -12.662   1.327
  301   1H6     A  28          1H6         A  28   5.838 -10.809   0.881
  302   2H6     A  28          2H6         A  28   7.257 -11.310  -0.012
  303    H2     A  28           H2         A  28   6.934 -10.931   5.241
  304   1H5*    A  29          1H5*        A  29  12.222 -16.663   8.383
  305   2H5*    A  29          2H5*        A  29  11.008 -17.951   8.520
  306    H4*    A  29           H4*        A  29  10.825 -15.818  10.049
  307    H3*    A  29           H3*        A  29   8.660 -17.336   8.594
  308    H2*    A  29           H2*        A  29   7.010 -15.735   9.180
  309   2HO*    A  29          2HO*        A  29   7.380 -15.261  11.286
  310    H1*    A  29           H1*        A  29   8.401 -13.498   8.634
  311    H8     A  29           H8         A  29   9.746 -15.770   6.061
  312   1H6     A  29          1H6         A  29   4.423 -15.370   2.989
  313   2H6     A  29          2H6         A  29   6.087 -15.905   2.914
  314    H2     A  29           H2         A  29   3.819 -13.572   7.066
  315   1H5*    A  30          1H5*        A  30   6.840 -18.058  12.776
  316   2H5*    A  30          2H5*        A  30   5.997 -19.583  12.435
  317    H4*    A  30           H4*        A  30   4.624 -17.355  12.804
  318    H3*    A  30           H3*        A  30   4.164 -19.520  10.721
  319    H2*    A  30           H2*        A  30   2.295 -18.287   9.905
  320   2HO*    A  30          2HO*        A  30   2.305 -17.305  12.456
  321    H1*    A  30           H1*        A  30   3.475 -15.842   9.894
  322    H8     A  30           H8         A  30   6.339 -17.789   8.806
  323   1H6     A  30          1H6         A  30   3.590 -18.921   3.411
  324   2H6     A  30          2H6         A  30   5.100 -18.984   4.293
  325    H2     A  30           H2         A  30   0.503 -17.270   6.229
  326   1H5*    G  31          1H5*        G  31   0.705 -18.481  11.565
  327   2H5*    G  31          2H5*        G  31  -0.197 -19.574  12.633
  328    H4*    G  31           H4*        G  31  -1.802 -19.021  11.024
  329    H3*    G  31           H3*        G  31  -0.366 -21.565  10.186
  330    H2*    G  31           H2*        G  31  -1.689 -21.639   8.231
  331   2HO*    G  31          2HO*        G  31  -3.639 -20.463   8.054
  332    H1*    G  31           H1*        G  31  -1.851 -18.887   7.776
  333    H8     G  31           H8         G  31   1.714 -19.705   8.392
  334    H1     G  31           H1         G  31  -0.177 -21.832   2.690
  335   1H2     G  31          1H2         G  31  -2.386 -21.705   2.528
  336   2H2     G  31          2H2         G  31  -3.391 -21.097   3.824
  337   1H5*    G  32          1H5*        G  32  -4.877 -22.569  10.859
  338   2H5*    G  32          2H5*        G  32  -5.028 -24.338  10.892
  339    H4*    G  32           H4*        G  32  -6.145 -22.944   8.945
  340    H3*    G  32           H3*        G  32  -4.658 -25.577   8.806
  341    H2*    G  32           H2*        G  32  -4.850 -25.613   6.449
  342   2HO*    G  32          2HO*        G  32  -7.185 -24.546   6.913
  343    H1*    G  32           H1*        G  32  -4.466 -22.935   5.958
  344    H8     G  32           H8         G  32  -1.913 -23.801   8.496
  345    H1     G  32           H1         G  32  -0.495 -26.346   2.827
  346   1H2     G  32          1H2         G  32  -2.239 -26.189   1.464
  347   2H2     G  32          2H2         G  32  -3.750 -25.455   1.954
  348   1H5*    U  33          1H5*        U  33  -7.696 -27.407   6.676
  349   2H5*    U  33          2H5*        U  33  -7.777 -29.004   7.450
  350    H4*    U  33           H4*        U  33  -6.753 -28.934   5.103
  351    H3*    U  33           H3*        U  33  -5.466 -30.166   7.547
  352    H2*    U  33           H2*        U  33  -3.467 -30.477   6.466
  353   2HO*    U  33          2HO*        U  33  -3.535 -30.733   4.043
  354    H1*    U  33           H1*        U  33  -3.821 -28.632   4.299
  355    H3     U  33           H3         U  33   0.503 -28.464   5.784
  356    H5     U  33           H5         U  33  -1.750 -26.405   8.693
  357    H6     U  33           H6         U  33  -3.764 -27.146   7.559
  358   1H5*    C  34          1H5*        C  34  -5.479 -32.979   4.343
  359   2H5*    C  34          2H5*        C  34  -6.277 -34.519   4.724
  360    H4*    C  34           H4*        C  34  -4.316 -35.373   3.896
  361    H3*    C  34           H3*        C  34  -3.727 -34.631   6.776
  362    H2*    C  34           H2*        C  34  -1.511 -35.320   6.502
  363   2HO*    C  34          2HO*        C  34  -1.705 -37.299   5.550
  364    H1*    C  34           H1*        C  34  -1.218 -34.462   3.857
  365   1H4     C  34          1H4         C  34   1.838 -30.085   7.262
  366   2H4     C  34          2H4         C  34   0.372 -29.636   8.103
  367    H5     C  34           H5         C  34  -1.737 -30.738   7.763
  368    H6     C  34           H6         C  34  -2.911 -32.506   6.526
  369    H3T    C  34           H3T        C  34  -3.489 -37.134   6.504
  370   1H5*    U  35          1H5*        U  35  -4.525 -13.332   3.234
  371   2H5*    U  35          2H5*        U  35  -5.013 -11.640   3.007
  372    H4*    U  35           H4*        U  35  -3.996 -11.495   5.082
  373    H3*    U  35           H3*        U  35  -1.924 -11.021   2.927
  374    H2*    U  35           H2*        U  35  -0.194 -10.948   4.518
  375   2HO*    U  35          2HO*        U  35  -0.597  -9.870   6.289
  376    H1*    U  35           H1*        U  35  -1.100 -12.895   6.245
  377    H3     U  35           H3         U  35   2.747 -14.475   4.442
  378    H5     U  35           H5         U  35  -0.064 -14.796   1.317
  379    H6     U  35           H6         U  35  -1.658 -13.622   2.722
  380    H5T    U  35           H5T        U  35  -3.686 -12.959   1.326
  381   1H5*    U  36          1H5*        U  36  -1.902  -7.697   6.122
  382   2H5*    U  36          2H5*        U  36  -0.883  -6.347   5.586
  383    H4*    U  36           H4*        U  36  -0.174  -7.803   7.676
  384    H3*    U  36           H3*        U  36   1.550  -6.713   5.433
  385    H2*    U  36           H2*        U  36   3.464  -7.780   6.351
  386   2HO*    U  36          2HO*        U  36   3.491  -8.608   8.445
  387    H1*    U  36           H1*        U  36   2.329 -10.176   6.913
  388    H3     U  36           H3         U  36   5.060 -10.440   3.228
  389    H5     U  36           H5         U  36   1.296  -9.237   1.760
  390    H6     U  36           H6         U  36   0.568  -8.945   4.057
  391   1H5*    C  37          1H5*        C  37   3.602  -5.064   9.412
  392   2H5*    C  37          2H5*        C  37   4.350  -3.582   8.785
  393    H4*    C  37           H4*        C  37   5.883  -5.382   9.877
  394    H3*    C  37           H3*        C  37   6.343  -3.961   7.236
  395    H2*    C  37           H2*        C  37   8.357  -5.176   6.927
  396   2HO*    C  37          2HO*        C  37   9.538  -5.699   8.606
  397    H1*    C  37           H1*        C  37   7.453  -7.617   7.740
  398   1H4     C  37          1H4         C  37   6.790  -7.187   1.395
  399   2H4     C  37          2H4         C  37   5.173  -6.556   1.619
  400    H5     C  37           H5         C  37   4.252  -6.026   3.779
  401    H6     C  37           H6         C  37   4.682  -5.973   6.193
  402   1H5*    G  38          1H5*        G  38   9.811  -2.322  10.349
  403   2H5*    G  38          2H5*        G  38  10.545  -1.011   9.406
  404    H4*    G  38           H4*        G  38  12.013  -3.052  10.205
  405    H3*    G  38           H3*        G  38  12.034  -1.552   7.588
  406    H2*    G  38           H2*        G  38  13.552  -3.079   6.603
  407   2HO*    G  38          2HO*        G  38  14.485  -3.269   9.064
  408    H1*    G  38           H1*        G  38  12.459  -5.389   7.471
  409    H8     G  38           H8         G  38   9.464  -3.281   6.949
  410    H1     G  38           H1         G  38  12.217  -4.789   1.395
  411   1H2     G  38          1H2         G  38  14.221  -5.664   1.756
  412   2H2     G  38          2H2         G  38  14.879  -5.873   3.364
  413   1H5*    G  39          1H5*        G  39  16.474  -0.711   9.108
  414   2H5*    G  39          2H5*        G  39  16.695   0.949   8.522
  415    H4*    G  39           H4*        G  39  18.339  -0.791   7.626
  416    H3*    G  39           H3*        G  39  16.694   1.114   5.961
  417    H2*    G  39           H2*        G  39  17.436   0.144   3.938
  418   2HO*    G  39          2HO*        G  39  19.582  -0.114   4.121
  419    H1*    G  39           H1*        G  39  17.342  -2.480   4.648
  420    H8     G  39           H8         G  39  14.358  -1.058   6.306
  421    H1     G  39           H1         G  39  13.598  -1.264  -0.021
  422   1H2     G  39          1H2         G  39  15.540  -1.692  -1.004
  423   2H2     G  39          2H2         G  39  17.019  -1.925  -0.101
  424   1H5*    C  40          1H5*        C  40  19.883   1.616   3.526
  425   2H5*    C  40          2H5*        C  40  20.602   3.162   4.023
  426    H4*    C  40           H4*        C  40  20.381   3.436   1.708
  427    H3*    C  40           H3*        C  40  17.981   4.577   3.167
  428    H2*    C  40           H2*        C  40  16.947   5.115   1.124
  429   2HO*    C  40          2HO*        C  40  19.506   5.516   0.368
  430    H1*    C  40           H1*        C  40  17.832   2.947  -0.379
  431   1H4     C  40          1H4         C  40  11.783   1.688   1.099
  432   2H4     C  40          2H4         C  40  12.197   1.462   2.785
  433    H5     C  40           H5         C  40  14.418   1.804   3.655
  434    H6     C  40           H6         C  40  16.720   2.436   3.099
  435   1H5*    U  41          1H5*        U  41  16.851   6.959   4.274
  436   2H5*    U  41          2H5*        U  41  16.112   6.209   2.845
  437    H4*    U  41           H4*        U  41  15.168   8.468   4.121
  438    H3*    U  41           H3*        U  41  14.780   7.224   1.403
  439    H2*    U  41           H2*        U  41  13.770   9.162   0.524
  440   2HO*    U  41          2HO*        U  41  12.374   9.452   2.382
  441    H1*    U  41           H1*        U  41  15.321  11.071   1.710
  442    H3     U  41           H3         U  41  15.901  10.541  -2.884
  443    H5     U  41           H5         U  41  18.925   8.316  -0.966
  444    H6     U  41           H6         U  41  17.756   8.660   1.132
  445   1H5*    C  42          1H5*        C  42   9.883   7.115   2.242
  446   2H5*    C  42          2H5*        C  42   9.912   5.536   1.432
  447    H4*    C  42           H4*        C  42   8.652   7.751   0.441
  448    H3*    C  42           H3*        C  42   9.697   5.199  -0.731
  449    H2*    C  42           H2*        C  42   9.710   5.987  -2.947
  450   2HO*    C  42          2HO*        C  42   8.478   7.759  -3.606
  451    H1*    C  42           H1*        C  42  10.557   8.536  -2.576
  452   1H4     C  42          1H4         C  42  15.551   4.650  -3.712
  453   2H4     C  42          2H4         C  42  16.008   4.881  -2.040
  454    H5     C  42           H5         C  42  14.622   6.027  -0.437
  455    H6     C  42           H6         C  42  12.498   7.200  -0.091
  456   1H5*    U  43          1H5*        U  43   8.025   3.978   1.961
  457   2H5*    U  43          2H5*        U  43   6.531   3.076   2.285
  458    H4*    U  43           H4*        U  43   7.431   4.813   4.051
  459    H3*    U  43           H3*        U  43   4.620   4.212   3.159
  460    H2*    U  43           H2*        U  43   3.708   6.071   4.282
  461   2HO*    U  43          2HO*        U  43   5.939   6.979   5.604
  462    H1*    U  43           H1*        U  43   5.641   7.921   3.801
  463    H3     U  43           H3         U  43   1.669   8.585   1.481
  464    H5     U  43           H5         U  43   4.265   6.482  -1.089
  465    H6     U  43           H6         U  43   5.749   6.136   0.801
  466   1H5*    U  44          1H5*        U  44   4.206   3.811   7.735
  467   2H5*    U  44          2H5*        U  44   2.825   2.714   7.934
  468    H4*    U  44           H4*        U  44   2.625   5.243   8.660
  469    H3*    U  44           H3*        U  44   0.621   3.469   7.263
  470    H2*    U  44           H2*        U  44  -0.876   5.263   6.932
  471   2HO*    U  44          2HO*        U  44   0.394   7.276   8.264
  472    H1*    U  44           H1*        U  44   0.917   7.231   6.317
  473    H3     U  44           H3         U  44  -1.700   5.903   2.738
  474    H5     U  44           H5         U  44   1.806   3.565   2.604
  475    H6     U  44           H6         U  44   2.374   4.409   4.807
  476   1H5*    C  45          1H5*        C  45  -1.813   4.917  10.746
  477   2H5*    C  45          2H5*        C  45  -2.541   3.461  11.452
  478    H4*    C  45           H4*        C  45  -4.278   5.093  10.829
  479    H3*    C  45           H3*        C  45  -4.100   2.461   9.337
  480    H2*    C  45           H2*        C  45  -5.915   3.071   7.965
  481   2HO*    C  45          2HO*        C  45  -6.990   5.245   8.745
  482    H1*    C  45           H1*        C  45  -5.361   5.777   7.722
  483   1H4     C  45          1H4         C  45  -3.444   2.929   2.355
  484   2H4     C  45          2H4         C  45  -1.939   2.475   3.121
  485    H5     C  45           H5         C  45  -1.477   2.861   5.454
  486    H6     C  45           H6         C  45  -2.356   3.766   7.554
  487   1H5*    C  46          1H5*        C  46  -8.351   3.042  11.192
  488   2H5*    C  46          2H5*        C  46  -9.150   1.456  11.145
  489    H4*    C  46           H4*        C  46 -10.150   3.469   9.774
  490    H3*    C  46           H3*        C  46  -9.838   0.571   8.971
  491    H2*    C  46           H2*        C  46 -10.615   1.019   6.784
  492   2HO*    C  46          2HO*        C  46 -11.305   3.687   7.459
  493    H1*    C  46           H1*        C  46  -9.332   3.383   6.351
  494   1H4     C  46          1H4         C  46  -5.690  -1.293   3.981
  495   2H4     C  46          2H4         C  46  -4.916  -1.479   5.538
  496    H5     C  46           H5         C  46  -5.617  -0.288   7.513
  497    H6     C  46           H6         C  46  -7.213   1.338   8.419
  498   1H5*    U  47          1H5*        U  47 -14.596   1.478   8.728
  499   2H5*    U  47          2H5*        U  47 -15.263  -0.167   8.711
  500    H4*    U  47           H4*        U  47 -15.663   1.448   6.661
  501    H3*    U  47           H3*        U  47 -15.027  -1.506   6.694
  502    H2*    U  47           H2*        U  47 -14.848  -1.576   4.340
  503   2HO*    U  47          2HO*        U  47 -16.814   0.054   4.355
  504    H1*    U  47           H1*        U  47 -13.551   0.796   3.935
  505    H3     U  47           H3         U  47 -10.833  -2.815   3.071
  506    H5     U  47           H5         U  47 -10.395  -1.999   7.183
  507    H6     U  47           H6         U  47 -12.243  -0.437   7.002
  508   1H5*    A  48          1H5*        A  48 -19.190  -1.328   4.423
  509   2H5*    A  48          2H5*        A  48 -19.757  -3.006   4.538
  510    H4*    A  48           H4*        A  48 -19.142  -1.981   2.190
  511    H3*    A  48           H3*        A  48 -18.567  -4.704   3.330
  512    H2*    A  48           H2*        A  48 -17.227  -5.342   1.516
  513   2HO*    A  48          2HO*        A  48 -18.080  -2.979   0.146
  514    H1*    A  48           H1*        A  48 -15.818  -3.054   1.224
  515    H8     A  48           H8         A  48 -16.283  -3.246   4.893
  516   1H6     A  48          1H6         A  48 -11.990  -7.658   5.101
  517   2H6     A  48          2H6         A  48 -12.968  -6.563   6.051
  518    H2     A  48           H2         A  48 -13.103  -6.998   0.796
  519    H3T    A  48           H3T        A  48 -19.799  -4.458   0.895
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  12.208 -26.830   4.194
    2   2H5*    G   1          2H5*        G   1  11.841 -25.913   2.718
    3    H4*    G   1           H4*        G   1  12.545 -27.968   1.855
    4    H3*    G   1           H3*        G   1   9.553 -27.764   2.072
    5    H2*    G   1           H2*        G   1   9.215 -30.067   1.581
    6   2HO*    G   1          2HO*        G   1  11.681 -29.771   0.377
    7    H1*    G   1           H1*        G   1  11.047 -31.115   3.191
    8    H8     G   1           H8         G   1  10.437 -28.347   5.386
    9    H1     G   1           H1         G   1   5.036 -31.675   4.751
   10   1H2     G   1          1H2         G   1   5.189 -33.045   3.011
   11   2H2     G   1          2H2         G   1   6.620 -33.138   2.010
   12    H5T    G   1           H5T        G   1  10.251 -26.343   4.720
   13   1H5*    G   2          1H5*        G   2   9.578 -29.507  -1.087
   14   2H5*    G   2          2H5*        G   2   9.235 -28.726  -2.643
   15    H4*    G   2           H4*        G   2   7.711 -30.492  -2.652
   16    H3*    G   2           H3*        G   2   6.374 -28.037  -1.455
   17    H2*    G   2           H2*        G   2   4.375 -29.322  -1.220
   18   2HO*    G   2          2HO*        G   2   4.805 -30.361  -3.388
   19    H1*    G   2           H1*        G   2   5.541 -31.589  -0.285
   20    H8     G   2           H8         G   2   7.442 -28.903   1.411
   21    H1     G   2           H1         G   2   1.519 -29.365   3.717
   22   1H2     G   2          1H2         G   2   0.282 -30.639   2.387
   23   2H2     G   2          2H2         G   2   0.917 -31.374   0.932
   24   1H5*    C   3          1H5*        C   3   3.525 -28.150  -4.912
   25   2H5*    C   3          2H5*        C   3   3.297 -26.408  -5.169
   26    H4*    C   3           H4*        C   3   1.273 -27.747  -4.287
   27    H3*    C   3           H3*        C   3   2.368 -25.213  -3.013
   28    H2*    C   3           H2*        C   3   0.679 -25.319  -1.386
   29   2HO*    C   3          2HO*        C   3  -1.285 -26.273  -1.752
   30    H1*    C   3           H1*        C   3   0.433 -28.133  -1.284
   31   1H4     C   3          1H4         C   3   3.036 -25.923   4.131
   32   2H4     C   3          2H4         C   3   4.621 -26.120   3.419
   33    H5     C   3           H5         C   3   4.966 -26.747   1.118
   34    H6     C   3           H6         C   3   3.870 -27.311  -0.994
   35   1H5*    C   4          1H5*        C   4  -1.754 -23.738  -5.234
   36   2H5*    C   4          2H5*        C   4  -1.524 -21.979  -5.192
   37    H4*    C   4           H4*        C   4  -3.589 -23.039  -3.967
   38    H3*    C   4           H3*        C   4  -1.730 -20.855  -3.002
   39    H2*    C   4           H2*        C   4  -2.833 -20.776  -0.906
   40   2HO*    C   4          2HO*        C   4  -4.890 -21.347  -0.655
   41    H1*    C   4           H1*        C   4  -3.085 -23.421  -0.473
   42   1H4     C   4          1H4         C   4   2.426 -21.536   2.136
   43   2H4     C   4          2H4         C   4   3.250 -21.865   0.628
   44    H5     C   4           H5         C   4   2.103 -22.517  -1.389
   45    H6     C   4           H6         C   4  -0.081 -22.991  -2.395
   46   1H5*    U   5          1H5*        U   5  -5.757 -18.764  -2.289
   47   2H5*    U   5          2H5*        U   5  -5.304 -17.077  -2.605
   48    H4*    U   5           H4*        U   5  -6.078 -17.795  -0.190
   49    H3*    U   5           H3*        U   5  -3.772 -15.991  -0.970
   50    H2*    U   5           H2*        U   5  -3.048 -15.869   1.238
   51   2HO*    U   5          2HO*        U   5  -4.644 -15.067   2.398
   52    H1*    U   5           H1*        U   5  -4.291 -18.288   2.195
   53    H3     U   5           H3         U   5  -0.005 -17.990   3.843
   54    H5     U   5           H5         U   5   0.350 -19.422  -0.109
   55    H6     U   5           H6         U   5  -1.995 -18.927  -0.428
   56   1H5*    U   6          1H5*        U   6  -8.957 -14.573  -0.737
   57   2H5*    U   6          2H5*        U   6  -8.305 -14.512  -2.388
   58    H4*    U   6           H4*        U   6  -9.776 -12.839  -2.766
   59    H3*    U   6           H3*        U   6  -7.711 -11.520  -0.997
   60    H2*    U   6           H2*        U   6  -9.151  -9.804  -0.431
   61   2HO*    U   6          2HO*        U   6  -9.143  -9.178  -2.709
   62    H1*    U   6           H1*        U   6 -11.615 -11.047  -1.390
   63    H3     U   6           H3         U   6 -12.796  -8.570   2.243
   64    H5     U   6           H5         U   6 -10.511 -11.742   3.816
   65    H6     U   6           H6         U   6  -9.976 -12.398   1.537
   66   1H5*    A   7          1H5*        A   7  -8.635  -9.137  -5.342
   67   2H5*    A   7          2H5*        A   7  -7.517  -7.761  -5.282
   68    H4*    A   7           H4*        A   7 -10.100  -7.361  -5.678
   69    H3*    A   7           H3*        A   7  -8.173  -5.793  -3.939
   70    H2*    A   7           H2*        A   7  -9.924  -4.405  -3.187
   71   2HO*    A   7          2HO*        A   7 -10.761  -4.610  -5.640
   72    H1*    A   7           H1*        A   7 -11.938  -6.302  -3.063
   73    H8     A   7           H8         A   7  -9.004  -7.882  -1.458
   74   1H6     A   7          1H6         A   7  -9.993  -4.418   3.536
   75   2H6     A   7          2H6         A   7  -9.110  -5.782   2.889
   76    H2     A   7           H2         A   7 -12.556  -2.827   0.206
   77   1H5*    G   8          1H5*        G   8  -9.594  -2.609  -6.857
   78   2H5*    G   8          2H5*        G   8  -8.317  -1.376  -6.876
   79    H4*    G   8           H4*        G   8 -10.654  -0.821  -5.797
   80    H3*    G   8           H3*        G   8  -7.887  -0.152  -4.759
   81    H2*    G   8           H2*        G   8  -8.786   0.754  -2.794
   82   2HO*    G   8          2HO*        G   8 -10.513   1.971  -2.901
   83    H1*    G   8           H1*        G   8 -11.042  -0.888  -2.547
   84    H8     G   8           H8         G   8  -8.125  -3.128  -2.926
   85    H1     G   8           H1         G   8  -8.157  -0.323   2.801
   86   1H2     G   8          1H2         G   8  -9.632   1.334   2.825
   87   2H2     G   8          2H2         G   8 -10.605   1.747   1.431
   88   1H5*    G   9          1H5*        G   9 -10.732   3.865  -5.776
   89   2H5*    G   9          2H5*        G   9  -9.573   5.192  -5.563
   90    H4*    G   9           H4*        G   9 -11.870   5.220  -4.268
   91    H3*    G   9           H3*        G   9  -9.117   6.049  -3.386
   92    H2*    G   9           H2*        G   9  -9.750   6.278  -1.115
   93   2HO*    G   9          2HO*        G   9 -11.719   6.876  -0.571
   94    H1*    G   9           H1*        G   9 -11.248   4.069  -0.835
   95    H8     G   9           H8         G   9  -8.688   2.908  -3.231
   96    H1     G   9           H1         G   9  -6.187   3.729   2.573
   97   1H2     G   9          1H2         G   9  -7.605   4.853   3.858
   98   2H2     G   9          2H2         G   9  -9.164   5.399   3.283
   99   1H5*    A  10          1H5*        A  10 -11.049   9.437  -1.706
  100   2H5*    A  10          2H5*        A  10 -10.001  10.824  -2.068
  101    H4*    A  10           H4*        A  10 -10.165  10.159   0.395
  102    H3*    A  10           H3*        A  10  -7.537  10.371  -1.118
  103    H2*    A  10           H2*        A  10  -6.375   9.815   0.854
  104   2HO*    A  10          2HO*        A  10  -8.521   9.938   2.613
  105    H1*    A  10           H1*        A  10  -8.278   8.064   1.935
  106    H8     A  10           H8         A  10  -7.716   6.876  -1.500
  107   1H6     A  10          1H6         A  10  -2.285   4.577   0.249
  108   2H6     A  10          2H6         A  10  -3.489   4.606  -1.019
  109    H2     A  10           H2         A  10  -3.777   7.261   3.529
  110   1H5*    A  11          1H5*        A  11  -7.393  13.508   2.246
  111   2H5*    A  11          2H5*        A  11  -6.050  14.611   1.876
  112    H4*    A  11           H4*        A  11  -5.912  12.999   3.967
  113    H3*    A  11           H3*        A  11  -3.761  13.711   1.958
  114    H2*    A  11           H2*        A  11  -2.239  12.231   3.013
  115   2HO*    A  11          2HO*        A  11  -3.761  11.380   5.122
  116    H1*    A  11           H1*        A  11  -3.972  10.177   3.517
  117    H8     A  11           H8         A  11  -4.913  11.283   0.115
  118   1H6     A  11          1H6         A  11   0.138   8.495  -2.055
  119   2H6     A  11          2H6         A  11  -1.379   9.251  -2.488
  120    H2     A  11           H2         A  11   0.452   8.667   2.423
  121   1H5*    A  12          1H5*        A  12  -1.100  14.178   5.154
  122   2H5*    A  12          2H5*        A  12  -0.111  15.554   4.626
  123    H4*    A  12           H4*        A  12   1.078  13.307   4.631
  124    H3*    A  12           H3*        A  12   0.835  15.050   2.160
  125    H2*    A  12           H2*        A  12   2.045  13.463   0.926
  126   2HO*    A  12          2HO*        A  12   2.825  11.760   2.935
  127    H1*    A  12           H1*        A  12   1.101  11.164   2.122
  128    H8     A  12           H8         A  12  -1.726  13.413   1.253
  129   1H6     A  12          1H6         A  12  -1.082  11.757  -4.641
  130   2H6     A  12          2H6         A  12  -2.098  12.605  -3.497
  131    H2     A  12           H2         A  12   2.432  10.167  -2.336
  132   1H5*    C  13          1H5*        C  13   5.296  14.747   3.802
  133   2H5*    C  13          2H5*        C  13   6.335  15.884   2.918
  134    H4*    C  13           H4*        C  13   6.948  13.364   2.854
  135    H3*    C  13           H3*        C  13   6.764  15.235   0.471
  136    H2*    C  13           H2*        C  13   7.379  13.434  -0.971
  137   2HO*    C  13          2HO*        C  13   7.679  11.317   0.523
  138    H1*    C  13           H1*        C  13   5.733  11.577   0.067
  139   1H4     C  13          1H4         C  13   2.542  14.709  -4.504
  140   2H4     C  13          2H4         C  13   1.763  15.656  -3.260
  141    H5     C  13           H5         C  13   2.376  15.542  -0.941
  142    H6     C  13           H6         C  13   3.858  14.493   0.697
  143   1H5*    A  14          1H5*        A  14  10.813  13.333  -0.227
  144   2H5*    A  14          2H5*        A  14  11.677  14.643  -1.056
  145    H4*    A  14           H4*        A  14  11.202  12.422  -2.350
  146    H3*    A  14           H3*        A  14  10.737  15.246  -3.378
  147    H2*    A  14           H2*        A  14  10.031  14.322  -5.445
  148   2HO*    A  14          2HO*        A  14  11.248  12.727  -6.129
  149    H1*    A  14           H1*        A  14   8.671  12.163  -4.443
  150    H8     A  14           H8         A  14   7.576  15.016  -2.362
  151   1H6     A  14          1H6         A  14   4.048  16.932  -7.024
  152   2H6     A  14          2H6         A  14   4.411  17.129  -5.324
  153    H2     A  14           H2         A  14   6.810  13.745  -8.583
  154   1H5*    G  15          1H5*        G  15  13.838  13.208  -6.343
  155   2H5*    G  15          2H5*        G  15  14.865  14.600  -6.740
  156    H4*    G  15           H4*        G  15  13.980  13.429  -8.766
  157    H3*    G  15           H3*        G  15  13.194  16.311  -8.196
  158    H2*    G  15           H2*        G  15  12.093  16.337 -10.351
  159   2HO*    G  15          2HO*        G  15  13.883  14.515 -10.982
  160    H1*    G  15           H1*        G  15  10.702  14.073  -9.917
  161    H8     G  15           H8         G  15  11.194  15.499  -6.511
  162    H1     G  15           H1         G  15   7.020  18.937  -9.873
  163   1H2     G  15          1H2         G  15   7.047  18.300 -11.997
  164   2H2     G  15          2H2         G  15   8.095  17.029 -12.584
  165   1H5*    U  16          1H5*        U  16  14.147  16.359 -11.474
  166   2H5*    U  16          2H5*        U  16  15.281  17.391 -12.367
  167    H4*    U  16           H4*        U  16  13.202  17.938 -13.315
  168    H3*    U  16           H3*        U  16  13.869  19.889 -11.071
  169    H2*    U  16           H2*        U  16  11.889  21.069 -11.614
  170   2HO*    U  16          2HO*        U  16  11.898  19.557 -14.044
  171    H1*    U  16           H1*        U  16  10.324  18.836 -12.180
  172    H3     U  16           H3         U  16   8.611  21.077  -8.567
  173    H5     U  16           H5         U  16  11.808  18.785  -7.062
  174    H6     U  16           H6         U  16  12.402  18.229  -9.330
  175   1H5*    U  17          1H5*        U  17  14.716  23.944 -11.902
  176   2H5*    U  17          2H5*        U  17  13.134  23.154 -12.029
  177    H4*    U  17           H4*        U  17  14.061  25.682 -13.199
  178    H3*    U  17           H3*        U  17  11.859  24.968 -11.817
  179    H2*    U  17           H2*        U  17  11.048  23.299 -13.329
  180   2HO*    U  17          2HO*        U  17   9.337  24.298 -14.527
  181    H1*    U  17           H1*        U  17  11.512  24.978 -15.763
  182    H3     U  17           H3         U  17   9.840  21.097 -17.496
  183    H5     U  17           H5         U  17  13.384  19.956 -15.522
  184    H6     U  17           H6         U  17  13.590  22.216 -14.709
  185   1H5*    C  18          1H5*        C  18   7.929  25.706 -13.127
  186   2H5*    C  18          2H5*        C  18   8.126  27.462 -12.957
  187    H4*    C  18           H4*        C  18   6.202  26.586 -11.642
  188    H3*    C  18           H3*        C  18   7.961  28.503 -10.817
  189    H2*    C  18           H2*        C  18   9.475  27.036  -9.679
  190   2HO*    C  18          2HO*        C  18   7.750  28.410  -8.122
  191    H1*    C  18           H1*        C  18   7.179  25.521  -8.439
  192   1H4     C  18          1H4         C  18  12.100  21.754  -7.029
  193   2H4     C  18          2H4         C  18  12.577  21.689  -8.710
  194    H5     C  18           H5         C  18  11.478  22.937 -10.446
  195    H6     C  18           H6         C  18   9.677  24.519 -10.952
  196   1H5*    G  19          1H5*        G  19   2.893  27.339 -10.920
  197   2H5*    G  19          2H5*        G  19   4.202  26.147 -10.791
  198    H4*    G  19           H4*        G  19   2.548  26.911 -13.190
  199    H3*    G  19           H3*        G  19   3.482  24.347 -11.840
  200    H2*    G  19           H2*        G  19   3.341  23.249 -13.917
  201   2HO*    G  19          2HO*        G  19   2.216  24.852 -15.636
  202    H1*    G  19           H1*        G  19   4.060  25.439 -15.533
  203    H8     G  19           H8         G  19   6.002  24.200 -16.605
  204    H1     G  19           H1         G  19   8.152  21.846 -11.084
  205   1H2     G  19          1H2         G  19   6.867  22.534  -9.413
  206   2H2     G  19          2H2         G  19   5.482  23.573  -9.660
  207   1H5*    C  20          1H5*        C  20   0.824  23.319 -14.160
  208   2H5*    C  20          2H5*        C  20  -0.186  21.910 -13.783
  209    H4*    C  20           H4*        C  20   1.456  21.490 -15.629
  210    H3*    C  20           H3*        C  20   1.436  19.891 -13.066
  211    H2*    C  20           H2*        C  20   3.349  18.656 -13.734
  212   2HO*    C  20          2HO*        C  20   2.637  19.615 -16.297
  213    H1*    C  20           H1*        C  20   4.841  20.694 -14.677
  214   1H4     C  20          1H4         C  20   6.048  20.114  -8.429
  215   2H4     C  20          2H4         C  20   4.761  21.249  -8.087
  216    H5     C  20           H5         C  20   3.286  22.117  -9.768
  217    H6     C  20           H6         C  20   2.723  22.105 -12.148
  218   1H5*    U  21          1H5*        U  21   2.225  17.159 -16.111
  219   2H5*    U  21          2H5*        U  21   1.025  15.852 -16.110
  220    H4*    U  21           H4*        U  21   3.310  14.939 -16.149
  221    H3*    U  21           H3*        U  21   1.586  14.499 -13.699
  222    H2*    U  21           H2*        U  21   3.346  13.267 -12.677
  223   2HO*    U  21          2HO*        U  21   4.743  13.352 -15.169
  224    H1*    U  21           H1*        U  21   5.412  14.895 -13.388
  225    H3     U  21           H3         U  21   4.777  15.541  -8.930
  226    H5     U  21           H5         U  21   1.837  17.922 -10.788
  227    H6     U  21           H6         U  21   2.427  16.881 -12.902
  228   1H5*    G  22          1H5*        G  22   3.255  10.873 -14.752
  229   2H5*    G  22          2H5*        G  22   2.374   9.442 -14.180
  230    H4*    G  22           H4*        G  22   4.635  10.015 -13.039
  231    H3*    G  22           H3*        G  22   2.018   9.338 -11.683
  232    H2*    G  22           H2*        G  22   2.822   9.974  -9.620
  233   2HO*    G  22          2HO*        G  22   4.441   8.219  -9.886
  234    H1*    G  22           H1*        G  22   5.155  11.435 -10.514
  235    H8     G  22           H8         G  22   1.933  13.193 -11.064
  236    H1     G  22           H1         G  22   3.683  13.431  -4.943
  237   1H2     G  22          1H2         G  22   5.377  12.047  -4.584
  238   2H2     G  22          2H2         G  22   6.075  11.068  -5.855
  239   1H5*    U  23          1H5*        U  23   5.092   5.783 -10.348
  240   2H5*    U  23          2H5*        U  23   3.957   4.627  -9.622
  241    H4*    U  23           H4*        U  23   5.847   5.734  -8.145
  242    H3*    U  23           H3*        U  23   2.936   5.250  -7.436
  243    H2*    U  23           H2*        U  23   3.256   6.268  -5.340
  244   2HO*    U  23          2HO*        U  23   5.594   6.732  -4.727
  245    H1*    U  23           H1*        U  23   5.101   8.213  -6.116
  246    H3     U  23           H3         U  23   1.256  10.059  -4.373
  247    H5     U  23           H5         U  23   0.527   9.461  -8.485
  248    H6     U  23           H6         U  23   2.586   8.185  -8.594
  249   1H5*    G  24          1H5*        G  24   5.129  -0.226  -6.216
  250   2H5*    G  24          2H5*        G  24   5.169   0.951  -4.886
  251    H4*    G  24           H4*        G  24   6.757   1.314  -7.450
  252    H3*    G  24           H3*        G  24   7.377  -0.307  -4.979
  253    H2*    G  24           H2*        G  24   9.514   0.636  -4.768
  254   2HO*    G  24          2HO*        G  24   9.692   2.098  -7.066
  255    H1*    G  24           H1*        G  24   8.995   3.195  -5.550
  256    H8     G  24           H8         G  24   6.187   2.502  -3.301
  257    H1     G  24           H1         G  24  11.679   2.594  -0.060
  258   1H2     G  24          1H2         G  24  13.391   2.543  -1.469
  259   2H2     G  24          2H2         G  24  13.177   2.485  -3.205
  260   1H5*    C  25          1H5*        C  25  10.811  -0.544  -7.504
  261   2H5*    C  25          2H5*        C  25  10.707  -2.139  -8.274
  262    H4*    C  25           H4*        C  25  12.996  -1.964  -7.873
  263    H3*    C  25           H3*        C  25  11.593  -3.420  -5.634
  264    H2*    C  25           H2*        C  25  13.542  -3.473  -4.299
  265   2HO*    C  25          2HO*        C  25  15.573  -3.276  -5.129
  266    H1*    C  25           H1*        C  25  14.462  -0.961  -4.756
  267   1H4     C  25          1H4         C  25  10.766  -0.664   0.430
  268   2H4     C  25          2H4         C  25   9.345  -0.494  -0.576
  269    H5     C  25           H5         C  25   9.407  -0.641  -2.982
  270    H6     C  25           H6         C  25  10.845  -0.983  -4.942
  271   1H5*    C  26          1H5*        C  26  14.979  -5.021  -5.682
  272   2H5*    C  26          2H5*        C  26  15.109  -6.489  -6.672
  273    H4*    C  26           H4*        C  26  16.444  -7.149  -4.927
  274    H3*    C  26           H3*        C  26  13.586  -7.820  -4.200
  275    H2*    C  26           H2*        C  26  14.228  -8.458  -2.008
  276   2HO*    C  26          2HO*        C  26  16.290  -9.443  -3.052
  277    H1*    C  26           H1*        C  26  15.945  -6.440  -1.476
  278   1H4     C  26          1H4         C  26  10.360  -4.244   0.598
  279   2H4     C  26          2H4         C  26   9.767  -4.071  -1.038
  280    H5     C  26           H5         C  26  11.031  -4.741  -2.978
  281    H6     C  26           H6         C  26  13.135  -5.719  -3.767
  282   1H5*    G  27          1H5*        G  27  15.918 -11.222  -2.825
  283   2H5*    G  27          2H5*        G  27  14.800 -12.583  -2.605
  284    H4*    G  27           H4*        G  27  15.817 -11.338  -0.505
  285    H3*    G  27           H3*        G  27  12.945 -12.258  -0.911
  286    H2*    G  27           H2*        G  27  12.415 -11.433   1.228
  287   2HO*    G  27          2HO*        G  27  14.174 -10.915   2.734
  288    H1*    G  27           H1*        G  27  14.215  -9.264   1.240
  289    H8     G  27           H8         G  27  12.158  -8.997  -1.829
  290    H1     G  27           H1         G  27   8.746  -7.587   3.369
  291   1H2     G  27          1H2         G  27   9.868  -8.175   5.193
  292   2H2     G  27          2H2         G  27  11.452  -8.913   5.124
  293   1H5*    A  28          1H5*        A  28  14.244 -14.841   2.681
  294   2H5*    A  28          2H5*        A  28  13.091 -16.191   2.650
  295    H4*    A  28           H4*        A  28  13.034 -14.432   4.626
  296    H3*    A  28           H3*        A  28  10.688 -15.649   3.125
  297    H2*    A  28           H2*        A  28   9.200 -14.371   4.419
  298   2HO*    A  28          2HO*        A  28  10.176 -15.007   6.435
  299    H1*    A  28           H1*        A  28  10.842 -12.116   4.787
  300    H8     A  28           H8         A  28  10.678 -12.769   1.148
  301   1H6     A  28          1H6         A  28   5.024 -10.328   1.069
  302   2H6     A  28          2H6         A  28   6.361 -10.878   0.086
  303    H2     A  28           H2         A  28   6.212 -10.954   5.357
  304   1H5*    A  29          1H5*        A  29  10.980 -17.370   7.758
  305   2H5*    A  29          2H5*        A  29   9.621 -18.501   7.930
  306    H4*    A  29           H4*        A  29   9.824 -16.414   9.536
  307    H3*    A  29           H3*        A  29   7.404 -17.662   8.246
  308    H2*    A  29           H2*        A  29   5.974 -15.899   8.919
  309   2HO*    A  29          2HO*        A  29   6.417 -15.381  10.963
  310    H1*    A  29           H1*        A  29   7.560 -13.804   8.330
  311    H8     A  29           H8         A  29   8.523 -16.095   5.623
  312   1H6     A  29          1H6         A  29   3.059 -15.173   2.934
  313   2H6     A  29          2H6         A  29   4.664 -15.835   2.728
  314    H2     A  29           H2         A  29   2.873 -13.471   7.090
  315   1H5*    A  30          1H5*        A  30   6.067 -18.257  12.734
  316   2H5*    A  30          2H5*        A  30   5.101 -19.735  12.548
  317    H4*    A  30           H4*        A  30   3.886 -17.532  13.223
  318    H3*    A  30           H3*        A  30   3.051 -19.532  11.111
  319    H2*    A  30           H2*        A  30   1.189 -18.186  10.509
  320   2HO*    A  30          2HO*        A  30   1.773 -16.602  12.823
  321    H1*    A  30           H1*        A  30   2.440 -15.784  10.481
  322    H8     A  30           H8         A  30   5.128 -17.909   9.181
  323   1H6     A  30          1H6         A  30   2.067 -18.541   3.882
  324   2H6     A  30          2H6         A  30   3.597 -18.786   4.693
  325    H2     A  30           H2         A  30  -0.732 -16.721   6.888
  326   1H5*    G  31          1H5*        G  31  -0.114 -18.945  12.189
  327   2H5*    G  31          2H5*        G  31  -0.987 -20.012  13.306
  328    H4*    G  31           H4*        G  31  -2.605 -19.832  11.685
  329    H3*    G  31           H3*        G  31  -0.735 -22.033  10.729
  330    H2*    G  31           H2*        G  31  -1.995 -22.208   8.749
  331   2HO*    G  31          2HO*        G  31  -4.136 -20.638   9.215
  332    H1*    G  31           H1*        G  31  -2.739 -19.502   8.531
  333    H8     G  31           H8         G  31   0.943 -19.653   8.915
  334    H1     G  31           H1         G  31  -0.855 -21.650   3.138
  335   1H2     G  31          1H2         G  31  -3.049 -21.955   3.088
  336   2H2     G  31          2H2         G  31  -4.071 -21.666   4.478
  337   1H5*    G  32          1H5*        G  32  -4.906 -24.236  11.593
  338   2H5*    G  32          2H5*        G  32  -4.473 -25.958  11.590
  339    H4*    G  32           H4*        G  32  -6.104 -24.992   9.747
  340    H3*    G  32           H3*        G  32  -3.852 -26.996   9.447
  341    H2*    G  32           H2*        G  32  -4.177 -27.077   7.109
  342   2HO*    G  32          2HO*        G  32  -6.752 -26.186   7.807
  343    H1*    G  32           H1*        G  32  -4.757 -24.417   6.674
  344    H8     G  32           H8         G  32  -1.853 -24.381   8.962
  345    H1     G  32           H1         G  32  -0.164 -26.276   3.115
  346   1H2     G  32          1H2         G  32  -1.973 -26.728   1.912
  347   2H2     G  32          2H2         G  32  -3.592 -26.562   2.553
  348   1H5*    U  33          1H5*        U  33  -6.268 -29.508   7.438
  349   2H5*    U  33          2H5*        U  33  -5.860 -31.132   8.030
  350    H4*    U  33           H4*        U  33  -5.028 -30.576   5.687
  351    H3*    U  33           H3*        U  33  -3.287 -31.545   7.958
  352    H2*    U  33           H2*        U  33  -1.345 -31.100   6.805
  353   2HO*    U  33          2HO*        U  33  -1.598 -31.187   4.309
  354    H1*    U  33           H1*        U  33  -2.450 -29.379   4.755
  355    H3     U  33           H3         U  33   1.739 -27.897   5.864
  356    H5     U  33           H5         U  33  -0.723 -26.803   9.106
  357    H6     U  33           H6         U  33  -2.509 -28.098   8.098
  358   1H5*    C  34          1H5*        C  34  -3.083 -34.643   4.453
  359   2H5*    C  34          2H5*        C  34  -2.829 -36.239   5.186
  360    H4*    C  34           H4*        C  34  -1.087 -35.792   3.517
  361    H3*    C  34           H3*        C  34  -0.262 -35.755   6.435
  362    H2*    C  34           H2*        C  34   1.949 -35.389   5.811
  363   2HO*    C  34          2HO*        C  34   1.808 -37.175   4.203
  364    H1*    C  34           H1*        C  34   1.396 -33.908   3.462
  365   1H4     C  34          1H4         C  34   3.885 -29.843   7.672
  366   2H4     C  34          2H4         C  34   2.394 -29.839   8.587
  367    H5     C  34           H5         C  34   0.513 -31.244   8.055
  368    H6     C  34           H6         C  34  -0.347 -32.961   6.531
  369    H3T    C  34           H3T        C  34  -0.666 -37.595   4.417
  370   1H5*    U  35          1H5*        U  35  -5.590 -12.470   4.224
  371   2H5*    U  35          2H5*        U  35  -5.323 -10.897   3.443
  372    H4*    U  35           H4*        U  35  -4.501 -10.895   5.774
  373    H3*    U  35           H3*        U  35  -2.601 -10.555   3.452
  374    H2*    U  35           H2*        U  35  -0.716 -10.556   4.863
  375   2HO*    U  35          2HO*        U  35  -2.612  -9.780   6.792
  376    H1*    U  35           H1*        U  35  -1.481 -12.479   6.648
  377    H3     U  35           H3         U  35   1.890 -14.350   4.282
  378    H5     U  35           H5         U  35  -1.338 -14.296   1.572
  379    H6     U  35           H6         U  35  -2.610 -13.047   3.220
  380    H5T    U  35           H5T        U  35  -4.413 -12.057   1.963
  381   1H5*    U  36          1H5*        U  36  -2.178  -7.361   6.701
  382   2H5*    U  36          2H5*        U  36  -1.171  -5.999   6.171
  383    H4*    U  36           H4*        U  36  -0.367  -7.559   8.145
  384    H3*    U  36           H3*        U  36   1.230  -6.353   5.876
  385    H2*    U  36           H2*        U  36   3.181  -7.521   6.547
  386   2HO*    U  36          2HO*        U  36   3.534  -8.025   8.590
  387    H1*    U  36           H1*        U  36   2.059  -9.931   7.063
  388    H3     U  36           H3         U  36   4.427 -10.042   3.139
  389    H5     U  36           H5         U  36   0.605  -8.610   2.092
  390    H6     U  36           H6         U  36   0.087  -8.461   4.459
  391   1H5*    C  37          1H5*        C  37   3.384  -5.070   9.830
  392   2H5*    C  37          2H5*        C  37   4.168  -3.530   9.427
  393    H4*    C  37           H4*        C  37   5.701  -5.421  10.238
  394    H3*    C  37           H3*        C  37   6.091  -3.861   7.664
  395    H2*    C  37           H2*        C  37   8.062  -5.105   7.220
  396   2HO*    C  37          2HO*        C  37   9.254  -5.420   8.953
  397    H1*    C  37           H1*        C  37   7.123  -7.564   7.956
  398   1H4     C  37          1H4         C  37   6.357  -6.865   1.652
  399   2H4     C  37          2H4         C  37   4.788  -6.142   1.925
  400    H5     C  37           H5         C  37   3.931  -5.640   4.118
  401    H6     C  37           H6         C  37   4.397  -5.712   6.526
  402   1H5*    G  38          1H5*        G  38   9.547  -2.220  10.844
  403   2H5*    G  38          2H5*        G  38  10.242  -0.863   9.937
  404    H4*    G  38           H4*        G  38  11.792  -2.839  10.686
  405    H3*    G  38           H3*        G  38  11.710  -1.378   8.046
  406    H2*    G  38           H2*        G  38  13.293  -2.855   7.077
  407   2HO*    G  38          2HO*        G  38  13.704  -4.024   9.654
  408    H1*    G  38           H1*        G  38  12.295  -5.190   7.988
  409    H8     G  38           H8         G  38   9.230  -3.179   7.453
  410    H1     G  38           H1         G  38  11.942  -4.773   1.906
  411   1H2     G  38          1H2         G  38  13.975  -5.583   2.260
  412   2H2     G  38          2H2         G  38  14.662  -5.730   3.863
  413   1H5*    G  39          1H5*        G  39  16.106  -0.389   9.401
  414   2H5*    G  39          2H5*        G  39  16.271   1.288   8.844
  415    H4*    G  39           H4*        G  39  17.919  -0.379   7.844
  416    H3*    G  39           H3*        G  39  16.137   1.481   6.273
  417    H2*    G  39           H2*        G  39  16.807   0.549   4.211
  418   2HO*    G  39          2HO*        G  39  19.047  -0.223   5.716
  419    H1*    G  39           H1*        G  39  16.865  -2.084   4.908
  420    H8     G  39           H8         G  39  13.890  -0.787   6.687
  421    H1     G  39           H1         G  39  12.884  -1.039   0.395
  422   1H2     G  39          1H2         G  39  14.800  -1.387  -0.665
  423   2H2     G  39          2H2         G  39  16.324  -1.556   0.178
  424   1H5*    C  40          1H5*        C  40  18.952   1.428   3.946
  425   2H5*    C  40          2H5*        C  40  20.115   2.753   4.159
  426    H4*    C  40           H4*        C  40  19.974   2.776   1.862
  427    H3*    C  40           H3*        C  40  17.745   4.518   2.941
  428    H2*    C  40           H2*        C  40  16.871   4.831   0.767
  429   2HO*    C  40          2HO*        C  40  19.501   4.258   0.046
  430    H1*    C  40           H1*        C  40  17.227   2.287  -0.191
  431   1H4     C  40          1H4         C  40  11.222   2.521   1.890
  432   2H4     C  40          2H4         C  40  11.758   2.535   3.556
  433    H5     C  40           H5         C  40  14.079   2.596   4.195
  434    H6     C  40           H6         C  40  16.389   2.656   3.377
  435   1H5*    U  41          1H5*        U  41  17.118   8.044   3.082
  436   2H5*    U  41          2H5*        U  41  16.241   6.853   2.102
  437    H4*    U  41           H4*        U  41  15.979   9.603   1.904
  438    H3*    U  41           H3*        U  41  15.274   7.245   0.164
  439    H2*    U  41           H2*        U  41  14.896   8.596  -1.729
  440   2HO*    U  41          2HO*        U  41  15.133  11.098  -0.983
  441    H1*    U  41           H1*        U  41  16.932  10.388  -1.434
  442    H3     U  41           H3         U  41  18.330   7.924  -4.933
  443    H5     U  41           H5         U  41  18.612   5.255  -1.683
  444    H6     U  41           H6         U  41  17.580   6.950  -0.286
  445   1H5*    C  42          1H5*        C  42  11.150   9.240  -0.903
  446   2H5*    C  42          2H5*        C  42  10.272   7.890  -0.157
  447    H4*    C  42           H4*        C  42   9.765   8.291  -2.614
  448    H3*    C  42           H3*        C  42  10.619   5.681  -1.393
  449    H2*    C  42           H2*        C  42  10.917   4.615  -3.467
  450   2HO*    C  42          2HO*        C  42   8.947   5.208  -4.409
  451    H1*    C  42           H1*        C  42  11.974   6.658  -4.929
  452   1H4     C  42          1H4         C  42  17.078   3.549  -2.789
  453   2H4     C  42          2H4         C  42  16.708   3.976  -1.132
  454    H5     C  42           H5         C  42  14.747   5.220  -0.497
  455    H6     C  42           H6         C  42  12.717   6.327  -1.310
  456   1H5*    U  43          1H5*        U  43   8.706   5.314   1.293
  457   2H5*    U  43          2H5*        U  43   7.890   3.757   1.045
  458    H4*    U  43           H4*        U  43   7.150   5.289   3.041
  459    H3*    U  43           H3*        U  43   5.442   3.731   1.101
  460    H2*    U  43           H2*        U  43   3.463   4.671   1.915
  461   2HO*    U  43          2HO*        U  43   3.441   5.719   4.024
  462    H1*    U  43           H1*        U  43   4.392   7.194   2.635
  463    H3     U  43           H3         U  43   1.280   8.116  -0.484
  464    H5     U  43           H5         U  43   4.318   6.176  -2.665
  465    H6     U  43           H6         U  43   5.458   5.748  -0.564
  466   1H5*    U  44          1H5*        U  44   4.798   3.408   5.999
  467   2H5*    U  44          2H5*        U  44   3.600   2.118   6.227
  468    H4*    U  44           H4*        U  44   3.204   4.495   7.300
  469    H3*    U  44           H3*        U  44   1.246   2.636   5.944
  470    H2*    U  44           H2*        U  44  -0.491   4.235   6.078
  471   2HO*    U  44          2HO*        U  44   1.162   5.850   7.760
  472    H1*    U  44           H1*        U  44   0.931   6.468   5.435
  473    H3     U  44           H3         U  44  -1.845   5.314   1.971
  474    H5     U  44           H5         U  44   1.643   3.011   1.429
  475    H6     U  44           H6         U  44   2.401   3.766   3.605
  476   1H5*    C  45          1H5*        C  45  -0.855   4.322   9.315
  477   2H5*    C  45          2H5*        C  45  -1.380   2.971  10.339
  478    H4*    C  45           H4*        C  45  -3.278   4.434   9.983
  479    H3*    C  45           H3*        C  45  -3.298   1.773   8.534
  480    H2*    C  45           H2*        C  45  -5.353   2.296   7.506
  481   2HO*    C  45          2HO*        C  45  -5.912   4.658   8.825
  482    H1*    C  45           H1*        C  45  -4.939   4.998   7.086
  483   1H4     C  45          1H4         C  45  -3.797   2.143   1.520
  484   2H4     C  45          2H4         C  45  -2.275   1.521   2.113
  485    H5     C  45           H5         C  45  -1.519   1.821   4.382
  486    H6     C  45           H6         C  45  -2.062   2.781   6.570
  487   1H5*    C  46          1H5*        C  46  -7.081   2.525  11.033
  488   2H5*    C  46          2H5*        C  46  -8.048   1.040  11.141
  489    H4*    C  46           H4*        C  46  -8.990   3.146   9.858
  490    H3*    C  46           H3*        C  46  -9.165   0.213   9.158
  491    H2*    C  46           H2*        C  46 -10.174   0.681   7.075
  492   2HO*    C  46          2HO*        C  46 -10.965   2.979   8.415
  493    H1*    C  46           H1*        C  46  -8.700   2.864   6.357
  494   1H4     C  46          1H4         C  46  -5.961  -2.241   3.689
  495   2H4     C  46          2H4         C  46  -5.057  -2.532   5.159
  496    H5     C  46           H5         C  46  -5.372  -1.257   7.178
  497    H6     C  46           H6         C  46  -6.624   0.571   8.227
  498   1H5*    U  47          1H5*        U  47 -13.752   1.762   9.364
  499   2H5*    U  47          2H5*        U  47 -14.612   0.216   9.509
  500    H4*    U  47           H4*        U  47 -15.048   1.778   7.433
  501    H3*    U  47           H3*        U  47 -14.741  -1.231   7.529
  502    H2*    U  47           H2*        U  47 -14.897  -1.374   5.172
  503   2HO*    U  47          2HO*        U  47 -15.550   0.518   3.936
  504    H1*    U  47           H1*        U  47 -13.384   0.808   4.523
  505    H3     U  47           H3         U  47 -11.188  -3.066   3.427
  506    H5     U  47           H5         U  47 -10.306  -2.388   7.494
  507    H6     U  47           H6         U  47 -11.946  -0.597   7.483
  508   1H5*    A  48          1H5*        A  48 -18.834  -0.380   5.491
  509   2H5*    A  48          2H5*        A  48 -19.705  -1.928   5.483
  510    H4*    A  48           H4*        A  48 -18.898  -0.852   3.216
  511    H3*    A  48           H3*        A  48 -18.834  -3.721   4.122
  512    H2*    A  48           H2*        A  48 -17.658  -4.429   2.215
  513   2HO*    A  48          2HO*        A  48 -17.639  -3.334   0.344
  514    H1*    A  48           H1*        A  48 -15.831  -2.447   2.128
  515    H8     A  48           H8         A  48 -16.376  -2.881   5.773
  516   1H6     A  48          1H6         A  48 -13.032  -8.051   5.545
  517   2H6     A  48          2H6         A  48 -13.784  -6.874   6.599
  518    H2     A  48           H2         A  48 -13.927  -6.780   1.328
  519    H3T    A  48           H3T        A  48 -20.107  -3.463   1.888
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  11.023 -30.210   6.162
    2   2H5*    G   1          2H5*        G   1  11.341 -29.435   4.596
    3    H4*    G   1           H4*        G   1  11.236 -31.655   3.943
    4    H3*    G   1           H3*        G   1   8.539 -30.344   3.710
    5    H2*    G   1           H2*        G   1   7.414 -32.394   3.329
    6   2HO*    G   1          2HO*        G   1   9.740 -33.085   2.224
    7    H1*    G   1           H1*        G   1   8.551 -33.880   5.226
    8    H8     G   1           H8         G   1   8.719 -30.829   7.131
    9    H1     G   1           H1         G   1   2.606 -32.211   5.965
   10   1H2     G   1          1H2         G   1   2.465 -33.749   4.375
   11   2H2     G   1          2H2         G   1   3.877 -34.435   3.601
   12    H5T    G   1           H5T        G   1   9.461 -28.796   6.172
   13   1H5*    G   2          1H5*        G   2   7.933 -32.791   0.462
   14   2H5*    G   2          2H5*        G   2   8.250 -31.766  -0.951
   15    H4*    G   2           H4*        G   2   6.207 -32.817  -1.473
   16    H3*    G   2           H3*        G   2   5.751 -30.057  -0.288
   17    H2*    G   2           H2*        G   2   3.413 -30.376  -0.542
   18   2HO*    G   2          2HO*        G   2   4.097 -32.602  -2.196
   19    H1*    G   2           H1*        G   2   3.306 -33.000   0.213
   20    H8     G   2           H8         G   2   5.592 -31.496   2.680
   21    H1     G   2           H1         G   2  -0.411 -29.587   3.642
   22   1H2     G   2          1H2         G   2  -1.663 -30.103   1.885
   23   2H2     G   2          2H2         G   2  -1.017 -30.916   0.477
   24   1H5*    C   3          1H5*        C   3   2.858 -29.805  -3.482
   25   2H5*    C   3          2H5*        C   3   3.354 -28.317  -4.314
   26    H4*    C   3           H4*        C   3   1.002 -28.182  -3.560
   27    H3*    C   3           H3*        C   3   3.083 -26.356  -2.325
   28    H2*    C   3           H2*        C   3   1.483 -25.426  -0.894
   29   2HO*    C   3          2HO*        C   3  -0.852 -25.790  -1.456
   30    H1*    C   3           H1*        C   3  -0.229 -27.667  -0.668
   31   1H4     C   3          1H4         C   3   2.528 -26.759   5.001
   32   2H4     C   3          2H4         C   3   3.985 -27.541   4.429
   33    H5     C   3           H5         C   3   4.292 -28.255   2.146
   34    H6     C   3           H6         C   3   3.272 -28.366  -0.073
   35   1H5*    C   4          1H5*        C   4  -0.402 -24.030  -4.953
   36   2H5*    C   4          2H5*        C   4   0.034 -22.310  -4.888
   37    H4*    C   4           H4*        C   4  -2.332 -23.114  -4.034
   38    H3*    C   4           H3*        C   4  -0.456 -21.035  -2.914
   39    H2*    C   4           H2*        C   4  -1.754 -20.756  -0.962
   40   2HO*    C   4          2HO*        C   4  -3.888 -21.851  -0.866
   41    H1*    C   4           H1*        C   4  -2.344 -23.318  -0.431
   42   1H4     C   4          1H4         C   4   3.047 -21.885   2.674
   43   2H4     C   4          2H4         C   4   3.979 -22.418   1.293
   44    H5     C   4           H5         C   4   2.981 -23.079  -0.798
   45    H6     C   4           H6         C   4   0.874 -23.369  -2.018
   46   1H5*    U   5          1H5*        U   5  -4.666 -19.109  -2.526
   47   2H5*    U   5          2H5*        U   5  -4.284 -17.395  -2.784
   48    H4*    U   5           H4*        U   5  -5.341 -18.187  -0.495
   49    H3*    U   5           H3*        U   5  -3.104 -16.194  -0.959
   50    H2*    U   5           H2*        U   5  -2.752 -15.979   1.341
   51   2HO*    U   5          2HO*        U   5  -5.356 -17.047   1.826
   52    H1*    U   5           H1*        U   5  -3.695 -18.544   2.147
   53    H3     U   5           H3         U   5   0.433 -17.759   4.006
   54    H5     U   5           H5         U   5   1.155 -19.067   0.062
   55    H6     U   5           H6         U   5  -1.215 -18.846  -0.372
   56   1H5*    U   6          1H5*        U   6  -7.190 -13.894   0.014
   57   2H5*    U   6          2H5*        U   6  -8.257 -15.080  -0.763
   58    H4*    U   6           H4*        U   6  -8.972 -13.213  -2.354
   59    H3*    U   6           H3*        U   6  -7.203 -11.665  -0.442
   60    H2*    U   6           H2*        U   6  -8.802  -9.999  -0.217
   61   2HO*    U   6          2HO*        U   6 -10.303  -9.586  -2.002
   62    H1*    U   6           H1*        U   6 -11.088 -11.525  -1.110
   63    H3     U   6           H3         U   6 -12.516  -9.047   2.431
   64    H5     U   6           H5         U   6  -9.892 -11.882   4.117
   65    H6     U   6           H6         U   6  -9.315 -12.587   1.868
   66   1H5*    A   7          1H5*        A   7  -7.288  -9.636  -5.022
   67   2H5*    A   7          2H5*        A   7  -6.364  -8.128  -4.869
   68    H4*    A   7           H4*        A   7  -8.871  -8.072  -5.697
   69    H3*    A   7           H3*        A   7  -7.402  -6.207  -3.833
   70    H2*    A   7           H2*        A   7  -9.372  -5.029  -3.290
   71   2HO*    A   7          2HO*        A   7 -10.133  -5.929  -5.798
   72    H1*    A   7           H1*        A   7 -11.127  -7.121  -3.153
   73    H8     A   7           H8         A   7  -8.066  -8.434  -1.536
   74   1H6     A   7          1H6         A   7  -9.372  -5.058   3.449
   75   2H6     A   7          2H6         A   7  -8.368  -6.340   2.808
   76    H2     A   7           H2         A   7 -12.060  -3.710   0.108
   77   1H5*    G   8          1H5*        G   8  -9.039  -3.335  -6.700
   78   2H5*    G   8          2H5*        G   8  -7.931  -1.951  -6.791
   79    H4*    G   8           H4*        G   8 -10.247  -1.608  -5.653
   80    H3*    G   8           H3*        G   8  -7.544  -0.753  -4.577
   81    H2*    G   8           H2*        G   8  -8.546   0.072  -2.621
   82   2HO*    G   8          2HO*        G   8 -10.449   1.034  -2.665
   83    H1*    G   8           H1*        G   8 -10.632  -1.776  -2.407
   84    H8     G   8           H8         G   8  -7.562  -3.776  -2.802
   85    H1     G   8           H1         G   8  -7.757  -0.969   2.921
   86   1H2     G   8          1H2         G   8  -9.347   0.579   2.951
   87   2H2     G   8          2H2         G   8 -10.355   0.917   1.562
   88   1H5*    G   9          1H5*        G   9 -10.770   2.996  -5.492
   89   2H5*    G   9          2H5*        G   9  -9.698   4.403  -5.335
   90    H4*    G   9           H4*        G   9 -11.962   4.331  -3.999
   91    H3*    G   9           H3*        G   9  -9.241   5.301  -3.150
   92    H2*    G   9           H2*        G   9  -9.898   5.558  -0.883
   93   2HO*    G   9          2HO*        G   9 -12.211   5.256  -0.348
   94    H1*    G   9           H1*        G   9 -11.252   3.270  -0.560
   95    H8     G   9           H8         G   9  -8.639   2.232  -2.961
   96    H1     G   9           H1         G   9  -6.165   3.298   2.818
   97   1H2     G   9          1H2         G   9  -7.644   4.344   4.095
   98   2H2     G   9          2H2         G   9  -9.240   4.779   3.523
   99   1H5*    A  10          1H5*        A  10 -11.057   9.255  -2.194
  100   2H5*    A  10          2H5*        A  10  -9.710  10.317  -2.654
  101    H4*    A  10           H4*        A  10 -10.234   9.973  -0.118
  102    H3*    A  10           H3*        A  10  -7.501   9.828  -1.438
  103    H2*    A  10           H2*        A  10  -6.529   9.436   0.684
  104   2HO*    A  10          2HO*        A  10  -7.748  11.125   1.745
  105    H1*    A  10           H1*        A  10  -8.518   7.799   1.701
  106    H8     A  10           H8         A  10  -8.037   6.365  -1.612
  107   1H6     A  10          1H6         A  10  -2.548   4.167   0.110
  108   2H6     A  10          2H6         A  10  -3.801   4.103  -1.110
  109    H2     A  10           H2         A  10  -3.903   7.123   3.213
  110   1H5*    A  11          1H5*        A  11  -7.216  13.687   1.268
  111   2H5*    A  11          2H5*        A  11  -5.785  14.527   0.634
  112    H4*    A  11           H4*        A  11  -5.762  13.522   3.075
  113    H3*    A  11           H3*        A  11  -3.588  13.523   0.972
  114    H2*    A  11           H2*        A  11  -2.181  12.183   2.341
  115   2HO*    A  11          2HO*        A  11  -3.768  11.966   4.567
  116    H1*    A  11           H1*        A  11  -4.031  10.421   3.224
  117    H8     A  11           H8         A  11  -5.180  10.898  -0.233
  118   1H6     A  11          1H6         A  11  -0.396   7.568  -2.223
  119   2H6     A  11          2H6         A  11  -1.931   8.281  -2.667
  120    H2     A  11           H2         A  11   0.316   8.589   2.096
  121   1H5*    A  12          1H5*        A  12  -1.565  13.931   3.914
  122   2H5*    A  12          2H5*        A  12  -0.418  15.276   4.078
  123    H4*    A  12           H4*        A  12   0.887  13.271   4.144
  124    H3*    A  12           H3*        A  12   0.969  14.734   1.489
  125    H2*    A  12           H2*        A  12   2.402  13.075   0.617
  126   2HO*    A  12          2HO*        A  12   3.624  11.726   1.893
  127    H1*    A  12           H1*        A  12   1.259  10.882   1.747
  128    H8     A  12           H8         A  12  -1.480  13.079   0.519
  129   1H6     A  12          1H6         A  12  -0.194  11.253  -5.217
  130   2H6     A  12          2H6         A  12  -1.335  12.118  -4.211
  131    H2     A  12           H2         A  12   3.083   9.796  -2.506
  132   1H5*    C  13          1H5*        C  13   5.254  14.608   3.505
  133   2H5*    C  13          2H5*        C  13   6.212  15.908   2.766
  134    H4*    C  13           H4*        C  13   7.199  13.544   2.642
  135    H3*    C  13           H3*        C  13   6.791  15.375   0.254
  136    H2*    C  13           H2*        C  13   7.764  13.706  -1.150
  137   2HO*    C  13          2HO*        C  13   8.877  12.891   1.236
  138    H1*    C  13           H1*        C  13   6.395  11.611  -0.188
  139   1H4     C  13          1H4         C  13   2.949  14.219  -4.898
  140   2H4     C  13          2H4         C  13   2.003  15.071  -3.700
  141    H5     C  13           H5         C  13   2.539  15.066  -1.354
  142    H6     C  13           H6         C  13   4.089  14.244   0.351
  143   1H5*    A  14          1H5*        A  14  11.353  14.529   0.016
  144   2H5*    A  14          2H5*        A  14  11.893  15.890  -0.986
  145    H4*    A  14           H4*        A  14  12.038  13.417  -1.907
  146    H3*    A  14           H3*        A  14  11.067  15.873  -3.429
  147    H2*    A  14           H2*        A  14  10.942  14.455  -5.367
  148   2HO*    A  14          2HO*        A  14  12.668  13.150  -5.362
  149    H1*    A  14           H1*        A  14   9.738  12.372  -4.104
  150    H8     A  14           H8         A  14   8.066  15.244  -2.524
  151   1H6     A  14          1H6         A  14   4.858  16.151  -7.688
  152   2H6     A  14          2H6         A  14   5.003  16.567  -5.996
  153    H2     A  14           H2         A  14   8.166  13.251  -8.600
  154   1H5*    G  15          1H5*        G  15  14.226  14.785  -5.567
  155   2H5*    G  15          2H5*        G  15  15.440  15.992  -6.037
  156    H4*    G  15           H4*        G  15  14.499  15.188  -8.075
  157    H3*    G  15           H3*        G  15  13.310  17.860  -7.229
  158    H2*    G  15           H2*        G  15  12.144  17.877  -9.339
  159   2HO*    G  15          2HO*        G  15  12.764  16.653 -11.016
  160    H1*    G  15           H1*        G  15  11.275  15.302  -9.165
  161    H8     G  15           H8         G  15  11.162  16.496  -5.645
  162    H1     G  15           H1         G  15   6.609  19.216  -9.166
  163   1H2     G  15          1H2         G  15   6.973  18.825 -11.318
  164   2H2     G  15          2H2         G  15   8.340  17.894 -11.884
  165   1H5*    U  16          1H5*        U  16  14.128  18.327 -10.531
  166   2H5*    U  16          2H5*        U  16  15.015  19.652 -11.309
  167    H4*    U  16           H4*        U  16  12.851  19.864 -12.195
  168    H3*    U  16           H3*        U  16  13.109  21.664  -9.744
  169    H2*    U  16           H2*        U  16  10.945  22.474 -10.255
  170   2HO*    U  16          2HO*        U  16   9.977  21.804 -12.362
  171    H1*    U  16           H1*        U  16   9.902  20.024 -11.121
  172    H3     U  16           H3         U  16   7.521  21.472  -7.506
  173    H5     U  16           H5         U  16  11.093  19.897  -5.929
  174    H6     U  16           H6         U  16  11.929  19.684  -8.176
  175   1H5*    U  17          1H5*        U  17  12.518  25.525 -10.269
  176   2H5*    U  17          2H5*        U  17  11.509  24.381 -11.172
  177    H4*    U  17           H4*        U  17  12.052  27.295 -11.746
  178    H3*    U  17           H3*        U  17   9.912  26.173 -10.565
  179    H2*    U  17           H2*        U  17   9.490  24.462 -12.183
  180   2HO*    U  17          2HO*        U  17   7.720  25.214 -13.473
  181    H1*    U  17           H1*        U  17   9.813  26.270 -14.541
  182    H3     U  17           H3         U  17   8.995  22.182 -16.405
  183    H5     U  17           H5         U  17  12.582  21.688 -14.253
  184    H6     U  17           H6         U  17  12.319  23.932 -13.409
  185   1H5*    C  18          1H5*        C  18   6.352  26.038 -12.099
  186   2H5*    C  18          2H5*        C  18   5.960  27.765 -11.959
  187    H4*    C  18           H4*        C  18   4.186  26.418 -10.940
  188    H3*    C  18           H3*        C  18   5.277  28.608  -9.740
  189    H2*    C  18           H2*        C  18   6.957  27.443  -8.485
  190   2HO*    C  18          2HO*        C  18   6.196  28.288  -6.692
  191    H1*    C  18           H1*        C  18   4.972  25.322  -7.667
  192   1H4     C  18          1H4         C  18  10.410  22.589  -5.873
  193   2H4     C  18          2H4         C  18  11.143  22.924  -7.426
  194    H5     C  18           H5         C  18  10.039  24.155  -9.170
  195    H6     C  18           H6         C  18   7.987  25.329  -9.813
  196   1H5*    G  19          1H5*        G  19   0.751  26.205 -10.528
  197   2H5*    G  19          2H5*        G  19   2.324  25.392 -10.384
  198    H4*    G  19           H4*        G  19   0.664  25.922 -12.841
  199    H3*    G  19           H3*        G  19   2.180  23.584 -11.622
  200    H2*    G  19           H2*        G  19   2.495  22.696 -13.779
  201   2HO*    G  19          2HO*        G  19   0.201  24.242 -14.373
  202    H1*    G  19           H1*        G  19   2.702  25.133 -15.160
  203    H8     G  19           H8         G  19   5.013  24.621 -16.087
  204    H1     G  19           H1         G  19   7.241  22.376 -10.550
  205   1H2     G  19          1H2         G  19   5.662  22.497  -8.996
  206   2H2     G  19          2H2         G  19   4.064  23.131  -9.325
  207   1H5*    C  20          1H5*        C  20   0.093  22.062 -14.184
  208   2H5*    C  20          2H5*        C  20  -0.502  20.402 -13.988
  209    H4*    C  20           H4*        C  20   1.354  20.614 -15.663
  210    H3*    C  20           H3*        C  20   1.532  18.853 -13.218
  211    H2*    C  20           H2*        C  20   3.774  18.250 -13.711
  212   2HO*    C  20          2HO*        C  20   4.678  18.514 -15.720
  213    H1*    C  20           H1*        C  20   4.720  20.691 -14.377
  214   1H4     C  20          1H4         C  20   5.413  19.951  -8.053
  215   2H4     C  20          2H4         C  20   3.884  20.769  -7.818
  216    H5     C  20           H5         C  20   2.435  21.403  -9.621
  217    H6     C  20           H6         C  20   2.128  21.402 -12.049
  218   1H5*    U  21          1H5*        U  21   3.261  16.966 -15.771
  219   2H5*    U  21          2H5*        U  21   2.445  15.709 -16.721
  220    H4*    U  21           H4*        U  21   4.480  14.679 -16.408
  221    H3*    U  21           H3*        U  21   2.683  13.982 -14.080
  222    H2*    U  21           H2*        U  21   4.456  12.842 -12.989
  223   2HO*    U  21          2HO*        U  21   5.586  11.662 -14.358
  224    H1*    U  21           H1*        U  21   6.445  14.629 -13.478
  225    H3     U  21           H3         U  21   5.503  15.247  -9.097
  226    H5     U  21           H5         U  21   2.312  17.133 -11.107
  227    H6     U  21           H6         U  21   3.172  16.220 -13.185
  228   1H5*    G  22          1H5*        G  22   4.532  10.336 -15.081
  229   2H5*    G  22          2H5*        G  22   3.578   8.972 -14.462
  230    H4*    G  22           H4*        G  22   5.810   9.606 -13.253
  231    H3*    G  22           H3*        G  22   3.129   9.017 -11.961
  232    H2*    G  22           H2*        G  22   3.978   9.587  -9.877
  233   2HO*    G  22          2HO*        G  22   6.289   9.326  -9.446
  234    H1*    G  22           H1*        G  22   6.198  11.171 -10.762
  235    H8     G  22           H8         G  22   2.887  12.694 -11.502
  236    H1     G  22           H1         G  22   4.350  13.207  -5.324
  237   1H2     G  22          1H2         G  22   6.125  11.965  -4.855
  238   2H2     G  22          2H2         G  22   6.949  11.013  -6.070
  239   1H5*    U  23          1H5*        U  23   6.153   5.430 -10.572
  240   2H5*    U  23          2H5*        U  23   5.011   4.279  -9.849
  241    H4*    U  23           H4*        U  23   6.929   5.345  -8.379
  242    H3*    U  23           H3*        U  23   4.030   4.841  -7.663
  243    H2*    U  23           H2*        U  23   4.312   5.874  -5.572
  244   2HO*    U  23          2HO*        U  23   6.388   6.161  -4.643
  245    H1*    U  23           H1*        U  23   6.151   7.833  -6.303
  246    H3     U  23           H3         U  23   2.232   9.613  -4.646
  247    H5     U  23           H5         U  23   1.641   9.074  -8.786
  248    H6     U  23           H6         U  23   3.714   7.816  -8.851
  249   1H5*    G  24          1H5*        G  24   5.661   0.675  -7.837
  250   2H5*    G  24          2H5*        G  24   6.643  -0.336  -6.759
  251    H4*    G  24           H4*        G  24   7.583   1.309  -8.823
  252    H3*    G  24           H3*        G  24   8.805  -0.259  -6.559
  253    H2*    G  24           H2*        G  24  10.851   0.937  -6.663
  254   2HO*    G  24          2HO*        G  24   9.872   1.918  -9.164
  255    H1*    G  24           H1*        G  24   9.901   3.416  -6.874
  256    H8     G  24           H8         G  24   7.224   1.988  -4.817
  257    H1     G  24           H1         G  24  12.652   2.344  -1.493
  258   1H2     G  24          1H2         G  24  14.357   2.728  -2.860
  259   2H2     G  24          2H2         G  24  14.155   2.895  -4.589
  260   1H5*    C  25          1H5*        C  25  11.725  -0.906  -8.839
  261   2H5*    C  25          2H5*        C  25  11.981  -2.563  -9.419
  262    H4*    C  25           H4*        C  25  13.968  -2.066  -8.246
  263    H3*    C  25           H3*        C  25  11.995  -3.606  -6.526
  264    H2*    C  25           H2*        C  25  13.479  -3.506  -4.712
  265   2HO*    C  25          2HO*        C  25  15.772  -2.646  -5.400
  266    H1*    C  25           H1*        C  25  14.644  -1.015  -5.279
  267   1H4     C  25          1H4         C  25  10.861  -0.382  -0.186
  268   2H4     C  25          2H4         C  25   9.489  -0.127  -1.240
  269    H5     C  25           H5         C  25   9.607  -0.340  -3.637
  270    H6     C  25           H6         C  25  11.065  -0.848  -5.537
  271   1H5*    C  26          1H5*        C  26  15.726  -5.283  -6.465
  272   2H5*    C  26          2H5*        C  26  15.896  -6.839  -7.303
  273    H4*    C  26           H4*        C  26  17.219  -7.274  -5.470
  274    H3*    C  26           H3*        C  26  14.364  -7.986  -4.765
  275    H2*    C  26           H2*        C  26  14.976  -8.433  -2.516
  276   2HO*    C  26          2HO*        C  26  17.565  -8.033  -2.337
  277    H1*    C  26           H1*        C  26  16.583  -6.298  -2.107
  278   1H4     C  26          1H4         C  26  10.819  -4.255  -0.389
  279   2H4     C  26          2H4         C  26  10.297  -4.192  -2.058
  280    H5     C  26           H5         C  26  11.673  -4.908  -3.901
  281    H6     C  26           H6         C  26  13.847  -5.841  -4.542
  282   1H5*    G  27          1H5*        G  27  16.813 -10.924  -2.921
  283   2H5*    G  27          2H5*        G  27  15.826 -12.341  -2.513
  284    H4*    G  27           H4*        G  27  16.620 -10.678  -0.616
  285    H3*    G  27           H3*        G  27  13.876 -11.947  -0.949
  286    H2*    G  27           H2*        G  27  13.162 -10.846   1.003
  287   2HO*    G  27          2HO*        G  27  14.540 -10.257   2.624
  288    H1*    G  27           H1*        G  27  14.724  -8.522   0.710
  289    H8     G  27           H8         G  27  12.864  -8.893  -2.444
  290    H1     G  27           H1         G  27   8.951  -7.281   2.322
  291   1H2     G  27          1H2         G  27   9.990  -7.521   4.268
  292   2H2     G  27          2H2         G  27  11.643  -8.077   4.388
  293   1H5*    A  28          1H5*        A  28  15.200 -13.967   3.040
  294   2H5*    A  28          2H5*        A  28  14.177 -15.418   3.044
  295    H4*    A  28           H4*        A  28  13.805 -13.517   4.848
  296    H3*    A  28           H3*        A  28  11.707 -15.073   3.295
  297    H2*    A  28           H2*        A  28  10.010 -13.836   4.346
  298   2HO*    A  28          2HO*        A  28  10.649 -12.532   6.299
  299    H1*    A  28           H1*        A  28  11.428 -11.419   4.665
  300    H8     A  28           H8         A  28  11.574 -12.360   1.085
  301   1H6     A  28          1H6         A  28   5.759 -10.429   0.449
  302   2H6     A  28          2H6         A  28   7.201 -10.940  -0.399
  303    H2     A  28           H2         A  28   6.700 -10.602   4.841
  304   1H5*    A  29          1H5*        A  29  11.799 -16.463   8.104
  305   2H5*    A  29          2H5*        A  29  10.490 -17.654   8.238
  306    H4*    A  29           H4*        A  29  10.475 -15.487   9.748
  307    H3*    A  29           H3*        A  29   8.209 -16.912   8.360
  308    H2*    A  29           H2*        A  29   6.658 -15.196   8.885
  309   2HO*    A  29          2HO*        A  29   8.607 -13.857  10.472
  310    H1*    A  29           H1*        A  29   8.162 -13.067   8.248
  311    H8     A  29           H8         A  29   9.434 -15.437   5.753
  312   1H6     A  29          1H6         A  29   4.077 -15.127   2.729
  313   2H6     A  29          2H6         A  29   5.737 -15.673   2.652
  314    H2     A  29           H2         A  29   3.530 -13.179   6.741
  315   1H5*    A  30          1H5*        A  30   6.646 -17.336  12.814
  316   2H5*    A  30          2H5*        A  30   5.867 -18.926  12.698
  317    H4*    A  30           H4*        A  30   4.354 -16.915  13.245
  318    H3*    A  30           H3*        A  30   3.870 -18.976  11.080
  319    H2*    A  30           H2*        A  30   1.889 -17.844  10.400
  320   2HO*    A  30          2HO*        A  30   1.544 -15.759  11.863
  321    H1*    A  30           H1*        A  30   2.882 -15.345  10.370
  322    H8     A  30           H8         A  30   5.878 -17.189   9.337
  323   1H6     A  30          1H6         A  30   3.318 -18.266   3.848
  324   2H6     A  30          2H6         A  30   4.798 -18.320   4.776
  325    H2     A  30           H2         A  30   0.114 -16.711   6.592
  326   1H5*    G  31          1H5*        G  31   0.525 -18.355  12.239
  327   2H5*    G  31          2H5*        G  31  -0.324 -19.517  13.276
  328    H4*    G  31           H4*        G  31  -1.965 -18.972  11.702
  329    H3*    G  31           H3*        G  31  -0.440 -21.420  10.735
  330    H2*    G  31           H2*        G  31  -1.842 -21.474   8.826
  331   2HO*    G  31          2HO*        G  31  -3.540 -19.584  10.141
  332    H1*    G  31           H1*        G  31  -2.042 -18.729   8.449
  333    H8     G  31           H8         G  31   1.540 -19.470   9.030
  334    H1     G  31           H1         G  31  -0.350 -21.544   3.307
  335   1H2     G  31          1H2         G  31  -2.561 -21.478   3.169
  336   2H2     G  31          2H2         G  31  -3.568 -20.924   4.488
  337   1H5*    G  32          1H5*        G  32  -4.946 -22.656  11.496
  338   2H5*    G  32          2H5*        G  32  -5.001 -24.421  11.311
  339    H4*    G  32           H4*        G  32  -6.292 -22.865   9.611
  340    H3*    G  32           H3*        G  32  -4.678 -25.371   9.061
  341    H2*    G  32           H2*        G  32  -5.062 -25.116   6.715
  342   2HO*    G  32          2HO*        G  32  -7.117 -23.410   7.617
  343    H1*    G  32           H1*        G  32  -4.499 -22.500   6.545
  344    H8     G  32           H8         G  32  -2.178 -23.582   9.222
  345    H1     G  32           H1         G  32  -0.375 -25.849   3.546
  346   1H2     G  32          1H2         G  32  -2.002 -25.571   2.064
  347   2H2     G  32          2H2         G  32  -3.530 -24.827   2.475
  348   1H5*    U  33          1H5*        U  33  -7.105 -26.001   6.762
  349   2H5*    U  33          2H5*        U  33  -8.339 -27.268   6.928
  350    H4*    U  33           H4*        U  33  -7.421 -27.829   4.872
  351    H3*    U  33           H3*        U  33  -5.904 -29.292   7.059
  352    H2*    U  33           H2*        U  33  -4.464 -30.224   5.432
  353   2HO*    U  33          2HO*        U  33  -6.600 -30.257   3.945
  354    H1*    U  33           H1*        U  33  -4.167 -28.011   3.855
  355    H3     U  33           H3         U  33  -0.170 -28.780   5.875
  356    H5     U  33           H5         U  33  -2.493 -26.850   8.815
  357    H6     U  33           H6         U  33  -4.406 -27.044   7.337
  358   1H5*    C  34          1H5*        C  34  -5.916 -32.062   3.798
  359   2H5*    C  34          2H5*        C  34  -6.753 -33.486   4.451
  360    H4*    C  34           H4*        C  34  -4.703 -34.322   3.583
  361    H3*    C  34           H3*        C  34  -4.569 -33.839   6.574
  362    H2*    C  34           H2*        C  34  -2.386 -34.640   6.608
  363   2HO*    C  34          2HO*        C  34  -3.323 -36.389   4.879
  364    H1*    C  34           H1*        C  34  -1.677 -33.790   3.999
  365   1H4     C  34          1H4         C  34   1.652 -30.097   7.947
  366   2H4     C  34          2H4         C  34   0.189 -29.404   8.609
  367    H5     C  34           H5         C  34  -2.019 -30.107   7.952
  368    H6     C  34           H6         C  34  -3.300 -31.627   6.523
  369    H3T    C  34           H3T        C  34  -4.511 -36.304   6.211
  370   1H5*    U  35          1H5*        U  35  -4.744 -13.054   3.276
  371   2H5*    U  35          2H5*        U  35  -4.588 -11.521   2.393
  372    H4*    U  35           H4*        U  35  -3.994 -11.202   4.750
  373    H3*    U  35           H3*        U  35  -1.890 -10.935   2.605
  374    H2*    U  35           H2*        U  35  -0.161 -10.639   4.177
  375   2HO*    U  35          2HO*        U  35  -2.215 -10.243   6.132
  376    H1*    U  35           H1*        U  35  -0.924 -12.467   6.045
  377    H3     U  35           H3         U  35   2.712 -14.294   4.068
  378    H5     U  35           H5         U  35  -0.311 -14.664   1.157
  379    H6     U  35           H6         U  35  -1.769 -13.377   2.609
  380    H5T    U  35           H5T        U  35  -3.509 -13.794   1.767
  381   1H5*    U  36          1H5*        U  36  -1.957  -7.366   5.486
  382   2H5*    U  36          2H5*        U  36  -0.957  -6.035   4.867
  383    H4*    U  36           H4*        U  36  -0.254  -7.317   7.070
  384    H3*    U  36           H3*        U  36   1.467  -6.327   4.787
  385    H2*    U  36           H2*        U  36   3.401  -7.320   5.738
  386   2HO*    U  36          2HO*        U  36   3.316  -8.212   7.894
  387    H1*    U  36           H1*        U  36   2.328  -9.702   6.426
  388    H3     U  36           H3         U  36   4.977 -10.076   2.693
  389    H5     U  36           H5         U  36   1.167  -8.988   1.258
  390    H6     U  36           H6         U  36   0.478  -8.627   3.558
  391   1H5*    C  37          1H5*        C  37   3.379  -4.207   8.650
  392   2H5*    C  37          2H5*        C  37   4.209  -2.839   7.882
  393    H4*    C  37           H4*        C  37   5.613  -4.602   9.216
  394    H3*    C  37           H3*        C  37   6.241  -3.415   6.495
  395    H2*    C  37           H2*        C  37   8.222  -4.721   6.384
  396   2HO*    C  37          2HO*        C  37   9.029  -5.826   8.215
  397    H1*    C  37           H1*        C  37   7.176  -7.056   7.302
  398   1H4     C  37          1H4         C  37   6.783  -6.955   0.919
  399   2H4     C  37          2H4         C  37   5.167  -6.295   1.046
  400    H5     C  37           H5         C  37   4.172  -5.637   3.136
  401    H6     C  37           H6         C  37   4.514  -5.455   5.559
  402   1H5*    G  38          1H5*        G  38   9.592  -1.581   9.649
  403   2H5*    G  38          2H5*        G  38  10.379  -0.350   8.643
  404    H4*    G  38           H4*        G  38  11.796  -2.323   9.673
  405    H3*    G  38           H3*        G  38  11.953  -1.022   6.959
  406    H2*    G  38           H2*        G  38  13.486  -2.631   6.143
  407   2HO*    G  38          2HO*        G  38  14.651  -3.986   7.503
  408    H1*    G  38           H1*        G  38  12.349  -4.866   7.140
  409    H8     G  38           H8         G  38   9.361  -2.859   6.358
  410    H1     G  38           H1         G  38  12.335  -4.687   1.018
  411   1H2     G  38          1H2         G  38  14.350  -5.473   1.504
  412   2H2     G  38          2H2         G  38  14.960  -5.546   3.142
  413   1H5*    G  39          1H5*        G  39  16.389  -0.250   8.573
  414   2H5*    G  39          2H5*        G  39  16.663   1.371   7.904
  415    H4*    G  39           H4*        G  39  18.306  -0.463   7.187
  416    H3*    G  39           H3*        G  39  16.823   1.436   5.377
  417    H2*    G  39           H2*        G  39  17.577   0.355   3.421
  418   2HO*    G  39          2HO*        G  39  19.533  -0.454   3.345
  419    H1*    G  39           H1*        G  39  17.384  -2.239   4.224
  420    H8     G  39           H8         G  39  14.382  -0.674   5.715
  421    H1     G  39           H1         G  39  13.839  -1.118  -0.622
  422   1H2     G  39          1H2         G  39  15.802  -1.628  -1.520
  423   2H2     G  39          2H2         G  39  17.244  -1.859  -0.557
  424   1H5*    C  40          1H5*        C  40  20.020   1.335   2.877
  425   2H5*    C  40          2H5*        C  40  20.880   2.844   3.250
  426    H4*    C  40           H4*        C  40  20.683   2.925   0.913
  427    H3*    C  40           H3*        C  40  18.438   4.444   2.267
  428    H2*    C  40           H2*        C  40  17.433   4.902   0.193
  429   2HO*    C  40          2HO*        C  40  19.571   5.579  -0.684
  430    H1*    C  40           H1*        C  40  18.111   2.546  -1.139
  431   1H4     C  40          1H4         C  40  11.949   2.001   0.313
  432   2H4     C  40          2H4         C  40  12.323   1.835   2.013
  433    H5     C  40           H5         C  40  14.558   2.011   2.897
  434    H6     C  40           H6         C  40  16.916   2.383   2.341
  435   1H5*    U  41          1H5*        U  41  17.846   6.924   3.671
  436   2H5*    U  41          2H5*        U  41  16.933   6.050   2.424
  437    H4*    U  41           H4*        U  41  16.120   8.400   3.569
  438    H3*    U  41           H3*        U  41  15.513   6.996   0.973
  439    H2*    U  41           H2*        U  41  14.459   8.889   0.049
  440   2HO*    U  41          2HO*        U  41  14.380  10.709   1.971
  441    H1*    U  41           H1*        U  41  16.102  10.852   1.002
  442    H3     U  41           H3         U  41  17.008  10.737  -3.420
  443    H5     U  41           H5         U  41  18.786   7.213  -1.940
  444    H6     U  41           H6         U  41  17.786   7.693   0.219
  445   1H5*    C  42          1H5*        C  42  11.277   7.274   2.668
  446   2H5*    C  42          2H5*        C  42  10.445   5.827   2.062
  447    H4*    C  42           H4*        C  42   9.659   8.042   1.081
  448    H3*    C  42           H3*        C  42  10.545   5.629  -0.491
  449    H2*    C  42           H2*        C  42  10.453   6.767  -2.549
  450   2HO*    C  42          2HO*        C  42   9.068   8.375  -2.924
  451    H1*    C  42           H1*        C  42  11.406   9.211  -1.786
  452   1H4     C  42          1H4         C  42  16.483   6.113  -4.020
  453   2H4     C  42          2H4         C  42  16.496   5.044  -2.635
  454    H5     C  42           H5         C  42  14.825   5.111  -0.901
  455    H6     C  42           H6         C  42  12.781   6.217  -0.120
  456   1H5*    U  43          1H5*        U  43   8.485   4.951   1.293
  457   2H5*    U  43          2H5*        U  43   7.788   3.340   1.558
  458    H4*    U  43           H4*        U  43   6.828   5.354   2.912
  459    H3*    U  43           H3*        U  43   5.263   3.223   1.430
  460    H2*    U  43           H2*        U  43   3.245   4.287   1.925
  461   2HO*    U  43          2HO*        U  43   3.466   6.017   3.758
  462    H1*    U  43           H1*        U  43   4.219   6.946   2.159
  463    H3     U  43           H3         U  43   0.808   7.357  -0.758
  464    H5     U  43           H5         U  43   3.634   5.035  -2.851
  465    H6     U  43           H6         U  43   4.967   4.951  -0.823
  466   1H5*    U  44          1H5*        U  44   4.639   3.921   6.330
  467   2H5*    U  44          2H5*        U  44   3.524   2.629   6.819
  468    H4*    U  44           H4*        U  44   2.969   5.098   7.478
  469    H3*    U  44           H3*        U  44   1.115   2.989   6.357
  470    H2*    U  44           H2*        U  44  -0.674   4.520   6.221
  471   2HO*    U  44          2HO*        U  44   0.178   6.779   7.286
  472    H1*    U  44           H1*        U  44   0.710   6.734   5.385
  473    H3     U  44           H3         U  44  -2.034   5.234   2.039
  474    H5     U  44           H5         U  44   1.476   2.922   1.724
  475    H6     U  44           H6         U  44   2.218   3.882   3.827
  476   1H5*    C  45          1H5*        C  45  -1.241   4.756   9.731
  477   2H5*    C  45          2H5*        C  45  -1.671   3.343  10.716
  478    H4*    C  45           H4*        C  45  -3.681   4.646  10.229
  479    H3*    C  45           H3*        C  45  -3.371   1.931   8.922
  480    H2*    C  45           H2*        C  45  -5.415   2.193   7.783
  481   2HO*    C  45          2HO*        C  45  -7.042   3.104   8.779
  482    H1*    C  45           H1*        C  45  -5.258   4.903   7.248
  483   1H4     C  45          1H4         C  45  -3.619   1.908   1.883
  484   2H4     C  45          2H4         C  45  -2.057   1.495   2.553
  485    H5     C  45           H5         C  45  -1.420   1.995   4.821
  486    H6     C  45           H6         C  45  -2.143   2.999   6.937
  487   1H5*    C  46          1H5*        C  46  -7.369   2.481  11.114
  488   2H5*    C  46          2H5*        C  46  -8.175   0.908  11.280
  489    H4*    C  46           H4*        C  46  -9.265   2.808   9.805
  490    H3*    C  46           H3*        C  46  -9.066  -0.164   9.269
  491    H2*    C  46           H2*        C  46 -10.056   0.098   7.137
  492   2HO*    C  46          2HO*        C  46 -11.154   2.002   6.547
  493    H1*    C  46           H1*        C  46  -8.773   2.375   6.361
  494   1H4     C  46          1H4         C  46  -5.426  -2.548   4.078
  495   2H4     C  46          2H4         C  46  -4.621  -2.734   5.620
  496    H5     C  46           H5         C  46  -5.185  -1.438   7.568
  497    H6     C  46           H6         C  46  -6.646   0.317   8.462
  498   1H5*    U  47          1H5*        U  47 -13.763   1.181   9.164
  499   2H5*    U  47          2H5*        U  47 -14.577  -0.388   9.328
  500    H4*    U  47           H4*        U  47 -15.061   1.137   7.234
  501    H3*    U  47           H3*        U  47 -14.678  -1.856   7.384
  502    H2*    U  47           H2*        U  47 -14.772  -2.064   5.035
  503   2HO*    U  47          2HO*        U  47 -16.650  -0.499   5.020
  504    H1*    U  47           H1*        U  47 -13.371   0.185   4.338
  505    H3     U  47           H3         U  47 -10.969  -3.566   3.263
  506    H5     U  47           H5         U  47 -10.117  -2.813   7.324
  507    H6     U  47           H6         U  47 -11.860  -1.124   7.310
  508   1H5*    A  48          1H5*        A  48 -19.148  -1.288   5.667
  509   2H5*    A  48          2H5*        A  48 -19.817  -2.924   5.828
  510    H4*    A  48           H4*        A  48 -19.465  -1.866   3.437
  511    H3*    A  48           H3*        A  48 -18.950  -4.666   4.411
  512    H2*    A  48           H2*        A  48 -17.950  -5.328   2.387
  513   2HO*    A  48          2HO*        A  48 -18.711  -2.822   1.240
  514    H1*    A  48           H1*        A  48 -16.378  -3.174   2.009
  515    H8     A  48           H8         A  48 -16.469  -3.490   5.712
  516   1H6     A  48          1H6         A  48 -12.614  -8.269   5.299
  517   2H6     A  48          2H6         A  48 -13.415  -7.163   6.391
  518    H2     A  48           H2         A  48 -14.072  -7.295   1.160
  519    H3T    A  48           H3T        A  48 -20.529  -3.909   2.201
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  10.530 -30.414   5.575
    2   2H5*    G   1          2H5*        G   1  10.349 -29.531   4.047
    3    H4*    G   1           H4*        G   1  10.621 -31.803   3.412
    4    H3*    G   1           H3*        G   1   7.815 -30.739   3.288
    5    H2*    G   1           H2*        G   1   6.850 -32.883   2.909
    6   2HO*    G   1          2HO*        G   1   9.540 -33.702   2.405
    7    H1*    G   1           H1*        G   1   8.134 -34.263   4.763
    8    H8     G   1           H8         G   1   8.238 -31.292   6.735
    9    H1     G   1           H1         G   1   2.134 -32.781   5.659
   10   1H2     G   1          1H2         G   1   1.991 -34.253   4.008
   11   2H2     G   1          2H2         G   1   3.399 -34.869   3.172
   12    H5T    G   1           H5T        G   1   8.802 -28.904   5.602
   13   1H5*    G   2          1H5*        G   2   7.696 -32.477  -0.276
   14   2H5*    G   2          2H5*        G   2   7.636 -31.381  -1.671
   15    H4*    G   2           H4*        G   2   5.703 -32.768  -1.852
   16    H3*    G   2           H3*        G   2   5.142 -29.994  -0.758
   17    H2*    G   2           H2*        G   2   2.839 -30.534  -0.563
   18   2HO*    G   2          2HO*        G   2   2.277 -31.529  -2.405
   19    H1*    G   2           H1*        G   2   3.112 -33.076   0.373
   20    H8     G   2           H8         G   2   5.722 -31.235   2.227
   21    H1     G   2           H1         G   2  -0.111 -29.666   4.261
   22   1H2     G   2          1H2         G   2  -1.637 -30.399   2.828
   23   2H2     G   2          2H2         G   2  -1.216 -31.275   1.373
   24   1H5*    C   3          1H5*        C   3   2.367 -29.689  -3.711
   25   2H5*    C   3          2H5*        C   3   2.681 -28.242  -4.691
   26    H4*    C   3           H4*        C   3   0.505 -27.998  -3.650
   27    H3*    C   3           H3*        C   3   2.734 -26.295  -2.483
   28    H2*    C   3           H2*        C   3   1.232 -25.395  -0.928
   29   2HO*    C   3          2HO*        C   3  -0.717 -26.065  -2.887
   30    H1*    C   3           H1*        C   3  -0.533 -27.624  -0.774
   31   1H4     C   3          1H4         C   3   2.295 -26.869   4.892
   32   2H4     C   3          2H4         C   3   3.709 -27.714   4.302
   33    H5     C   3           H5         C   3   3.966 -28.419   2.012
   34    H6     C   3           H6         C   3   2.927 -28.465  -0.202
   35   1H5*    C   4          1H5*        C   4  -0.775 -23.633  -4.818
   36   2H5*    C   4          2H5*        C   4  -0.206 -21.960  -4.645
   37    H4*    C   4           H4*        C   4  -2.596 -22.651  -3.754
   38    H3*    C   4           H3*        C   4  -0.526 -20.835  -2.491
   39    H2*    C   4           H2*        C   4  -1.883 -20.562  -0.570
   40   2HO*    C   4          2HO*        C   4  -3.868 -20.306  -1.801
   41    H1*    C   4           H1*        C   4  -2.667 -23.121  -0.253
   42   1H4     C   4          1H4         C   4   2.633 -22.244   3.203
   43   2H4     C   4          2H4         C   4   3.599 -22.761   1.839
   44    H5     C   4           H5         C   4   2.670 -23.223  -0.337
   45    H6     C   4           H6         C   4   0.616 -23.290  -1.674
   46   1H5*    U   5          1H5*        U   5  -4.427 -18.312  -2.220
   47   2H5*    U   5          2H5*        U   5  -3.767 -16.673  -2.393
   48    H4*    U   5           H4*        U   5  -5.044 -17.355  -0.186
   49    H3*    U   5           H3*        U   5  -2.478 -15.757  -0.454
   50    H2*    U   5           H2*        U   5  -2.265 -15.656   1.873
   51   2HO*    U   5          2HO*        U   5  -4.683 -14.977   1.843
   52    H1*    U   5           H1*        U   5  -3.654 -18.063   2.505
   53    H3     U   5           H3         U   5   0.442 -17.877   4.626
   54    H5     U   5           H5         U   5   1.165 -19.365   0.748
   55    H6     U   5           H6         U   5  -1.112 -18.783   0.173
   56   1H5*    U   6          1H5*        U   6  -7.534 -14.695  -1.494
   57   2H5*    U   6          2H5*        U   6  -6.628 -14.496  -3.009
   58    H4*    U   6           H4*        U   6  -8.283 -13.059  -3.597
   59    H3*    U   6           H3*        U   6  -6.623 -11.477  -1.621
   60    H2*    U   6           H2*        U   6  -8.283  -9.880  -1.379
   61   2HO*    U   6          2HO*        U   6  -8.572 -10.390  -4.109
   62    H1*    U   6           H1*        U   6 -10.502 -11.443  -2.366
   63    H3     U   6           H3         U   6 -12.030  -9.058   1.201
   64    H5     U   6           H5         U   6  -9.440 -11.931   2.872
   65    H6     U   6           H6         U   6  -8.800 -12.567   0.623
   66   1H5*    A   7          1H5*        A   7  -6.851  -9.308  -6.189
   67   2H5*    A   7          2H5*        A   7  -5.865  -7.849  -5.965
   68    H4*    A   7           H4*        A   7  -8.302  -7.616  -6.898
   69    H3*    A   7           H3*        A   7  -6.875  -5.937  -4.841
   70    H2*    A   7           H2*        A   7  -8.823  -4.724  -4.297
   71   2HO*    A   7          2HO*        A   7 -10.418  -5.831  -6.324
   72    H1*    A   7           H1*        A   7 -10.661  -6.736  -4.377
   73    H8     A   7           H8         A   7  -7.720  -8.322  -2.782
   74   1H6     A   7          1H6         A   7  -9.032  -5.291   2.416
   75   2H6     A   7          2H6         A   7  -8.070  -6.565   1.703
   76    H2     A   7           H2         A   7 -11.540  -3.551  -0.883
   77   1H5*    G   8          1H5*        G   8  -8.157  -2.744  -7.809
   78   2H5*    G   8          2H5*        G   8  -6.956  -1.447  -7.638
   79    H4*    G   8           H4*        G   8  -9.419  -1.022  -6.848
   80    H3*    G   8           H3*        G   8  -6.836  -0.303  -5.452
   81    H2*    G   8           H2*        G   8  -7.975   0.454  -3.546
   82   2HO*    G   8          2HO*        G   8  -9.603   1.730  -3.986
   83    H1*    G   8           H1*        G   8 -10.097  -1.325  -3.543
   84    H8     G   8           H8         G   8  -7.082  -3.412  -3.981
   85    H1     G   8           H1         G   8  -7.378  -0.990   1.911
   86   1H2     G   8          1H2         G   8  -8.925   0.599   1.997
   87   2H2     G   8          2H2         G   8  -9.879   1.059   0.605
   88   1H5*    G   9          1H5*        G   9  -9.876   3.586  -6.317
   89   2H5*    G   9          2H5*        G   9  -8.759   4.938  -6.043
   90    H4*    G   9           H4*        G   9 -11.074   4.870  -4.788
   91    H3*    G   9           H3*        G   9  -8.355   5.719  -3.819
   92    H2*    G   9           H2*        G   9  -9.054   5.872  -1.559
   93   2HO*    G   9          2HO*        G   9 -11.236   6.773  -2.481
   94    H1*    G   9           H1*        G   9 -10.495   3.618  -1.385
   95    H8     G   9           H8         G   9  -7.854   2.613  -3.768
   96    H1     G   9           H1         G   9  -5.504   3.294   2.120
   97   1H2     G   9          1H2         G   9  -6.983   4.330   3.411
   98   2H2     G   9          2H2         G   9  -8.544   4.851   2.819
   99   1H5*    A  10          1H5*        A  10 -10.493   8.740  -2.065
  100   2H5*    A  10          2H5*        A  10  -9.656  10.294  -2.247
  101    H4*    A  10           H4*        A  10  -9.767   9.455   0.128
  102    H3*    A  10           H3*        A  10  -7.128   9.972  -1.280
  103    H2*    A  10           H2*        A  10  -5.964   9.354   0.673
  104   2HO*    A  10          2HO*        A  10  -8.246  10.330   1.866
  105    H1*    A  10           H1*        A  10  -7.705   7.356   1.550
  106    H8     A  10           H8         A  10  -7.069   6.594  -1.995
  107   1H6     A  10          1H6         A  10  -1.487   4.493  -0.466
  108   2H6     A  10          2H6         A  10  -2.690   4.577  -1.733
  109    H2     A  10           H2         A  10  -3.166   6.694   3.074
  110   1H5*    A  11          1H5*        A  11  -7.334  13.488   2.002
  111   2H5*    A  11          2H5*        A  11  -6.040  14.567   1.444
  112    H4*    A  11           H4*        A  11  -5.829  13.330   3.768
  113    H3*    A  11           H3*        A  11  -3.719  13.812   1.652
  114    H2*    A  11           H2*        A  11  -2.122  12.559   2.904
  115   2HO*    A  11          2HO*        A  11  -2.281  12.268   5.040
  116    H1*    A  11           H1*        A  11  -3.704  10.485   3.571
  117    H8     A  11           H8         A  11  -4.948  11.234   0.180
  118   1H6     A  11          1H6         A  11   0.184   8.761  -2.161
  119   2H6     A  11          2H6         A  11  -1.424   9.342  -2.528
  120    H2     A  11           H2         A  11   0.788   9.301   2.259
  121   1H5*    A  12          1H5*        A  12  -1.127  14.866   4.885
  122   2H5*    A  12          2H5*        A  12  -0.179  16.191   4.181
  123    H4*    A  12           H4*        A  12   1.103  14.035   4.628
  124    H3*    A  12           H3*        A  12   0.980  15.414   1.932
  125    H2*    A  12           H2*        A  12   2.347  13.723   0.996
  126   2HO*    A  12          2HO*        A  12   2.802  12.469   3.482
  127    H1*    A  12           H1*        A  12   1.226  11.576   2.164
  128    H8     A  12           H8         A  12  -1.562  13.883   1.316
  129   1H6     A  12          1H6         A  12  -0.936  12.269  -4.593
  130   2H6     A  12          2H6         A  12  -1.940  13.120  -3.440
  131    H2     A  12           H2         A  12   2.561  10.615  -2.299
  132   1H5*    C  13          1H5*        C  13   5.244  15.338   3.722
  133   2H5*    C  13          2H5*        C  13   6.299  16.563   2.987
  134    H4*    C  13           H4*        C  13   7.125  14.161   2.820
  135    H3*    C  13           H3*        C  13   6.721  15.977   0.420
  136    H2*    C  13           H2*        C  13   7.538  14.231  -0.997
  137   2HO*    C  13          2HO*        C  13   8.731  12.579  -0.259
  138    H1*    C  13           H1*        C  13   6.060  12.252   0.037
  139   1H4     C  13          1H4         C  13   2.612  15.135  -4.513
  140   2H4     C  13          2H4         C  13   1.771  16.028  -3.268
  141    H5     C  13           H5         C  13   2.397  15.958  -0.948
  142    H6     C  13           H6         C  13   3.954  15.015   0.687
  143   1H5*    A  14          1H5*        A  14  11.176  14.915  -0.099
  144   2H5*    A  14          2H5*        A  14  11.723  16.294  -1.072
  145    H4*    A  14           H4*        A  14  11.700  13.863  -2.104
  146    H3*    A  14           H3*        A  14  10.763  16.429  -3.454
  147    H2*    A  14           H2*        A  14  10.419  15.118  -5.435
  148   2HO*    A  14          2HO*        A  14  11.764  13.015  -4.040
  149    H1*    A  14           H1*        A  14   9.222  13.021  -4.199
  150    H8     A  14           H8         A  14   7.745  15.828  -2.357
  151   1H6     A  14          1H6         A  14   4.253  17.142  -7.250
  152   2H6     A  14          2H6         A  14   4.508  17.446  -5.547
  153    H2     A  14           H2         A  14   7.428  14.241  -8.546
  154   1H5*    G  15          1H5*        G  15  13.789  15.137  -5.930
  155   2H5*    G  15          2H5*        G  15  14.993  16.359  -6.384
  156    H4*    G  15           H4*        G  15  14.026  15.538  -8.424
  157    H3*    G  15           H3*        G  15  12.933  18.253  -7.581
  158    H2*    G  15           H2*        G  15  11.781  18.302  -9.702
  159   2HO*    G  15          2HO*        G  15  12.134  16.293 -11.072
  160    H1*    G  15           H1*        G  15  10.783  15.787  -9.489
  161    H8     G  15           H8         G  15  10.821  17.027  -5.977
  162    H1     G  15           H1         G  15   6.312  19.928  -9.412
  163   1H2     G  15          1H2         G  15   6.592  19.481 -11.569
  164   2H2     G  15          2H2         G  15   7.892  18.469 -12.156
  165   1H5*    U  16          1H5*        U  16  13.796  18.633 -10.913
  166   2H5*    U  16          2H5*        U  16  14.725  19.918 -11.709
  167    H4*    U  16           H4*        U  16  12.567  20.138 -12.629
  168    H3*    U  16           H3*        U  16  12.871  22.035 -10.258
  169    H2*    U  16           H2*        U  16  10.731  22.886 -10.813
  170   2HO*    U  16          2HO*        U  16   9.894  21.740 -12.976
  171    H1*    U  16           H1*        U  16   9.602  20.441 -11.520
  172    H3     U  16           H3         U  16   7.383  22.153  -7.913
  173    H5     U  16           H5         U  16  10.927  20.499  -6.352
  174    H6     U  16           H6         U  16  11.693  20.152  -8.611
  175   1H5*    U  17          1H5*        U  17  12.110  25.682 -10.988
  176   2H5*    U  17          2H5*        U  17  11.228  24.589 -12.069
  177    H4*    U  17           H4*        U  17  11.916  27.510 -12.551
  178    H3*    U  17           H3*        U  17   9.742  26.582 -11.266
  179    H2*    U  17           H2*        U  17   9.105  24.892 -12.832
  180   2HO*    U  17          2HO*        U  17   7.706  26.579 -14.403
  181    H1*    U  17           H1*        U  17   9.497  26.618 -15.239
  182    H3     U  17           H3         U  17   8.288  22.598 -17.020
  183    H5     U  17           H5         U  17  11.858  21.809 -14.927
  184    H6     U  17           H6         U  17  11.814  24.075 -14.112
  185   1H5*    C  18          1H5*        C  18   6.085  26.502 -12.337
  186   2H5*    C  18          2H5*        C  18   5.824  28.257 -12.405
  187    H4*    C  18           H4*        C  18   4.104  27.247 -11.007
  188    H3*    C  18           H3*        C  18   5.520  29.429 -10.218
  189    H2*    C  18           H2*        C  18   7.258  28.266  -9.052
  190   2HO*    C  18          2HO*        C  18   5.117  28.821  -7.260
  191    H1*    C  18           H1*        C  18   5.291  26.409  -7.729
  192   1H4     C  18          1H4         C  18  10.813  23.494  -6.562
  193   2H4     C  18          2H4         C  18  11.272  23.600  -8.246
  194    H5     C  18           H5         C  18   9.937  24.707  -9.912
  195    H6     C  18           H6         C  18   7.867  25.943 -10.333
  196   1H5*    G  19          1H5*        G  19   0.700  27.414 -10.514
  197   2H5*    G  19          2H5*        G  19   2.065  26.298 -10.308
  198    H4*    G  19           H4*        G  19   0.460  26.926 -12.741
  199    H3*    G  19           H3*        G  19   1.910  24.524 -11.561
  200    H2*    G  19           H2*        G  19   2.028  23.581 -13.720
  201   2HO*    G  19          2HO*        G  19  -0.270  25.096 -14.083
  202    H1*    G  19           H1*        G  19   2.373  25.959 -15.146
  203    H8     G  19           H8         G  19   4.610  25.228 -16.113
  204    H1     G  19           H1         G  19   6.832  23.068 -10.540
  205   1H2     G  19          1H2         G  19   5.315  23.377  -8.950
  206   2H2     G  19          2H2         G  19   3.759  24.114  -9.265
  207   1H5*    C  20          1H5*        C  20  -0.407  23.075 -13.974
  208   2H5*    C  20          2H5*        C  20  -1.076  21.452 -13.707
  209    H4*    C  20           H4*        C  20   0.689  21.537 -15.491
  210    H3*    C  20           H3*        C  20   0.900  19.801 -13.031
  211    H2*    C  20           H2*        C  20   3.084  19.083 -13.605
  212   2HO*    C  20          2HO*        C  20   2.172  19.545 -16.120
  213    H1*    C  20           H1*        C  20   4.122  21.454 -14.390
  214   1H4     C  20          1H4         C  20   5.140  20.792  -8.103
  215   2H4     C  20          2H4         C  20   3.677  21.700  -7.796
  216    H5     C  20           H5         C  20   2.160  22.383  -9.527
  217    H6     C  20           H6         C  20   1.713  22.357 -11.933
  218   1H5*    U  21          1H5*        U  21   2.527  17.712 -15.723
  219   2H5*    U  21          2H5*        U  21   1.578  16.371 -16.395
  220    H4*    U  21           H4*        U  21   3.688  15.401 -16.124
  221    H3*    U  21           H3*        U  21   1.934  14.851 -13.715
  222    H2*    U  21           H2*        U  21   3.725  13.687 -12.667
  223   2HO*    U  21          2HO*        U  21   5.770  13.576 -14.142
  224    H1*    U  21           H1*        U  21   5.718  15.436 -13.278
  225    H3     U  21           H3         U  21   4.927  16.120  -8.865
  226    H5     U  21           H5         U  21   1.725  18.061 -10.801
  227    H6     U  21           H6         U  21   2.497  17.104 -12.895
  228   1H5*    G  22          1H5*        G  22   3.697  11.240 -14.720
  229   2H5*    G  22          2H5*        G  22   2.800   9.820 -14.144
  230    H4*    G  22           H4*        G  22   5.022  10.422 -12.945
  231    H3*    G  22           H3*        G  22   2.363   9.808 -11.633
  232    H2*    G  22           H2*        G  22   3.172  10.436  -9.560
  233   2HO*    G  22          2HO*        G  22   4.876   9.400  -8.870
  234    H1*    G  22           H1*        G  22   5.486  11.910 -10.458
  235    H8     G  22           H8         G  22   2.241  13.608 -11.097
  236    H1     G  22           H1         G  22   3.912  14.017  -4.964
  237   1H2     G  22          1H2         G  22   5.624  12.671  -4.553
  238   2H2     G  22          2H2         G  22   6.354  11.675  -5.791
  239   1H5*    U  23          1H5*        U  23   5.258   6.095 -10.302
  240   2H5*    U  23          2H5*        U  23   4.062   5.000  -9.579
  241    H4*    U  23           H4*        U  23   5.994   6.012  -8.094
  242    H3*    U  23           H3*        U  23   3.056   5.692  -7.398
  243    H2*    U  23           H2*        U  23   3.447   6.670  -5.288
  244   2HO*    U  23          2HO*        U  23   5.727   6.979  -4.598
  245    H1*    U  23           H1*        U  23   5.357   8.536  -6.070
  246    H3     U  23           H3         U  23   1.549  10.480  -4.332
  247    H5     U  23           H5         U  23   0.853   9.975  -8.461
  248    H6     U  23           H6         U  23   2.873   8.637  -8.570
  249   1H5*    G  24          1H5*        G  24   4.919   0.820  -7.937
  250   2H5*    G  24          2H5*        G  24   5.005  -0.017  -6.374
  251    H4*    G  24           H4*        G  24   7.116   1.321  -7.879
  252    H3*    G  24           H3*        G  24   6.911  -0.558  -5.502
  253    H2*    G  24           H2*        G  24   9.027   0.071  -4.776
  254   2HO*    G  24          2HO*        G  24  10.352   1.285  -6.572
  255    H1*    G  24           H1*        G  24   9.116   2.668  -5.894
  256    H8     G  24           H8         G  24   6.267   2.575  -3.578
  257    H1     G  24           H1         G  24  11.786   2.413  -0.390
  258   1H2     G  24          1H2         G  24  13.456   2.000  -1.787
  259   2H2     G  24          2H2         G  24  13.210   1.764  -3.502
  260   1H5*    C  25          1H5*        C  25  10.434  -1.939  -8.398
  261   2H5*    C  25          2H5*        C  25  10.362  -3.709  -8.289
  262    H4*    C  25           H4*        C  25  12.668  -2.861  -7.956
  263    H3*    C  25           H3*        C  25  11.207  -4.280  -5.713
  264    H2*    C  25           H2*        C  25  13.042  -3.982  -4.266
  265   2HO*    C  25          2HO*        C  25  15.120  -3.593  -5.013
  266    H1*    C  25           H1*        C  25  13.837  -1.468  -5.101
  267   1H4     C  25          1H4         C  25  10.519  -0.798   0.300
  268   2H4     C  25          2H4         C  25   9.027  -0.782  -0.613
  269    H5     C  25           H5         C  25   8.929  -1.179  -2.986
  270    H6     C  25           H6         C  25  10.239  -1.673  -5.000
  271   1H5*    C  26          1H5*        C  26  15.027  -5.417  -5.662
  272   2H5*    C  26          2H5*        C  26  15.235  -7.013  -6.410
  273    H4*    C  26           H4*        C  26  16.752  -7.184  -4.671
  274    H3*    C  26           H3*        C  26  14.048  -8.167  -3.738
  275    H2*    C  26           H2*        C  26  14.842  -8.426  -1.513
  276   2HO*    C  26          2HO*        C  26  17.444  -8.062  -2.648
  277    H1*    C  26           H1*        C  26  16.195  -6.102  -1.300
  278   1H4     C  26          1H4         C  26  10.305  -4.631   0.574
  279   2H4     C  26          2H4         C  26   9.719  -4.698  -1.073
  280    H5     C  26           H5         C  26  11.100  -5.345  -2.939
  281    H6     C  26           H6         C  26  13.339  -6.067  -3.628
  282   1H5*    G  27          1H5*        G  27  16.689 -11.192  -2.098
  283   2H5*    G  27          2H5*        G  27  15.662 -12.591  -1.728
  284    H4*    G  27           H4*        G  27  16.551 -11.031   0.217
  285    H3*    G  27           H3*        G  27  13.752 -12.189  -0.095
  286    H2*    G  27           H2*        G  27  13.161 -11.169   1.951
  287   2HO*    G  27          2HO*        G  27  14.739 -11.700   3.348
  288    H1*    G  27           H1*        G  27  14.725  -8.861   1.661
  289    H8     G  27           H8         G  27  12.792  -9.104  -1.460
  290    H1     G  27           H1         G  27   8.984  -7.700   3.456
  291   1H2     G  27          1H2         G  27  10.064  -8.022   5.365
  292   2H2     G  27          2H2         G  27  11.720  -8.581   5.427
  293   1H5*    A  28          1H5*        A  28  15.323 -14.672   3.684
  294   2H5*    A  28          2H5*        A  28  14.200 -16.045   3.630
  295    H4*    A  28           H4*        A  28  14.159 -14.371   5.676
  296    H3*    A  28           H3*        A  28  11.812 -15.603   4.194
  297    H2*    A  28           H2*        A  28  10.311 -14.413   5.569
  298   2HO*    A  28          2HO*        A  28  12.225 -14.818   7.397
  299    H1*    A  28           H1*        A  28  11.772 -12.069   5.828
  300    H8     A  28           H8         A  28  11.818 -12.881   2.217
  301   1H6     A  28          1H6         A  28   5.992 -10.922   1.811
  302   2H6     A  28          2H6         A  28   7.412 -11.398   0.905
  303    H2     A  28           H2         A  28   7.041 -11.280   6.165
  304   1H5*    A  29          1H5*        A  29  11.875 -17.290   8.763
  305   2H5*    A  29          2H5*        A  29  10.591 -18.517   8.807
  306    H4*    A  29           H4*        A  29  10.429 -16.364  10.333
  307    H3*    A  29           H3*        A  29   8.284 -17.829   8.796
  308    H2*    A  29           H2*        A  29   6.665 -16.158   9.259
  309   2HO*    A  29          2HO*        A  29   7.992 -14.370  10.748
  310    H1*    A  29           H1*        A  29   8.153 -13.985   8.739
  311    H8     A  29           H8         A  29   9.574 -16.353   6.296
  312   1H6     A  29          1H6         A  29   4.423 -15.908   2.944
  313   2H6     A  29          2H6         A  29   6.075 -16.483   2.962
  314    H2     A  29           H2         A  29   3.658 -14.000   6.939
  315   1H5*    A  30          1H5*        A  30   6.650 -18.275  13.319
  316   2H5*    A  30          2H5*        A  30   5.762 -19.803  13.162
  317    H4*    A  30           H4*        A  30   4.402 -17.732  13.853
  318    H3*    A  30           H3*        A  30   3.724 -19.654  11.617
  319    H2*    A  30           H2*        A  30   1.815 -18.354  11.014
  320   2HO*    A  30          2HO*        A  30   1.301 -16.449  12.361
  321    H1*    A  30           H1*        A  30   3.006 -15.960  10.981
  322    H8     A  30           H8         A  30   5.863 -18.093  10.049
  323   1H6     A  30          1H6         A  30   3.418 -18.901   4.467
  324   2H6     A  30          2H6         A  30   4.844 -19.110   5.455
  325    H2     A  30           H2         A  30   0.290 -17.006   7.090
  326   1H5*    G  31          1H5*        G  31   0.565 -18.991  12.921
  327   2H5*    G  31          2H5*        G  31  -0.425 -20.059  13.937
  328    H4*    G  31           H4*        G  31  -1.980 -19.391  12.341
  329    H3*    G  31           H3*        G  31  -0.611 -21.908  11.319
  330    H2*    G  31           H2*        G  31  -1.953 -21.789   9.374
  331   2HO*    G  31          2HO*        G  31  -3.607 -20.115  10.976
  332    H1*    G  31           H1*        G  31  -1.981 -19.014   9.123
  333    H8     G  31           H8         G  31   1.544 -20.028   9.687
  334    H1     G  31           H1         G  31  -0.430 -21.662   3.850
  335   1H2     G  31          1H2         G  31  -2.632 -21.436   3.703
  336   2H2     G  31          2H2         G  31  -3.611 -20.883   5.043
  337   1H5*    G  32          1H5*        G  32  -5.128 -22.853  11.763
  338   2H5*    G  32          2H5*        G  32  -5.311 -24.613  11.623
  339    H4*    G  32           H4*        G  32  -6.301 -23.015   9.763
  340    H3*    G  32           H3*        G  32  -4.852 -25.657   9.428
  341    H2*    G  32           H2*        G  32  -4.964 -25.450   7.072
  342   2HO*    G  32          2HO*        G  32  -6.306 -23.600   6.217
  343    H1*    G  32           H1*        G  32  -4.475 -22.758   6.878
  344    H8     G  32           H8         G  32  -2.070 -23.959   9.429
  345    H1     G  32           H1         G  32  -0.467 -25.975   3.600
  346   1H2     G  32          1H2         G  32  -2.144 -25.627   2.187
  347   2H2     G  32          2H2         G  32  -3.653 -24.895   2.686
  348   1H5*    U  33          1H5*        U  33  -7.801 -26.982   7.070
  349   2H5*    U  33          2H5*        U  33  -8.190 -28.639   7.573
  350    H4*    U  33           H4*        U  33  -7.010 -28.511   5.358
  351    H3*    U  33           H3*        U  33  -5.902 -30.021   7.730
  352    H2*    U  33           H2*        U  33  -3.868 -30.359   6.708
  353   2HO*    U  33          2HO*        U  33  -3.722 -30.731   4.446
  354    H1*    U  33           H1*        U  33  -4.062 -28.353   4.649
  355    H3     U  33           H3         U  33   0.247 -28.503   6.169
  356    H5     U  33           H5         U  33  -1.935 -26.593   9.229
  357    H6     U  33           H6         U  33  -3.969 -27.140   8.026
  358   1H5*    C  34          1H5*        C  34  -6.264 -32.808   4.175
  359   2H5*    C  34          2H5*        C  34  -6.919 -34.367   4.718
  360    H4*    C  34           H4*        C  34  -4.957 -34.914   3.492
  361    H3*    C  34           H3*        C  34  -4.454 -34.833   6.482
  362    H2*    C  34           H2*        C  34  -2.247 -35.511   6.120
  363   2HO*    C  34          2HO*        C  34  -3.332 -36.926   4.154
  364    H1*    C  34           H1*        C  34  -1.866 -34.111   3.723
  365   1H4     C  34          1H4         C  34   1.277 -30.822   8.156
  366   2H4     C  34          2H4         C  34  -0.223 -30.306   8.894
  367    H5     C  34           H5         C  34  -2.385 -31.059   8.152
  368    H6     C  34           H6         C  34  -3.584 -32.462   6.537
  369    H3T    C  34           H3T        C  34  -5.832 -36.464   5.705
  370   1H5*    U  35          1H5*        U  35  -4.757 -13.218   3.859
  371   2H5*    U  35          2H5*        U  35  -4.534 -11.559   3.264
  372    H4*    U  35           H4*        U  35  -3.709 -11.777   5.575
  373    H3*    U  35           H3*        U  35  -1.776 -11.220   3.317
  374    H2*    U  35           H2*        U  35   0.068 -11.315   4.765
  375   2HO*    U  35          2HO*        U  35  -0.053 -10.555   6.747
  376    H1*    U  35           H1*        U  35  -0.793 -13.308   6.473
  377    H3     U  35           H3         U  35   2.879 -14.942   4.381
  378    H5     U  35           H5         U  35  -0.122 -15.045   1.423
  379    H6     U  35           H6         U  35  -1.583 -13.866   2.964
  380    H5T    U  35           H5T        U  35  -3.697 -13.786   2.163
  381   1H5*    U  36          1H5*        U  36  -1.598  -8.018   6.799
  382   2H5*    U  36          2H5*        U  36  -0.566  -6.676   6.268
  383    H4*    U  36           H4*        U  36   0.122  -8.134   8.361
  384    H3*    U  36           H3*        U  36   1.854  -7.048   6.126
  385    H2*    U  36           H2*        U  36   3.764  -8.138   7.024
  386   2HO*    U  36          2HO*        U  36   3.762  -7.922   9.169
  387    H1*    U  36           H1*        U  36   2.626 -10.532   7.552
  388    H3     U  36           H3         U  36   5.288 -10.714   3.814
  389    H5     U  36           H5         U  36   1.496  -9.488   2.440
  390    H6     U  36           H6         U  36   0.810  -9.249   4.754
  391   1H5*    C  37          1H5*        C  37   3.663  -4.887  10.055
  392   2H5*    C  37          2H5*        C  37   4.513  -3.525   9.298
  393    H4*    C  37           H4*        C  37   5.876  -5.301  10.673
  394    H3*    C  37           H3*        C  37   6.573  -4.065   7.994
  395    H2*    C  37           H2*        C  37   8.546  -5.378   7.880
  396   2HO*    C  37          2HO*        C  37   8.535  -6.774  10.162
  397    H1*    C  37           H1*        C  37   7.487  -7.731   8.745
  398   1H4     C  37          1H4         C  37   7.219  -7.434   2.349
  399   2H4     C  37          2H4         C  37   5.567  -6.868   2.472
  400    H5     C  37           H5         C  37   4.506  -6.334   4.567
  401    H6     C  37           H6         C  37   4.801  -6.220   6.998
  402   1H5*    G  38          1H5*        G  38   9.965  -2.306  11.040
  403   2H5*    G  38          2H5*        G  38  10.499  -0.881  10.127
  404    H4*    G  38           H4*        G  38  12.263  -2.695  10.727
  405    H3*    G  38           H3*        G  38  11.833  -1.325   8.071
  406    H2*    G  38           H2*        G  38  13.456  -2.685   7.007
  407   2HO*    G  38          2HO*        G  38  14.395  -2.927   9.607
  408    H1*    G  38           H1*        G  38  12.757  -5.071   8.066
  409    H8     G  38           H8         G  38   9.479  -3.402   7.713
  410    H1     G  38           H1         G  38  11.947  -4.873   2.016
  411   1H2     G  38          1H2         G  38  14.077  -5.446   2.240
  412   2H2     G  38          2H2         G  38  14.886  -5.464   3.791
  413   1H5*    G  39          1H5*        G  39  16.233  -0.043   9.140
  414   2H5*    G  39          2H5*        G  39  16.344   1.588   8.450
  415    H4*    G  39           H4*        G  39  17.987  -0.152   7.536
  416    H3*    G  39           H3*        G  39  16.178   1.625   5.902
  417    H2*    G  39           H2*        G  39  16.801   0.573   3.879
  418   2HO*    G  39          2HO*        G  39  18.998   0.456   4.028
  419    H1*    G  39           H1*        G  39  16.834  -2.012   4.715
  420    H8     G  39           H8         G  39  13.935  -0.600   6.523
  421    H1     G  39           H1         G  39  12.726  -1.133   0.285
  422   1H2     G  39          1H2         G  39  14.605  -1.538  -0.820
  423   2H2     G  39          2H2         G  39  16.155  -1.675  -0.020
  424   1H5*    C  40          1H5*        C  40  19.975   1.948   3.822
  425   2H5*    C  40          2H5*        C  40  20.292   3.672   3.539
  426    H4*    C  40           H4*        C  40  20.302   2.328   1.434
  427    H3*    C  40           H3*        C  40  18.290   4.547   1.887
  428    H2*    C  40           H2*        C  40  17.291   4.126  -0.203
  429   2HO*    C  40          2HO*        C  40  19.531   2.494  -0.899
  430    H1*    C  40           H1*        C  40  17.553   1.366  -0.248
  431   1H4     C  40          1H4         C  40  11.521   2.703   1.331
  432   2H4     C  40          2H4         C  40  12.002   2.938   2.996
  433    H5     C  40           H5         C  40  14.293   2.880   3.730
  434    H6     C  40           H6         C  40  16.624   2.588   3.031
  435   1H5*    U  41          1H5*        U  41  17.919   7.362   1.744
  436   2H5*    U  41          2H5*        U  41  16.780   6.383   0.797
  437    H4*    U  41           H4*        U  41  16.788   9.128   0.877
  438    H3*    U  41           H3*        U  41  15.695   7.052  -1.003
  439    H2*    U  41           H2*        U  41  15.333   8.596  -2.747
  440   2HO*    U  41          2HO*        U  41  14.365  10.328  -1.906
  441    H1*    U  41           H1*        U  41  17.572  10.115  -2.511
  442    H3     U  41           H3         U  41  17.730   7.420  -6.239
  443    H5     U  41           H5         U  41  19.391   5.149  -3.099
  444    H6     U  41           H6         U  41  18.647   6.865  -1.553
  445   1H5*    C  42          1H5*        C  42  11.831   9.076  -1.839
  446   2H5*    C  42          2H5*        C  42  10.879   7.927  -0.877
  447    H4*    C  42           H4*        C  42  10.278   8.064  -3.353
  448    H3*    C  42           H3*        C  42  10.970   5.533  -1.858
  449    H2*    C  42           H2*        C  42  10.899   4.237  -3.812
  450   2HO*    C  42          2HO*        C  42   9.087   4.643  -4.864
  451    H1*    C  42           H1*        C  42  11.853   6.093  -5.640
  452   1H4     C  42          1H4         C  42  16.873   2.381  -4.539
  453   2H4     C  42          2H4         C  42  16.832   2.730  -2.826
  454    H5     C  42           H5         C  42  15.163   4.136  -1.806
  455    H6     C  42           H6         C  42  13.173   5.512  -2.208
  456   1H5*    U  43          1H5*        U  43   9.295   5.413   0.966
  457   2H5*    U  43          2H5*        U  43   8.220   4.005   0.854
  458    H4*    U  43           H4*        U  43   8.031   5.663   2.902
  459    H3*    U  43           H3*        U  43   5.825   4.335   1.308
  460    H2*    U  43           H2*        U  43   4.177   5.487   2.546
  461   2HO*    U  43          2HO*        U  43   5.802   6.723   4.403
  462    H1*    U  43           H1*        U  43   5.454   7.912   2.792
  463    H3     U  43           H3         U  43   1.779   8.501   0.172
  464    H5     U  43           H5         U  43   4.648   6.773  -2.387
  465    H6     U  43           H6         U  43   6.074   6.438  -0.452
  466   1H5*    U  44          1H5*        U  44   5.343   3.468   5.922
  467   2H5*    U  44          2H5*        U  44   4.241   2.081   6.044
  468    H4*    U  44           H4*        U  44   3.570   4.372   7.143
  469    H3*    U  44           H3*        U  44   1.866   2.455   5.541
  470    H2*    U  44           H2*        U  44   0.022   3.929   5.598
  471   2HO*    U  44          2HO*        U  44   0.931   5.957   7.143
  472    H1*    U  44           H1*        U  44   1.341   6.283   5.202
  473    H3     U  44           H3         U  44  -1.103   5.201   1.485
  474    H5     U  44           H5         U  44   2.531   3.107   1.072
  475    H6     U  44           H6         U  44   3.090   3.765   3.340
  476   1H5*    C  45          1H5*        C  45  -0.497   3.269   9.481
  477   2H5*    C  45          2H5*        C  45  -1.206   1.682   9.842
  478    H4*    C  45           H4*        C  45  -2.862   3.605   9.699
  479    H3*    C  45           H3*        C  45  -3.043   1.068   8.058
  480    H2*    C  45           H2*        C  45  -4.953   1.862   6.932
  481   2HO*    C  45          2HO*        C  45  -5.348   3.136   9.313
  482    H1*    C  45           H1*        C  45  -4.265   4.533   6.743
  483   1H4     C  45          1H4         C  45  -3.051   1.816   1.110
  484   2H4     C  45          2H4         C  45  -1.508   1.248   1.704
  485    H5     C  45           H5         C  45  -0.794   1.512   3.991
  486    H6     C  45           H6         C  45  -1.409   2.378   6.201
  487   1H5*    C  46          1H5*        C  46  -7.009   1.734  10.316
  488   2H5*    C  46          2H5*        C  46  -7.881   0.188  10.328
  489    H4*    C  46           H4*        C  46  -8.893   2.259   9.052
  490    H3*    C  46           H3*        C  46  -8.791  -0.645   8.216
  491    H2*    C  46           H2*        C  46  -9.727  -0.142   6.105
  492   2HO*    C  46          2HO*        C  46 -10.453   2.210   5.831
  493    H1*    C  46           H1*        C  46  -8.384   2.179   5.585
  494   1H4     C  46          1H4         C  46  -5.196  -2.605   2.812
  495   2H4     C  46          2H4         C  46  -4.317  -2.887   4.299
  496    H5     C  46           H5         C  46  -4.789  -1.719   6.353
  497    H6     C  46           H6         C  46  -6.208  -0.032   7.425
  498   1H5*    U  47          1H5*        U  47 -13.347   0.691   8.256
  499   2H5*    U  47          2H5*        U  47 -14.265  -0.827   8.303
  500    H4*    U  47           H4*        U  47 -14.564   0.788   6.260
  501    H3*    U  47           H3*        U  47 -14.250  -2.220   6.257
  502    H2*    U  47           H2*        U  47 -14.229  -2.282   3.897
  503   2HO*    U  47          2HO*        U  47 -15.820  -1.037   3.161
  504    H1*    U  47           H1*        U  47 -12.730  -0.040   3.421
  505    H3     U  47           H3         U  47 -10.423  -3.838   2.269
  506    H5     U  47           H5         U  47  -9.721  -3.293   6.389
  507    H6     U  47           H6         U  47 -11.399  -1.540   6.376
  508   1H5*    A  48          1H5*        A  48 -18.639  -1.488   4.381
  509   2H5*    A  48          2H5*        A  48 -19.326  -3.125   4.426
  510    H4*    A  48           H4*        A  48 -18.875  -1.940   2.111
  511    H3*    A  48           H3*        A  48 -18.418  -4.793   2.946
  512    H2*    A  48           H2*        A  48 -17.361  -5.352   0.920
  513   2HO*    A  48          2HO*        A  48 -18.996  -3.809  -0.221
  514    H1*    A  48           H1*        A  48 -15.754  -3.200   0.720
  515    H8     A  48           H8         A  48 -15.976  -3.718   4.392
  516   1H6     A  48          1H6         A  48 -12.157  -8.516   3.845
  517   2H6     A  48          2H6         A  48 -12.995  -7.472   4.972
  518    H2     A  48           H2         A  48 -13.457  -7.293  -0.280
  519    H3T    A  48           H3T        A  48 -20.487  -4.416   2.397
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1   7.614 -31.841   5.658
    2   2H5*    G   1          2H5*        G   1   8.034 -30.991   4.158
    3    H4*    G   1           H4*        G   1   7.696 -33.096   3.291
    4    H3*    G   1           H3*        G   1   5.128 -31.550   3.260
    5    H2*    G   1           H2*        G   1   3.766 -33.455   2.846
    6   2HO*    G   1          2HO*        G   1   5.979 -35.188   2.573
    7    H1*    G   1           H1*        G   1   4.817 -35.146   4.580
    8    H8     G   1           H8         G   1   5.496 -32.322   6.671
    9    H1     G   1           H1         G   1  -0.784 -32.600   5.623
   10   1H2     G   1          1H2         G   1  -1.215 -33.980   3.940
   11   2H2     G   1          2H2         G   1   0.048 -34.830   3.078
   12    H5T    G   1           H5T        G   1   6.481 -29.820   5.241
   13   1H5*    G   2          1H5*        G   2   5.476 -32.636  -1.110
   14   2H5*    G   2          2H5*        G   2   5.138 -31.179  -2.065
   15    H4*    G   2           H4*        G   2   3.449 -33.000  -2.397
   16    H3*    G   2           H3*        G   2   2.725 -30.258  -1.357
   17    H2*    G   2           H2*        G   2   0.455 -30.890  -1.058
   18   2HO*    G   2          2HO*        G   2  -0.042 -31.982  -2.898
   19    H1*    G   2           H1*        G   2   0.843 -33.326   0.027
   20    H8     G   2           H8         G   2   3.607 -31.701   1.692
   21    H1     G   2           H1         G   2  -1.882 -29.084   3.615
   22   1H2     G   2          1H2         G   2  -3.523 -29.662   2.240
   23   2H2     G   2          2H2         G   2  -3.265 -30.693   0.850
   24   1H5*    C   3          1H5*        C   3   0.428 -29.589  -4.770
   25   2H5*    C   3          2H5*        C   3   0.944 -28.043  -5.474
   26    H4*    C   3           H4*        C   3  -1.305 -27.904  -4.405
   27    H3*    C   3           H3*        C   3   1.014 -26.286  -3.287
   28    H2*    C   3           H2*        C   3  -0.423 -25.371  -1.674
   29   2HO*    C   3          2HO*        C   3  -2.100 -24.575  -2.789
   30    H1*    C   3           H1*        C   3  -2.185 -27.582  -1.448
   31   1H4     C   3          1H4         C   3   1.143 -26.790   3.962
   32   2H4     C   3          2H4         C   3   2.322 -27.936   3.363
   33    H5     C   3           H5         C   3   2.268 -28.838   1.130
   34    H6     C   3           H6         C   3   1.076 -28.839  -1.009
   35   1H5*    C   4          1H5*        C   4  -2.054 -23.282  -5.481
   36   2H5*    C   4          2H5*        C   4  -1.120 -21.795  -5.741
   37    H4*    C   4           H4*        C   4  -3.331 -21.659  -4.365
   38    H3*    C   4           H3*        C   4  -0.652 -20.412  -3.720
   39    H2*    C   4           H2*        C   4  -1.465 -19.600  -1.658
   40   2HO*    C   4          2HO*        C   4  -3.870 -19.931  -1.265
   41    H1*    C   4           H1*        C   4  -2.911 -21.741  -0.879
   42   1H4     C   4          1H4         C   4   2.840 -22.315   1.790
   43   2H4     C   4          2H4         C   4   3.457 -23.064   0.333
   44    H5     C   4           H5         C   4   2.160 -23.286  -1.688
   45    H6     C   4           H6         C   4  -0.007 -22.840  -2.745
   46   1H5*    U   5          1H5*        U   5  -3.853 -16.998  -3.230
   47   2H5*    U   5          2H5*        U   5  -2.876 -15.546  -3.532
   48    H4*    U   5           H4*        U   5  -4.056 -15.897  -1.190
   49    H3*    U   5           H3*        U   5  -1.262 -14.860  -1.764
   50    H2*    U   5           H2*        U   5  -0.820 -14.715   0.535
   51   2HO*    U   5          2HO*        U   5  -3.602 -14.933   1.120
   52    H1*    U   5           H1*        U   5  -2.469 -16.847   1.395
   53    H3     U   5           H3         U   5   1.798 -17.489   2.933
   54    H5     U   5           H5         U   5   1.804 -18.837  -1.061
   55    H6     U   5           H6         U   5  -0.403 -17.870  -1.318
   56   1H5*    U   6          1H5*        U   6  -5.289 -11.179  -0.747
   57   2H5*    U   6          2H5*        U   6  -4.802 -12.850  -1.098
   58    H4*    U   6           H4*        U   6  -5.399 -12.343  -3.547
   59    H3*    U   6           H3*        U   6  -6.273  -9.797  -2.204
   60    H2*    U   6           H2*        U   6  -8.404  -9.816  -3.242
   61   2HO*    U   6          2HO*        U   6  -8.845 -11.179  -5.028
   62    H1*    U   6           H1*        U   6  -9.000 -12.412  -3.020
   63    H3     U   6           H3         U   6 -11.037  -9.341  -0.077
   64    H5     U   6           H5         U   6  -8.100 -11.496   2.044
   65    H6     U   6           H6         U   6  -7.289 -12.354  -0.072
   66   1H5*    A   7          1H5*        A   7  -6.220  -8.765  -6.327
   67   2H5*    A   7          2H5*        A   7  -5.205  -7.381  -6.783
   68    H4*    A   7           H4*        A   7  -7.473  -6.885  -7.442
   69    H3*    A   7           H3*        A   7  -6.260  -5.369  -5.160
   70    H2*    A   7           H2*        A   7  -8.278  -4.378  -4.478
   71   2HO*    A   7          2HO*        A   7  -9.961  -5.163  -6.487
   72    H1*    A   7           H1*        A   7 -10.022  -6.424  -4.882
   73    H8     A   7           H8         A   7  -7.071  -8.175  -3.522
   74   1H6     A   7          1H6         A   7  -8.466  -5.999   2.068
   75   2H6     A   7          2H6         A   7  -7.478  -7.135   1.177
   76    H2     A   7           H2         A   7 -10.973  -3.805  -0.946
   77   1H5*    G   8          1H5*        G   8  -7.727  -1.902  -7.659
   78   2H5*    G   8          2H5*        G   8  -6.601  -0.579  -7.293
   79    H4*    G   8           H4*        G   8  -9.098  -0.474  -6.433
   80    H3*    G   8           H3*        G   8  -6.547   0.283  -4.981
   81    H2*    G   8           H2*        G   8  -7.750   0.756  -3.023
   82   2HO*    G   8          2HO*        G   8 -10.308   0.613  -4.118
   83    H1*    G   8           H1*        G   8  -9.772  -1.155  -3.294
   84    H8     G   8           H8         G   8  -6.572  -2.956  -3.711
   85    H1     G   8           H1         G   8  -7.453  -1.164   2.345
   86   1H2     G   8          1H2         G   8  -9.126   0.286   2.469
   87   2H2     G   8          2H2         G   8 -10.021   0.811   1.061
   88   1H5*    G   9          1H5*        G   9  -9.816   4.047  -5.621
   89   2H5*    G   9          2H5*        G   9  -8.823   5.438  -5.143
   90    H4*    G   9           H4*        G   9 -11.194   5.080  -4.054
   91    H3*    G   9           H3*        G   9  -8.606   6.007  -2.833
   92    H2*    G   9           H2*        G   9  -9.432   5.871  -0.619
   93   2HO*    G   9          2HO*        G   9 -11.630   5.760  -0.157
   94    H1*    G   9           H1*        G   9 -10.742   3.524  -0.768
   95    H8     G   9           H8         G   9  -7.871   2.940  -3.030
   96    H1     G   9           H1         G   9  -6.006   3.170   3.063
   97   1H2     G   9          1H2         G   9  -7.650   3.959   4.329
   98   2H2     G   9          2H2         G   9  -9.201   4.427   3.670
   99   1H5*    A  10          1H5*        A  10 -10.844   8.768  -0.713
  100   2H5*    A  10          2H5*        A  10 -10.069  10.344  -0.963
  101    H4*    A  10           H4*        A  10 -10.005   9.582   1.422
  102    H3*    A  10           H3*        A  10  -7.438  10.005  -0.145
  103    H2*    A  10           H2*        A  10  -6.190   9.433   1.766
  104   2HO*    A  10          2HO*        A  10  -8.332   9.451   3.563
  105    H1*    A  10           H1*        A  10  -7.990   7.572   2.859
  106    H8     A  10           H8         A  10  -7.361   6.566  -0.645
  107   1H6     A  10          1H6         A  10  -1.889   4.334   1.085
  108   2H6     A  10          2H6         A  10  -3.068   4.400  -0.206
  109    H2     A  10           H2         A  10  -3.536   6.775   4.480
  110   1H5*    A  11          1H5*        A  11  -7.525  13.676   2.990
  111   2H5*    A  11          2H5*        A  11  -6.237  14.724   2.360
  112    H4*    A  11           H4*        A  11  -5.984  13.599   4.733
  113    H3*    A  11           H3*        A  11  -3.910  13.938   2.551
  114    H2*    A  11           H2*        A  11  -2.309  12.761   3.841
  115   2HO*    A  11          2HO*        A  11  -4.051  13.428   5.962
  116    H1*    A  11           H1*        A  11  -3.938  10.780   4.780
  117    H8     A  11           H8         A  11  -5.055  11.222   1.277
  118   1H6     A  11          1H6         A  11   0.006   8.268  -0.605
  119   2H6     A  11          2H6         A  11  -1.557   8.888  -1.087
  120    H2     A  11           H2         A  11   0.496   9.228   3.760
  121   1H5*    A  12          1H5*        A  12  -1.310  14.869   5.495
  122   2H5*    A  12          2H5*        A  12  -0.354  16.238   4.895
  123    H4*    A  12           H4*        A  12   0.986  14.140   5.112
  124    H3*    A  12           H3*        A  12   0.558  15.416   2.387
  125    H2*    A  12           H2*        A  12   1.921  13.750   1.431
  126   2HO*    A  12          2HO*        A  12   3.497  12.712   2.524
  127    H1*    A  12           H1*        A  12   1.122  11.625   2.981
  128    H8     A  12           H8         A  12  -1.869  13.505   1.826
  129   1H6     A  12          1H6         A  12  -1.126  11.001  -3.751
  130   2H6     A  12          2H6         A  12  -2.198  11.939  -2.737
  131    H2     A  12           H2         A  12   2.508  10.054  -1.282
  132   1H5*    C  13          1H5*        C  13   4.953  15.757   3.979
  133   2H5*    C  13          2H5*        C  13   5.899  16.935   3.047
  134    H4*    C  13           H4*        C  13   6.870  14.581   3.162
  135    H3*    C  13           H3*        C  13   6.273  16.023   0.554
  136    H2*    C  13           H2*        C  13   7.209  14.160  -0.624
  137   2HO*    C  13          2HO*        C  13   8.690  12.933   0.275
  138    H1*    C  13           H1*        C  13   5.893  12.247   0.727
  139   1H4     C  13          1H4         C  13   2.210  14.179  -4.141
  140   2H4     C  13          2H4         C  13   1.318  15.186  -3.024
  141    H5     C  13           H5         C  13   1.966  15.504  -0.732
  142    H6     C  13           H6         C  13   3.599  14.922   0.994
  143   1H5*    A  14          1H5*        A  14  10.730  15.327   0.191
  144   2H5*    A  14          2H5*        A  14  11.234  16.450  -1.087
  145    H4*    A  14           H4*        A  14  11.219  13.844  -1.528
  146    H3*    A  14           H3*        A  14  10.202  16.007  -3.425
  147    H2*    A  14           H2*        A  14   9.921  14.244  -5.034
  148   2HO*    A  14          2HO*        A  14  11.542  12.847  -4.924
  149    H1*    A  14           H1*        A  14   8.766  12.490  -3.306
  150    H8     A  14           H8         A  14   7.136  15.557  -2.200
  151   1H6     A  14          1H6         A  14   3.838  15.684  -7.390
  152   2H6     A  14          2H6         A  14   4.004  16.343  -5.779
  153    H2     A  14           H2         A  14   7.162  12.705  -7.928
  154   1H5*    G  15          1H5*        G  15  12.849  14.157  -5.570
  155   2H5*    G  15          2H5*        G  15  14.173  15.065  -6.324
  156    H4*    G  15           H4*        G  15  13.070  13.929  -8.106
  157    H3*    G  15           H3*        G  15  12.242  16.851  -7.899
  158    H2*    G  15           H2*        G  15  10.958  16.529  -9.908
  159   2HO*    G  15          2HO*        G  15  11.115  14.282 -10.868
  160    H1*    G  15           H1*        G  15   9.847  14.155  -9.153
  161    H8     G  15           H8         G  15   9.956  16.094  -5.991
  162    H1     G  15           H1         G  15   5.580  18.423  -9.987
  163   1H2     G  15          1H2         G  15   5.845  17.541 -12.005
  164   2H2     G  15          2H2         G  15   7.103  16.380 -12.363
  165   1H5*    U  16          1H5*        U  16  12.895  16.409 -11.282
  166   2H5*    U  16          2H5*        U  16  13.856  17.455 -12.343
  167    H4*    U  16           H4*        U  16  11.663  17.635 -13.195
  168    H3*    U  16           H3*        U  16  12.204  19.939 -11.265
  169    H2*    U  16           H2*        U  16  10.108  20.816 -11.944
  170   2HO*    U  16          2HO*        U  16   9.633  20.669 -13.997
  171    H1*    U  16           H1*        U  16   8.811  18.342 -12.128
  172    H3     U  16           H3         U  16   6.722  20.865  -8.954
  173    H5     U  16           H5         U  16  10.218  19.423  -7.099
  174    H6     U  16           H6         U  16  10.933  18.570  -9.235
  175   1H5*    U  17          1H5*        U  17  12.960  24.128 -13.190
  176   2H5*    U  17          2H5*        U  17  11.483  23.303 -12.659
  177    H4*    U  17           H4*        U  17  11.758  25.388 -14.618
  178    H3*    U  17           H3*        U  17   9.809  24.674 -12.890
  179    H2*    U  17           H2*        U  17   9.302  22.541 -13.882
  180   2HO*    U  17          2HO*        U  17   7.618  24.099 -15.541
  181    H1*    U  17           H1*        U  17   9.261  23.679 -16.662
  182    H3     U  17           H3         U  17   8.261  19.312 -17.493
  183    H5     U  17           H5         U  17  12.002  19.198 -15.553
  184    H6     U  17           H6         U  17  11.827  21.577 -15.211
  185   1H5*    C  18          1H5*        C  18   5.741  24.207 -14.381
  186   2H5*    C  18          2H5*        C  18   5.627  25.952 -14.685
  187    H4*    C  18           H4*        C  18   3.775  25.202 -13.248
  188    H3*    C  18           H3*        C  18   5.227  27.449 -12.787
  189    H2*    C  18           H2*        C  18   6.895  26.453 -11.383
  190   2HO*    C  18          2HO*        C  18   5.476  26.715  -9.127
  191    H1*    C  18           H1*        C  18   4.826  24.918  -9.824
  192   1H4     C  18          1H4         C  18  10.132  21.971  -7.974
  193   2H4     C  18          2H4         C  18  10.736  21.919  -9.615
  194    H5     C  18           H5         C  18   9.571  22.886 -11.483
  195    H6     C  18           H6         C  18   7.570  24.107 -12.191
  196   1H5*    G  19          1H5*        G  19   0.383  25.573 -12.664
  197   2H5*    G  19          2H5*        G  19   1.814  24.573 -12.341
  198    H4*    G  19           H4*        G  19   0.080  24.700 -14.790
  199    H3*    G  19           H3*        G  19   1.433  22.557 -13.105
  200    H2*    G  19           H2*        G  19   1.482  21.146 -14.986
  201   2HO*    G  19          2HO*        G  19  -0.563  22.854 -16.010
  202    H1*    G  19           H1*        G  19   1.841  23.130 -16.937
  203    H8     G  19           H8         G  19   3.999  22.105 -17.812
  204    H1     G  19           H1         G  19   6.397  21.059 -11.998
  205   1H2     G  19          1H2         G  19   4.971  21.767 -10.453
  206   2H2     G  19          2H2         G  19   3.434  22.496 -10.856
  207   1H5*    C  20          1H5*        C  20  -0.979  20.712 -15.158
  208   2H5*    C  20          2H5*        C  20  -1.708  19.224 -14.524
  209    H4*    C  20           H4*        C  20   0.020  18.824 -16.302
  210    H3*    C  20           H3*        C  20   0.222  17.685 -13.512
  211    H2*    C  20           H2*        C  20   2.351  16.740 -13.964
  212   2HO*    C  20          2HO*        C  20   1.525  17.067 -16.640
  213    H1*    C  20           H1*        C  20   3.470  18.831 -15.251
  214   1H4     C  20          1H4         C  20   4.572  19.511  -8.980
  215   2H4     C  20          2H4         C  20   3.116  20.471  -8.849
  216    H5     C  20           H5         C  20   1.581  20.796 -10.661
  217    H6     C  20           H6         C  20   1.101  20.286 -13.006
  218   1H5*    U  21          1H5*        U  21   1.632  14.871 -15.924
  219   2H5*    U  21          2H5*        U  21   0.670  13.379 -15.971
  220    H4*    U  21           H4*        U  21   2.980  12.744 -15.717
  221    H3*    U  21           H3*        U  21   1.272  12.483 -13.226
  222    H2*    U  21           H2*        U  21   3.154  11.624 -12.049
  223   2HO*    U  21          2HO*        U  21   5.174  11.322 -13.447
  224    H1*    U  21           H1*        U  21   5.022  13.360 -13.030
  225    H3     U  21           H3         U  21   4.352  14.541  -8.685
  226    H5     U  21           H5         U  21   1.129  16.273 -10.780
  227    H6     U  21           H6         U  21   1.825  15.027 -12.746
  228   1H5*    G  22          1H5*        G  22   3.259   8.887 -13.704
  229   2H5*    G  22          2H5*        G  22   2.474   7.513 -12.898
  230    H4*    G  22           H4*        G  22   4.671   8.442 -11.870
  231    H3*    G  22           H3*        G  22   2.095   7.812 -10.413
  232    H2*    G  22           H2*        G  22   2.835   8.853  -8.493
  233   2HO*    G  22          2HO*        G  22   5.121   8.731  -7.919
  234    H1*    G  22           H1*        G  22   5.090  10.271  -9.652
  235    H8     G  22           H8         G  22   1.750  11.712 -10.412
  236    H1     G  22           H1         G  22   3.575  13.107  -4.470
  237   1H2     G  22          1H2         G  22   5.369  11.924  -3.926
  238   2H2     G  22          2H2         G  22   6.117  10.792  -5.033
  239   1H5*    U  23          1H5*        U  23   5.374   4.652  -8.636
  240   2H5*    U  23          2H5*        U  23   4.339   3.566  -7.688
  241    H4*    U  23           H4*        U  23   6.192   5.024  -6.490
  242    H3*    U  23           H3*        U  23   3.349   4.459  -5.593
  243    H2*    U  23           H2*        U  23   3.642   5.841  -3.711
  244   2HO*    U  23          2HO*        U  23   5.534   5.066  -2.873
  245    H1*    U  23           H1*        U  23   5.325   7.748  -4.867
  246    H3     U  23           H3         U  23   1.384   9.558  -3.276
  247    H5     U  23           H5         U  23   0.633   8.332  -7.243
  248    H6     U  23           H6         U  23   2.773   7.192  -7.225
  249   1H5*    G  24          1H5*        G  24   5.787   0.260  -6.657
  250   2H5*    G  24          2H5*        G  24   6.741  -0.593  -5.429
  251    H4*    G  24           H4*        G  24   7.668   1.228  -7.409
  252    H3*    G  24           H3*        G  24   8.872  -0.347  -5.125
  253    H2*    G  24           H2*        G  24  10.808   0.994  -5.115
  254   2HO*    G  24          2HO*        G  24  10.529   1.038  -7.666
  255    H1*    G  24           H1*        G  24   9.687   3.412  -5.424
  256    H8     G  24           H8         G  24   7.255   1.650  -3.255
  257    H1     G  24           H1         G  24  12.643   2.962  -0.107
  258   1H2     G  24          1H2         G  24  14.216   3.606  -1.533
  259   2H2     G  24          2H2         G  24  13.936   3.710  -3.256
  260   1H5*    C  25          1H5*        C  25  12.398   0.252  -7.333
  261   2H5*    C  25          2H5*        C  25  12.398  -1.218  -8.327
  262    H4*    C  25           H4*        C  25  14.619  -1.207  -7.745
  263    H3*    C  25           H3*        C  25  13.100  -2.638  -5.560
  264    H2*    C  25           H2*        C  25  15.022  -2.755  -4.187
  265   2HO*    C  25          2HO*        C  25  16.753  -1.690  -6.137
  266    H1*    C  25           H1*        C  25  16.022  -0.262  -4.633
  267   1H4     C  25          1H4         C  25  12.348   0.116   0.565
  268   2H4     C  25          2H4         C  25  10.916   0.235  -0.434
  269    H5     C  25           H5         C  25  10.961   0.044  -2.834
  270    H6     C  25           H6         C  25  12.389  -0.305  -4.796
  271   1H5*    C  26          1H5*        C  26  16.930  -4.281  -6.033
  272   2H5*    C  26          2H5*        C  26  16.816  -5.979  -6.537
  273    H4*    C  26           H4*        C  26  18.510  -5.873  -4.840
  274    H3*    C  26           H3*        C  26  15.846  -7.014  -3.945
  275    H2*    C  26           H2*        C  26  16.708  -7.328  -1.751
  276   2HO*    C  26          2HO*        C  26  18.791  -8.125  -2.533
  277    H1*    C  26           H1*        C  26  17.979  -4.946  -1.503
  278   1H4     C  26          1H4         C  26  12.149  -3.892   0.799
  279   2H4     C  26          2H4         C  26  11.477  -3.861  -0.815
  280    H5     C  26           H5         C  26  12.776  -4.313  -2.794
  281    H6     C  26           H6         C  26  14.998  -4.890  -3.652
  282   1H5*    G  27          1H5*        G  27  18.537 -10.221  -2.508
  283   2H5*    G  27          2H5*        G  27  17.453 -11.619  -2.369
  284    H4*    G  27           H4*        G  27  18.353 -10.407  -0.197
  285    H3*    G  27           H3*        G  27  15.528 -11.397  -0.737
  286    H2*    G  27           H2*        G  27  14.897 -10.657   1.409
  287   2HO*    G  27          2HO*        G  27  16.501 -10.190   3.023
  288    H1*    G  27           H1*        G  27  16.588  -8.416   1.533
  289    H8     G  27           H8         G  27  14.707  -8.122  -1.629
  290    H1     G  27           H1         G  27  10.906  -7.125   3.392
  291   1H2     G  27          1H2         G  27  11.933  -7.748   5.256
  292   2H2     G  27          2H2         G  27  13.554  -8.407   5.261
  293   1H5*    A  28          1H5*        A  28  16.754 -14.177   2.851
  294   2H5*    A  28          2H5*        A  28  15.621 -15.524   2.621
  295    H4*    A  28           H4*        A  28  15.443 -13.980   4.763
  296    H3*    A  28           H3*        A  28  13.190 -15.055   3.029
  297    H2*    A  28           H2*        A  28  11.621 -13.941   4.389
  298   2HO*    A  28          2HO*        A  28  13.326 -14.600   6.309
  299    H1*    A  28           H1*        A  28  13.153 -11.679   4.973
  300    H8     A  28           H8         A  28  13.284 -12.134   1.299
  301   1H6     A  28          1H6         A  28   7.552  -9.913   0.928
  302   2H6     A  28          2H6         A  28   8.977 -10.359   0.019
  303    H2     A  28           H2         A  28   8.460 -10.713   5.255
  304   1H5*    A  29          1H5*        A  29  13.030 -17.205   7.485
  305   2H5*    A  29          2H5*        A  29  11.784 -18.450   7.274
  306    H4*    A  29           H4*        A  29  11.513 -16.606   9.142
  307    H3*    A  29           H3*        A  29   9.468 -17.841   7.307
  308    H2*    A  29           H2*        A  29   7.783 -16.306   7.932
  309   2HO*    A  29          2HO*        A  29   9.124 -14.874   9.852
  310    H1*    A  29           H1*        A  29   9.231 -14.029   7.946
  311    H8     A  29           H8         A  29  10.773 -15.898   5.152
  312   1H6     A  29          1H6         A  29   5.798 -14.728   1.720
  313   2H6     A  29          2H6         A  29   7.440 -15.330   1.707
  314    H2     A  29           H2         A  29   4.861 -13.589   5.966
  315   1H5*    A  30          1H5*        A  30   7.679 -18.699  11.697
  316   2H5*    A  30          2H5*        A  30   6.503 -19.980  11.340
  317    H4*    A  30           H4*        A  30   5.683 -17.638  12.240
  318    H3*    A  30           H3*        A  30   4.480 -19.395  10.089
  319    H2*    A  30           H2*        A  30   2.806 -17.754   9.641
  320   2HO*    A  30          2HO*        A  30   2.431 -16.018  11.012
  321    H1*    A  30           H1*        A  30   4.416 -15.608   9.551
  322    H8     A  30           H8         A  30   6.691 -18.188   8.231
  323   1H6     A  30          1H6         A  30   3.525 -18.229   2.953
  324   2H6     A  30          2H6         A  30   4.988 -18.756   3.753
  325    H2     A  30           H2         A  30   1.140 -15.921   5.984
  326   1H5*    G  31          1H5*        G  31   1.707 -18.269  11.785
  327   2H5*    G  31          2H5*        G  31   0.491 -19.107  12.771
  328    H4*    G  31           H4*        G  31  -0.820 -18.039  11.151
  329    H3*    G  31           H3*        G  31  -0.167 -20.870  10.259
  330    H2*    G  31           H2*        G  31  -1.364 -20.499   8.258
  331   2HO*    G  31          2HO*        G  31  -2.858 -18.939   9.882
  332    H1*    G  31           H1*        G  31  -0.689 -17.819   7.891
  333    H8     G  31           H8         G  31   2.465 -19.616   8.611
  334    H1     G  31           H1         G  31   0.286 -21.024   2.788
  335   1H2     G  31          1H2         G  31  -1.798 -20.302   2.564
  336   2H2     G  31          2H2         G  31  -2.649 -19.473   3.848
  337   1H5*    G  32          1H5*        G  32  -4.833 -20.586  10.901
  338   2H5*    G  32          2H5*        G  32  -5.445 -22.253  10.899
  339    H4*    G  32           H4*        G  32  -6.173 -20.567   9.000
  340    H3*    G  32           H3*        G  32  -5.449 -23.496   8.799
  341    H2*    G  32           H2*        G  32  -5.617 -23.444   6.444
  342   2HO*    G  32          2HO*        G  32  -7.541 -21.679   6.973
  343    H1*    G  32           H1*        G  32  -4.543 -20.957   5.987
  344    H8     G  32           H8         G  32  -2.296 -22.459   8.515
  345    H1     G  32           H1         G  32  -1.589 -25.269   2.834
  346   1H2     G  32          1H2         G  32  -3.240 -24.673   1.482
  347   2H2     G  32          2H2         G  32  -4.516 -23.583   1.978
  348   1H5*    U  33          1H5*        U  33  -8.496 -24.142   6.359
  349   2H5*    U  33          2H5*        U  33  -9.395 -25.525   7.013
  350    H4*    U  33           H4*        U  33  -8.282 -26.063   4.854
  351    H3*    U  33           H3*        U  33  -7.569 -27.493   7.416
  352    H2*    U  33           H2*        U  33  -5.723 -28.498   6.486
  353   2HO*    U  33          2HO*        U  33  -7.455 -29.329   4.830
  354    H1*    U  33           H1*        U  33  -5.468 -26.847   4.124
  355    H3     U  33           H3         U  33  -1.273 -27.941   5.527
  356    H5     U  33           H5         U  33  -2.680 -25.180   8.384
  357    H6     U  33           H6         U  33  -4.857 -25.292   7.319
  358   1H5*    C  34          1H5*        C  34  -9.045 -30.622   4.276
  359   2H5*    C  34          2H5*        C  34  -9.860 -31.910   5.185
  360    H4*    C  34           H4*        C  34  -8.142 -32.899   3.769
  361    H3*    C  34           H3*        C  34  -7.521 -32.792   6.737
  362    H2*    C  34           H2*        C  34  -5.533 -33.953   6.353
  363   2HO*    C  34          2HO*        C  34  -5.177 -35.179   4.485
  364    H1*    C  34           H1*        C  34  -4.985 -32.838   3.827
  365   1H4     C  34          1H4         C  34  -0.840 -30.242   7.883
  366   2H4     C  34          2H4         C  34  -2.105 -29.286   8.620
  367    H5     C  34           H5         C  34  -4.427 -29.474   8.007
  368    H6     C  34           H6         C  34  -6.037 -30.615   6.554
  369    H3T    C  34           H3T        C  34  -8.546 -34.678   6.699
  370   1H5*    U  35          1H5*        U  35  -3.289 -12.024   2.306
  371   2H5*    U  35          2H5*        U  35  -2.402 -10.721   1.488
  372    H4*    U  35           H4*        U  35  -2.274 -10.929   4.103
  373    H3*    U  35           H3*        U  35  -0.085 -10.329   2.117
  374    H2*    U  35           H2*        U  35   1.594 -10.435   3.767
  375   2HO*    U  35          2HO*        U  35  -0.474  -9.637   5.376
  376    H1*    U  35           H1*        U  35   0.685 -12.563   5.206
  377    H3     U  35           H3         U  35   4.334 -14.115   3.027
  378    H5     U  35           H5         U  35   1.431 -13.747  -0.005
  379    H6     U  35           H6         U  35  -0.045 -12.723   1.628
  380    H5T    U  35           H5T        U  35  -2.244 -13.125   0.820
  381   1H5*    U  36          1H5*        U  36  -0.241  -7.148   5.581
  382   2H5*    U  36          2H5*        U  36   0.850  -5.808   5.172
  383    H4*    U  36           H4*        U  36   1.350  -7.343   7.265
  384    H3*    U  36           H3*        U  36   3.257  -6.196   5.215
  385    H2*    U  36           H2*        U  36   5.086  -7.376   6.169
  386   2HO*    U  36          2HO*        U  36   3.305  -7.931   8.341
  387    H1*    U  36           H1*        U  36   3.890  -9.770   6.474
  388    H3     U  36           H3         U  36   6.698  -9.770   2.839
  389    H5     U  36           H5         U  36   3.007  -8.334   1.400
  390    H6     U  36           H6         U  36   2.220  -8.249   3.694
  391   1H5*    C  37          1H5*        C  37   4.980  -4.564   9.402
  392   2H5*    C  37          2H5*        C  37   5.924  -3.173   8.834
  393    H4*    C  37           H4*        C  37   7.127  -5.164  10.070
  394    H3*    C  37           H3*        C  37   8.028  -3.643   7.609
  395    H2*    C  37           H2*        C  37   9.950  -5.020   7.432
  396   2HO*    C  37          2HO*        C  37  10.204  -6.660   9.273
  397    H1*    C  37           H1*        C  37   8.758  -7.414   7.956
  398   1H4     C  37          1H4         C  37   8.835  -6.457   1.630
  399   2H4     C  37          2H4         C  37   7.221  -5.791   1.732
  400    H5     C  37           H5         C  37   6.087  -5.395   3.819
  401    H6     C  37           H6         C  37   6.259  -5.539   6.262
  402   1H5*    G  38          1H5*        G  38  11.187  -2.275  11.109
  403   2H5*    G  38          2H5*        G  38  11.688  -0.697  10.470
  404    H4*    G  38           H4*        G  38  13.558  -2.387  10.919
  405    H3*    G  38           H3*        G  38  13.114  -0.899   8.324
  406    H2*    G  38           H2*        G  38  14.911  -2.046   7.285
  407   2HO*    G  38          2HO*        G  38  16.534  -2.969   8.403
  408    H1*    G  38           H1*        G  38  14.374  -4.539   8.183
  409    H8     G  38           H8         G  38  10.995  -3.100   7.689
  410    H1     G  38           H1         G  38  13.898  -4.148   2.110
  411   1H2     G  38          1H2         G  38  16.044  -4.589   2.442
  412   2H2     G  38          2H2         G  38  16.761  -4.622   4.037
  413   1H5*    G  39          1H5*        G  39  17.315   0.547   9.733
  414   2H5*    G  39          2H5*        G  39  17.430   2.234   9.193
  415    H4*    G  39           H4*        G  39  19.209   0.663   8.274
  416    H3*    G  39           H3*        G  39  17.407   2.414   6.600
  417    H2*    G  39           H2*        G  39  18.271   1.528   4.585
  418   2HO*    G  39          2HO*        G  39  20.472   1.596   5.063
  419    H1*    G  39           H1*        G  39  18.406  -1.097   5.291
  420    H8     G  39           H8         G  39  15.280   0.071   6.897
  421    H1     G  39           H1         G  39  14.637  -0.229   0.562
  422   1H2     G  39          1H2         G  39  16.620  -0.500  -0.391
  423   2H2     G  39          2H2         G  39  18.101  -0.608   0.535
  424   1H5*    C  40          1H5*        C  40  20.001   3.028   4.088
  425   2H5*    C  40          2H5*        C  40  20.863   4.530   4.481
  426    H4*    C  40           H4*        C  40  20.367   4.980   2.279
  427    H3*    C  40           H3*        C  40  17.966   5.829   3.929
  428    H2*    C  40           H2*        C  40  16.777   6.359   1.969
  429   2HO*    C  40          2HO*        C  40  18.614   6.079   0.016
  430    H1*    C  40           H1*        C  40  17.788   4.348   0.321
  431   1H4     C  40          1H4         C  40  11.967   2.400   1.936
  432   2H4     C  40          2H4         C  40  12.405   2.320   3.627
  433    H5     C  40           H5         C  40  14.574   2.958   4.460
  434    H6     C  40           H6         C  40  16.790   3.810   3.852
  435   1H5*    U  41          1H5*        U  41  15.731   7.385   3.710
  436   2H5*    U  41          2H5*        U  41  16.204   8.528   2.437
  437    H4*    U  41           H4*        U  41  15.142   9.202   5.207
  438    H3*    U  41           H3*        U  41  13.971   9.094   2.453
  439    H2*    U  41           H2*        U  41  13.077  11.267   2.515
  440   2HO*    U  41          2HO*        U  41  12.902  10.691   5.185
  441    H1*    U  41           H1*        U  41  15.038  12.597   3.833
  442    H3     U  41           H3         U  41  14.596  13.354  -0.779
  443    H5     U  41           H5         U  41  17.864  10.762  -0.175
  444    H6     U  41           H6         U  41  17.146  10.499   2.128
  445   1H5*    C  42          1H5*        C  42  10.071   7.108   3.366
  446   2H5*    C  42          2H5*        C  42  10.719   5.555   2.803
  447    H4*    C  42           H4*        C  42   9.063   7.055   1.305
  448    H3*    C  42           H3*        C  42  11.318   5.180   0.601
  449    H2*    C  42           H2*        C  42  11.371   5.844  -1.633
  450   2HO*    C  42          2HO*        C  42   9.559   6.809  -2.653
  451    H1*    C  42           H1*        C  42  10.573   8.503  -1.369
  452   1H4     C  42          1H4         C  42  16.815   8.967  -2.375
  453   2H4     C  42          2H4         C  42  17.170   7.830  -1.094
  454    H5     C  42           H5         C  42  15.466   6.751   0.223
  455    H6     C  42           H6         C  42  13.053   6.531   0.598
  456   1H5*    U  43          1H5*        U  43   8.606   5.065   2.401
  457   2H5*    U  43          2H5*        U  43   7.569   3.626   2.473
  458    H4*    U  43           H4*        U  43   7.515   5.249   4.490
  459    H3*    U  43           H3*        U  43   5.169   4.047   3.027
  460    H2*    U  43           H2*        U  43   3.605   5.338   4.230
  461   2HO*    U  43          2HO*        U  43   5.654   6.220   6.006
  462    H1*    U  43           H1*        U  43   4.937   7.710   4.310
  463    H3     U  43           H3         U  43   1.439   8.174   1.432
  464    H5     U  43           H5         U  43   4.404   6.186  -0.808
  465    H6     U  43           H6         U  43   5.709   5.978   1.227
  466   1H5*    U  44          1H5*        U  44   4.613   2.879   7.572
  467   2H5*    U  44          2H5*        U  44   3.388   1.594   7.561
  468    H4*    U  44           H4*        U  44   2.855   3.928   8.676
  469    H3*    U  44           H3*        U  44   1.093   2.170   6.955
  470    H2*    U  44           H2*        U  44  -0.635   3.787   6.969
  471   2HO*    U  44          2HO*        U  44  -0.674   5.496   8.447
  472    H1*    U  44           H1*        U  44   0.887   6.017   6.629
  473    H3     U  44           H3         U  44  -1.500   5.008   2.831
  474    H5     U  44           H5         U  44   2.081   2.806   2.544
  475    H6     U  44           H6         U  44   2.582   3.448   4.830
  476   1H5*    C  45          1H5*        C  45  -1.514   3.151  10.516
  477   2H5*    C  45          2H5*        C  45  -2.050   1.558  11.087
  478    H4*    C  45           H4*        C  45  -3.983   3.034  10.805
  479    H3*    C  45           H3*        C  45  -3.654   0.698   8.903
  480    H2*    C  45           H2*        C  45  -5.625   1.310   7.756
  481   2HO*    C  45          2HO*        C  45  -7.168   2.693   8.661
  482    H1*    C  45           H1*        C  45  -5.315   4.048   7.840
  483   1H4     C  45          1H4         C  45  -3.338   2.095   2.108
  484   2H4     C  45          2H4         C  45  -1.798   1.612   2.783
  485    H5     C  45           H5         C  45  -1.302   1.702   5.138
  486    H6     C  45           H6         C  45  -2.175   2.273   7.356
  487   1H5*    C  46          1H5*        C  46  -7.686   0.554  10.950
  488   2H5*    C  46          2H5*        C  46  -8.448  -1.034  10.722
  489    H4*    C  46           H4*        C  46  -9.494   1.115   9.598
  490    H3*    C  46           H3*        C  46  -9.163  -1.675   8.473
  491    H2*    C  46           H2*        C  46  -9.998  -0.990   6.369
  492   2HO*    C  46          2HO*        C  46 -10.870   1.291   6.252
  493    H1*    C  46           H1*        C  46  -8.749   1.431   6.190
  494   1H4     C  46          1H4         C  46  -5.113  -2.854   3.170
  495   2H4     C  46          2H4         C  46  -4.347  -3.282   4.683
  496    H5     C  46           H5         C  46  -5.041  -2.391   6.813
  497    H6     C  46           H6         C  46  -6.620  -0.900   7.949
  498   1H5*    U  47          1H5*        U  47 -13.869  -0.551   8.180
  499   2H5*    U  47          2H5*        U  47 -14.594  -2.164   8.019
  500    H4*    U  47           H4*        U  47 -14.965  -0.375   6.128
  501    H3*    U  47           H3*        U  47 -14.328  -3.323   5.850
  502    H2*    U  47           H2*        U  47 -14.231  -3.126   3.492
  503   2HO*    U  47          2HO*        U  47 -16.191  -1.674   3.559
  504    H1*    U  47           H1*        U  47 -12.895  -0.749   3.340
  505    H3     U  47           H3         U  47 -10.202  -4.221   2.015
  506    H5     U  47           H5         U  47  -9.834  -4.054   6.210
  507    H6     U  47           H6         U  47 -11.639  -2.433   6.239
  508   1H5*    A  48          1H5*        A  48 -18.775  -3.154   3.979
  509   2H5*    A  48          2H5*        A  48 -19.191  -4.879   4.043
  510    H4*    A  48           H4*        A  48 -18.938  -3.681   1.714
  511    H3*    A  48           H3*        A  48 -17.975  -6.393   2.596
  512    H2*    A  48           H2*        A  48 -16.845  -6.787   0.574
  513   2HO*    A  48          2HO*        A  48 -18.710  -5.686  -0.628
  514    H1*    A  48           H1*        A  48 -15.671  -4.372   0.311
  515    H8     A  48           H8         A  48 -15.691  -4.835   3.986
  516   1H6     A  48          1H6         A  48 -11.036  -8.820   3.416
  517   2H6     A  48          2H6         A  48 -12.017  -7.911   4.542
  518    H2     A  48           H2         A  48 -12.702  -8.028  -0.687
  519    H3T    A  48           H3T        A  48 -19.701  -5.624   0.462
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1   8.994 -31.074   5.147
    2   2H5*    G   1          2H5*        G   1   9.437 -30.023   3.786
    3    H4*    G   1           H4*        G   1   9.381 -32.045   2.682
    4    H3*    G   1           H3*        G   1   6.676 -30.749   2.587
    5    H2*    G   1           H2*        G   1   5.578 -32.715   1.810
    6   2HO*    G   1          2HO*        G   1   6.908 -33.524   0.264
    7    H1*    G   1           H1*        G   1   6.637 -34.483   3.463
    8    H8     G   1           H8         G   1   6.814 -31.890   5.913
    9    H1     G   1           H1         G   1   0.720 -32.629   4.197
   10   1H2     G   1          1H2         G   1   0.598 -33.810   2.322
   11   2H2     G   1          2H2         G   1   2.019 -34.413   1.498
   12    H5T    G   1           H5T        G   1   7.459 -29.229   3.718
   13   1H5*    G   2          1H5*        G   2   7.087 -31.664  -1.449
   14   2H5*    G   2          2H5*        G   2   6.896 -30.292  -2.559
   15    H4*    G   2           H4*        G   2   5.129 -31.927  -2.963
   16    H3*    G   2           H3*        G   2   4.348 -29.277  -1.710
   17    H2*    G   2           H2*        G   2   2.073 -29.971  -1.656
   18   2HO*    G   2          2HO*        G   2   1.332 -31.189  -3.215
   19    H1*    G   2           H1*        G   2   2.467 -32.508  -0.803
   20    H8     G   2           H8         G   2   4.967 -30.782   1.226
   21    H1     G   2           H1         G   2  -0.918 -29.045   2.965
   22   1H2     G   2          1H2         G   2  -2.382 -29.686   1.423
   23   2H2     G   2          2H2         G   2  -1.904 -30.538  -0.029
   24   1H5*    C   3          1H5*        C   3   1.968 -28.272  -5.297
   25   2H5*    C   3          2H5*        C   3   2.418 -26.565  -5.489
   26    H4*    C   3           H4*        C   3  -0.002 -27.073  -4.747
   27    H3*    C   3           H3*        C   3   1.897 -25.151  -3.367
   28    H2*    C   3           H2*        C   3   0.288 -24.697  -1.731
   29   2HO*    C   3          2HO*        C   3  -1.480 -25.299  -3.835
   30    H1*    C   3           H1*        C   3  -1.089 -27.180  -1.823
   31   1H4     C   3          1H4         C   3   1.789 -26.421   3.843
   32   2H4     C   3          2H4         C   3   3.176 -27.282   3.211
   33    H5     C   3           H5         C   3   3.385 -27.935   0.903
   34    H6     C   3           H6         C   3   2.314 -27.904  -1.296
   35   1H5*    C   4          1H5*        C   4  -1.395 -22.316  -5.714
   36   2H5*    C   4          2H5*        C   4  -0.637 -20.717  -5.573
   37    H4*    C   4           H4*        C   4  -3.002 -21.082  -4.530
   38    H3*    C   4           H3*        C   4  -0.611 -19.685  -3.319
   39    H2*    C   4           H2*        C   4  -1.732 -19.385  -1.262
   40   2HO*    C   4          2HO*        C   4  -4.168 -20.377  -1.629
   41    H1*    C   4           H1*        C   4  -2.896 -21.800  -1.039
   42   1H4     C   4          1H4         C   4   2.751 -22.004   1.929
   43   2H4     C   4          2H4         C   4   3.497 -22.582   0.455
   44    H5     C   4           H5         C   4   2.319 -22.752  -1.642
   45    H6     C   4           H6         C   4   0.172 -22.401  -2.776
   46   1H5*    U   5          1H5*        U   5  -4.120 -16.823  -2.366
   47   2H5*    U   5          2H5*        U   5  -3.312 -15.247  -2.486
   48    H4*    U   5           H4*        U   5  -4.396 -15.963  -0.207
   49    H3*    U   5           H3*        U   5  -1.659 -14.719  -0.631
   50    H2*    U   5           H2*        U   5  -1.226 -14.852   1.668
   51   2HO*    U   5          2HO*        U   5  -3.709 -15.464   2.646
   52    H1*    U   5           H1*        U   5  -2.821 -17.132   2.237
   53    H3     U   5           H3         U   5   1.441 -17.745   3.832
   54    H5     U   5           H5         U   5   1.591 -18.692  -0.273
   55    H6     U   5           H6         U   5  -0.646 -17.794  -0.491
   56   1H5*    U   6          1H5*        U   6  -5.835 -11.779  -0.311
   57   2H5*    U   6          2H5*        U   6  -5.464 -13.365  -1.016
   58    H4*    U   6           H4*        U   6  -6.059 -12.439  -3.274
   59    H3*    U   6           H3*        U   6  -6.440  -9.949  -1.630
   60    H2*    U   6           H2*        U   6  -8.537  -9.455  -2.606
   61   2HO*    U   6          2HO*        U   6  -8.673  -9.736  -4.694
   62    H1*    U   6           H1*        U   6  -9.591 -11.908  -2.769
   63    H3     U   6           H3         U   6 -11.306  -9.013   0.486
   64    H5     U   6           H5         U   6  -8.601 -11.622   2.396
   65    H6     U   6           H6         U   6  -7.886 -12.378   0.201
   66   1H5*    A   7          1H5*        A   7  -6.066  -8.447  -5.969
   67   2H5*    A   7          2H5*        A   7  -5.243  -6.875  -5.911
   68    H4*    A   7           H4*        A   7  -7.609  -6.874  -6.881
   69    H3*    A   7           H3*        A   7  -6.514  -5.062  -4.761
   70    H2*    A   7           H2*        A   7  -8.602  -4.183  -4.145
   71   2HO*    A   7          2HO*        A   7  -9.825  -3.649  -5.789
   72    H1*    A   7           H1*        A   7 -10.171  -6.390  -4.336
   73    H8     A   7           H8         A   7  -7.179  -7.877  -2.845
   74   1H6     A   7          1H6         A   7  -8.549  -5.153   2.509
   75   2H6     A   7          2H6         A   7  -7.557  -6.364   1.729
   76    H2     A   7           H2         A   7 -11.107  -3.303  -0.691
   77   1H5*    G   8          1H5*        G   8  -8.312  -2.065  -7.468
   78   2H5*    G   8          2H5*        G   8  -7.303  -0.605  -7.389
   79    H4*    G   8           H4*        G   8  -9.684  -0.499  -6.357
   80    H3*    G   8           H3*        G   8  -7.100   0.416  -5.068
   81    H2*    G   8           H2*        G   8  -8.216   0.959  -3.081
   82   2HO*    G   8          2HO*        G   8 -10.522   1.088  -4.745
   83    H1*    G   8           H1*        G   8 -10.188  -1.010  -3.131
   84    H8     G   8           H8         G   8  -6.989  -2.775  -3.627
   85    H1     G   8           H1         G   8  -7.501  -0.580   2.337
   86   1H2     G   8          1H2         G   8  -9.188   0.852   2.475
   87   2H2     G   8          2H2         G   8 -10.185   1.266   1.098
   88   1H5*    G   9          1H5*        G   9 -10.461   4.094  -5.702
   89   2H5*    G   9          2H5*        G   9  -9.418   5.513  -5.470
   90    H4*    G   9           H4*        G   9 -11.646   5.345  -4.115
   91    H3*    G   9           H3*        G   9  -8.917   6.213  -3.192
   92    H2*    G   9           H2*        G   9  -9.556   6.269  -0.910
   93   2HO*    G   9          2HO*        G   9 -12.051   6.659  -2.024
   94    H1*    G   9           H1*        G   9 -10.952   3.979  -0.784
   95    H8     G   9           H8         G   9  -8.345   3.127  -3.265
   96    H1     G   9           H1         G   9  -5.878   3.613   2.594
   97   1H2     G   9          1H2         G   9  -7.348   4.562   3.959
   98   2H2     G   9          2H2         G   9  -8.933   5.075   3.425
   99   1H5*    A  10          1H5*        A  10 -10.866   9.704  -1.520
  100   2H5*    A  10          2H5*        A  10  -9.689  11.003  -1.811
  101    H4*    A  10           H4*        A  10 -10.024  10.216   0.631
  102    H3*    A  10           H3*        A  10  -7.340  10.467  -0.775
  103    H2*    A  10           H2*        A  10  -6.264   9.807   1.216
  104   2HO*    A  10          2HO*        A  10  -8.202  11.210   2.341
  105    H1*    A  10           H1*        A  10  -8.199   7.994   2.102
  106    H8     A  10           H8         A  10  -7.571   6.999  -1.366
  107   1H6     A  10          1H6         A  10  -2.135   4.657   0.335
  108   2H6     A  10          2H6         A  10  -3.324   4.736  -0.945
  109    H2     A  10           H2         A  10  -3.692   7.172   3.718
  110   1H5*    A  11          1H5*        A  11  -7.202  13.885   2.511
  111   2H5*    A  11          2H5*        A  11  -5.826  14.878   1.991
  112    H4*    A  11           H4*        A  11  -5.705  13.520   4.254
  113    H3*    A  11           H3*        A  11  -3.576  13.926   2.141
  114    H2*    A  11           H2*        A  11  -2.084  12.489   3.292
  115   2HO*    A  11          2HO*        A  11  -3.221  13.474   5.427
  116    H1*    A  11           H1*        A  11  -3.850  10.535   3.978
  117    H8     A  11           H8         A  11  -4.979  11.467   0.584
  118   1H6     A  11          1H6         A  11  -0.092   8.545  -1.760
  119   2H6     A  11          2H6         A  11  -1.630   9.294  -2.129
  120    H2     A  11           H2         A  11   0.504   8.918   2.680
  121   1H5*    A  12          1H5*        A  12  -0.972  14.294   5.093
  122   2H5*    A  12          2H5*        A  12   0.070  15.684   4.731
  123    H4*    A  12           H4*        A  12   1.333  13.562   4.593
  124    H3*    A  12           H3*        A  12   0.856  15.144   2.044
  125    H2*    A  12           H2*        A  12   2.084  13.543   0.846
  126   2HO*    A  12          2HO*        A  12   3.285  11.890   2.296
  127    H1*    A  12           H1*        A  12   1.348  11.287   2.286
  128    H8     A  12           H8         A  12  -1.634  13.296   1.307
  129   1H6     A  12          1H6         A  12  -1.058  11.120  -4.424
  130   2H6     A  12          2H6         A  12  -2.085  12.024  -3.333
  131    H2     A  12           H2         A  12   2.587   9.917  -2.087
  132   1H5*    C  13          1H5*        C  13   5.342  15.223   3.525
  133   2H5*    C  13          2H5*        C  13   6.293  16.419   2.622
  134    H4*    C  13           H4*        C  13   7.161  14.012   2.572
  135    H3*    C  13           H3*        C  13   6.578  15.656   0.080
  136    H2*    C  13           H2*        C  13   7.408  13.836  -1.238
  137   2HO*    C  13          2HO*        C  13   8.421  12.038  -0.264
  138    H1*    C  13           H1*        C  13   6.041  11.896   0.020
  139   1H4     C  13          1H4         C  13   2.360  14.234  -4.659
  140   2H4     C  13          2H4         C  13   1.520  15.203  -3.470
  141    H5     C  13           H5         C  13   2.213  15.364  -1.173
  142    H6     C  13           H6         C  13   3.853  14.630   0.487
  143   1H5*    A  14          1H5*        A  14  11.033  14.714  -0.550
  144   2H5*    A  14          2H5*        A  14  11.505  16.013  -1.665
  145    H4*    A  14           H4*        A  14  11.495  13.498  -2.476
  146    H3*    A  14           H3*        A  14  10.439  15.914  -4.007
  147    H2*    A  14           H2*        A  14  10.062  14.424  -5.850
  148   2HO*    A  14          2HO*        A  14  12.086  13.058  -4.688
  149    H1*    A  14           H1*        A  14   8.979  12.412  -4.377
  150    H8     A  14           H8         A  14   7.444  15.304  -2.747
  151   1H6     A  14          1H6         A  14   3.813  16.106  -7.648
  152   2H6     A  14          2H6         A  14   4.090  16.550  -5.979
  153    H2     A  14           H2         A  14   7.068  13.225  -8.785
  154   1H5*    G  15          1H5*        G  15  13.442  14.538  -6.272
  155   2H5*    G  15          2H5*        G  15  14.671  15.627  -6.950
  156    H4*    G  15           H4*        G  15  13.556  14.656  -8.822
  157    H3*    G  15           H3*        G  15  12.538  17.456  -8.195
  158    H2*    G  15           H2*        G  15  11.228  17.306 -10.213
  159   2HO*    G  15          2HO*        G  15  12.306  14.740 -10.781
  160    H1*    G  15           H1*        G  15  10.283  14.798  -9.712
  161    H8     G  15           H8         G  15  10.443  16.377  -6.345
  162    H1     G  15           H1         G  15   5.743  18.851  -9.859
  163   1H2     G  15          1H2         G  15   5.948  18.207 -11.970
  164   2H2     G  15          2H2         G  15   7.246  17.168 -12.513
  165   1H5*    U  16          1H5*        U  16  13.160  17.511 -11.584
  166   2H5*    U  16          2H5*        U  16  14.043  18.704 -12.556
  167    H4*    U  16           H4*        U  16  11.834  18.891 -13.337
  168    H3*    U  16           H3*        U  16  12.299  20.959 -11.141
  169    H2*    U  16           H2*        U  16  10.138  21.795 -11.639
  170   2HO*    U  16          2HO*        U  16   9.179  20.512 -13.673
  171    H1*    U  16           H1*        U  16   8.967  19.299 -12.136
  172    H3     U  16           H3         U  16   6.837  21.235  -8.593
  173    H5     U  16           H5         U  16  10.464  19.758  -7.041
  174    H6     U  16           H6         U  16  11.155  19.251  -9.289
  175   1H5*    U  17          1H5*        U  17  12.244  25.233 -12.339
  176   2H5*    U  17          2H5*        U  17  10.807  24.215 -12.135
  177    H4*    U  17           H4*        U  17  11.093  26.676 -13.630
  178    H3*    U  17           H3*        U  17   9.110  25.589 -12.151
  179    H2*    U  17           H2*        U  17   8.700  23.670 -13.528
  180   2HO*    U  17          2HO*        U  17   6.927  24.585 -15.109
  181    H1*    U  17           H1*        U  17   8.766  25.246 -16.077
  182    H3     U  17           H3         U  17   7.967  21.004 -17.558
  183    H5     U  17           H5         U  17  11.672  20.765 -15.567
  184    H6     U  17           H6         U  17  11.390  23.061 -14.888
  185   1H5*    C  18          1H5*        C  18   5.405  25.064 -13.451
  186   2H5*    C  18          2H5*        C  18   5.065  26.793 -13.677
  187    H4*    C  18           H4*        C  18   3.261  25.777 -12.385
  188    H3*    C  18           H3*        C  18   4.437  28.100 -11.649
  189    H2*    C  18           H2*        C  18   6.166  27.182 -10.279
  190   2HO*    C  18          2HO*        C  18   5.511  27.505  -8.122
  191    H1*    C  18           H1*        C  18   4.320  25.242  -8.926
  192   1H4     C  18          1H4         C  18  10.062  22.955  -7.465
  193   2H4     C  18          2H4         C  18  10.474  22.815  -9.160
  194    H5     C  18           H5         C  18   9.038  23.568 -10.936
  195    H6     C  18           H6         C  18   6.892  24.617 -11.477
  196   1H5*    G  19          1H5*        G  19  -0.153  25.754 -11.814
  197   2H5*    G  19          2H5*        G  19   1.391  24.892 -11.642
  198    H4*    G  19           H4*        G  19  -0.407  25.139 -14.038
  199    H3*    G  19           H3*        G  19   1.166  22.948 -12.632
  200    H2*    G  19           H2*        G  19   1.318  21.781 -14.674
  201   2HO*    G  19          2HO*        G  19  -1.081  23.060 -15.135
  202    H1*    G  19           H1*        G  19   1.520  23.996 -16.365
  203    H8     G  19           H8         G  19   3.782  23.279 -17.280
  204    H1     G  19           H1         G  19   6.163  21.836 -11.544
  205   1H2     G  19          1H2         G  19   4.651  22.243  -9.974
  206   2H2     G  19          2H2         G  19   3.060  22.871 -10.338
  207   1H5*    C  20          1H5*        C  20  -1.076  21.119 -14.861
  208   2H5*    C  20          2H5*        C  20  -1.653  19.506 -14.397
  209    H4*    C  20           H4*        C  20   0.098  19.477 -16.200
  210    H3*    C  20           H3*        C  20   0.425  18.057 -13.553
  211    H2*    C  20           H2*        C  20   2.631  17.372 -14.105
  212   2HO*    C  20          2HO*        C  20   2.804  18.429 -16.641
  213    H1*    C  20           H1*        C  20   3.534  19.698 -15.133
  214   1H4     C  20          1H4         C  20   4.589  19.746  -8.815
  215   2H4     C  20          2H4         C  20   3.085  20.616  -8.601
  216    H5     C  20           H5         C  20   1.540  21.041 -10.382
  217    H6     C  20           H6         C  20   1.089  20.740 -12.768
  218   1H5*    U  21          1H5*        U  21   2.108  15.818 -15.963
  219   2H5*    U  21          2H5*        U  21   1.219  14.412 -16.581
  220    H4*    U  21           H4*        U  21   3.339  13.508 -16.269
  221    H3*    U  21           H3*        U  21   1.645  13.070 -13.805
  222    H2*    U  21           H2*        U  21   3.487  12.108 -12.655
  223   2HO*    U  21          2HO*        U  21   5.318  12.216 -14.736
  224    H1*    U  21           H1*        U  21   5.405  13.869 -13.424
  225    H3     U  21           H3         U  21   4.545  14.973  -9.113
  226    H5     U  21           H5         U  21   1.301  16.593 -11.263
  227    H6     U  21           H6         U  21   2.123  15.445 -13.239
  228   1H5*    G  22          1H5*        G  22   3.552   9.370 -14.486
  229   2H5*    G  22          2H5*        G  22   2.668   8.041 -13.708
  230    H4*    G  22           H4*        G  22   4.929   8.880 -12.661
  231    H3*    G  22           H3*        G  22   2.341   8.179 -11.262
  232    H2*    G  22           H2*        G  22   3.061   9.116  -9.279
  233   2HO*    G  22          2HO*        G  22   4.861   8.386  -8.428
  234    H1*    G  22           H1*        G  22   5.326  10.594 -10.329
  235    H8     G  22           H8         G  22   2.003  12.077 -11.079
  236    H1     G  22           H1         G  22   3.729  13.169  -5.046
  237   1H2     G  22          1H2         G  22   5.508  11.950  -4.533
  238   2H2     G  22          2H2         G  22   6.269  10.871  -5.681
  239   1H5*    U  23          1H5*        U  23   5.543   4.876  -9.599
  240   2H5*    U  23          2H5*        U  23   4.454   3.751  -8.762
  241    H4*    U  23           H4*        U  23   6.272   5.103  -7.401
  242    H3*    U  23           H3*        U  23   3.383   4.544  -6.657
  243    H2*    U  23           H2*        U  23   3.635   5.794  -4.679
  244   2HO*    U  23          2HO*        U  23   6.408   6.120  -4.859
  245    H1*    U  23           H1*        U  23   5.399   7.730  -5.647
  246    H3     U  23           H3         U  23   1.447   9.519  -4.064
  247    H5     U  23           H5         U  23   0.794   8.568  -8.123
  248    H6     U  23           H6         U  23   2.913   7.389  -8.119
  249   1H5*    G  24          1H5*        G  24   4.994  -0.600  -4.975
  250   2H5*    G  24          2H5*        G  24   5.586   0.136  -3.472
  251    H4*    G  24           H4*        G  24   6.707   0.451  -6.275
  252    H3*    G  24           H3*        G  24   7.560  -0.905  -3.732
  253    H2*    G  24           H2*        G  24   9.737  -0.044  -3.799
  254   2HO*    G  24          2HO*        G  24   9.549  -0.485  -6.334
  255    H1*    G  24           H1*        G  24   9.286   2.449  -4.745
  256    H8     G  24           H8         G  24   6.514   1.877  -2.347
  257    H1     G  24           H1         G  24  12.101   2.521   0.659
  258   1H2     G  24          1H2         G  24  13.763   2.434  -0.805
  259   2H2     G  24          2H2         G  24  13.494   2.215  -2.520
  260   1H5*    C  25          1H5*        C  25  10.895  -1.783  -7.067
  261   2H5*    C  25          2H5*        C  25  10.838  -3.552  -6.935
  262    H4*    C  25           H4*        C  25  13.166  -2.721  -6.935
  263    H3*    C  25           H3*        C  25  12.020  -4.113  -4.508
  264    H2*    C  25           H2*        C  25  14.015  -3.780  -3.284
  265   2HO*    C  25          2HO*        C  25  15.918  -2.908  -4.464
  266    H1*    C  25           H1*        C  25  14.572  -1.228  -4.067
  267   1H4     C  25          1H4         C  25  11.272  -0.822   1.366
  268   2H4     C  25          2H4         C  25   9.769  -0.960   0.481
  269    H5     C  25           H5         C  25   9.669  -1.375  -1.892
  270    H6     C  25           H6         C  25  10.988  -1.748  -3.926
  271   1H5*    C  26          1H5*        C  26  15.801  -5.241  -4.698
  272   2H5*    C  26          2H5*        C  26  15.951  -6.838  -5.460
  273    H4*    C  26           H4*        C  26  17.550  -7.035  -3.799
  274    H3*    C  26           H3*        C  26  14.883  -7.986  -2.738
  275    H2*    C  26           H2*        C  26  15.780  -8.259  -0.555
  276   2HO*    C  26          2HO*        C  26  17.862  -9.100  -1.603
  277    H1*    C  26           H1*        C  26  17.167  -5.958  -0.400
  278   1H4     C  26          1H4         C  26  11.384  -4.423   1.748
  279   2H4     C  26          2H4         C  26  10.714  -4.514   0.135
  280    H5     C  26           H5         C  26  11.994  -5.185  -1.791
  281    H6     C  26           H6         C  26  14.194  -5.913  -2.588
  282   1H5*    G  27          1H5*        G  27  17.504 -11.356  -1.391
  283   2H5*    G  27          2H5*        G  27  16.352 -12.679  -1.120
  284    H4*    G  27           H4*        G  27  17.507 -11.470   0.931
  285    H3*    G  27           H3*        G  27  14.587 -12.290   0.664
  286    H2*    G  27           H2*        G  27  14.205 -11.471   2.844
  287   2HO*    G  27          2HO*        G  27  16.683 -12.382   3.240
  288    H1*    G  27           H1*        G  27  15.990  -9.312   2.733
  289    H8     G  27           H8         G  27  13.845  -9.131  -0.289
  290    H1     G  27           H1         G  27  10.575  -7.605   4.966
  291   1H2     G  27          1H2         G  27  11.756  -8.127   6.772
  292   2H2     G  27          2H2         G  27  13.346  -8.851   6.677
  293   1H5*    A  28          1H5*        A  28  15.939 -15.414   3.980
  294   2H5*    A  28          2H5*        A  28  14.632 -16.602   3.812
  295    H4*    A  28           H4*        A  28  14.848 -15.163   6.018
  296    H3*    A  28           H3*        A  28  12.343 -15.907   4.474
  297    H2*    A  28           H2*        A  28  11.020 -14.658   5.978
  298   2HO*    A  28          2HO*        A  28  13.306 -14.612   7.700
  299    H1*    A  28           H1*        A  28  12.747 -12.542   6.378
  300    H8     A  28           H8         A  28  12.773 -13.130   2.722
  301   1H6     A  28          1H6         A  28   7.224 -10.480   2.363
  302   2H6     A  28          2H6         A  28   8.596 -11.065   1.448
  303    H2     A  28           H2         A  28   8.141 -11.214   6.701
  304   1H5*    A  29          1H5*        A  29  12.149 -18.299   8.782
  305   2H5*    A  29          2H5*        A  29  10.732 -19.346   8.576
  306    H4*    A  29           H4*        A  29  10.768 -17.514  10.480
  307    H3*    A  29           H3*        A  29   8.526 -18.403   8.669
  308    H2*    A  29           H2*        A  29   7.092 -16.661   9.400
  309   2HO*    A  29          2HO*        A  29   8.477 -16.925  11.673
  310    H1*    A  29           H1*        A  29   8.837 -14.623   9.321
  311    H8     A  29           H8         A  29  10.115 -16.596   6.500
  312   1H6     A  29          1H6         A  29   5.135 -15.083   3.205
  313   2H6     A  29          2H6         A  29   6.733 -15.790   3.144
  314    H2     A  29           H2         A  29   4.388 -13.912   7.479
  315   1H5*    A  30          1H5*        A  30   6.539 -19.531  12.851
  316   2H5*    A  30          2H5*        A  30   5.396 -20.770  12.294
  317    H4*    A  30           H4*        A  30   4.496 -18.479  13.234
  318    H3*    A  30           H3*        A  30   3.538 -20.082  10.855
  319    H2*    A  30           H2*        A  30   1.995 -18.376  10.246
  320   2HO*    A  30          2HO*        A  30   2.434 -17.534  12.904
  321    H1*    A  30           H1*        A  30   3.631 -16.261  10.499
  322    H8     A  30           H8         A  30   6.144 -18.629   9.356
  323   1H6     A  30          1H6         A  30   3.605 -18.686   3.748
  324   2H6     A  30          2H6         A  30   5.011 -19.125   4.691
  325    H2     A  30           H2         A  30   0.703 -16.733   6.572
  326   1H5*    G  31          1H5*        G  31   0.511 -18.887  11.973
  327   2H5*    G  31          2H5*        G  31  -0.704 -19.766  12.920
  328    H4*    G  31           H4*        G  31  -2.048 -18.846  11.271
  329    H3*    G  31           H3*        G  31  -1.039 -21.528  10.262
  330    H2*    G  31           H2*        G  31  -2.138 -21.162   8.213
  331   2HO*    G  31          2HO*        G  31  -4.101 -20.438   9.511
  332    H1*    G  31           H1*        G  31  -1.835 -18.375   8.096
  333    H8     G  31           H8         G  31   1.511 -19.832   8.728
  334    H1     G  31           H1         G  31  -0.390 -20.933   2.745
  335   1H2     G  31          1H2         G  31  -2.544 -20.449   2.531
  336   2H2     G  31          2H2         G  31  -3.510 -19.853   3.862
  337   1H5*    G  32          1H5*        G  32  -5.772 -22.031  10.660
  338   2H5*    G  32          2H5*        G  32  -6.024 -23.782  10.515
  339    H4*    G  32           H4*        G  32  -6.967 -22.140   8.669
  340    H3*    G  32           H3*        G  32  -5.633 -24.839   8.328
  341    H2*    G  32           H2*        G  32  -5.720 -24.634   5.975
  342   2HO*    G  32          2HO*        G  32  -7.080 -22.329   5.614
  343    H1*    G  32           H1*        G  32  -5.142 -21.954   5.768
  344    H8     G  32           H8         G  32  -2.787 -23.241   8.324
  345    H1     G  32           H1         G  32  -1.236 -25.317   2.499
  346   1H2     G  32          1H2         G  32  -2.891 -24.904   1.080
  347   2H2     G  32          2H2         G  32  -4.374 -24.116   1.571
  348   1H5*    U  33          1H5*        U  33  -8.249 -25.652   5.750
  349   2H5*    U  33          2H5*        U  33  -9.053 -27.209   6.035
  350    H4*    U  33           H4*        U  33  -7.696 -27.330   3.997
  351    H3*    U  33           H3*        U  33  -6.900 -28.942   6.422
  352    H2*    U  33           H2*        U  33  -4.848 -29.479   5.550
  353   2HO*    U  33          2HO*        U  33  -6.068 -30.605   3.817
  354    H1*    U  33           H1*        U  33  -4.775 -27.546   3.390
  355    H3     U  33           H3         U  33  -0.516 -28.106   4.917
  356    H5     U  33           H5         U  33  -2.497 -26.007   7.990
  357    H6     U  33           H6         U  33  -4.573 -26.325   6.777
  358   1H5*    C  34          1H5*        C  34  -7.464 -31.263   2.768
  359   2H5*    C  34          2H5*        C  34  -8.342 -32.801   2.901
  360    H4*    C  34           H4*        C  34  -6.401 -33.382   1.697
  361    H3*    C  34           H3*        C  34  -6.017 -33.868   4.665
  362    H2*    C  34           H2*        C  34  -3.868 -34.678   4.262
  363   2HO*    C  34          2HO*        C  34  -4.195 -36.147   2.648
  364    H1*    C  34           H1*        C  34  -3.267 -32.986   2.099
  365   1H4     C  34          1H4         C  34   0.126 -30.808   7.008
  366   2H4     C  34          2H4         C  34  -1.321 -30.215   7.792
  367    H5     C  34           H5         C  34  -3.536 -30.573   6.921
  368    H6     C  34           H6         C  34  -4.846 -31.574   5.106
  369    H3T    C  34           H3T        C  34  -7.509 -35.072   3.148
  370   1H5*    U  35          1H5*        U  35  -3.796 -11.770   4.139
  371   2H5*    U  35          2H5*        U  35  -2.911 -10.419   3.400
  372    H4*    U  35           H4*        U  35  -2.680 -10.809   5.968
  373    H3*    U  35           H3*        U  35  -0.510 -10.218   3.953
  374    H2*    U  35           H2*        U  35   1.196 -10.513   5.553
  375   2HO*    U  35          2HO*        U  35  -0.876  -9.881   7.321
  376    H1*    U  35           H1*        U  35   0.184 -12.659   6.902
  377    H3     U  35           H3         U  35   3.694 -14.357   4.623
  378    H5     U  35           H5         U  35   0.822 -13.620   1.628
  379    H6     U  35           H6         U  35  -0.572 -12.571   3.316
  380    H5T    U  35           H5T        U  35  -2.199 -11.923   2.131
  381   1H5*    U  36          1H5*        U  36  -0.414  -7.115   7.512
  382   2H5*    U  36          2H5*        U  36   0.723  -5.823   7.075
  383    H4*    U  36           H4*        U  36   1.230  -7.404   9.132
  384    H3*    U  36           H3*        U  36   3.115  -6.339   7.017
  385    H2*    U  36           H2*        U  36   4.915  -7.596   7.920
  386   2HO*    U  36          2HO*        U  36   4.987  -8.186   9.987
  387    H1*    U  36           H1*        U  36   3.598  -9.929   8.332
  388    H3     U  36           H3         U  36   6.373 -10.242   4.689
  389    H5     U  36           H5         U  36   2.773  -8.623   3.213
  390    H6     U  36           H6         U  36   2.011  -8.401   5.508
  391   1H5*    C  37          1H5*        C  37   5.076  -4.756  11.069
  392   2H5*    C  37          2H5*        C  37   5.881  -3.294  10.466
  393    H4*    C  37           H4*        C  37   7.351  -5.130  11.563
  394    H3*    C  37           H3*        C  37   7.864  -3.748   8.913
  395    H2*    C  37           H2*        C  37   9.829  -5.036   8.606
  396   2HO*    C  37          2HO*        C  37  10.871  -5.032  10.515
  397    H1*    C  37           H1*        C  37   8.854  -7.438   9.460
  398   1H4     C  37          1H4         C  37   8.254  -7.047   3.102
  399   2H4     C  37          2H4         C  37   6.646  -6.391   3.308
  400    H5     C  37           H5         C  37   5.713  -5.832   5.456
  401    H6     C  37           H6         C  37   6.123  -5.772   7.873
  402   1H5*    G  38          1H5*        G  38  11.211  -1.849  12.007
  403   2H5*    G  38          2H5*        G  38  11.667  -0.379  11.125
  404    H4*    G  38           H4*        G  38  13.549  -2.048  11.694
  405    H3*    G  38           H3*        G  38  12.992  -0.805   8.996
  406    H2*    G  38           H2*        G  38  14.719  -2.072   7.976
  407   2HO*    G  38          2HO*        G  38  16.054  -3.456   9.486
  408    H1*    G  38           H1*        G  38  14.192  -4.464   9.118
  409    H8     G  38           H8         G  38  10.815  -2.990   8.701
  410    H1     G  38           H1         G  38  13.348  -4.605   3.077
  411   1H2     G  38          1H2         G  38  15.503  -5.070   3.321
  412   2H2     G  38          2H2         G  38  16.313  -4.982   4.869
  413   1H5*    G  39          1H5*        G  39  17.319   0.990   9.874
  414   2H5*    G  39          2H5*        G  39  17.124   2.597   9.144
  415    H4*    G  39           H4*        G  39  18.993   1.132   8.187
  416    H3*    G  39           H3*        G  39  16.830   2.514   6.597
  417    H2*    G  39           H2*        G  39  17.560   1.526   4.575
  418   2HO*    G  39          2HO*        G  39  19.596   0.604   4.348
  419    H1*    G  39           H1*        G  39  18.058  -0.988   5.475
  420    H8     G  39           H8         G  39  15.037   0.011   7.370
  421    H1     G  39           H1         G  39  13.680  -0.951   1.215
  422   1H2     G  39          1H2         G  39  15.553  -1.115   0.041
  423   2H2     G  39          2H2         G  39  17.137  -0.987   0.774
  424   1H5*    C  40          1H5*        C  40  19.673   2.753   4.329
  425   2H5*    C  40          2H5*        C  40  20.607   4.262   4.263
  426    H4*    C  40           H4*        C  40  20.457   3.789   2.005
  427    H3*    C  40           H3*        C  40  18.076   5.468   2.822
  428    H2*    C  40           H2*        C  40  17.115   5.260   0.675
  429   2HO*    C  40          2HO*        C  40  19.661   4.273  -0.187
  430    H1*    C  40           H1*        C  40  17.736   2.635   0.183
  431   1H4     C  40          1H4         C  40  11.785   2.675   2.437
  432   2H4     C  40          2H4         C  40  12.368   2.946   4.064
  433    H5     C  40           H5         C  40  14.694   3.282   4.593
  434    H6     C  40           H6         C  40  16.963   3.435   3.676
  435   1H5*    U  41          1H5*        U  41  16.077   7.666   2.273
  436   2H5*    U  41          2H5*        U  41  16.679   7.525   0.609
  437    H4*    U  41           H4*        U  41  16.322  10.074   2.231
  438    H3*    U  41           H3*        U  41  14.898   8.778  -0.100
  439    H2*    U  41           H2*        U  41  14.675  10.834  -1.214
  440   2HO*    U  41          2HO*        U  41  15.160  12.841   0.064
  441    H1*    U  41           H1*        U  41  17.058  12.025  -0.443
  442    H3     U  41           H3         U  41  17.916  11.646  -4.815
  443    H5     U  41           H5         U  41  17.243   7.653  -3.648
  444    H6     U  41           H6         U  41  16.722   8.461  -1.420
  445   1H5*    C  42          1H5*        C  42  11.233   9.254   0.278
  446   2H5*    C  42          2H5*        C  42  10.618   7.697   0.870
  447    H4*    C  42           H4*        C  42  10.554   8.375  -1.734
  448    H3*    C  42           H3*        C  42  10.663   5.801  -0.254
  449    H2*    C  42           H2*        C  42  12.009   4.724  -1.787
  450   2HO*    C  42          2HO*        C  42   9.739   5.384  -3.203
  451    H1*    C  42           H1*        C  42  12.015   6.970  -3.763
  452   1H4     C  42          1H4         C  42  17.737   4.429  -4.790
  453   2H4     C  42          2H4         C  42  17.964   4.097  -3.088
  454    H5     C  42           H5         C  42  16.315   4.614  -1.410
  455    H6     C  42           H6         C  42  14.089   5.560  -1.002
  456   1H5*    U  43          1H5*        U  43   8.925   5.218   1.399
  457   2H5*    U  43          2H5*        U  43   8.068   3.693   1.098
  458    H4*    U  43           H4*        U  43   7.364   5.236   3.124
  459    H3*    U  43           H3*        U  43   5.609   3.714   1.179
  460    H2*    U  43           H2*        U  43   3.672   4.626   2.129
  461   2HO*    U  43          2HO*        U  43   5.256   5.335   4.404
  462    H1*    U  43           H1*        U  43   4.684   7.124   2.878
  463    H3     U  43           H3         U  43   1.322   8.161   0.059
  464    H5     U  43           H5         U  43   4.165   6.294  -2.431
  465    H6     U  43           H6         U  43   5.475   5.795  -0.449
  466   1H5*    U  44          1H5*        U  44   5.010   3.032   5.993
  467   2H5*    U  44          2H5*        U  44   3.820   1.725   6.153
  468    H4*    U  44           H4*        U  44   3.384   4.065   7.296
  469    H3*    U  44           H3*        U  44   1.454   2.253   5.831
  470    H2*    U  44           H2*        U  44  -0.286   3.843   6.040
  471   2HO*    U  44          2HO*        U  44   0.232   4.302   8.297
  472    H1*    U  44           H1*        U  44   1.146   6.100   5.516
  473    H3     U  44           H3         U  44  -1.624   5.222   1.990
  474    H5     U  44           H5         U  44   1.755   2.781   1.361
  475    H6     U  44           H6         U  44   2.539   3.414   3.569
  476   1H5*    C  45          1H5*        C  45  -0.766   3.400   9.777
  477   2H5*    C  45          2H5*        C  45  -1.421   1.815  10.236
  478    H4*    C  45           H4*        C  45  -3.160   3.622  10.111
  479    H3*    C  45           H3*        C  45  -3.278   1.144   8.369
  480    H2*    C  45           H2*        C  45  -5.260   1.917   7.346
  481   2HO*    C  45          2HO*        C  45  -5.485   4.001   9.278
  482    H1*    C  45           H1*        C  45  -4.637   4.601   7.214
  483   1H4     C  45          1H4         C  45  -3.442   2.144   1.467
  484   2H4     C  45          2H4         C  45  -1.930   1.479   2.041
  485    H5     C  45           H5         C  45  -1.219   1.601   4.341
  486    H6     C  45           H6         C  45  -1.812   2.385   6.588
  487   1H5*    C  46          1H5*        C  46  -7.182   1.338  10.878
  488   2H5*    C  46          2H5*        C  46  -7.987  -0.233  10.692
  489    H4*    C  46           H4*        C  46  -9.076   1.943   9.670
  490    H3*    C  46           H3*        C  46  -8.883  -0.844   8.516
  491    H2*    C  46           H2*        C  46  -9.836  -0.142   6.469
  492   2HO*    C  46          2HO*        C  46 -11.549   1.092   7.283
  493    H1*    C  46           H1*        C  46  -8.537   2.233   6.190
  494   1H4     C  46          1H4         C  46  -5.201  -2.234   3.074
  495   2H4     C  46          2H4         C  46  -4.302  -2.578   4.535
  496    H5     C  46           H5         C  46  -4.809  -1.574   6.666
  497    H6     C  46           H6         C  46  -6.290  -0.025   7.855
  498   1H5*    U  47          1H5*        U  47 -13.493   0.312   8.471
  499   2H5*    U  47          2H5*        U  47 -14.297  -1.269   8.405
  500    H4*    U  47           H4*        U  47 -14.661   0.436   6.449
  501    H3*    U  47           H3*        U  47 -14.139  -2.537   6.294
  502    H2*    U  47           H2*        U  47 -14.032  -2.474   3.937
  503   2HO*    U  47          2HO*        U  47 -14.659   0.135   3.444
  504    H1*    U  47           H1*        U  47 -12.665  -0.125   3.628
  505    H3     U  47           H3         U  47 -10.053  -3.696   2.423
  506    H5     U  47           H5         U  47  -9.599  -3.331   6.598
  507    H6     U  47           H6         U  47 -11.383  -1.686   6.582
  508   1H5*    A  48          1H5*        A  48 -18.456  -2.072   4.260
  509   2H5*    A  48          2H5*        A  48 -19.032  -3.751   4.255
  510    H4*    A  48           H4*        A  48 -18.547  -2.512   1.978
  511    H3*    A  48           H3*        A  48 -17.939  -5.337   2.817
  512    H2*    A  48           H2*        A  48 -16.751  -5.805   0.843
  513   2HO*    A  48          2HO*        A  48 -18.038  -3.461  -0.121
  514    H1*    A  48           H1*        A  48 -15.298  -3.537   0.720
  515    H8     A  48           H8         A  48 -15.585  -4.078   4.374
  516   1H6     A  48          1H6         A  48 -11.416  -8.591   3.928
  517   2H6     A  48          2H6         A  48 -12.316  -7.575   5.032
  518    H2     A  48           H2         A  48 -12.722  -7.485  -0.226
  519    H3T    A  48           H3T        A  48 -19.570  -5.723   1.330
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  11.386 -28.565   3.885
    2   2H5*    G   1          2H5*        G   1  10.428 -27.925   2.535
    3    H4*    G   1           H4*        G   1  10.896 -30.391   2.375
    4    H3*    G   1           H3*        G   1   8.136 -29.186   2.381
    5    H2*    G   1           H2*        G   1   7.079 -31.308   2.449
    6   2HO*    G   1          2HO*        G   1   7.980 -32.926   1.424
    7    H1*    G   1           H1*        G   1   8.572 -32.465   4.342
    8    H8     G   1           H8         G   1   8.767 -29.118   5.713
    9    H1     G   1           H1         G   1   2.702 -31.089   5.799
   10   1H2     G   1          1H2         G   1   2.470 -32.884   4.517
   11   2H2     G   1          2H2         G   1   3.807 -33.595   3.642
   12    H5T    G   1           H5T        G   1   9.076 -27.263   3.964
   13   1H5*    G   2          1H5*        G   2   7.280 -31.961  -0.209
   14   2H5*    G   2          2H5*        G   2   7.368 -31.325  -1.865
   15    H4*    G   2           H4*        G   2   5.349 -32.473  -1.938
   16    H3*    G   2           H3*        G   2   4.793 -29.610  -1.077
   17    H2*    G   2           H2*        G   2   2.488 -30.144  -0.923
   18   2HO*    G   2          2HO*        G   2   2.073 -32.533  -1.757
   19    H1*    G   2           H1*        G   2   2.760 -32.697   0.082
   20    H8     G   2           H8         G   2   5.061 -30.650   2.109
   21    H1     G   2           H1         G   2  -1.017 -29.388   3.541
   22   1H2     G   2          1H2         G   2  -2.356 -30.254   2.001
   23   2H2     G   2          2H2         G   2  -1.750 -31.143   0.621
   24   1H5*    C   3          1H5*        C   3   2.410 -29.661  -4.075
   25   2H5*    C   3          2H5*        C   3   2.490 -28.358  -5.275
   26    H4*    C   3           H4*        C   3   0.392 -28.102  -4.145
   27    H3*    C   3           H3*        C   3   2.554 -26.159  -3.300
   28    H2*    C   3           H2*        C   3   1.250 -25.340  -1.565
   29   2HO*    C   3          2HO*        C   3  -0.635 -24.588  -2.124
   30    H1*    C   3           H1*        C   3  -0.611 -27.555  -1.392
   31   1H4     C   3          1H4         C   3   1.844 -26.694   4.421
   32   2H4     C   3          2H4         C   3   3.364 -27.385   3.897
   33    H5     C   3           H5         C   3   3.806 -28.022   1.614
   34    H6     C   3           H6         C   3   2.899 -28.121  -0.651
   35   1H5*    C   4          1H5*        C   4  -1.277 -23.776  -5.450
   36   2H5*    C   4          2H5*        C   4  -0.686 -22.103  -5.498
   37    H4*    C   4           H4*        C   4  -2.956 -22.638  -4.291
   38    H3*    C   4           H3*        C   4  -0.709 -20.829  -3.368
   39    H2*    C   4           H2*        C   4  -1.852 -20.387  -1.344
   40   2HO*    C   4          2HO*        C   4  -4.143 -21.676  -1.475
   41    H1*    C   4           H1*        C   4  -2.725 -22.886  -0.805
   42   1H4     C   4          1H4         C   4   2.826 -22.121   2.233
   43   2H4     C   4          2H4         C   4   3.687 -22.643   0.801
   44    H5     C   4           H5         C   4   2.601 -23.094  -1.303
   45    H6     C   4           H6         C   4   0.455 -23.141  -2.487
   46   1H5*    U   5          1H5*        U   5  -4.609 -18.310  -2.831
   47   2H5*    U   5          2H5*        U   5  -3.984 -16.663  -3.055
   48    H4*    U   5           H4*        U   5  -5.096 -17.367  -0.761
   49    H3*    U   5           H3*        U   5  -2.599 -15.702  -1.216
   50    H2*    U   5           H2*        U   5  -2.232 -15.577   1.093
   51   2HO*    U   5          2HO*        U   5  -3.958 -14.886   2.108
   52    H1*    U   5           H1*        U   5  -3.482 -18.026   1.828
   53    H3     U   5           H3         U   5   0.728 -17.833   3.650
   54    H5     U   5           H5         U   5   1.248 -19.073  -0.346
   55    H6     U   5           H6         U   5  -1.085 -18.555  -0.738
   56   1H5*    U   6          1H5*        U   6  -7.269 -14.559  -2.431
   57   2H5*    U   6          2H5*        U   6  -6.259 -13.871  -3.718
   58    H4*    U   6           H4*        U   6  -8.296 -12.786  -4.087
   59    H3*    U   6           H3*        U   6  -6.516 -11.129  -2.283
   60    H2*    U   6           H2*        U   6  -8.242  -9.669  -1.801
   61   2HO*    U   6          2HO*        U   6  -9.272 -10.281  -4.397
   62    H1*    U   6           H1*        U   6 -10.436 -11.360  -2.678
   63    H3     U   6           H3         U   6 -11.851  -8.998   0.961
   64    H5     U   6           H5         U   6  -9.100 -11.794   2.496
   65    H6     U   6           H6         U   6  -8.553 -12.410   0.215
   66   1H5*    A   7          1H5*        A   7  -6.981  -8.735  -6.666
   67   2H5*    A   7          2H5*        A   7  -5.974  -7.296  -6.406
   68    H4*    A   7           H4*        A   7  -8.523  -7.020  -7.004
   69    H3*    A   7           H3*        A   7  -6.848  -5.501  -5.003
   70    H2*    A   7           H2*        A   7  -8.725  -4.335  -4.178
   71   2HO*    A   7          2HO*        A   7  -9.906  -3.612  -5.807
   72    H1*    A   7           H1*        A   7 -10.573  -6.356  -4.242
   73    H8     A   7           H8         A   7  -7.514  -7.996  -2.968
   74   1H6     A   7          1H6         A   7  -8.464  -5.313   2.492
   75   2H6     A   7          2H6         A   7  -7.550  -6.532   1.631
   76    H2     A   7           H2         A   7 -11.206  -3.387  -0.503
   77   1H5*    G   8          1H5*        G   8  -8.520  -2.147  -7.495
   78   2H5*    G   8          2H5*        G   8  -7.365  -0.805  -7.351
   79    H4*    G   8           H4*        G   8  -9.730  -0.603  -6.225
   80    H3*    G   8           H3*        G   8  -7.028   0.161  -5.097
   81    H2*    G   8           H2*        G   8  -7.972   0.709  -3.022
   82   2HO*    G   8          2HO*        G   8  -9.796   1.813  -4.424
   83    H1*    G   8           H1*        G   8 -10.047  -1.160  -2.971
   84    H8     G   8           H8         G   8  -6.984  -3.065  -3.747
   85    H1     G   8           H1         G   8  -6.995  -1.095   2.316
   86   1H2     G   8          1H2         G   8  -8.585   0.420   2.619
   87   2H2     G   8          2H2         G   8  -9.642   0.945   1.326
   88   1H5*    G   9          1H5*        G   9 -10.323   3.895  -5.505
   89   2H5*    G   9          2H5*        G   9  -9.351   5.327  -5.109
   90    H4*    G   9           H4*        G   9 -11.604   4.858  -3.818
   91    H3*    G   9           H3*        G   9  -8.968   5.926  -2.835
   92    H2*    G   9           H2*        G   9  -9.589   5.763  -0.555
   93   2HO*    G   9          2HO*        G   9 -12.256   5.302  -1.492
   94    H1*    G   9           H1*        G   9 -10.758   3.345  -0.579
   95    H8     G   9           H8         G   9  -8.110   2.894  -3.117
   96    H1     G   9           H1         G   9  -5.632   3.264   2.745
   97   1H2     G   9          1H2         G   9  -7.160   3.999   4.172
   98   2H2     G   9          2H2         G   9  -8.791   4.399   3.681
   99   1H5*    A  10          1H5*        A  10 -11.107   8.823  -0.597
  100   2H5*    A  10          2H5*        A  10 -10.241  10.334  -0.943
  101    H4*    A  10           H4*        A  10 -10.064   9.525   1.455
  102    H3*    A  10           H3*        A  10  -7.630   9.985  -0.307
  103    H2*    A  10           H2*        A  10  -6.234   9.402   1.502
  104   2HO*    A  10          2HO*        A  10  -6.764  10.273   3.352
  105    H1*    A  10           H1*        A  10  -7.888   7.459   2.647
  106    H8     A  10           H8         A  10  -7.624   6.607  -0.939
  107   1H6     A  10          1H6         A  10  -1.976   4.389   0.109
  108   2H6     A  10          2H6         A  10  -3.290   4.481  -1.041
  109    H2     A  10           H2         A  10  -3.263   6.700   3.742
  110   1H5*    A  11          1H5*        A  11  -7.409  13.357   3.046
  111   2H5*    A  11          2H5*        A  11  -6.155  14.461   2.445
  112    H4*    A  11           H4*        A  11  -5.759  13.079   4.661
  113    H3*    A  11           H3*        A  11  -3.835  13.679   2.401
  114    H2*    A  11           H2*        A  11  -2.154  12.350   3.418
  115   2HO*    A  11          2HO*        A  11  -2.018  12.218   5.530
  116    H1*    A  11           H1*        A  11  -3.710  10.260   4.190
  117    H8     A  11           H8         A  11  -5.124  11.182   0.888
  118   1H6     A  11          1H6         A  11  -0.252   8.543  -1.805
  119   2H6     A  11          2H6         A  11  -1.846   9.217  -2.067
  120    H2     A  11           H2         A  11   0.602   8.887   2.593
  121   1H5*    A  12          1H5*        A  12  -1.059  14.378   5.381
  122   2H5*    A  12          2H5*        A  12  -0.076  15.730   4.786
  123    H4*    A  12           H4*        A  12   1.123  13.500   4.854
  124    H3*    A  12           H3*        A  12   0.793  15.099   2.293
  125    H2*    A  12           H2*        A  12   2.021  13.456   1.134
  126   2HO*    A  12          2HO*        A  12   3.767  12.815   2.155
  127    H1*    A  12           H1*        A  12   1.061  11.231   2.424
  128    H8     A  12           H8         A  12  -1.787  13.456   1.577
  129   1H6     A  12          1H6         A  12  -1.308  11.623  -4.285
  130   2H6     A  12          2H6         A  12  -2.296  12.501  -3.137
  131    H2     A  12           H2         A  12   2.282  10.122  -2.036
  132   1H5*    C  13          1H5*        C  13   5.194  14.876   3.914
  133   2H5*    C  13          2H5*        C  13   6.275  16.002   3.066
  134    H4*    C  13           H4*        C  13   6.913  13.505   3.027
  135    H3*    C  13           H3*        C  13   6.716  15.325   0.609
  136    H2*    C  13           H2*        C  13   7.343  13.512  -0.807
  137   2HO*    C  13          2HO*        C  13   8.011  12.175   1.630
  138    H1*    C  13           H1*        C  13   5.737  11.640   0.276
  139   1H4     C  13          1H4         C  13   2.471  14.579  -4.368
  140   2H4     C  13          2H4         C  13   1.667  15.537  -3.147
  141    H5     C  13           H5         C  13   2.283  15.495  -0.824
  142    H6     C  13           H6         C  13   3.791  14.525   0.838
  143   1H5*    A  14          1H5*        A  14  10.895  13.829  -0.008
  144   2H5*    A  14          2H5*        A  14  11.651  15.179  -0.876
  145    H4*    A  14           H4*        A  14  11.291  12.925  -2.137
  146    H3*    A  14           H3*        A  14  10.541  15.682  -3.187
  147    H2*    A  14           H2*        A  14   9.897  14.642  -5.222
  148   2HO*    A  14          2HO*        A  14  10.443  12.116  -5.078
  149    H1*    A  14           H1*        A  14   8.761  12.399  -4.126
  150    H8     A  14           H8         A  14   7.419  15.187  -2.115
  151   1H6     A  14          1H6         A  14   3.758  16.714  -6.820
  152   2H6     A  14          2H6         A  14   4.100  16.977  -5.126
  153    H2     A  14           H2         A  14   6.769  13.726  -8.309
  154   1H5*    G  15          1H5*        G  15  13.751  13.911  -5.966
  155   2H5*    G  15          2H5*        G  15  14.796  15.267  -6.431
  156    H4*    G  15           H4*        G  15  14.020  14.064  -8.428
  157    H3*    G  15           H3*        G  15  12.907  16.856  -7.957
  158    H2*    G  15           H2*        G  15  11.870  16.692 -10.137
  159   2HO*    G  15          2HO*        G  15  12.761  15.444 -11.606
  160    H1*    G  15           H1*        G  15  10.732  14.297  -9.654
  161    H8     G  15           H8         G  15  10.960  15.901  -6.297
  162    H1     G  15           H1         G  15   6.542  18.719  -9.912
  163   1H2     G  15          1H2         G  15   6.699  17.997 -12.007
  164   2H2     G  15          2H2         G  15   7.897  16.824 -12.506
  165   1H5*    U  16          1H5*        U  16  13.900  16.960 -11.226
  166   2H5*    U  16          2H5*        U  16  14.918  18.132 -12.086
  167    H4*    U  16           H4*        U  16  12.807  18.389 -13.097
  168    H3*    U  16           H3*        U  16  13.153  20.444 -10.872
  169    H2*    U  16           H2*        U  16  11.061  21.358 -11.531
  170   2HO*    U  16          2HO*        U  16  10.125  20.187 -13.572
  171    H1*    U  16           H1*        U  16   9.801  18.931 -12.014
  172    H3     U  16           H3         U  16   7.818  21.087  -8.490
  173    H5     U  16           H5         U  16  11.199  19.158  -6.886
  174    H6     U  16           H6         U  16  11.892  18.624  -9.134
  175   1H5*    U  17          1H5*        U  17  14.126  24.783 -12.003
  176   2H5*    U  17          2H5*        U  17  12.644  23.909 -11.582
  177    H4*    U  17           H4*        U  17  12.901  26.322 -13.093
  178    H3*    U  17           H3*        U  17  10.950  25.247 -11.548
  179    H2*    U  17           H2*        U  17  10.385  23.414 -12.986
  180   2HO*    U  17          2HO*        U  17   8.783  25.420 -14.213
  181    H1*    U  17           H1*        U  17  10.410  25.123 -15.453
  182    H3     U  17           H3         U  17   9.300  21.045 -17.170
  183    H5     U  17           H5         U  17  13.036  20.442 -15.313
  184    H6     U  17           H6         U  17  12.926  22.701 -14.490
  185   1H5*    C  18          1H5*        C  18   6.818  25.165 -12.839
  186   2H5*    C  18          2H5*        C  18   6.836  26.937 -12.964
  187    H4*    C  18           H4*        C  18   4.967  26.226 -11.553
  188    H3*    C  18           H3*        C  18   6.651  28.234 -10.862
  189    H2*    C  18           H2*        C  18   8.249  26.919  -9.662
  190   2HO*    C  18          2HO*        C  18   7.861  28.264  -8.032
  191    H1*    C  18           H1*        C  18   6.119  25.366  -8.221
  192   1H4     C  18          1H4         C  18  11.150  21.650  -7.183
  193   2H4     C  18          2H4         C  18  11.733  21.884  -8.816
  194    H5     C  18           H5         C  18  10.633  23.294 -10.422
  195    H6     C  18           H6         C  18   8.732  24.786 -10.817
  196   1H5*    G  19          1H5*        G  19   1.639  26.838 -10.848
  197   2H5*    G  19          2H5*        G  19   2.926  25.623 -10.701
  198    H4*    G  19           H4*        G  19   1.183  26.294 -13.038
  199    H3*    G  19           H3*        G  19   2.411  23.807 -11.789
  200    H2*    G  19           H2*        G  19   2.297  22.726 -13.873
  201   2HO*    G  19          2HO*        G  19   0.918  23.497 -15.548
  202    H1*    G  19           H1*        G  19   2.758  24.968 -15.493
  203    H8     G  19           H8         G  19   4.820  23.975 -16.595
  204    H1     G  19           H1         G  19   7.277  21.816 -11.122
  205   1H2     G  19          1H2         G  19   5.939  22.340  -9.433
  206   2H2     G  19          2H2         G  19   4.444  23.221  -9.655
  207   1H5*    C  20          1H5*        C  20  -0.198  22.507 -14.001
  208   2H5*    C  20          2H5*        C  20  -1.026  20.995 -13.586
  209    H4*    C  20           H4*        C  20   0.609  20.756 -15.474
  210    H3*    C  20           H3*        C  20   0.815  19.178 -12.907
  211    H2*    C  20           H2*        C  20   2.847  18.167 -13.599
  212   2HO*    C  20          2HO*        C  20   3.577  18.299 -15.756
  213    H1*    C  20           H1*        C  20   4.081  20.350 -14.589
  214   1H4     C  20          1H4         C  20   5.451  19.932  -8.353
  215   2H4     C  20          2H4         C  20   4.078  20.957  -8.000
  216    H5     C  20           H5         C  20   2.503  21.675  -9.665
  217    H6     C  20           H6         C  20   1.904  21.585 -12.037
  218   1H5*    U  21          1H5*        U  21   2.042  16.658 -15.850
  219   2H5*    U  21          2H5*        U  21   0.928  15.288 -16.029
  220    H4*    U  21           H4*        U  21   3.191  14.428 -16.006
  221    H3*    U  21           H3*        U  21   1.499  13.916 -13.549
  222    H2*    U  21           H2*        U  21   3.307  12.787 -12.503
  223   2HO*    U  21          2HO*        U  21   3.836  11.903 -14.840
  224    H1*    U  21           H1*        U  21   5.313  14.483 -13.237
  225    H3     U  21           H3         U  21   4.707  15.234  -8.808
  226    H5     U  21           H5         U  21   1.558  17.329 -10.668
  227    H6     U  21           H6         U  21   2.192  16.282 -12.766
  228   1H5*    G  22          1H5*        G  22   3.186  10.196 -14.482
  229   2H5*    G  22          2H5*        G  22   2.241   8.863 -13.789
  230    H4*    G  22           H4*        G  22   4.538   9.496 -12.701
  231    H3*    G  22           H3*        G  22   1.913   8.889 -11.326
  232    H2*    G  22           H2*        G  22   2.706   9.652  -9.300
  233   2HO*    G  22          2HO*        G  22   5.296   8.764 -10.109
  234    H1*    G  22           H1*        G  22   5.065  11.030 -10.280
  235    H8     G  22           H8         G  22   1.856  12.793 -10.890
  236    H1     G  22           H1         G  22   3.676  13.357  -4.811
  237   1H2     G  22          1H2         G  22   5.362  11.981  -4.391
  238   2H2     G  22          2H2         G  22   6.039  10.926  -5.612
  239   1H5*    U  23          1H5*        U  23   5.032   5.446  -9.793
  240   2H5*    U  23          2H5*        U  23   3.920   4.327  -8.980
  241    H4*    U  23           H4*        U  23   5.821   5.547  -7.607
  242    H3*    U  23           H3*        U  23   2.933   5.052  -6.823
  243    H2*    U  23           H2*        U  23   3.253   6.216  -4.803
  244   2HO*    U  23          2HO*        U  23   5.830   6.754  -4.622
  245    H1*    U  23           H1*        U  23   5.046   8.143  -5.718
  246    H3     U  23           H3         U  23   1.171  10.009  -4.061
  247    H5     U  23           H5         U  23   0.433   9.149  -8.126
  248    H6     U  23           H6         U  23   2.516   7.910  -8.172
  249   1H5*    G  24          1H5*        G  24   4.425   0.675  -6.897
  250   2H5*    G  24          2H5*        G  24   5.449  -0.210  -5.751
  251    H4*    G  24           H4*        G  24   6.301   1.171  -8.038
  252    H3*    G  24           H3*        G  24   7.614  -0.151  -5.673
  253    H2*    G  24           H2*        G  24   9.657   1.012  -5.974
  254   2HO*    G  24          2HO*        G  24   9.356   0.718  -8.419
  255    H1*    G  24           H1*        G  24   8.717   3.462  -6.425
  256    H8     G  24           H8         G  24   6.120   2.178  -4.137
  257    H1     G  24           H1         G  24  11.619   3.141  -1.057
  258   1H2     G  24          1H2         G  24  13.261   3.452  -2.519
  259   2H2     G  24          2H2         G  24  12.999   3.422  -4.247
  260   1H5*    C  25          1H5*        C  25  10.425  -2.254  -8.362
  261   2H5*    C  25          2H5*        C  25  10.346  -3.885  -7.668
  262    H4*    C  25           H4*        C  25  12.535  -2.553  -7.329
  263    H3*    C  25           H3*        C  25  10.953  -3.914  -5.120
  264    H2*    C  25           H2*        C  25  12.535  -3.189  -3.547
  265   2HO*    C  25          2HO*        C  25  14.397  -3.941  -4.512
  266    H1*    C  25           H1*        C  25  13.288  -0.789  -4.839
  267   1H4     C  25          1H4         C  25  10.050   0.442   0.551
  268   2H4     C  25          2H4         C  25   8.601   0.616  -0.413
  269    H5     C  25           H5         C  25   8.515   0.111  -2.769
  270    H6     C  25           H6         C  25   9.797  -0.675  -4.701
  271   1H5*    C  26          1H5*        C  26  15.029  -5.928  -5.875
  272   2H5*    C  26          2H5*        C  26  14.916  -7.683  -5.634
  273    H4*    C  26           H4*        C  26  16.836  -6.707  -4.408
  274    H3*    C  26           H3*        C  26  14.546  -8.026  -2.940
  275    H2*    C  26           H2*        C  26  15.512  -7.506  -0.834
  276   2HO*    C  26          2HO*        C  26  17.863  -6.734  -2.275
  277    H1*    C  26           H1*        C  26  16.255  -4.962  -1.346
  278   1H4     C  26          1H4         C  26  10.327  -4.619   0.970
  279   2H4     C  26          2H4         C  26   9.674  -4.911  -0.627
  280    H5     C  26           H5         C  26  11.044  -5.423  -2.540
  281    H6     C  26           H6         C  26  13.335  -5.768  -3.337
  282   1H5*    G  27          1H5*        G  27  17.578 -10.900  -1.294
  283   2H5*    G  27          2H5*        G  27  16.525 -12.304  -1.020
  284    H4*    G  27           H4*        G  27  17.388 -10.864   1.024
  285    H3*    G  27           H3*        G  27  14.594 -11.976   0.570
  286    H2*    G  27           H2*        G  27  13.913 -11.034   2.615
  287   2HO*    G  27          2HO*        G  27  16.399 -10.248   3.556
  288    H1*    G  27           H1*        G  27  15.565  -8.757   2.542
  289    H8     G  27           H8         G  27  13.740  -8.724  -0.645
  290    H1     G  27           H1         G  27   9.792  -7.529   4.218
  291   1H2     G  27          1H2         G  27  10.790  -8.009   6.141
  292   2H2     G  27          2H2         G  27  12.425  -8.623   6.223
  293   1H5*    A  28          1H5*        A  28  15.774 -14.696   4.205
  294   2H5*    A  28          2H5*        A  28  14.647 -16.041   3.948
  295    H4*    A  28           H4*        A  28  14.356 -14.436   6.029
  296    H3*    A  28           H3*        A  28  12.200 -15.543   4.196
  297    H2*    A  28           H2*        A  28  10.564 -14.395   5.451
  298   2HO*    A  28          2HO*        A  28  12.412 -14.768   7.462
  299    H1*    A  28           H1*        A  28  12.057 -12.112   6.025
  300    H8     A  28           H8         A  28  12.429 -12.708   2.389
  301   1H6     A  28          1H6         A  28   6.719 -10.546   1.551
  302   2H6     A  28          2H6         A  28   8.204 -11.019   0.756
  303    H2     A  28           H2         A  28   7.346 -11.162   5.959
  304   1H5*    A  29          1H5*        A  29  11.854 -17.367   8.678
  305   2H5*    A  29          2H5*        A  29  10.545 -18.565   8.650
  306    H4*    A  29           H4*        A  29  10.374 -16.451  10.222
  307    H3*    A  29           H3*        A  29   8.268 -17.848   8.586
  308    H2*    A  29           H2*        A  29   6.659 -16.154   8.958
  309   2HO*    A  29          2HO*        A  29   8.313 -14.733  10.754
  310    H1*    A  29           H1*        A  29   8.209 -13.983   8.599
  311    H8     A  29           H8         A  29   9.715 -16.292   6.156
  312   1H6     A  29          1H6         A  29   4.760 -15.641   2.557
  313   2H6     A  29          2H6         A  29   6.399 -16.247   2.643
  314    H2     A  29           H2         A  29   3.816 -13.854   6.570
  315   1H5*    A  30          1H5*        A  30   6.376 -18.462  12.936
  316   2H5*    A  30          2H5*        A  30   5.412 -19.920  12.626
  317    H4*    A  30           H4*        A  30   4.185 -17.680  13.194
  318    H3*    A  30           H3*        A  30   3.501 -19.660  11.002
  319    H2*    A  30           H2*        A  30   1.686 -18.275  10.319
  320   2HO*    A  30          2HO*        A  30   1.936 -17.331  12.917
  321    H1*    A  30           H1*        A  30   2.997 -15.914  10.377
  322    H8     A  30           H8         A  30   5.702 -18.106   9.228
  323   1H6     A  30          1H6         A  30   2.973 -18.559   3.733
  324   2H6     A  30          2H6         A  30   4.439 -18.859   4.635
  325    H2     A  30           H2         A  30   0.035 -16.717   6.592
  326   1H5*    G  31          1H5*        G  31   0.289 -18.794  12.108
  327   2H5*    G  31          2H5*        G  31  -0.734 -19.829  13.124
  328    H4*    G  31           H4*        G  31  -2.251 -19.187  11.484
  329    H3*    G  31           H3*        G  31  -0.868 -21.725  10.539
  330    H2*    G  31           H2*        G  31  -2.153 -21.639   8.558
  331   2HO*    G  31          2HO*        G  31  -3.822 -19.738   9.899
  332    H1*    G  31           H1*        G  31  -2.192 -18.863   8.266
  333    H8     G  31           H8         G  31   1.320 -19.865   8.909
  334    H1     G  31           H1         G  31  -0.530 -21.569   3.053
  335   1H2     G  31          1H2         G  31  -2.727 -21.348   2.856
  336   2H2     G  31          2H2         G  31  -3.735 -20.782   4.169
  337   1H5*    G  32          1H5*        G  32  -5.477 -22.861  11.233
  338   2H5*    G  32          2H5*        G  32  -5.508 -24.627  11.062
  339    H4*    G  32           H4*        G  32  -6.799 -23.098   9.335
  340    H3*    G  32           H3*        G  32  -5.139 -25.580   8.804
  341    H2*    G  32           H2*        G  32  -5.558 -25.346   6.460
  342   2HO*    G  32          2HO*        G  32  -7.061 -23.169   6.257
  343    H1*    G  32           H1*        G  32  -5.114 -22.695   6.285
  344    H8     G  32           H8         G  32  -2.621 -23.758   8.812
  345    H1     G  32           H1         G  32  -1.051 -25.849   2.997
  346   1H2     G  32          1H2         G  32  -2.755 -25.587   1.606
  347   2H2     G  32          2H2         G  32  -4.282 -24.896   2.110
  348   1H5*    U  33          1H5*        U  33  -8.173 -26.819   6.898
  349   2H5*    U  33          2H5*        U  33  -8.914 -28.354   7.394
  350    H4*    U  33           H4*        U  33  -8.095 -28.783   5.220
  351    H3*    U  33           H3*        U  33  -6.188 -29.758   7.375
  352    H2*    U  33           H2*        U  33  -4.708 -30.529   5.703
  353   2HO*    U  33          2HO*        U  33  -5.339 -30.968   3.638
  354    H1*    U  33           H1*        U  33  -4.970 -28.441   3.951
  355    H3     U  33           H3         U  33  -0.748 -28.326   5.642
  356    H5     U  33           H5         U  33  -3.146 -26.537   8.611
  357    H6     U  33           H6         U  33  -5.100 -27.210   7.344
  358   1H5*    C  34          1H5*        C  34  -5.959 -32.467   4.703
  359   2H5*    C  34          2H5*        C  34  -6.706 -34.013   5.146
  360    H4*    C  34           H4*        C  34  -4.685 -34.822   4.410
  361    H3*    C  34           H3*        C  34  -4.243 -33.944   7.277
  362    H2*    C  34           H2*        C  34  -1.989 -34.473   7.117
  363   2HO*    C  34          2HO*        C  34  -1.188 -36.008   5.705
  364    H1*    C  34           H1*        C  34  -1.707 -33.959   4.339
  365   1H4     C  34          1H4         C  34   1.655 -29.421   7.233
  366   2H4     C  34          2H4         C  34   0.221 -28.786   8.009
  367    H5     C  34           H5         C  34  -1.959 -29.792   7.783
  368    H6     C  34           H6         C  34  -3.232 -31.621   6.768
  369    H3T    C  34           H3T        C  34  -4.691 -36.007   7.640
  370   1H5*    U  35          1H5*        U  35  -4.071 -13.029   2.778
  371   2H5*    U  35          2H5*        U  35  -3.799 -11.410   2.101
  372    H4*    U  35           H4*        U  35  -3.319 -11.394   4.499
  373    H3*    U  35           H3*        U  35  -1.074 -11.022   2.519
  374    H2*    U  35           H2*        U  35   0.568 -11.028   4.203
  375   2HO*    U  35          2HO*        U  35   0.146 -10.072   6.042
  376    H1*    U  35           H1*        U  35  -0.420 -12.992   5.809
  377    H3     U  35           H3         U  35   3.233 -14.805   3.845
  378    H5     U  35           H5         U  35   0.362 -14.715   0.763
  379    H6     U  35           H6         U  35  -1.105 -13.491   2.261
  380    H5T    U  35           H5T        U  35  -2.818 -12.782   0.726
  381   1H5*    U  36          1H5*        U  36  -1.289  -7.677   5.766
  382   2H5*    U  36          2H5*        U  36  -0.179  -6.350   5.367
  383    H4*    U  36           H4*        U  36   0.207  -7.798   7.543
  384    H3*    U  36           H3*        U  36   2.213  -6.711   5.561
  385    H2*    U  36           H2*        U  36   3.999  -7.859   6.620
  386   2HO*    U  36          2HO*        U  36   2.756  -9.101   8.675
  387    H1*    U  36           H1*        U  36   2.799 -10.245   6.973
  388    H3     U  36           H3         U  36   5.773 -10.328   3.465
  389    H5     U  36           H5         U  36   2.102  -9.084   1.811
  390    H6     U  36           H6         U  36   1.224  -8.903   4.067
  391   1H5*    C  37          1H5*        C  37   3.653  -4.672   9.678
  392   2H5*    C  37          2H5*        C  37   4.592  -3.309   9.034
  393    H4*    C  37           H4*        C  37   5.793  -5.172  10.452
  394    H3*    C  37           H3*        C  37   6.733  -3.826   7.907
  395    H2*    C  37           H2*        C  37   8.677  -5.182   7.868
  396   2HO*    C  37          2HO*        C  37   9.416  -6.284   9.653
  397    H1*    C  37           H1*        C  37   7.518  -7.552   8.544
  398   1H4     C  37          1H4         C  37   7.700  -7.014   2.163
  399   2H4     C  37          2H4         C  37   6.051  -6.432   2.196
  400    H5     C  37           H5         C  37   4.860  -5.956   4.229
  401    H6     C  37           H6         C  37   4.990  -5.923   6.678
  402   1H5*    G  38          1H5*        G  38   9.693  -1.957  11.326
  403   2H5*    G  38          2H5*        G  38   9.991  -0.354  10.624
  404    H4*    G  38           H4*        G  38  12.072  -1.733  11.078
  405    H3*    G  38           H3*        G  38  11.348  -0.554   8.392
  406    H2*    G  38           H2*        G  38  13.223  -1.559   7.356
  407   2HO*    G  38          2HO*        G  38  14.789  -2.703   8.830
  408    H1*    G  38           H1*        G  38  13.101  -4.002   8.540
  409    H8     G  38           H8         G  38   9.540  -3.130   8.023
  410    H1     G  38           H1         G  38  12.427  -4.399   2.481
  411   1H2     G  38          1H2         G  38  14.625  -4.482   2.771
  412   2H2     G  38          2H2         G  38  15.377  -4.222   4.329
  413   1H5*    G  39          1H5*        G  39  15.602   1.177   9.289
  414   2H5*    G  39          2H5*        G  39  15.644   2.666   8.325
  415    H4*    G  39           H4*        G  39  17.327   0.731   7.782
  416    H3*    G  39           H3*        G  39  15.752   2.493   5.919
  417    H2*    G  39           H2*        G  39  16.347   1.242   4.008
  418   2HO*    G  39          2HO*        G  39  18.209   0.187   3.865
  419    H1*    G  39           H1*        G  39  16.131  -1.267   5.014
  420    H8     G  39           H8         G  39  13.344   0.521   6.667
  421    H1     G  39           H1         G  39  12.171  -0.324   0.457
  422   1H2     G  39          1H2         G  39  14.017  -0.985  -0.580
  423   2H2     G  39          2H2         G  39  15.535  -1.218   0.258
  424   1H5*    C  40          1H5*        C  40  18.336   2.476   3.434
  425   2H5*    C  40          2H5*        C  40  19.515   3.781   3.676
  426    H4*    C  40           H4*        C  40  19.142   4.121   1.444
  427    H3*    C  40           H3*        C  40  16.953   5.581   2.932
  428    H2*    C  40           H2*        C  40  15.792   6.043   0.943
  429   2HO*    C  40          2HO*        C  40  17.999   6.635  -0.038
  430    H1*    C  40           H1*        C  40  16.343   3.717  -0.454
  431   1H4     C  40          1H4         C  40  10.458   2.850   1.745
  432   2H4     C  40          2H4         C  40  11.008   2.927   3.405
  433    H5     C  40           H5         C  40  13.299   3.351   4.017
  434    H6     C  40           H6         C  40  15.557   3.791   3.173
  435   1H5*    U  41          1H5*        U  41  16.015   8.298   2.029
  436   2H5*    U  41          2H5*        U  41  16.938   7.935   0.557
  437    H4*    U  41           H4*        U  41  15.765  10.569   1.469
  438    H3*    U  41           H3*        U  41  15.497   8.715  -0.890
  439    H2*    U  41           H2*        U  41  15.453  10.474  -2.448
  440   2HO*    U  41          2HO*        U  41  15.319  12.554  -0.585
  441    H1*    U  41           H1*        U  41  17.275  12.171  -1.313
  442    H3     U  41           H3         U  41  18.914  10.428  -5.226
  443    H5     U  41           H5         U  41  19.877   7.614  -2.240
  444    H6     U  41           H6         U  41  18.482   8.867  -0.700
  445   1H5*    C  42          1H5*        C  42  10.923   9.888  -1.301
  446   2H5*    C  42          2H5*        C  42  10.360   8.354  -0.605
  447    H4*    C  42           H4*        C  42   9.595   8.991  -3.015
  448    H3*    C  42           H3*        C  42  10.586   6.338  -1.986
  449    H2*    C  42           H2*        C  42  10.666   5.385  -4.137
  450   2HO*    C  42          2HO*        C  42   9.157   7.619  -5.094
  451    H1*    C  42           H1*        C  42  11.577   7.525  -5.570
  452   1H4     C  42          1H4         C  42  16.698   4.030  -4.130
  453   2H4     C  42          2H4         C  42  16.743   4.716  -2.522
  454    H5     C  42           H5         C  42  15.061   6.223  -1.682
  455    H6     C  42           H6         C  42  12.972   7.396  -2.203
  456   1H5*    U  43          1H5*        U  43   9.042   5.518   0.673
  457   2H5*    U  43          2H5*        U  43   8.039   4.071   0.446
  458    H4*    U  43           H4*        U  43   7.843   5.493   2.665
  459    H3*    U  43           H3*        U  43   5.648   4.212   1.016
  460    H2*    U  43           H2*        U  43   3.993   5.129   2.436
  461   2HO*    U  43          2HO*        U  43   6.083   5.857   4.251
  462    H1*    U  43           H1*        U  43   5.106   7.602   2.817
  463    H3     U  43           H3         U  43   1.425   8.279   0.271
  464    H5     U  43           H5         U  43   4.217   6.603  -2.401
  465    H6     U  43           H6         U  43   5.702   6.241  -0.516
  466   1H5*    U  44          1H5*        U  44   5.471   3.251   5.595
  467   2H5*    U  44          2H5*        U  44   4.364   1.883   5.828
  468    H4*    U  44           H4*        U  44   3.847   4.216   6.951
  469    H3*    U  44           H3*        U  44   1.969   2.260   5.616
  470    H2*    U  44           H2*        U  44   0.144   3.748   5.826
  471   2HO*    U  44          2HO*        U  44   0.359   5.672   7.160
  472    H1*    U  44           H1*        U  44   1.413   6.073   5.193
  473    H3     U  44           H3         U  44  -1.370   4.920   1.762
  474    H5     U  44           H5         U  44   2.142   2.679   1.120
  475    H6     U  44           H6         U  44   2.930   3.417   3.294
  476   1H5*    C  45          1H5*        C  45  -0.231   3.486   9.620
  477   2H5*    C  45          2H5*        C  45  -0.603   1.850  10.200
  478    H4*    C  45           H4*        C  45  -2.613   3.293  10.212
  479    H3*    C  45           H3*        C  45  -2.472   0.899   8.360
  480    H2*    C  45           H2*        C  45  -4.614   1.394   7.494
  481   2HO*    C  45          2HO*        C  45  -5.029   2.275   9.984
  482    H1*    C  45           H1*        C  45  -4.408   4.138   7.425
  483   1H4     C  45          1H4         C  45  -3.107   2.122   1.533
  484   2H4     C  45          2H4         C  45  -1.507   1.618   2.028
  485    H5     C  45           H5         C  45  -0.736   1.723   4.308
  486    H6     C  45           H6         C  45  -1.332   2.332   6.606
  487   1H5*    C  46          1H5*        C  46  -6.194   1.015  10.907
  488   2H5*    C  46          2H5*        C  46  -7.100  -0.510  10.829
  489    H4*    C  46           H4*        C  46  -8.117   1.694   9.788
  490    H3*    C  46           H3*        C  46  -8.165  -1.138   8.734
  491    H2*    C  46           H2*        C  46  -9.183  -0.453   6.716
  492   2HO*    C  46          2HO*        C  46 -10.547   1.183   6.665
  493    H1*    C  46           H1*        C  46  -7.800   1.864   6.295
  494   1H4     C  46          1H4         C  46  -4.863  -2.739   2.997
  495   2H4     C  46          2H4         C  46  -3.919  -3.154   4.411
  496    H5     C  46           H5         C  46  -4.270  -2.152   6.573
  497    H6     C  46           H6         C  46  -5.602  -0.538   7.848
  498   1H5*    U  47          1H5*        U  47 -12.756   0.330   8.859
  499   2H5*    U  47          2H5*        U  47 -13.606  -1.227   8.830
  500    H4*    U  47           H4*        U  47 -13.968   0.519   6.882
  501    H3*    U  47           H3*        U  47 -13.678  -2.486   6.751
  502    H2*    U  47           H2*        U  47 -13.667  -2.467   4.393
  503   2HO*    U  47          2HO*        U  47 -14.276   0.270   4.169
  504    H1*    U  47           H1*        U  47 -12.174  -0.210   3.974
  505    H3     U  47           H3         U  47  -9.822  -3.908   2.653
  506    H5     U  47           H5         U  47  -9.167  -3.595   6.807
  507    H6     U  47           H6         U  47 -10.859  -1.856   6.876
  508   1H5*    A  48          1H5*        A  48 -18.163  -1.707   5.028
  509   2H5*    A  48          2H5*        A  48 -18.821  -3.356   5.075
  510    H4*    A  48           H4*        A  48 -18.490  -2.124   2.764
  511    H3*    A  48           H3*        A  48 -17.960  -4.984   3.535
  512    H2*    A  48           H2*        A  48 -16.975  -5.502   1.465
  513   2HO*    A  48          2HO*        A  48 -18.603  -3.547   0.571
  514    H1*    A  48           H1*        A  48 -15.411  -3.321   1.225
  515    H8     A  48           H8         A  48 -15.458  -3.878   4.896
  516   1H6     A  48          1H6         A  48 -11.599  -8.611   4.121
  517   2H6     A  48          2H6         A  48 -12.383  -7.577   5.293
  518    H2     A  48           H2         A  48 -13.127  -7.379   0.076
  519    H3T    A  48           H3T        A  48 -20.009  -4.846   2.980
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  10.067 -28.504   5.137
    2   2H5*    G   1          2H5*        G   1   9.791 -27.721   3.566
    3    H4*    G   1           H4*        G   1  10.605 -29.908   3.066
    4    H3*    G   1           H3*        G   1   7.686 -29.401   2.630
    5    H2*    G   1           H2*        G   1   7.118 -31.683   2.347
    6   2HO*    G   1          2HO*        G   1   9.872 -32.408   2.365
    7    H1*    G   1           H1*        G   1   8.489 -32.761   4.352
    8    H8     G   1           H8         G   1   7.930 -29.649   6.076
    9    H1     G   1           H1         G   1   2.308 -32.438   4.962
   10   1H2     G   1          1H2         G   1   2.539 -34.048   3.461
   11   2H2     G   1          2H2         G   1   4.080 -34.439   2.729
   12    H5T    G   1           H5T        G   1   7.802 -27.498   4.111
   13   1H5*    G   2          1H5*        G   2   7.834 -31.496  -0.329
   14   2H5*    G   2          2H5*        G   2   7.922 -30.739  -1.932
   15    H4*    G   2           H4*        G   2   6.064 -32.118  -2.179
   16    H3*    G   2           H3*        G   2   5.132 -29.393  -1.204
   17    H2*    G   2           H2*        G   2   2.896 -30.196  -1.249
   18   2HO*    G   2          2HO*        G   2   2.250 -31.778  -2.565
   19    H1*    G   2           H1*        G   2   3.402 -32.718  -0.289
   20    H8     G   2           H8         G   2   5.397 -30.492   1.883
   21    H1     G   2           H1         G   2  -0.836 -29.905   3.070
   22   1H2     G   2          1H2         G   2  -2.012 -30.881   1.463
   23   2H2     G   2          2H2         G   2  -1.259 -31.677   0.099
   24   1H5*    C   3          1H5*        C   3   2.692 -29.356  -4.212
   25   2H5*    C   3          2H5*        C   3   2.869 -27.927  -5.251
   26    H4*    C   3           H4*        C   3   0.683 -27.772  -4.303
   27    H3*    C   3           H3*        C   3   2.731 -25.995  -2.931
   28    H2*    C   3           H2*        C   3   1.080 -25.238  -1.445
   29   2HO*    C   3          2HO*        C   3  -0.513 -25.625  -3.653
   30    H1*    C   3           H1*        C   3  -0.489 -27.587  -1.376
   31   1H4     C   3          1H4         C   3   2.338 -26.883   4.295
   32   2H4     C   3          2H4         C   3   3.826 -27.535   3.646
   33    H5     C   3           H5         C   3   4.121 -28.087   1.319
   34    H6     C   3           H6         C   3   3.060 -28.131  -0.883
   35   1H5*    C   4          1H5*        C   4  -0.654 -23.614  -5.319
   36   2H5*    C   4          2H5*        C   4  -0.248 -21.887  -5.365
   37    H4*    C   4           H4*        C   4  -2.527 -22.610  -4.324
   38    H3*    C   4           H3*        C   4  -0.528 -20.605  -3.275
   39    H2*    C   4           H2*        C   4  -1.716 -20.319  -1.266
   40   2HO*    C   4          2HO*        C   4  -3.872 -21.487  -2.706
   41    H1*    C   4           H1*        C   4  -2.441 -22.878  -0.780
   42   1H4     C   4          1H4         C   4   2.988 -21.818   2.386
   43   2H4     C   4          2H4         C   4   3.911 -22.236   0.961
   44    H5     C   4           H5         C   4   2.899 -22.704  -1.178
   45    H6     C   4           H6         C   4   0.784 -22.870  -2.407
   46   1H5*    U   5          1H5*        U   5  -4.671 -18.526  -2.798
   47   2H5*    U   5          2H5*        U   5  -4.233 -16.822  -3.043
   48    H4*    U   5           H4*        U   5  -5.276 -17.613  -0.745
   49    H3*    U   5           H3*        U   5  -3.014 -15.669  -1.258
   50    H2*    U   5           H2*        U   5  -2.495 -15.555   1.003
   51   2HO*    U   5          2HO*        U   5  -5.269 -15.697   1.197
   52    H1*    U   5           H1*        U   5  -3.766 -18.014   1.832
   53    H3     U   5           H3         U   5   0.242 -17.630   4.024
   54    H5     U   5           H5         U   5   1.201 -18.855   0.105
   55    H6     U   5           H6         U   5  -1.109 -18.473  -0.510
   56   1H5*    U   6          1H5*        U   6  -8.397 -14.684  -0.966
   57   2H5*    U   6          2H5*        U   6  -8.109 -14.872  -2.707
   58    H4*    U   6           H4*        U   6  -9.524 -13.171  -3.118
   59    H3*    U   6           H3*        U   6  -7.440 -11.700  -1.495
   60    H2*    U   6           H2*        U   6  -8.936 -10.040  -0.906
   61   2HO*    U   6          2HO*        U   6  -9.380 -10.177  -3.564
   62    H1*    U   6           H1*        U   6 -11.376 -11.441  -1.689
   63    H3     U   6           H3         U   6 -12.478  -8.912   1.938
   64    H5     U   6           H5         U   6  -9.917 -11.890   3.460
   65    H6     U   6           H6         U   6  -9.494 -12.601   1.175
   66   1H5*    A   7          1H5*        A   7  -7.936  -9.448  -5.963
   67   2H5*    A   7          2H5*        A   7  -6.784  -8.103  -5.840
   68    H4*    A   7           H4*        A   7  -9.334  -7.618  -6.307
   69    H3*    A   7           H3*        A   7  -7.419  -6.159  -4.474
   70    H2*    A   7           H2*        A   7  -9.144  -4.754  -3.696
   71   2HO*    A   7          2HO*        A   7 -10.028  -4.150  -5.674
   72    H1*    A   7           H1*        A   7 -11.208  -6.591  -3.650
   73    H8     A   7           H8         A   7  -8.322  -8.342  -2.131
   74   1H6     A   7          1H6         A   7  -9.174  -5.069   3.016
   75   2H6     A   7          2H6         A   7  -8.337  -6.430   2.304
   76    H2     A   7           H2         A   7 -11.704  -3.254  -0.226
   77   1H5*    G   8          1H5*        G   8  -8.996  -3.014  -7.029
   78   2H5*    G   8          2H5*        G   8  -7.827  -1.688  -7.191
   79    H4*    G   8           H4*        G   8 -10.016  -1.257  -5.843
   80    H3*    G   8           H3*        G   8  -7.188  -0.561  -4.995
   81    H2*    G   8           H2*        G   8  -7.972   0.262  -2.947
   82   2HO*    G   8          2HO*        G   8 -10.300   0.752  -2.724
   83    H1*    G   8           H1*        G   8 -10.195  -1.437  -2.640
   84    H8     G   8           H8         G   8  -7.218  -3.567  -3.178
   85    H1     G   8           H1         G   8  -7.138  -0.890   2.609
   86   1H2     G   8          1H2         G   8  -8.669   0.707   2.727
   87   2H2     G   8          2H2         G   8  -9.710   1.113   1.381
   88   1H5*    G   9          1H5*        G   9 -10.345   3.322  -5.680
   89   2H5*    G   9          2H5*        G   9  -9.248   4.705  -5.488
   90    H4*    G   9           H4*        G   9 -11.483   4.620  -4.109
   91    H3*    G   9           H3*        G   9  -8.725   5.485  -3.261
   92    H2*    G   9           H2*        G   9  -9.353   5.669  -0.979
   93   2HO*    G   9          2HO*        G   9 -11.737   5.265  -0.520
   94    H1*    G   9           H1*        G   9 -10.741   3.388  -0.733
   95    H8     G   9           H8         G   9  -8.184   2.426  -3.227
   96    H1     G   9           H1         G   9  -5.597   3.158   2.553
   97   1H2     G   9          1H2         G   9  -7.033   4.169   3.906
   98   2H2     G   9          2H2         G   9  -8.628   4.663   3.385
   99   1H5*    A  10          1H5*        A  10 -10.612   9.172  -1.671
  100   2H5*    A  10          2H5*        A  10  -9.307  10.338  -1.966
  101    H4*    A  10           H4*        A  10  -9.848   9.600   0.495
  102    H3*    A  10           H3*        A  10  -7.105   9.838  -0.791
  103    H2*    A  10           H2*        A  10  -6.120   9.217   1.267
  104   2HO*    A  10          2HO*        A  10  -6.961  10.023   3.027
  105    H1*    A  10           H1*        A  10  -8.029   7.351   2.036
  106    H8     A  10           H8         A  10  -7.359   6.376  -1.410
  107   1H6     A  10          1H6         A  10  -1.835   4.239   0.267
  108   2H6     A  10          2H6         A  10  -3.036   4.266  -1.004
  109    H2     A  10           H2         A  10  -3.451   6.728   3.643
  110   1H5*    A  11          1H5*        A  11  -7.110  13.363   2.379
  111   2H5*    A  11          2H5*        A  11  -5.750  14.372   1.846
  112    H4*    A  11           H4*        A  11  -5.632  13.101   4.155
  113    H3*    A  11           H3*        A  11  -3.496  13.521   2.065
  114    H2*    A  11           H2*        A  11  -1.976  12.110   3.196
  115   2HO*    A  11          2HO*        A  11  -3.755  12.345   5.424
  116    H1*    A  11           H1*        A  11  -3.693  10.139   3.964
  117    H8     A  11           H8         A  11  -4.910  10.904   0.576
  118   1H6     A  11          1H6         A  11   0.000   8.018  -1.764
  119   2H6     A  11          2H6         A  11  -1.570   8.698  -2.125
  120    H2     A  11           H2         A  11   0.710   8.635   2.631
  121   1H5*    A  12          1H5*        A  12  -0.986  13.827   5.043
  122   2H5*    A  12          2H5*        A  12   0.047  15.251   4.806
  123    H4*    A  12           H4*        A  12   1.367  13.176   4.630
  124    H3*    A  12           H3*        A  12   0.955  14.854   2.132
  125    H2*    A  12           H2*        A  12   2.250  13.334   0.909
  126   2HO*    A  12          2HO*        A  12   4.071  13.211   2.181
  127    H1*    A  12           H1*        A  12   1.548  10.998   2.245
  128    H8     A  12           H8         A  12  -1.469  12.916   1.220
  129   1H6     A  12          1H6         A  12  -0.598  10.959  -4.553
  130   2H6     A  12          2H6         A  12  -1.701  11.780  -3.472
  131    H2     A  12           H2         A  12   3.018   9.849  -2.125
  132   1H5*    C  13          1H5*        C  13   5.543  14.922   3.635
  133   2H5*    C  13          2H5*        C  13   6.373  16.153   2.664
  134    H4*    C  13           H4*        C  13   7.316  13.735   2.636
  135    H3*    C  13           H3*        C  13   6.747  15.460   0.199
  136    H2*    C  13           H2*        C  13   7.579  13.695  -1.185
  137   2HO*    C  13          2HO*        C  13   9.359  13.012   0.002
  138    H1*    C  13           H1*        C  13   6.233  11.701  -0.022
  139   1H4     C  13          1H4         C  13   2.528  14.211  -4.581
  140   2H4     C  13          2H4         C  13   1.677  15.115  -3.351
  141    H5     C  13           H5         C  13   2.371  15.181  -1.049
  142    H6     C  13           H6         C  13   4.023  14.394   0.573
  143   1H5*    A  14          1H5*        A  14  11.284  14.408  -0.312
  144   2H5*    A  14          2H5*        A  14  11.800  15.715  -1.395
  145    H4*    A  14           H4*        A  14  11.870  13.205  -2.213
  146    H3*    A  14           H3*        A  14  10.908  15.637  -3.770
  147    H2*    A  14           H2*        A  14  10.571  14.190  -5.655
  148   2HO*    A  14          2HO*        A  14  11.439  12.163  -5.770
  149    H1*    A  14           H1*        A  14   9.333  12.209  -4.296
  150    H8     A  14           H8         A  14   8.012  15.177  -2.563
  151   1H6     A  14          1H6         A  14   4.377  16.292  -7.399
  152   2H6     A  14          2H6         A  14   4.707  16.694  -5.729
  153    H2     A  14           H2         A  14   7.407  13.205  -8.618
  154   1H5*    G  15          1H5*        G  15  13.836  14.287  -6.169
  155   2H5*    G  15          2H5*        G  15  15.046  15.462  -6.719
  156    H4*    G  15           H4*        G  15  13.968  14.612  -8.684
  157    H3*    G  15           H3*        G  15  12.966  17.370  -7.868
  158    H2*    G  15           H2*        G  15  11.697  17.382  -9.920
  159   2HO*    G  15          2HO*        G  15  12.123  16.019 -11.569
  160    H1*    G  15           H1*        G  15  10.693  14.875  -9.608
  161    H8     G  15           H8         G  15  10.864  16.180  -6.130
  162    H1     G  15           H1         G  15   6.258  19.052  -9.464
  163   1H2     G  15          1H2         G  15   6.469  18.572 -11.619
  164   2H2     G  15          2H2         G  15   7.744  17.544 -12.233
  165   1H5*    U  16          1H5*        U  16  13.644  17.651 -11.246
  166   2H5*    U  16          2H5*        U  16  14.551  18.900 -12.120
  167    H4*    U  16           H4*        U  16  12.352  19.149 -12.923
  168    H3*    U  16           H3*        U  16  12.826  21.081 -10.610
  169    H2*    U  16           H2*        U  16  10.677  21.970 -11.057
  170   2HO*    U  16          2HO*        U  16  10.501  20.459 -13.465
  171    H1*    U  16           H1*        U  16   9.469  19.531 -11.700
  172    H3     U  16           H3         U  16   7.391  21.295  -8.036
  173    H5     U  16           H5         U  16  10.982  19.639  -6.590
  174    H6     U  16           H6         U  16  11.659  19.257  -8.868
  175   1H5*    U  17          1H5*        U  17  12.798  25.153 -11.269
  176   2H5*    U  17          2H5*        U  17  11.417  24.102 -11.634
  177    H4*    U  17           H4*        U  17  12.027  26.840 -12.601
  178    H3*    U  17           H3*        U  17   9.941  25.813 -11.243
  179    H2*    U  17           H2*        U  17   9.354  24.084 -12.794
  180   2HO*    U  17          2HO*        U  17   7.874  25.966 -14.211
  181    H1*    U  17           H1*        U  17   9.574  25.858 -15.194
  182    H3     U  17           H3         U  17   8.462  21.802 -16.980
  183    H5     U  17           H5         U  17  12.153  21.160 -15.053
  184    H6     U  17           H6         U  17  12.036  23.411 -14.200
  185   1H5*    C  18          1H5*        C  18   6.001  25.946 -12.689
  186   2H5*    C  18          2H5*        C  18   5.873  27.700 -12.450
  187    H4*    C  18           H4*        C  18   4.094  26.439 -11.242
  188    H3*    C  18           H3*        C  18   5.457  28.604 -10.284
  189    H2*    C  18           H2*        C  18   7.173  27.391  -9.137
  190   2HO*    C  18          2HO*        C  18   4.977  27.644  -7.321
  191    H1*    C  18           H1*        C  18   5.161  25.428  -8.043
  192   1H4     C  18          1H4         C  18  10.622  22.511  -6.627
  193   2H4     C  18          2H4         C  18  11.178  22.663  -8.278
  194    H5     C  18           H5         C  18   9.942  23.817  -9.989
  195    H6     C  18           H6         C  18   7.900  25.075 -10.491
  196   1H5*    G  19          1H5*        G  19   0.677  26.531 -10.677
  197   2H5*    G  19          2H5*        G  19   2.142  25.545 -10.494
  198    H4*    G  19           H4*        G  19   0.499  26.094 -12.950
  199    H3*    G  19           H3*        G  19   1.876  23.705 -11.662
  200    H2*    G  19           H2*        G  19   1.976  22.686 -13.788
  201   2HO*    G  19          2HO*        G  19  -0.173  24.437 -14.347
  202    H1*    G  19           H1*        G  19   2.387  25.019 -15.279
  203    H8     G  19           H8         G  19   4.587  24.177 -16.241
  204    H1     G  19           H1         G  19   6.776  22.106 -10.622
  205   1H2     G  19          1H2         G  19   5.283  22.508  -9.034
  206   2H2     G  19          2H2         G  19   3.750  23.286  -9.359
  207   1H5*    C  20          1H5*        C  20  -0.465  22.251 -14.048
  208   2H5*    C  20          2H5*        C  20  -1.189  20.660 -13.745
  209    H4*    C  20           H4*        C  20   0.569  20.623 -15.525
  210    H3*    C  20           H3*        C  20   0.777  18.986 -12.993
  211    H2*    C  20           H2*        C  20   2.925  18.181 -13.596
  212   2HO*    C  20          2HO*        C  20   1.968  18.547 -16.093
  213    H1*    C  20           H1*        C  20   4.005  20.499 -14.465
  214   1H4     C  20          1H4         C  20   5.109  20.007  -8.182
  215   2H4     C  20          2H4         C  20   3.647  20.917  -7.873
  216    H5     C  20           H5         C  20   2.105  21.561  -9.595
  217    H6     C  20           H6         C  20   1.623  21.483 -11.993
  218   1H5*    U  21          1H5*        U  21   2.267  16.823 -15.663
  219   2H5*    U  21          2H5*        U  21   1.287  15.500 -16.328
  220    H4*    U  21           H4*        U  21   3.391  14.502 -16.133
  221    H3*    U  21           H3*        U  21   1.709  13.946 -13.678
  222    H2*    U  21           H2*        U  21   3.521  12.770 -12.684
  223   2HO*    U  21          2HO*        U  21   5.455  12.350 -13.978
  224    H1*    U  21           H1*        U  21   5.507  14.498 -13.342
  225    H3     U  21           H3         U  21   4.865  15.206  -8.916
  226    H5     U  21           H5         U  21   1.646  17.207 -10.763
  227    H6     U  21           H6         U  21   2.328  16.216 -12.872
  228   1H5*    G  22          1H5*        G  22   3.479  10.222 -14.773
  229   2H5*    G  22          2H5*        G  22   2.604   8.878 -14.012
  230    H4*    G  22           H4*        G  22   4.972   9.587 -13.096
  231    H3*    G  22           H3*        G  22   2.479   8.876 -11.525
  232    H2*    G  22           H2*        G  22   3.509   9.474  -9.534
  233   2HO*    G  22          2HO*        G  22   5.662   9.097  -9.142
  234    H1*    G  22           H1*        G  22   5.510  11.213 -10.591
  235    H8     G  22           H8         G  22   2.081  12.520 -11.123
  236    H1     G  22           H1         G  22   3.874  13.137  -5.044
  237   1H2     G  22          1H2         G  22   5.731  11.987  -4.678
  238   2H2     G  22          2H2         G  22   6.531  11.070  -5.936
  239   1H5*    U  23          1H5*        U  23   5.984   5.782 -10.367
  240   2H5*    U  23          2H5*        U  23   5.101   4.436  -9.620
  241    H4*    U  23           H4*        U  23   6.931   5.676  -8.224
  242    H3*    U  23           H3*        U  23   4.151   4.858  -7.348
  243    H2*    U  23           H2*        U  23   4.434   5.895  -5.261
  244   2HO*    U  23          2HO*        U  23   7.123   5.341  -5.784
  245    H1*    U  23           H1*        U  23   6.031   8.039  -6.049
  246    H3     U  23           H3         U  23   2.102   9.488  -4.155
  247    H5     U  23           H5         U  23   1.250   8.803  -8.229
  248    H6     U  23           H6         U  23   3.422   7.746  -8.437
  249   1H5*    G  24          1H5*        G  24   5.855   0.761  -7.931
  250   2H5*    G  24          2H5*        G  24   6.643  -0.375  -6.818
  251    H4*    G  24           H4*        G  24   7.846   0.732  -9.023
  252    H3*    G  24           H3*        G  24   8.816  -0.555  -6.484
  253    H2*    G  24           H2*        G  24  11.026   0.262  -6.738
  254   2HO*    G  24          2HO*        G  24  10.626  -0.085  -9.256
  255    H1*    G  24           H1*        G  24  10.494   2.783  -7.413
  256    H8     G  24           H8         G  24   7.598   2.011  -5.237
  257    H1     G  24           H1         G  24  12.973   2.471  -1.839
  258   1H2     G  24          1H2         G  24  14.728   2.481  -3.192
  259   2H2     G  24          2H2         G  24  14.575   2.375  -4.932
  260   1H5*    C  25          1H5*        C  25  12.324  -1.141  -8.440
  261   2H5*    C  25          2H5*        C  25  12.313  -2.866  -8.850
  262    H4*    C  25           H4*        C  25  14.413  -2.505  -7.807
  263    H3*    C  25           H3*        C  25  12.356  -3.693  -5.915
  264    H2*    C  25           H2*        C  25  13.936  -3.669  -4.171
  265   2HO*    C  25          2HO*        C  25  15.911  -3.344  -6.215
  266    H1*    C  25           H1*        C  25  15.260  -1.316  -4.854
  267   1H4     C  25          1H4         C  25  11.439  -0.028   0.081
  268   2H4     C  25          2H4         C  25  10.080   0.147  -1.006
  269    H5     C  25           H5         C  25  10.211  -0.311  -3.366
  270    H6     C  25           H6         C  25  11.672  -1.038  -5.190
  271   1H5*    C  26          1H5*        C  26  15.953  -5.401  -5.446
  272   2H5*    C  26          2H5*        C  26  16.046  -7.041  -6.118
  273    H4*    C  26           H4*        C  26  17.319  -7.316  -4.206
  274    H3*    C  26           H3*        C  26  14.422  -7.919  -3.566
  275    H2*    C  26           H2*        C  26  14.947  -8.207  -1.267
  276   2HO*    C  26          2HO*        C  26  16.798  -9.118  -0.809
  277    H1*    C  26           H1*        C  26  16.567  -6.070  -0.963
  278   1H4     C  26          1H4         C  26  10.779  -3.816   0.362
  279   2H4     C  26          2H4         C  26  10.320  -3.880  -1.326
  280    H5     C  26           H5         C  26  11.752  -4.761  -3.050
  281    H6     C  26           H6         C  26  13.933  -5.769  -3.532
  282   1H5*    G  27          1H5*        G  27  16.867 -10.833  -1.498
  283   2H5*    G  27          2H5*        G  27  15.863 -12.225  -1.047
  284    H4*    G  27           H4*        G  27  16.721 -10.541   0.803
  285    H3*    G  27           H3*        G  27  13.940 -11.753   0.551
  286    H2*    G  27           H2*        G  27  13.325 -10.627   2.530
  287   2HO*    G  27          2HO*        G  27  15.583  -9.537   3.443
  288    H1*    G  27           H1*        G  27  14.879  -8.323   2.123
  289    H8     G  27           H8         G  27  12.916  -8.824  -0.967
  290    H1     G  27           H1         G  27   9.173  -6.969   3.848
  291   1H2     G  27          1H2         G  27  10.280  -7.110   5.765
  292   2H2     G  27          2H2         G  27  11.938  -7.662   5.855
  293   1H5*    A  28          1H5*        A  28  15.301 -14.125   4.392
  294   2H5*    A  28          2H5*        A  28  14.166 -15.487   4.300
  295    H4*    A  28           H4*        A  28  13.948 -13.701   6.237
  296    H3*    A  28           H3*        A  28  11.747 -14.991   4.593
  297    H2*    A  28           H2*        A  28  10.126 -13.710   5.727
  298   2HO*    A  28          2HO*        A  28  11.313 -14.220   7.821
  299    H1*    A  28           H1*        A  28  11.590 -11.367   6.012
  300    H8     A  28           H8         A  28  12.008 -12.380   2.478
  301   1H6     A  28          1H6         A  28   6.291 -10.384   1.343
  302   2H6     A  28          2H6         A  28   7.790 -10.926   0.622
  303    H2     A  28           H2         A  28   6.869 -10.506   5.798
  304   1H5*    A  29          1H5*        A  29  11.433 -16.426   9.357
  305   2H5*    A  29          2H5*        A  29  10.184 -17.685   9.276
  306    H4*    A  29           H4*        A  29   9.880 -15.615  10.888
  307    H3*    A  29           H3*        A  29   7.873 -17.069   9.175
  308    H2*    A  29           H2*        A  29   6.177 -15.466   9.579
  309   2HO*    A  29          2HO*        A  29   7.572 -15.120  11.890
  310    H1*    A  29           H1*        A  29   7.626 -13.223   9.263
  311    H8     A  29           H8         A  29   9.287 -15.430   6.823
  312   1H6     A  29          1H6         A  29   4.357 -15.017   3.152
  313   2H6     A  29          2H6         A  29   6.023 -15.540   3.261
  314    H2     A  29           H2         A  29   3.265 -13.295   7.157
  315   1H5*    A  30          1H5*        A  30   5.780 -17.688  13.370
  316   2H5*    A  30          2H5*        A  30   5.074 -19.295  13.109
  317    H4*    A  30           H4*        A  30   3.445 -17.337  13.531
  318    H3*    A  30           H3*        A  30   3.271 -19.334  11.252
  319    H2*    A  30           H2*        A  30   1.303 -18.241  10.458
  320   2HO*    A  30          2HO*        A  30   1.357 -16.513  12.722
  321    H1*    A  30           H1*        A  30   2.219 -15.717  10.616
  322    H8     A  30           H8         A  30   5.326 -17.484   9.743
  323   1H6     A  30          1H6         A  30   3.221 -18.279   4.011
  324   2H6     A  30          2H6         A  30   4.624 -18.382   5.052
  325    H2     A  30           H2         A  30  -0.198 -16.869   6.566
  326   1H5*    G  31          1H5*        G  31  -0.093 -18.930  12.281
  327   2H5*    G  31          2H5*        G  31  -1.054 -20.097  13.213
  328    H4*    G  31           H4*        G  31  -2.554 -19.462  11.540
  329    H3*    G  31           H3*        G  31  -1.018 -21.916  10.616
  330    H2*    G  31           H2*        G  31  -2.196 -21.854   8.573
  331   2HO*    G  31          2HO*        G  31  -4.189 -21.075  10.132
  332    H1*    G  31           H1*        G  31  -2.406 -19.075   8.334
  333    H8     G  31           H8         G  31   1.135 -19.862   9.079
  334    H1     G  31           H1         G  31  -0.395 -21.537   3.122
  335   1H2     G  31          1H2         G  31  -2.595 -21.464   2.856
  336   2H2     G  31          2H2         G  31  -3.684 -21.004   4.146
  337   1H5*    G  32          1H5*        G  32  -5.579 -23.069  11.037
  338   2H5*    G  32          2H5*        G  32  -5.672 -24.839  10.924
  339    H4*    G  32           H4*        G  32  -6.794 -23.328   9.069
  340    H3*    G  32           H3*        G  32  -5.234 -25.898   8.777
  341    H2*    G  32           H2*        G  32  -5.300 -25.755   6.417
  342   2HO*    G  32          2HO*        G  32  -6.886 -23.584   6.030
  343    H1*    G  32           H1*        G  32  -4.976 -23.049   6.137
  344    H8     G  32           H8         G  32  -2.534 -23.995   8.755
  345    H1     G  32           H1         G  32  -0.709 -26.095   3.019
  346   1H2     G  32          1H2         G  32  -2.382 -25.913   1.576
  347   2H2     G  32          2H2         G  32  -3.948 -25.274   2.027
  348   1H5*    U  33          1H5*        U  33  -8.317 -27.824   6.650
  349   2H5*    U  33          2H5*        U  33  -8.249 -29.445   7.371
  350    H4*    U  33           H4*        U  33  -7.304 -29.168   4.982
  351    H3*    U  33           H3*        U  33  -5.947 -30.517   7.322
  352    H2*    U  33           H2*        U  33  -3.940 -30.669   6.209
  353   2HO*    U  33          2HO*        U  33  -4.825 -32.031   4.599
  354    H1*    U  33           H1*        U  33  -4.409 -28.716   4.156
  355    H3     U  33           H3         U  33  -0.056 -28.484   5.574
  356    H5     U  33           H5         U  33  -2.323 -26.634   8.608
  357    H6     U  33           H6         U  33  -4.330 -27.389   7.473
  358   1H5*    C  34          1H5*        C  34  -5.836 -33.336   3.939
  359   2H5*    C  34          2H5*        C  34  -6.509 -34.896   4.451
  360    H4*    C  34           H4*        C  34  -4.487 -35.586   3.549
  361    H3*    C  34           H3*        C  34  -4.011 -34.892   6.462
  362    H2*    C  34           H2*        C  34  -1.758 -35.475   6.227
  363   2HO*    C  34          2HO*        C  34  -1.135 -36.548   4.116
  364    H1*    C  34           H1*        C  34  -1.444 -34.533   3.612
  365   1H4     C  34          1H4         C  34   1.341 -30.168   7.281
  366   2H4     C  34          2H4         C  34  -0.181 -29.762   8.039
  367    H5     C  34           H5         C  34  -2.243 -30.899   7.551
  368    H6     C  34           H6         C  34  -3.303 -32.668   6.219
  369    H3T    C  34           H3T        C  34  -4.196 -37.083   6.671
  370   1H5*    U  35          1H5*        U  35  -4.265 -13.073   3.209
  371   2H5*    U  35          2H5*        U  35  -4.556 -11.397   2.703
  372    H4*    U  35           H4*        U  35  -3.769 -11.154   4.903
  373    H3*    U  35           H3*        U  35  -1.610 -10.763   2.833
  374    H2*    U  35           H2*        U  35   0.083 -10.616   4.465
  375   2HO*    U  35          2HO*        U  35  -1.844  -9.464   5.882
  376    H1*    U  35           H1*        U  35  -0.772 -12.550   6.187
  377    H3     U  35           H3         U  35   2.909 -14.312   4.248
  378    H5     U  35           H5         U  35   0.019 -14.414   1.184
  379    H6     U  35           H6         U  35  -1.485 -13.205   2.656
  380    H5T    U  35           H5T        U  35  -3.352 -11.998   1.088
  381   1H5*    U  36          1H5*        U  36  -1.837  -7.315   5.947
  382   2H5*    U  36          2H5*        U  36  -0.832  -5.946   5.426
  383    H4*    U  36           H4*        U  36  -0.238  -7.267   7.635
  384    H3*    U  36           H3*        U  36   1.599  -6.191   5.483
  385    H2*    U  36           H2*        U  36   3.490  -7.152   6.540
  386   2HO*    U  36          2HO*        U  36   1.765  -7.610   8.779
  387    H1*    U  36           H1*        U  36   2.419  -9.567   7.160
  388    H3     U  36           H3         U  36   5.359  -9.931   3.657
  389    H5     U  36           H5         U  36   1.665  -8.893   1.914
  390    H6     U  36           H6         U  36   0.792  -8.524   4.149
  391   1H5*    C  37          1H5*        C  37   3.159  -4.021   9.388
  392   2H5*    C  37          2H5*        C  37   3.834  -2.523   8.718
  393    H4*    C  37           H4*        C  37   5.452  -4.070   9.991
  394    H3*    C  37           H3*        C  37   5.920  -2.970   7.199
  395    H2*    C  37           H2*        C  37   8.029  -4.059   7.142
  396   2HO*    C  37          2HO*        C  37   9.118  -4.055   8.958
  397    H1*    C  37           H1*        C  37   7.244  -6.432   8.237
  398   1H4     C  37          1H4         C  37   6.946  -6.845   1.859
  399   2H4     C  37          2H4         C  37   5.285  -6.300   1.911
  400    H5     C  37           H5         C  37   4.197  -5.570   3.933
  401    H6     C  37           H6         C  37   4.471  -5.198   6.341
  402   1H5*    G  38          1H5*        G  38   9.039  -0.750  10.268
  403   2H5*    G  38          2H5*        G  38   9.837   0.468   9.256
  404    H4*    G  38           H4*        G  38  11.258  -1.427  10.417
  405    H3*    G  38           H3*        G  38  11.505  -0.224   7.663
  406    H2*    G  38           H2*        G  38  13.125  -1.814   6.991
  407   2HO*    G  38          2HO*        G  38  13.267  -2.760   9.684
  408    H1*    G  38           H1*        G  38  11.997  -4.040   8.011
  409    H8     G  38           H8         G  38   9.018  -2.100   6.998
  410    H1     G  38           H1         G  38  12.278  -4.131   1.905
  411   1H2     G  38          1H2         G  38  14.267  -4.883   2.528
  412   2H2     G  38          2H2         G  38  14.792  -4.883   4.196
  413   1H5*    G  39          1H5*        G  39  15.782   0.705   9.412
  414   2H5*    G  39          2H5*        G  39  16.147   2.263   8.643
  415    H4*    G  39           H4*        G  39  17.719   0.303   8.101
  416    H3*    G  39           H3*        G  39  16.392   2.160   6.136
  417    H2*    G  39           H2*        G  39  17.129   0.922   4.270
  418   2HO*    G  39          2HO*        G  39  18.703  -0.954   5.503
  419    H1*    G  39           H1*        G  39  16.780  -1.603   5.220
  420    H8     G  39           H8         G  39  13.833   0.204   6.534
  421    H1     G  39           H1         G  39  13.410  -0.602   0.224
  422   1H2     G  39          1H2         G  39  15.365  -1.264  -0.589
  423   2H2     G  39          2H2         G  39  16.771  -1.507   0.424
  424   1H5*    C  40          1H5*        C  40  19.126   1.758   3.880
  425   2H5*    C  40          2H5*        C  40  20.340   3.043   4.032
  426    H4*    C  40           H4*        C  40  20.049   3.138   1.756
  427    H3*    C  40           H3*        C  40  17.846   4.833   2.975
  428    H2*    C  40           H2*        C  40  16.913   5.181   0.844
  429   2HO*    C  40          2HO*        C  40  18.506   5.821  -0.455
  430    H1*    C  40           H1*        C  40  17.553   2.701  -0.286
  431   1H4     C  40          1H4         C  40  11.316   2.491   0.886
  432   2H4     C  40          2H4         C  40  11.584   2.612   2.610
  433    H5     C  40           H5         C  40  13.770   2.870   3.590
  434    H6     C  40           H6         C  40  16.170   3.069   3.128
  435   1H5*    U  41          1H5*        U  41  17.127   7.882   3.209
  436   2H5*    U  41          2H5*        U  41  15.914   7.008   2.251
  437    H4*    U  41           H4*        U  41  15.610   9.531   2.351
  438    H3*    U  41           H3*        U  41  15.811   7.912  -0.192
  439    H2*    U  41           H2*        U  41  15.773   9.835  -1.537
  440   2HO*    U  41          2HO*        U  41  15.237  11.900  -0.040
  441    H1*    U  41           H1*        U  41  17.158  11.582   0.112
  442    H3     U  41           H3         U  41  20.235  11.359  -3.115
  443    H5     U  41           H5         U  41  19.695   7.308  -2.082
  444    H6     U  41           H6         U  41  17.983   8.007  -0.509
  445   1H5*    C  42          1H5*        C  42  11.046   8.765  -0.452
  446   2H5*    C  42          2H5*        C  42  10.562   7.069  -0.249
  447    H4*    C  42           H4*        C  42   9.852   8.449  -2.407
  448    H3*    C  42           H3*        C  42  10.528   5.571  -1.983
  449    H2*    C  42           H2*        C  42  10.929   5.075  -4.230
  450   2HO*    C  42          2HO*        C  42  10.082   6.491  -5.911
  451    H1*    C  42           H1*        C  42  11.957   7.440  -5.161
  452   1H4     C  42          1H4         C  42  16.792   3.421  -4.036
  453   2H4     C  42          2H4         C  42  16.970   4.116  -2.442
  454    H5     C  42           H5         C  42  15.434   5.730  -1.526
  455    H6     C  42           H6         C  42  13.396   7.027  -1.942
  456   1H5*    U  43          1H5*        U  43   9.052   5.372   0.714
  457   2H5*    U  43          2H5*        U  43   8.268   3.784   0.599
  458    H4*    U  43           H4*        U  43   7.637   5.430   2.563
  459    H3*    U  43           H3*        U  43   5.826   3.681   0.881
  460    H2*    U  43           H2*        U  43   3.914   4.555   1.922
  461   2HO*    U  43          2HO*        U  43   5.380   4.426   4.062
  462    H1*    U  43           H1*        U  43   4.797   7.163   2.343
  463    H3     U  43           H3         U  43   1.267   7.733  -0.392
  464    H5     U  43           H5         U  43   4.084   5.748  -2.820
  465    H6     U  43           H6         U  43   5.511   5.528  -0.869
  466   1H5*    U  44          1H5*        U  44   5.487   3.208   5.803
  467   2H5*    U  44          2H5*        U  44   4.430   1.795   5.991
  468    H4*    U  44           H4*        U  44   3.791   4.091   7.127
  469    H3*    U  44           H3*        U  44   2.017   2.094   5.704
  470    H2*    U  44           H2*        U  44   0.139   3.510   5.934
  471   2HO*    U  44          2HO*        U  44   0.766   5.599   7.296
  472    H1*    U  44           H1*        U  44   1.347   5.899   5.399
  473    H3     U  44           H3         U  44  -1.378   4.853   1.897
  474    H5     U  44           H5         U  44   2.124   2.601   1.246
  475    H6     U  44           H6         U  44   2.898   3.293   3.439
  476   1H5*    C  45          1H5*        C  45  -0.119   3.808   9.167
  477   2H5*    C  45          2H5*        C  45  -0.500   2.410  10.193
  478    H4*    C  45           H4*        C  45  -2.485   3.774  10.048
  479    H3*    C  45           H3*        C  45  -2.508   1.190   8.468
  480    H2*    C  45           H2*        C  45  -4.670   1.667   7.644
  481   2HO*    C  45          2HO*        C  45  -6.090   2.700   8.840
  482    H1*    C  45           H1*        C  45  -4.369   4.366   7.234
  483   1H4     C  45          1H4         C  45  -3.288   1.676   1.577
  484   2H4     C  45          2H4         C  45  -1.757   1.037   2.129
  485    H5     C  45           H5         C  45  -0.962   1.282   4.389
  486    H6     C  45           H6         C  45  -1.464   2.189   6.610
  487   1H5*    C  46          1H5*        C  46  -6.213   1.668  11.025
  488   2H5*    C  46          2H5*        C  46  -7.108   0.136  11.073
  489    H4*    C  46           H4*        C  46  -8.126   2.231   9.828
  490    H3*    C  46           H3*        C  46  -8.130  -0.681   9.003
  491    H2*    C  46           H2*        C  46  -9.176  -0.151   6.948
  492   2HO*    C  46          2HO*        C  46 -10.788   1.232   7.519
  493    H1*    C  46           H1*        C  46  -7.784   2.118   6.348
  494   1H4     C  46          1H4         C  46  -4.860  -2.750   3.443
  495   2H4     C  46          2H4         C  46  -3.983  -3.113   4.912
  496    H5     C  46           H5         C  46  -4.366  -1.970   6.997
  497    H6     C  46           H6         C  46  -5.677  -0.232   8.125
  498   1H5*    U  47          1H5*        U  47 -12.691   0.894   9.302
  499   2H5*    U  47          2H5*        U  47 -13.639  -0.607   9.355
  500    H4*    U  47           H4*        U  47 -14.062   1.128   7.428
  501    H3*    U  47           H3*        U  47 -13.882  -1.885   7.276
  502    H2*    U  47           H2*        U  47 -14.061  -1.855   4.923
  503   2HO*    U  47          2HO*        U  47 -14.825   0.896   5.135
  504    H1*    U  47           H1*        U  47 -12.500   0.330   4.399
  505    H3     U  47           H3         U  47 -10.458  -3.523   2.968
  506    H5     U  47           H5         U  47  -9.423  -3.141   7.036
  507    H6     U  47           H6         U  47 -11.013  -1.316   7.202
  508   1H5*    A  48          1H5*        A  48 -18.357  -0.829   5.839
  509   2H5*    A  48          2H5*        A  48 -19.168  -2.407   5.897
  510    H4*    A  48           H4*        A  48 -18.853  -1.164   3.593
  511    H3*    A  48           H3*        A  48 -18.543  -4.077   4.281
  512    H2*    A  48           H2*        A  48 -17.744  -4.631   2.141
  513   2HO*    A  48          2HO*        A  48 -18.847  -3.601   0.620
  514    H1*    A  48           H1*        A  48 -16.015  -2.585   1.833
  515    H8     A  48           H8         A  48 -15.839  -3.243   5.480
  516   1H6     A  48          1H6         A  48 -12.464  -8.260   4.302
  517   2H6     A  48          2H6         A  48 -13.071  -7.202   5.556
  518    H2     A  48           H2         A  48 -14.189  -6.797   0.418
  519    H3T    A  48           H3T        A  48 -20.560  -2.706   3.830
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  10.255 -31.709   4.139
    2   2H5*    G   1          2H5*        G   1   9.126 -30.694   3.219
    3    H4*    G   1           H4*        G   1   9.651 -33.056   2.295
    4    H3*    G   1           H3*        G   1   6.968 -31.725   2.603
    5    H2*    G   1           H2*        G   1   5.779 -33.711   2.029
    6   2HO*    G   1          2HO*        G   1   7.056 -35.613   1.350
    7    H1*    G   1           H1*        G   1   7.074 -35.417   3.582
    8    H8     G   1           H8         G   1   7.579 -32.772   5.908
    9    H1     G   1           H1         G   1   1.303 -33.515   5.069
   10   1H2     G   1          1H2         G   1   0.919 -34.730   3.255
   11   2H2     G   1          2H2         G   1   2.208 -35.357   2.253
   12    H5T    G   1           H5T        G   1   8.586 -30.638   5.386
   13   1H5*    G   2          1H5*        G   2   6.816 -32.826  -1.264
   14   2H5*    G   2          2H5*        G   2   6.518 -31.618  -2.531
   15    H4*    G   2           H4*        G   2   4.677 -33.186  -2.536
   16    H3*    G   2           H3*        G   2   4.090 -30.438  -1.391
   17    H2*    G   2           H2*        G   2   1.841 -31.092  -0.986
   18   2HO*    G   2          2HO*        G   2   2.264 -32.622  -3.141
   19    H1*    G   2           H1*        G   2   2.337 -33.606  -0.064
   20    H8     G   2           H8         G   2   5.022 -31.781   1.596
   21    H1     G   2           H1         G   2  -0.649 -29.993   3.902
   22   1H2     G   2          1H2         G   2  -2.269 -30.695   2.556
   23   2H2     G   2          2H2         G   2  -1.949 -31.603   1.095
   24   1H5*    C   3          1H5*        C   3   1.531 -30.205  -4.144
   25   2H5*    C   3          2H5*        C   3   1.541 -28.893  -5.338
   26    H4*    C   3           H4*        C   3  -0.350 -28.432  -3.993
   27    H3*    C   3           H3*        C   3   2.079 -26.830  -3.123
   28    H2*    C   3           H2*        C   3   0.852 -25.907  -1.363
   29   2HO*    C   3          2HO*        C   3  -1.649 -26.650  -2.448
   30    H1*    C   3           H1*        C   3  -1.028 -28.039  -1.050
   31   1H4     C   3          1H4         C   3   2.360 -27.507   4.324
   32   2H4     C   3          2H4         C   3   3.665 -28.414   3.593
   33    H5     C   3           H5         C   3   3.667 -29.098   1.281
   34    H6     C   3           H6         C   3   2.422 -29.056  -0.824
   35   1H5*    C   4          1H5*        C   4  -1.704 -24.215  -5.050
   36   2H5*    C   4          2H5*        C   4  -1.152 -22.528  -5.012
   37    H4*    C   4           H4*        C   4  -3.442 -23.167  -3.896
   38    H3*    C   4           H3*        C   4  -1.273 -21.317  -2.899
   39    H2*    C   4           H2*        C   4  -2.381 -21.005  -0.828
   40   2HO*    C   4          2HO*        C   4  -4.508 -21.187  -0.617
   41    H1*    C   4           H1*        C   4  -3.078 -23.540  -0.328
   42   1H4     C   4          1H4         C   4   2.723 -22.547   2.160
   43   2H4     C   4          2H4         C   4   3.448 -23.136   0.679
   44    H5     C   4           H5         C   4   2.169 -23.691  -1.287
   45    H6     C   4           H6         C   4  -0.079 -23.802  -2.257
   46   1H5*    U   5          1H5*        U   5  -4.991 -18.578  -2.410
   47   2H5*    U   5          2H5*        U   5  -4.257 -16.986  -2.691
   48    H4*    U   5           H4*        U   5  -5.298 -17.582  -0.330
   49    H3*    U   5           H3*        U   5  -2.714 -16.108  -0.939
   50    H2*    U   5           H2*        U   5  -2.209 -15.994   1.342
   51   2HO*    U   5          2HO*        U   5  -4.832 -16.649   2.166
   52    H1*    U   5           H1*        U   5  -3.607 -18.331   2.177
   53    H3     U   5           H3         U   5   0.733 -18.236   3.750
   54    H5     U   5           H5         U   5   0.900 -19.864  -0.136
   55    H6     U   5           H6         U   5  -1.412 -19.216  -0.433
   56   1H5*    U   6          1H5*        U   6  -5.459 -12.600  -1.744
   57   2H5*    U   6          2H5*        U   6  -6.687 -12.086  -0.570
   58    H4*    U   6           H4*        U   6  -7.046 -12.769  -3.498
   59    H3*    U   6           H3*        U   6  -7.272 -10.326  -1.769
   60    H2*    U   6           H2*        U   6  -9.359  -9.671  -2.666
   61   2HO*    U   6          2HO*        U   6  -8.424 -10.327  -4.897
   62    H1*    U   6           H1*        U   6 -10.573 -12.038  -2.892
   63    H3     U   6           H3         U   6 -11.940  -9.217   0.588
   64    H5     U   6           H5         U   6  -9.363 -12.122   2.228
   65    H6     U   6           H6         U   6  -8.790 -12.795  -0.030
   66   1H5*    A   7          1H5*        A   7  -6.795  -8.768  -5.993
   67   2H5*    A   7          2H5*        A   7  -5.762  -7.325  -6.013
   68    H4*    A   7           H4*        A   7  -8.090  -6.912  -6.853
   69    H3*    A   7           H3*        A   7  -6.818  -5.428  -4.574
   70    H2*    A   7           H2*        A   7  -8.808  -4.341  -3.941
   71   2HO*    A   7          2HO*        A   7 -10.545  -5.095  -5.879
   72    H1*    A   7           H1*        A   7 -10.601  -6.347  -4.288
   73    H8     A   7           H8         A   7  -7.808  -8.253  -2.894
   74   1H6     A   7          1H6         A   7  -8.817  -5.684   2.611
   75   2H6     A   7          2H6         A   7  -7.972  -6.953   1.753
   76    H2     A   7           H2         A   7 -11.186  -3.397  -0.449
   77   1H5*    G   8          1H5*        G   8  -8.204  -2.096  -7.249
   78   2H5*    G   8          2H5*        G   8  -7.095  -0.727  -7.030
   79    H4*    G   8           H4*        G   8  -9.565  -0.503  -6.199
   80    H3*    G   8           H3*        G   8  -7.017   0.314  -4.800
   81    H2*    G   8           H2*        G   8  -8.158   0.874  -2.829
   82   2HO*    G   8          2HO*        G   8 -10.182   1.426  -4.630
   83    H1*    G   8           H1*        G   8 -10.156  -1.038  -2.883
   84    H8     G   8           H8         G   8  -7.035  -2.894  -3.545
   85    H1     G   8           H1         G   8  -7.307  -0.915   2.510
   86   1H2     G   8          1H2         G   8  -8.937   0.570   2.749
   87   2H2     G   8          2H2         G   8  -9.955   1.072   1.418
   88   1H5*    G   9          1H5*        G   9 -10.355   3.996  -5.371
   89   2H5*    G   9          2H5*        G   9  -9.338   5.416  -5.049
   90    H4*    G   9           H4*        G   9 -11.599   5.103  -3.739
   91    H3*    G   9           H3*        G   9  -8.918   6.078  -2.787
   92    H2*    G   9           H2*        G   9  -9.566   6.051  -0.504
   93   2HO*    G   9          2HO*        G   9 -11.541   6.703  -0.112
   94    H1*    G   9           H1*        G   9 -10.839   3.694  -0.438
   95    H8     G   9           H8         G   9  -8.186   3.047  -2.937
   96    H1     G   9           H1         G   9  -5.756   3.513   2.940
   97   1H2     G   9          1H2         G   9  -7.279   4.333   4.328
   98   2H2     G   9          2H2         G   9  -8.892   4.765   3.805
   99   1H5*    A  10          1H5*        A  10 -10.948   9.429  -1.136
  100   2H5*    A  10          2H5*        A  10  -9.989  10.850  -1.596
  101    H4*    A  10           H4*        A  10  -9.949  10.346   0.869
  102    H3*    A  10           H3*        A  10  -7.416  10.368  -0.806
  103    H2*    A  10           H2*        A  10  -6.141   9.897   1.129
  104   2HO*    A  10          2HO*        A  10  -6.876  10.298   3.187
  105    H1*    A  10           H1*        A  10  -7.906   8.142   2.335
  106    H8     A  10           H8         A  10  -7.810   7.088  -1.201
  107   1H6     A  10          1H6         A  10  -2.255   4.614  -0.240
  108   2H6     A  10          2H6         A  10  -3.602   4.727  -1.351
  109    H2     A  10           H2         A  10  -3.289   7.148   3.325
  110   1H5*    A  11          1H5*        A  11  -7.043  14.084   2.149
  111   2H5*    A  11          2H5*        A  11  -5.691  15.028   1.490
  112    H4*    A  11           H4*        A  11  -5.487  13.892   3.866
  113    H3*    A  11           H3*        A  11  -3.426  14.095   1.655
  114    H2*    A  11           H2*        A  11  -1.889  12.797   2.918
  115   2HO*    A  11          2HO*        A  11  -1.876  12.914   5.034
  116    H1*    A  11           H1*        A  11  -3.614  10.901   3.804
  117    H8     A  11           H8         A  11  -4.860  11.498   0.380
  118   1H6     A  11          1H6         A  11   0.007   8.435  -1.832
  119   2H6     A  11          2H6         A  11  -1.556   9.117  -2.223
  120    H2     A  11           H2         A  11   0.738   9.257   2.524
  121   1H5*    A  12          1H5*        A  12  -0.672  14.761   4.658
  122   2H5*    A  12          2H5*        A  12   0.351  16.069   4.028
  123    H4*    A  12           H4*        A  12   1.528  13.847   4.259
  124    H3*    A  12           H3*        A  12   1.290  15.305   1.611
  125    H2*    A  12           H2*        A  12   2.483  13.579   0.544
  126   2HO*    A  12          2HO*        A  12   3.753  13.466   2.896
  127    H1*    A  12           H1*        A  12   1.470  11.440   1.904
  128    H8     A  12           H8         A  12  -1.363  13.653   0.988
  129   1H6     A  12          1H6         A  12  -0.911  11.608  -4.804
  130   2H6     A  12          2H6         A  12  -1.893  12.526  -3.684
  131    H2     A  12           H2         A  12   2.694  10.193  -2.522
  132   1H5*    C  13          1H5*        C  13   5.717  15.118   3.112
  133   2H5*    C  13          2H5*        C  13   6.691  16.363   2.303
  134    H4*    C  13           H4*        C  13   7.537  13.980   2.042
  135    H3*    C  13           H3*        C  13   6.873  15.779  -0.317
  136    H2*    C  13           H2*        C  13   7.605  14.045  -1.783
  137   2HO*    C  13          2HO*        C  13   9.206  12.821  -1.150
  138    H1*    C  13           H1*        C  13   6.338  12.017  -0.580
  139   1H4     C  13          1H4         C  13   2.497  14.559  -5.016
  140   2H4     C  13          2H4         C  13   1.700  15.480  -3.761
  141    H5     C  13           H5         C  13   2.465  15.538  -1.481
  142    H6     C  13           H6         C  13   4.152  14.723   0.094
  143   1H5*    A  14          1H5*        A  14  11.461  14.666  -0.889
  144   2H5*    A  14          2H5*        A  14  11.968  15.930  -2.027
  145    H4*    A  14           H4*        A  14  12.071  13.390  -2.733
  146    H3*    A  14           H3*        A  14  11.075  15.736  -4.397
  147    H2*    A  14           H2*        A  14  10.747  14.201  -6.216
  148   2HO*    A  14          2HO*        A  14  12.444  12.588  -4.654
  149    H1*    A  14           H1*        A  14   9.480  12.307  -4.774
  150    H8     A  14           H8         A  14   8.321  15.408  -3.130
  151   1H6     A  14          1H6         A  14   4.562  16.427  -7.893
  152   2H6     A  14          2H6         A  14   4.970  16.903  -6.260
  153    H2     A  14           H2         A  14   7.409  13.146  -9.041
  154   1H5*    G  15          1H5*        G  15  13.866  14.342  -6.783
  155   2H5*    G  15          2H5*        G  15  15.082  15.465  -7.425
  156    H4*    G  15           H4*        G  15  13.890  14.602  -9.313
  157    H3*    G  15           H3*        G  15  12.982  17.398  -8.520
  158    H2*    G  15           H2*        G  15  11.599  17.387 -10.493
  159   2HO*    G  15          2HO*        G  15  12.152  14.874 -11.415
  160    H1*    G  15           H1*        G  15  10.590  14.889 -10.090
  161    H8     G  15           H8         G  15  10.905  16.251  -6.651
  162    H1     G  15           H1         G  15   6.198  19.103  -9.852
  163   1H2     G  15          1H2         G  15   6.320  18.594 -12.005
  164   2H2     G  15          2H2         G  15   7.566  17.551 -12.654
  165   1H5*    U  16          1H5*        U  16  13.471  17.623 -11.916
  166   2H5*    U  16          2H5*        U  16  14.360  18.840 -12.851
  167    H4*    U  16           H4*        U  16  12.132  19.162 -13.527
  168    H3*    U  16           H3*        U  16  12.768  21.062 -11.225
  169    H2*    U  16           H2*        U  16  10.618  21.992 -11.545
  170   2HO*    U  16          2HO*        U  16   9.507  20.932 -13.618
  171    H1*    U  16           H1*        U  16   9.330  19.586 -12.179
  172    H3     U  16           H3         U  16   7.423  21.354  -8.428
  173    H5     U  16           H5         U  16  11.044  19.642  -7.133
  174    H6     U  16           H6         U  16  11.626  19.262  -9.436
  175   1H5*    U  17          1H5*        U  17  12.149  24.924 -11.946
  176   2H5*    U  17          2H5*        U  17  10.912  23.855 -12.631
  177    H4*    U  17           H4*        U  17  11.631  26.675 -13.414
  178    H3*    U  17           H3*        U  17   9.562  25.773 -11.945
  179    H2*    U  17           H2*        U  17   8.787  24.076 -13.439
  180   2HO*    U  17          2HO*        U  17   7.333  25.918 -14.868
  181    H1*    U  17           H1*        U  17   8.997  25.778 -15.885
  182    H3     U  17           H3         U  17   7.614  21.755 -17.527
  183    H5     U  17           H5         U  17  11.333  20.950 -15.718
  184    H6     U  17           H6         U  17  11.375  23.226 -14.924
  185   1H5*    C  18          1H5*        C  18   5.748  26.022 -13.255
  186   2H5*    C  18          2H5*        C  18   5.582  27.773 -13.008
  187    H4*    C  18           H4*        C  18   3.796  26.455 -11.858
  188    H3*    C  18           H3*        C  18   5.022  28.670 -10.876
  189    H2*    C  18           H2*        C  18   6.810  27.562  -9.738
  190   2HO*    C  18          2HO*        C  18   6.368  28.190  -7.763
  191    H1*    C  18           H1*        C  18   4.967  25.475  -8.598
  192   1H4     C  18          1H4         C  18  10.799  23.173  -7.467
  193   2H4     C  18          2H4         C  18  11.071  22.997  -9.186
  194    H5     C  18           H5         C  18   9.520  23.764 -10.853
  195    H6     C  18           H6         C  18   7.366  24.861 -11.242
  196   1H5*    G  19          1H5*        G  19   0.419  26.324 -11.076
  197   2H5*    G  19          2H5*        G  19   1.989  25.493 -11.067
  198    H4*    G  19           H4*        G  19   0.089  25.959 -13.359
  199    H3*    G  19           H3*        G  19   1.684  23.631 -12.215
  200    H2*    G  19           H2*        G  19   1.654  22.638 -14.363
  201   2HO*    G  19          2HO*        G  19  -0.447  24.490 -14.942
  202    H1*    G  19           H1*        G  19   1.903  24.994 -15.835
  203    H8     G  19           H8         G  19   4.088  24.244 -16.899
  204    H1     G  19           H1         G  19   6.619  22.256 -11.395
  205   1H2     G  19          1H2         G  19   5.190  22.605  -9.735
  206   2H2     G  19          2H2         G  19   3.617  23.329  -9.983
  207   1H5*    C  20          1H5*        C  20  -0.660  21.987 -14.484
  208   2H5*    C  20          2H5*        C  20  -1.243  20.362 -14.070
  209    H4*    C  20           H4*        C  20   0.419  20.426 -15.970
  210    H3*    C  20           H3*        C  20   0.778  18.798 -13.454
  211    H2*    C  20           H2*        C  20   2.940  18.080 -14.115
  212   2HO*    C  20          2HO*        C  20   3.666  18.739 -16.338
  213    H1*    C  20           H1*        C  20   3.903  20.439 -15.015
  214   1H4     C  20          1H4         C  20   5.157  20.049  -8.743
  215   2H4     C  20          2H4         C  20   3.711  20.986  -8.432
  216    H5     C  20           H5         C  20   2.139  21.593 -10.135
  217    H6     C  20           H6         C  20   1.599  21.452 -12.518
  218   1H5*    U  21          1H5*        U  21   2.138  16.682 -15.993
  219   2H5*    U  21          2H5*        U  21   1.194  15.433 -16.830
  220    H4*    U  21           H4*        U  21   3.188  14.305 -16.612
  221    H3*    U  21           H3*        U  21   1.521  13.805 -14.146
  222    H2*    U  21           H2*        U  21   3.302  12.674 -13.077
  223   2HO*    U  21          2HO*        U  21   4.593  12.623 -15.631
  224    H1*    U  21           H1*        U  21   5.361  14.286 -13.839
  225    H3     U  21           H3         U  21   4.828  15.200  -9.435
  226    H5     U  21           H5         U  21   1.656  17.247 -11.310
  227    H6     U  21           H6         U  21   2.257  16.139 -13.387
  228   1H5*    G  22          1H5*        G  22   3.197   9.987 -15.040
  229   2H5*    G  22          2H5*        G  22   2.234   8.733 -14.231
  230    H4*    G  22           H4*        G  22   4.600   9.434 -13.268
  231    H3*    G  22           H3*        G  22   2.030   8.801 -11.801
  232    H2*    G  22           H2*        G  22   2.852   9.657  -9.822
  233   2HO*    G  22          2HO*        G  22   5.383   9.487  -9.667
  234    H1*    G  22           H1*        G  22   5.148  11.062 -10.912
  235    H8     G  22           H8         G  22   1.856  12.703 -11.483
  236    H1     G  22           H1         G  22   3.868  13.540  -5.499
  237   1H2     G  22          1H2         G  22   5.618  12.245  -5.098
  238   2H2     G  22          2H2         G  22   6.293  11.176  -6.307
  239   1H5*    U  23          1H5*        U  23   5.266   5.500 -10.382
  240   2H5*    U  23          2H5*        U  23   4.277   4.287  -9.545
  241    H4*    U  23           H4*        U  23   6.106   5.630  -8.209
  242    H3*    U  23           H3*        U  23   3.282   4.924  -7.375
  243    H2*    U  23           H2*        U  23   3.483   6.166  -5.403
  244   2HO*    U  23          2HO*        U  23   6.303   6.357  -5.637
  245    H1*    U  23           H1*        U  23   5.283   8.134  -6.305
  246    H3     U  23           H3         U  23   1.452   9.974  -4.525
  247    H5     U  23           H5         U  23   0.614   9.157  -8.579
  248    H6     U  23           H6         U  23   2.695   7.916  -8.689
  249   1H5*    G  24          1H5*        G  24   6.108  -0.096  -5.757
  250   2H5*    G  24          2H5*        G  24   6.088   1.038  -4.394
  251    H4*    G  24           H4*        G  24   7.375   1.694  -7.064
  252    H3*    G  24           H3*        G  24   8.410   0.066  -4.763
  253    H2*    G  24           H2*        G  24  10.359   1.336  -4.507
  254   2HO*    G  24          2HO*        G  24  11.353   2.296  -6.165
  255    H1*    G  24           H1*        G  24   9.446   3.825  -5.036
  256    H8     G  24           H8         G  24   6.721   2.572  -2.956
  257    H1     G  24           H1         G  24  12.064   3.111   0.481
  258   1H2     G  24          1H2         G  24  13.806   3.380  -0.863
  259   2H2     G  24          2H2         G  24  13.651   3.426  -2.605
  260   1H5*    C  25          1H5*        C  25  12.158   0.635  -7.169
  261   2H5*    C  25          2H5*        C  25  12.123  -0.945  -7.979
  262    H4*    C  25           H4*        C  25  14.374  -0.729  -7.362
  263    H3*    C  25           H3*        C  25  12.780  -2.353  -5.384
  264    H2*    C  25           H2*        C  25  14.580  -2.480  -3.864
  265   2HO*    C  25          2HO*        C  25  16.242  -1.518  -5.989
  266    H1*    C  25           H1*        C  25  15.541   0.058  -4.088
  267   1H4     C  25          1H4         C  25  11.480   0.041   0.821
  268   2H4     C  25          2H4         C  25  10.124   0.191  -0.274
  269    H5     C  25           H5         C  25  10.352   0.145  -2.670
  270    H6     C  25           H6         C  25  11.931  -0.053  -4.539
  271   1H5*    C  26          1H5*        C  26  16.584  -3.886  -5.158
  272   2H5*    C  26          2H5*        C  26  16.568  -5.427  -6.041
  273    H4*    C  26           H4*        C  26  17.835  -5.903  -4.111
  274    H3*    C  26           H3*        C  26  14.948  -6.773  -3.869
  275    H2*    C  26           H2*        C  26  15.283  -7.462  -1.629
  276   2HO*    C  26          2HO*        C  26  18.090  -7.067  -1.967
  277    H1*    C  26           H1*        C  26  16.810  -5.389  -0.775
  278   1H4     C  26          1H4         C  26  10.895  -3.583   0.656
  279   2H4     C  26          2H4         C  26  10.491  -3.396  -1.036
  280    H5     C  26           H5         C  26  12.015  -3.929  -2.823
  281    H6     C  26           H6         C  26  14.255  -4.754  -3.377
  282   1H5*    G  27          1H5*        G  27  17.386  -9.862  -2.159
  283   2H5*    G  27          2H5*        G  27  16.446 -11.362  -2.037
  284    H4*    G  27           H4*        G  27  17.008  -9.961   0.135
  285    H3*    G  27           H3*        G  27  14.356 -11.264  -0.593
  286    H2*    G  27           H2*        G  27  13.469 -10.493   1.444
  287   2HO*    G  27          2HO*        G  27  15.604  -9.540   2.771
  288    H1*    G  27           H1*        G  27  15.008  -8.125   1.629
  289    H8     G  27           H8         G  27  13.229  -8.100  -1.620
  290    H1     G  27           H1         G  27   9.219  -7.046   3.222
  291   1H2     G  27          1H2         G  27  10.221  -7.500   5.147
  292   2H2     G  27          2H2         G  27  11.874  -8.062   5.237
  293   1H5*    A  28          1H5*        A  28  15.671 -13.816   3.075
  294   2H5*    A  28          2H5*        A  28  14.689 -15.286   2.908
  295    H4*    A  28           H4*        A  28  14.261 -13.617   4.916
  296    H3*    A  28           H3*        A  28  12.209 -15.036   3.181
  297    H2*    A  28           H2*        A  28  10.481 -13.985   4.377
  298   2HO*    A  28          2HO*        A  28  10.628 -13.822   6.479
  299    H1*    A  28           H1*        A  28  11.827 -11.580   4.970
  300    H8     A  28           H8         A  28  11.989 -12.101   1.304
  301   1H6     A  28          1H6         A  28   6.116 -10.284   0.898
  302   2H6     A  28          2H6         A  28   7.568 -10.650  -0.006
  303    H2     A  28           H2         A  28   7.079 -10.935   5.238
  304   1H5*    A  29          1H5*        A  29  12.340 -16.805   7.876
  305   2H5*    A  29          2H5*        A  29  11.120 -18.094   7.855
  306    H4*    A  29           H4*        A  29  10.963 -16.159   9.639
  307    H3*    A  29           H3*        A  29   8.806 -17.547   8.063
  308    H2*    A  29           H2*        A  29   7.130 -16.024   8.743
  309   2HO*    A  29          2HO*        A  29   8.651 -14.480  10.463
  310    H1*    A  29           H1*        A  29   8.495 -13.714   8.485
  311    H8     A  29           H8         A  29   9.908 -15.650   5.689
  312   1H6     A  29          1H6         A  29   4.617 -14.973   2.610
  313   2H6     A  29          2H6         A  29   6.291 -15.469   2.493
  314    H2     A  29           H2         A  29   3.932 -13.684   6.860
  315   1H5*    A  30          1H5*        A  30   7.198 -18.445  12.422
  316   2H5*    A  30          2H5*        A  30   6.229 -19.894  12.087
  317    H4*    A  30           H4*        A  30   5.051 -17.643  12.812
  318    H3*    A  30           H3*        A  30   4.208 -19.657  10.711
  319    H2*    A  30           H2*        A  30   2.347 -18.294  10.116
  320   2HO*    A  30          2HO*        A  30   1.411 -17.114  11.603
  321    H1*    A  30           H1*        A  30   3.648 -15.944   9.981
  322    H8     A  30           H8         A  30   6.322 -18.185   8.841
  323   1H6     A  30          1H6         A  30   3.337 -19.033   3.526
  324   2H6     A  30          2H6         A  30   4.846 -19.269   4.377
  325    H2     A  30           H2         A  30   0.533 -16.986   6.381
  326   1H5*    G  31          1H5*        G  31   1.028 -18.846  12.079
  327   2H5*    G  31          2H5*        G  31   0.158 -19.893  13.217
  328    H4*    G  31           H4*        G  31  -1.542 -19.362  11.724
  329    H3*    G  31           H3*        G  31  -0.154 -21.875  10.723
  330    H2*    G  31           H2*        G  31  -1.584 -21.892   8.848
  331   2HO*    G  31          2HO*        G  31  -3.252 -20.225  10.450
  332    H1*    G  31           H1*        G  31  -1.814 -19.124   8.512
  333    H8     G  31           H8         G  31   1.796 -19.918   8.810
  334    H1     G  31           H1         G  31  -0.538 -21.859   3.203
  335   1H2     G  31          1H2         G  31  -2.752 -21.759   3.230
  336   2H2     G  31          2H2         G  31  -3.653 -21.214   4.626
  337   1H5*    G  32          1H5*        G  32  -4.640 -22.679  11.442
  338   2H5*    G  32          2H5*        G  32  -4.946 -24.425  11.356
  339    H4*    G  32           H4*        G  32  -5.960 -22.800   9.532
  340    H3*    G  32           H3*        G  32  -4.735 -25.546   9.188
  341    H2*    G  32           H2*        G  32  -4.937 -25.399   6.832
  342   2HO*    G  32          2HO*        G  32  -6.673 -24.490   6.048
  343    H1*    G  32           H1*        G  32  -4.231 -22.776   6.515
  344    H8     G  32           H8         G  32  -1.865 -24.043   9.072
  345    H1     G  32           H1         G  32  -0.556 -26.445   3.313
  346   1H2     G  32          1H2         G  32  -2.231 -26.033   1.919
  347   2H2     G  32          2H2         G  32  -3.670 -25.167   2.410
  348   1H5*    U  33          1H5*        U  33  -7.891 -26.596   7.089
  349   2H5*    U  33          2H5*        U  33  -8.463 -28.202   7.584
  350    H4*    U  33           H4*        U  33  -7.353 -28.212   5.342
  351    H3*    U  33           H3*        U  33  -6.319 -29.821   7.678
  352    H2*    U  33           H2*        U  33  -4.351 -30.342   6.609
  353   2HO*    U  33          2HO*        U  33  -4.417 -31.237   4.673
  354    H1*    U  33           H1*        U  33  -4.470 -28.370   4.493
  355    H3     U  33           H3         U  33  -0.108 -28.910   5.740
  356    H5     U  33           H5         U  33  -1.898 -26.753   8.889
  357    H6     U  33           H6         U  33  -4.047 -27.125   7.830
  358   1H5*    C  34          1H5*        C  34  -6.931 -32.101   4.212
  359   2H5*    C  34          2H5*        C  34  -7.946 -33.556   4.261
  360    H4*    C  34           H4*        C  34  -6.087 -34.413   3.183
  361    H3*    C  34           H3*        C  34  -5.574 -34.617   6.164
  362    H2*    C  34           H2*        C  34  -3.474 -35.544   5.746
  363   2HO*    C  34          2HO*        C  34  -3.327 -37.000   4.232
  364    H1*    C  34           H1*        C  34  -2.927 -34.101   3.395
  365   1H4     C  34          1H4         C  34   0.785 -31.531   7.860
  366   2H4     C  34          2H4         C  34  -0.605 -30.911   8.722
  367    H5     C  34           H5         C  34  -2.876 -31.345   8.050
  368    H6     C  34           H6         C  34  -4.307 -32.464   6.405
  369    H3T    C  34           H3T        C  34  -5.690 -36.948   5.080
  370   1H5*    U  35          1H5*        U  35  -4.517 -12.956   3.446
  371   2H5*    U  35          2H5*        U  35  -3.991 -11.464   2.639
  372    H4*    U  35           H4*        U  35  -3.689 -11.531   5.174
  373    H3*    U  35           H3*        U  35  -1.566 -10.854   3.146
  374    H2*    U  35           H2*        U  35   0.133 -10.755   4.774
  375   2HO*    U  35          2HO*        U  35  -1.890  -9.902   6.319
  376    H1*    U  35           H1*        U  35  -0.582 -12.874   6.323
  377    H3     U  35           H3         U  35   3.124 -14.278   4.146
  378    H5     U  35           H5         U  35   0.152 -14.253   1.158
  379    H6     U  35           H6         U  35  -1.362 -13.251   2.769
  380    H5T    U  35           H5T        U  35  -3.265 -13.886   2.061
  381   1H5*    U  36          1H5*        U  36  -1.685  -7.718   6.488
  382   2H5*    U  36          2H5*        U  36  -0.717  -6.310   6.006
  383    H4*    U  36           H4*        U  36   0.080  -7.854   7.996
  384    H3*    U  36           H3*        U  36   1.724  -6.610   5.773
  385    H2*    U  36           H2*        U  36   3.685  -7.650   6.624
  386   2HO*    U  36          2HO*        U  36   2.862  -9.007   8.760
  387    H1*    U  36           H1*        U  36   2.627 -10.104   7.089
  388    H3     U  36           H3         U  36   5.315 -10.176   3.377
  389    H5     U  36           H5         U  36   1.548  -8.892   1.992
  390    H6     U  36           H6         U  36   0.827  -8.733   4.304
  391   1H5*    C  37          1H5*        C  37   3.544  -4.892   9.852
  392   2H5*    C  37          2H5*        C  37   4.300  -3.384   9.301
  393    H4*    C  37           H4*        C  37   5.793  -5.170  10.467
  394    H3*    C  37           H3*        C  37   6.399  -3.698   7.884
  395    H2*    C  37           H2*        C  37   8.465  -4.854   7.713
  396   2HO*    C  37          2HO*        C  37   9.254  -6.127   9.481
  397    H1*    C  37           H1*        C  37   7.560  -7.330   8.410
  398   1H4     C  37          1H4         C  37   7.385  -6.701   2.042
  399   2H4     C  37          2H4         C  37   5.719  -6.181   2.156
  400    H5     C  37           H5         C  37   4.600  -5.790   4.253
  401    H6     C  37           H6         C  37   4.839  -5.802   6.695
  402   1H5*    G  38          1H5*        G  38   9.550  -1.916  11.198
  403   2H5*    G  38          2H5*        G  38  10.262  -0.548  10.324
  404    H4*    G  38           H4*        G  38  11.789  -2.537  11.133
  405    H3*    G  38           H3*        G  38  11.844  -0.973   8.555
  406    H2*    G  38           H2*        G  38  13.469  -2.402   7.596
  407   2HO*    G  38          2HO*        G  38  14.477  -2.507   9.932
  408    H1*    G  38           H1*        G  38  12.466  -4.786   8.380
  409    H8     G  38           H8         G  38   9.383  -2.852   7.773
  410    H1     G  38           H1         G  38  12.432  -4.085   2.305
  411   1H2     G  38          1H2         G  38  14.476  -4.832   2.730
  412   2H2     G  38          2H2         G  38  15.086  -5.025   4.359
  413   1H5*    G  39          1H5*        G  39  16.070  -0.006  10.223
  414   2H5*    G  39          2H5*        G  39  16.286   1.712   9.834
  415    H4*    G  39           H4*        G  39  17.985   0.168   8.776
  416    H3*    G  39           H3*        G  39  16.217   2.058   7.217
  417    H2*    G  39           H2*        G  39  17.050   1.266   5.151
  418   2HO*    G  39          2HO*        G  39  19.020  -0.358   6.363
  419    H1*    G  39           H1*        G  39  17.156  -1.398   5.720
  420    H8     G  39           H8         G  39  14.025  -0.293   7.352
  421    H1     G  39           H1         G  39  13.462  -0.244   0.999
  422   1H2     G  39          1H2         G  39  15.460  -0.470   0.061
  423   2H2     G  39          2H2         G  39  16.927  -0.633   1.001
  424   1H5*    C  40          1H5*        C  40  19.217   2.555   5.249
  425   2H5*    C  40          2H5*        C  40  20.156   4.049   5.444
  426    H4*    C  40           H4*        C  40  19.899   4.010   3.138
  427    H3*    C  40           H3*        C  40  17.592   5.533   4.377
  428    H2*    C  40           H2*        C  40  16.563   5.776   2.277
  429   2HO*    C  40          2HO*        C  40  19.088   5.984   1.456
  430    H1*    C  40           H1*        C  40  17.296   3.337   1.158
  431   1H4     C  40          1H4         C  40  11.196   2.760   2.849
  432   2H4     C  40          2H4         C  40  11.633   2.704   4.542
  433    H5     C  40           H5         C  40  13.892   2.982   5.333
  434    H6     C  40           H6         C  40  16.219   3.375   4.670
  435   1H5*    U  41          1H5*        U  41  19.499   9.855   3.095
  436   2H5*    U  41          2H5*        U  41  18.175  10.588   4.024
  437    H4*    U  41           H4*        U  41  17.014  10.888   2.123
  438    H3*    U  41           H3*        U  41  17.213   7.871   2.105
  439    H2*    U  41           H2*        U  41  16.610   7.771  -0.168
  440   2HO*    U  41          2HO*        U  41  14.795   9.200   0.073
  441    H1*    U  41           H1*        U  41  17.892  10.049  -1.066
  442    H3     U  41           H3         U  41  19.924   6.566  -3.138
  443    H5     U  41           H5         U  41  21.399   6.433   0.808
  444    H6     U  41           H6         U  41  19.816   8.178   1.389
  445   1H5*    C  42          1H5*        C  42  11.929   8.674   2.190
  446   2H5*    C  42          2H5*        C  42  11.689   6.947   1.862
  447    H4*    C  42           H4*        C  42  10.725   8.997   0.297
  448    H3*    C  42           H3*        C  42  11.235   6.059  -0.100
  449    H2*    C  42           H2*        C  42  11.092   6.195  -2.445
  450   2HO*    C  42          2HO*        C  42  10.275   8.264  -3.393
  451    H1*    C  42           H1*        C  42  12.345   8.578  -2.872
  452   1H4     C  42          1H4         C  42  16.844   4.134  -3.576
  453   2H4     C  42          2H4         C  42  16.978   3.953  -1.841
  454    H5     C  42           H5         C  42  15.550   5.105  -0.278
  455    H6     C  42           H6         C  42  13.687   6.678  -0.042
  456   1H5*    U  43          1H5*        U  43   8.877   5.874   1.380
  457   2H5*    U  43          2H5*        U  43   8.251   4.216   1.483
  458    H4*    U  43           H4*        U  43   7.297   5.946   3.144
  459    H3*    U  43           H3*        U  43   5.675   4.098   1.370
  460    H2*    U  43           H2*        U  43   3.674   5.030   2.159
  461   2HO*    U  43          2HO*        U  43   4.915   6.414   4.285
  462    H1*    U  43           H1*        U  43   4.570   7.649   2.596
  463    H3     U  43           H3         U  43   1.248   8.233  -0.377
  464    H5     U  43           H5         U  43   4.136   6.074  -2.555
  465    H6     U  43           H6         U  43   5.436   5.884  -0.514
  466   1H5*    U  44          1H5*        U  44   5.116   4.110   6.263
  467   2H5*    U  44          2H5*        U  44   4.150   2.660   6.607
  468    H4*    U  44           H4*        U  44   3.371   4.900   7.645
  469    H3*    U  44           H3*        U  44   1.669   2.905   6.136
  470    H2*    U  44           H2*        U  44  -0.230   4.304   6.317
  471   2HO*    U  44          2HO*        U  44   0.118   4.808   8.565
  472    H1*    U  44           H1*        U  44   0.981   6.707   5.844
  473    H3     U  44           H3         U  44  -1.626   5.641   2.251
  474    H5     U  44           H5         U  44   1.942   3.471   1.682
  475    H6     U  44           H6         U  44   2.636   4.157   3.902
  476   1H5*    C  45          1H5*        C  45  -0.692   3.595  10.160
  477   2H5*    C  45          2H5*        C  45  -1.170   1.922  10.506
  478    H4*    C  45           H4*        C  45  -3.089   3.553  10.457
  479    H3*    C  45           H3*        C  45  -2.934   1.148   8.621
  480    H2*    C  45           H2*        C  45  -4.985   1.740   7.615
  481   2HO*    C  45          2HO*        C  45  -6.414   3.237   8.596
  482    H1*    C  45           H1*        C  45  -4.655   4.481   7.590
  483   1H4     C  45          1H4         C  45  -3.198   2.346   1.769
  484   2H4     C  45          2H4         C  45  -1.607   1.871   2.320
  485    H5     C  45           H5         C  45  -0.907   2.026   4.620
  486    H6     C  45           H6         C  45  -1.581   2.668   6.889
  487   1H5*    C  46          1H5*        C  46  -6.778   1.122  11.092
  488   2H5*    C  46          2H5*        C  46  -7.581  -0.457  10.967
  489    H4*    C  46           H4*        C  46  -8.719   1.693   9.943
  490    H3*    C  46           H3*        C  46  -8.552  -1.115   8.846
  491    H2*    C  46           H2*        C  46  -9.562  -0.469   6.807
  492   2HO*    C  46          2HO*        C  46 -10.291   1.922   8.196
  493    H1*    C  46           H1*        C  46  -8.280   1.899   6.425
  494   1H4     C  46          1H4         C  46  -4.951  -2.619   3.384
  495   2H4     C  46          2H4         C  46  -4.056  -2.951   4.850
  496    H5     C  46           H5         C  46  -4.558  -1.915   6.967
  497    H6     C  46           H6         C  46  -6.027  -0.338   8.134
  498   1H5*    U  47          1H5*        U  47 -13.146   0.092   8.932
  499   2H5*    U  47          2H5*        U  47 -13.991  -1.466   8.841
  500    H4*    U  47           H4*        U  47 -14.310   0.320   6.930
  501    H3*    U  47           H3*        U  47 -13.961  -2.677   6.708
  502    H2*    U  47           H2*        U  47 -13.944  -2.560   4.346
  503   2HO*    U  47          2HO*        U  47 -15.568  -1.250   3.764
  504    H1*    U  47           H1*        U  47 -12.427  -0.303   4.052
  505    H3     U  47           H3         U  47 -10.112  -4.037   2.711
  506    H5     U  47           H5         U  47  -9.487  -3.751   6.870
  507    H6     U  47           H6         U  47 -11.149  -1.984   6.933
  508   1H5*    A  48          1H5*        A  48 -18.484  -1.910   5.078
  509   2H5*    A  48          2H5*        A  48 -19.137  -3.561   5.097
  510    H4*    A  48           H4*        A  48 -18.877  -2.264   2.813
  511    H3*    A  48           H3*        A  48 -18.306  -5.144   3.481
  512    H2*    A  48           H2*        A  48 -17.404  -5.587   1.354
  513   2HO*    A  48          2HO*        A  48 -19.144  -4.097   0.380
  514    H1*    A  48           H1*        A  48 -15.860  -3.390   1.130
  515    H8     A  48           H8         A  48 -15.755  -4.083   4.777
  516   1H6     A  48          1H6         A  48 -11.928  -8.778   3.677
  517   2H6     A  48          2H6         A  48 -12.669  -7.792   4.917
  518    H2     A  48           H2         A  48 -13.604  -7.396  -0.258
  519    H3T    A  48           H3T        A  48 -20.440  -4.591   3.154
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  11.993 -28.425   4.976
    2   2H5*    G   1          2H5*        G   1  11.313 -27.484   3.632
    3    H4*    G   1           H4*        G   1  12.080 -29.584   2.730
    4    H3*    G   1           H3*        G   1   9.114 -29.133   2.944
    5    H2*    G   1           H2*        G   1   8.587 -31.378   2.340
    6   2HO*    G   1          2HO*        G   1  11.316 -31.980   1.855
    7    H1*    G   1           H1*        G   1  10.303 -32.646   3.899
    8    H8     G   1           H8         G   1   9.914 -30.000   6.260
    9    H1     G   1           H1         G   1   4.202 -32.645   5.254
   10   1H2     G   1          1H2         G   1   4.257 -33.902   3.428
   11   2H2     G   1          2H2         G   1   5.701 -34.088   2.459
   12    H5T    G   1           H5T        G   1   9.702 -27.319   4.974
   13   1H5*    G   2          1H5*        G   2   9.415 -29.709  -1.426
   14   2H5*    G   2          2H5*        G   2   8.581 -28.377  -2.251
   15    H4*    G   2           H4*        G   2   7.498 -30.566  -2.690
   16    H3*    G   2           H3*        G   2   6.030 -28.372  -1.204
   17    H2*    G   2           H2*        G   2   4.125 -29.774  -0.957
   18   2HO*    G   2          2HO*        G   2   4.681 -30.648  -3.274
   19    H1*    G   2           H1*        G   2   5.398 -32.046  -0.265
   20    H8     G   2           H8         G   2   7.530 -29.748   1.555
   21    H1     G   2           H1         G   2   1.638 -29.643   3.994
   22   1H2     G   2          1H2         G   2   0.216 -30.594   2.585
   23   2H2     G   2          2H2         G   2   0.718 -31.255   1.046
   24   1H5*    C   3          1H5*        C   3   3.247 -28.943  -3.711
   25   2H5*    C   3          2H5*        C   3   2.827 -27.609  -4.805
   26    H4*    C   3           H4*        C   3   0.841 -28.034  -3.576
   27    H3*    C   3           H3*        C   3   2.421 -25.677  -2.497
   28    H2*    C   3           H2*        C   3   0.856 -25.390  -0.778
   29   2HO*    C   3          2HO*        C   3  -0.860 -26.390  -2.717
   30    H1*    C   3           H1*        C   3   0.051 -28.083  -0.505
   31   1H4     C   3          1H4         C   3   3.298 -26.351   4.708
   32   2H4     C   3          2H4         C   3   4.795 -26.761   3.901
   33    H5     C   3           H5         C   3   4.910 -27.413   1.580
   34    H6     C   3           H6         C   3   3.618 -27.798  -0.459
   35   1H5*    C   4          1H5*        C   4  -1.909 -24.477  -4.184
   36   2H5*    C   4          2H5*        C   4  -1.848 -22.731  -4.501
   37    H4*    C   4           H4*        C   4  -3.791 -23.519  -3.053
   38    H3*    C   4           H3*        C   4  -1.818 -21.362  -2.281
   39    H2*    C   4           H2*        C   4  -2.832 -21.107  -0.163
   40   2HO*    C   4          2HO*        C   4  -5.034 -21.468  -1.362
   41    H1*    C   4           H1*        C   4  -3.231 -23.707   0.437
   42   1H4     C   4          1H4         C   4   2.386 -21.925   2.875
   43   2H4     C   4          2H4         C   4   3.176 -22.308   1.362
   44    H5     C   4           H5         C   4   1.975 -22.991  -0.617
   45    H6     C   4           H6         C   4  -0.239 -23.449  -1.565
   46   1H5*    U   5          1H5*        U   5  -5.925 -19.465  -1.312
   47   2H5*    U   5          2H5*        U   5  -5.599 -17.756  -1.660
   48    H4*    U   5           H4*        U   5  -6.287 -18.477   0.774
   49    H3*    U   5           H3*        U   5  -4.059 -16.568  -0.021
   50    H2*    U   5           H2*        U   5  -3.477 -16.306   2.231
   51   2HO*    U   5          2HO*        U   5  -6.143 -16.355   2.517
   52    H1*    U   5           H1*        U   5  -4.385 -18.853   3.153
   53    H3     U   5           H3         U   5  -0.082 -18.097   4.596
   54    H5     U   5           H5         U   5   0.234 -19.467   0.618
   55    H6     U   5           H6         U   5  -2.164 -19.224   0.417
   56   1H5*    U   6          1H5*        U   6  -9.020 -14.991  -0.186
   57   2H5*    U   6          2H5*        U   6  -7.782 -14.726  -1.430
   58    H4*    U   6           H4*        U   6  -9.322 -13.154  -2.119
   59    H3*    U   6           H3*        U   6  -7.559 -11.852  -0.026
   60    H2*    U   6           H2*        U   6  -8.932  -9.979   0.049
   61   2HO*    U   6          2HO*        U   6  -8.626  -9.927  -2.413
   62    H1*    U   6           H1*        U   6 -11.334 -11.191  -0.963
   63    H3     U   6           H3         U   6 -12.680  -8.691   2.561
   64    H5     U   6           H5         U   6 -10.391 -11.768   4.306
   65    H6     U   6           H6         U   6  -9.784 -12.495   2.070
   66   1H5*    A   7          1H5*        A   7  -7.149  -9.978  -4.671
   67   2H5*    A   7          2H5*        A   7  -6.203  -8.482  -4.541
   68    H4*    A   7           H4*        A   7  -8.606  -8.437  -5.629
   69    H3*    A   7           H3*        A   7  -7.269  -6.464  -3.784
   70    H2*    A   7           H2*        A   7  -9.241  -5.203  -3.508
   71   2HO*    A   7          2HO*        A   7 -10.866  -6.519  -5.309
   72    H1*    A   7           H1*        A   7 -11.071  -7.225  -3.383
   73    H8     A   7           H8         A   7  -8.218  -8.517  -1.411
   74   1H6     A   7          1H6         A   7  -9.820  -4.746   3.189
   75   2H6     A   7          2H6         A   7  -8.815  -6.104   2.730
   76    H2     A   7           H2         A   7 -12.148  -3.554  -0.465
   77   1H5*    G   8          1H5*        G   8  -8.739  -3.996  -6.834
   78   2H5*    G   8          2H5*        G   8  -7.683  -2.624  -7.230
   79    H4*    G   8           H4*        G   8  -9.888  -2.010  -6.126
   80    H3*    G   8           H3*        G   8  -7.176  -1.219  -5.032
   81    H2*    G   8           H2*        G   8  -8.171  -0.185  -3.178
   82   2HO*    G   8          2HO*        G   8  -9.967   0.936  -3.381
   83    H1*    G   8           H1*        G   8 -10.421  -1.844  -2.917
   84    H8     G   8           H8         G   8  -7.451  -4.046  -2.976
   85    H1     G   8           H1         G   8  -7.839  -0.835   2.520
   86   1H2     G   8          1H2         G   8  -9.340   0.787   2.345
   87   2H2     G   8          2H2         G   8 -10.243   1.078   0.875
   88   1H5*    G   9          1H5*        G   9 -10.057   2.640  -6.475
   89   2H5*    G   9          2H5*        G   9  -8.941   4.009  -6.303
   90    H4*    G   9           H4*        G   9 -11.301   4.071  -5.127
   91    H3*    G   9           H3*        G   9  -8.614   5.025  -4.167
   92    H2*    G   9           H2*        G   9  -9.395   5.428  -1.965
   93   2HO*    G   9          2HO*        G   9 -11.502   5.754  -1.490
   94    H1*    G   9           H1*        G   9 -10.830   3.198  -1.591
   95    H8     G   9           H8         G   9  -8.121   1.944  -3.767
   96    H1     G   9           H1         G   9  -5.935   3.276   2.071
   97   1H2     G   9          1H2         G   9  -7.440   4.443   3.201
   98   2H2     G   9          2H2         G   9  -8.986   4.896   2.518
   99   1H5*    A  10          1H5*        A  10 -10.963   8.159  -2.449
  100   2H5*    A  10          2H5*        A  10 -10.078   9.649  -2.829
  101    H4*    A  10           H4*        A  10 -10.311   9.103  -0.349
  102    H3*    A  10           H3*        A  10  -7.639   9.556  -1.723
  103    H2*    A  10           H2*        A  10  -6.541   9.256   0.344
  104   2HO*    A  10          2HO*        A  10  -9.071   9.958   1.394
  105    H1*    A  10           H1*        A  10  -8.213   7.285   1.384
  106    H8     A  10           H8         A  10  -7.383   6.189  -2.045
  107   1H6     A  10          1H6         A  10  -1.785   4.554  -0.071
  108   2H6     A  10          2H6         A  10  -2.927   4.450  -1.392
  109    H2     A  10           H2         A  10  -3.745   6.992   3.156
  110   1H5*    A  11          1H5*        A  11  -8.192  13.371   1.148
  111   2H5*    A  11          2H5*        A  11  -6.914  14.468   0.587
  112    H4*    A  11           H4*        A  11  -6.829  13.466   3.029
  113    H3*    A  11           H3*        A  11  -4.570  13.868   1.050
  114    H2*    A  11           H2*        A  11  -3.034  12.840   2.561
  115   2HO*    A  11          2HO*        A  11  -5.072  13.399   4.435
  116    H1*    A  11           H1*        A  11  -4.561  10.757   3.297
  117    H8     A  11           H8         A  11  -5.518  11.092  -0.252
  118   1H6     A  11          1H6         A  11  -0.087   8.670  -1.853
  119   2H6     A  11          2H6         A  11  -1.679   9.123  -2.419
  120    H2     A  11           H2         A  11   0.079   9.697   2.520
  121   1H5*    A  12          1H5*        A  12  -2.433  15.526   4.476
  122   2H5*    A  12          2H5*        A  12  -1.420  16.759   3.696
  123    H4*    A  12           H4*        A  12  -0.207  14.710   4.656
  124    H3*    A  12           H3*        A  12   0.094  15.796   1.850
  125    H2*    A  12           H2*        A  12   1.560  14.028   1.272
  126   2HO*    A  12          2HO*        A  12   2.385  12.598   2.925
  127    H1*    A  12           H1*        A  12   0.254  11.995   2.397
  128    H8     A  12           H8         A  12  -2.409  14.255   1.128
  129   1H6     A  12          1H6         A  12  -1.154  12.323  -4.579
  130   2H6     A  12          2H6         A  12  -2.274  13.231  -3.587
  131    H2     A  12           H2         A  12   2.078  10.816  -1.843
  132   1H5*    C  13          1H5*        C  13   4.085  15.873   4.157
  133   2H5*    C  13          2H5*        C  13   5.245  17.010   3.442
  134    H4*    C  13           H4*        C  13   5.995  14.571   3.565
  135    H3*    C  13           H3*        C  13   5.966  16.226   1.020
  136    H2*    C  13           H2*        C  13   6.864  14.362  -0.175
  137   2HO*    C  13          2HO*        C  13   8.055  13.798   2.050
  138    H1*    C  13           H1*        C  13   5.190  12.505   0.797
  139   1H4     C  13          1H4         C  13   2.412  15.203  -4.296
  140   2H4     C  13          2H4         C  13   1.461  16.191  -3.211
  141    H5     C  13           H5         C  13   1.810  16.246  -0.832
  142    H6     C  13           H6         C  13   3.136  15.362   1.024
  143   1H5*    A  14          1H5*        A  14  10.271  14.694   1.010
  144   2H5*    A  14          2H5*        A  14  11.088  15.994   0.121
  145    H4*    A  14           H4*        A  14  10.981  13.587  -0.920
  146    H3*    A  14           H3*        A  14  10.399  16.202  -2.371
  147    H2*    A  14           H2*        A  14  10.155  14.918  -4.371
  148   2HO*    A  14          2HO*        A  14  11.536  12.953  -2.866
  149    H1*    A  14           H1*        A  14   8.768  12.853  -3.264
  150    H8     A  14           H8         A  14   7.188  15.789  -1.708
  151   1H6     A  14          1H6         A  14   4.394  17.040  -7.044
  152   2H6     A  14          2H6         A  14   4.454  17.408  -5.335
  153    H2     A  14           H2         A  14   7.551  13.939  -7.820
  154   1H5*    G  15          1H5*        G  15  13.898  14.415  -4.487
  155   2H5*    G  15          2H5*        G  15  15.061  15.714  -4.817
  156    H4*    G  15           H4*        G  15  14.514  14.560  -6.900
  157    H3*    G  15           H3*        G  15  13.429  17.374  -6.544
  158    H2*    G  15           H2*        G  15  12.582  17.260  -8.801
  159   2HO*    G  15          2HO*        G  15  13.457  15.940 -10.226
  160    H1*    G  15           H1*        G  15  11.334  14.907  -8.472
  161    H8     G  15           H8         G  15  11.312  16.390  -5.049
  162    H1     G  15           H1         G  15   7.314  19.473  -8.931
  163   1H2     G  15          1H2         G  15   7.638  18.830 -11.024
  164   2H2     G  15          2H2         G  15   8.841  17.640 -11.468
  165   1H5*    U  16          1H5*        U  16  14.739  17.423  -9.715
  166   2H5*    U  16          2H5*        U  16  15.861  18.556 -10.494
  167    H4*    U  16           H4*        U  16  13.852  18.856 -11.687
  168    H3*    U  16           H3*        U  16  14.094  20.931  -9.468
  169    H2*    U  16           H2*        U  16  12.079  21.897 -10.257
  170   2HO*    U  16          2HO*        U  16  11.230  20.839 -12.362
  171    H1*    U  16           H1*        U  16  10.783  19.518 -10.864
  172    H3     U  16           H3         U  16   8.559  21.710  -7.519
  173    H5     U  16           H5         U  16  11.783  19.764  -5.635
  174    H6     U  16           H6         U  16  12.638  19.192  -7.816
  175   1H5*    U  17          1H5*        U  17  13.923  24.412 -10.334
  176   2H5*    U  17          2H5*        U  17  13.113  23.350 -11.496
  177    H4*    U  17           H4*        U  17  14.070  26.196 -11.976
  178    H3*    U  17           H3*        U  17  11.726  25.511 -10.843
  179    H2*    U  17           H2*        U  17  11.074  23.822 -12.404
  180   2HO*    U  17          2HO*        U  17   9.942  26.301 -12.863
  181    H1*    U  17           H1*        U  17  11.803  25.428 -14.817
  182    H3     U  17           H3         U  17  10.324  21.447 -16.521
  183    H5     U  17           H5         U  17  13.690  20.445 -14.194
  184    H6     U  17           H6         U  17  13.804  22.742 -13.476
  185   1H5*    C  18          1H5*        C  18   8.207  26.069 -12.526
  186   2H5*    C  18          2H5*        C  18   8.203  27.842 -12.419
  187    H4*    C  18           H4*        C  18   6.149  26.814 -11.441
  188    H3*    C  18           H3*        C  18   7.494  28.950 -10.428
  189    H2*    C  18           H2*        C  18   8.963  27.729  -8.983
  190   2HO*    C  18          2HO*        C  18   7.986  27.851  -6.842
  191    H1*    C  18           H1*        C  18   6.721  25.967  -8.014
  192   1H4     C  18          1H4         C  18  11.856  22.918  -5.843
  193   2H4     C  18          2H4         C  18  12.508  22.805  -7.463
  194    H5     C  18           H5         C  18  11.471  23.814  -9.379
  195    H6     C  18           H6         C  18   9.574  25.147 -10.169
  196   1H5*    G  19          1H5*        G  19   2.699  27.175 -11.201
  197   2H5*    G  19          2H5*        G  19   4.127  26.168 -10.885
  198    H4*    G  19           H4*        G  19   2.699  26.690 -13.490
  199    H3*    G  19           H3*        G  19   3.726  24.279 -11.943
  200    H2*    G  19           H2*        G  19   3.964  23.123 -13.982
  201   2HO*    G  19          2HO*        G  19   2.480  25.125 -15.359
  202    H1*    G  19           H1*        G  19   4.692  25.320 -15.564
  203    H8     G  19           H8         G  19   6.890  24.253 -16.269
  204    H1     G  19           H1         G  19   8.409  22.379 -10.366
  205   1H2     G  19          1H2         G  19   6.819  22.995  -8.946
  206   2H2     G  19          2H2         G  19   5.390  23.866  -9.453
  207   1H5*    C  20          1H5*        C  20   1.512  22.887 -14.488
  208   2H5*    C  20          2H5*        C  20   0.626  21.380 -14.184
  209    H4*    C  20           H4*        C  20   2.547  21.099 -15.767
  210    H3*    C  20           H3*        C  20   2.350  19.596 -13.153
  211    H2*    C  20           H2*        C  20   4.465  18.577 -13.496
  212   2HO*    C  20          2HO*        C  20   3.889  19.172 -16.154
  213    H1*    C  20           H1*        C  20   5.833  20.745 -14.340
  214   1H4     C  20          1H4         C  20   6.234  20.522  -7.957
  215   2H4     C  20          2H4         C  20   4.832  21.565  -7.855
  216    H5     C  20           H5         C  20   3.536  22.227  -9.762
  217    H6     C  20           H6         C  20   3.299  22.053 -12.190
  218   1H5*    U  21          1H5*        U  21   3.746  17.191 -15.551
  219   2H5*    U  21          2H5*        U  21   2.787  15.879 -16.265
  220    H4*    U  21           H4*        U  21   4.789  14.794 -15.744
  221    H3*    U  21           H3*        U  21   2.765  14.471 -13.521
  222    H2*    U  21           H2*        U  21   4.353  13.293 -12.202
  223   2HO*    U  21          2HO*        U  21   6.471  12.781 -13.228
  224    H1*    U  21           H1*        U  21   6.504  14.882 -12.662
  225    H3     U  21           H3         U  21   5.183  15.894  -8.435
  226    H5     U  21           H5         U  21   2.464  17.961 -10.905
  227    H6     U  21           H6         U  21   3.417  16.801 -12.813
  228   1H5*    G  22          1H5*        G  22   4.498  10.792 -14.136
  229   2H5*    G  22          2H5*        G  22   3.518   9.415 -13.592
  230    H4*    G  22           H4*        G  22   5.606  10.029 -12.189
  231    H3*    G  22           H3*        G  22   2.803   9.582 -11.124
  232    H2*    G  22           H2*        G  22   3.448  10.265  -9.011
  233   2HO*    G  22          2HO*        G  22   5.417   8.573  -9.525
  234    H1*    G  22           H1*        G  22   5.855  11.666  -9.753
  235    H8     G  22           H8         G  22   2.707  13.347 -10.811
  236    H1     G  22           H1         G  22   3.739  14.055  -4.564
  237   1H2     G  22          1H2         G  22   5.396  12.735  -3.912
  238   2H2     G  22          2H2         G  22   6.248  11.682  -5.019
  239   1H5*    U  23          1H5*        U  23   5.549   5.971  -9.344
  240   2H5*    U  23          2H5*        U  23   4.328   4.891  -8.642
  241    H4*    U  23           H4*        U  23   6.154   5.995  -7.093
  242    H3*    U  23           H3*        U  23   3.187   5.656  -6.566
  243    H2*    U  23           H2*        U  23   3.405   6.762  -4.497
  244   2HO*    U  23          2HO*        U  23   5.418   7.004  -3.466
  245    H1*    U  23           H1*        U  23   5.316   8.634  -5.237
  246    H3     U  23           H3         U  23   1.308  10.539  -3.948
  247    H5     U  23           H5         U  23   1.019   9.815  -8.095
  248    H6     U  23           H6         U  23   3.069   8.528  -7.944
  249   1H5*    G  24          1H5*        G  24   4.240   0.225  -6.585
  250   2H5*    G  24          2H5*        G  24   4.960   0.933  -5.125
  251    H4*    G  24           H4*        G  24   5.768   1.459  -8.011
  252    H3*    G  24           H3*        G  24   6.857  -0.211  -5.768
  253    H2*    G  24           H2*        G  24   9.046   0.615  -5.983
  254   2HO*    G  24          2HO*        G  24   8.181   1.303  -8.591
  255    H1*    G  24           H1*        G  24   8.573   3.210  -6.486
  256    H8     G  24           H8         G  24   5.979   2.488  -3.979
  257    H1     G  24           H1         G  24  11.788   2.190  -1.367
  258   1H2     G  24          1H2         G  24  13.332   2.178  -2.953
  259   2H2     G  24          2H2         G  24  12.932   2.241  -4.655
  260   1H5*    C  25          1H5*        C  25  10.091  -0.709  -9.076
  261   2H5*    C  25          2H5*        C  25   9.664  -2.387  -9.470
  262    H4*    C  25           H4*        C  25  12.046  -2.336  -9.310
  263    H3*    C  25           H3*        C  25  10.615  -3.543  -6.937
  264    H2*    C  25           H2*        C  25  12.651  -3.839  -5.766
  265   2HO*    C  25          2HO*        C  25  13.969  -3.241  -8.239
  266    H1*    C  25           H1*        C  25  13.833  -1.466  -6.372
  267   1H4     C  25          1H4         C  25  10.728  -0.613  -0.875
  268   2H4     C  25          2H4         C  25   9.237  -0.329  -1.744
  269    H5     C  25           H5         C  25   9.038  -0.554  -4.132
  270    H6     C  25           H6         C  25  10.228  -1.099  -6.210
  271   1H5*    C  26          1H5*        C  26  14.203  -6.149  -7.829
  272   2H5*    C  26          2H5*        C  26  13.499  -7.776  -7.930
  273    H4*    C  26           H4*        C  26  15.482  -7.694  -6.430
  274    H3*    C  26           H3*        C  26  12.739  -8.413  -5.364
  275    H2*    C  26           H2*        C  26  13.637  -8.670  -3.176
  276   2HO*    C  26          2HO*        C  26  15.869  -8.767  -2.799
  277    H1*    C  26           H1*        C  26  15.190  -6.462  -3.137
  278   1H4     C  26          1H4         C  26   9.598  -4.483  -0.854
  279   2H4     C  26          2H4         C  26   8.909  -4.470  -2.462
  280    H5     C  26           H5         C  26  10.097  -5.227  -4.414
  281    H6     C  26           H6         C  26  12.204  -6.161  -5.249
  282   1H5*    G  27          1H5*        G  27  15.402 -11.592  -3.854
  283   2H5*    G  27          2H5*        G  27  14.365 -12.958  -3.393
  284    H4*    G  27           H4*        G  27  15.561 -11.502  -1.536
  285    H3*    G  27           H3*        G  27  12.700 -12.536  -1.538
  286    H2*    G  27           H2*        G  27  12.377 -11.545   0.575
  287   2HO*    G  27          2HO*        G  27  14.838 -12.340   0.983
  288    H1*    G  27           H1*        G  27  14.014  -9.301   0.182
  289    H8     G  27           H8         G  27  11.710  -9.439  -2.707
  290    H1     G  27           H1         G  27   8.632  -7.743   2.610
  291   1H2     G  27          1H2         G  27   9.920  -8.106   4.380
  292   2H2     G  27          2H2         G  27  11.534  -8.765   4.249
  293   1H5*    A  28          1H5*        A  28  14.386 -14.420   2.311
  294   2H5*    A  28          2H5*        A  28  13.330 -15.833   2.521
  295    H4*    A  28           H4*        A  28  13.278 -13.854   4.278
  296    H3*    A  28           H3*        A  28  10.936 -15.395   3.106
  297    H2*    A  28           H2*        A  28   9.438 -14.062   4.331
  298   2HO*    A  28          2HO*        A  28  11.127 -12.671   5.956
  299    H1*    A  28           H1*        A  28  10.919 -11.674   4.304
  300    H8     A  28           H8         A  28  10.609 -12.819   0.796
  301   1H6     A  28          1H6         A  28   4.784 -10.820   0.767
  302   2H6     A  28          2H6         A  28   6.105 -11.401  -0.222
  303    H2     A  28           H2         A  28   6.253 -10.776   5.014
  304   1H5*    A  29          1H5*        A  29  11.518 -16.463   7.985
  305   2H5*    A  29          2H5*        A  29  10.262 -17.691   8.239
  306    H4*    A  29           H4*        A  29  10.301 -15.513   9.727
  307    H3*    A  29           H3*        A  29   7.975 -17.010   8.525
  308    H2*    A  29           H2*        A  29   6.421 -15.338   9.163
  309   2HO*    A  29          2HO*        A  29   8.035 -15.027  11.213
  310    H1*    A  29           H1*        A  29   7.819 -13.163   8.422
  311    H8     A  29           H8         A  29   8.918 -15.560   5.849
  312   1H6     A  29          1H6         A  29   3.364 -15.222   3.213
  313   2H6     A  29          2H6         A  29   5.010 -15.783   3.023
  314    H2     A  29           H2         A  29   3.120 -13.232   7.235
  315   1H5*    A  30          1H5*        A  30   6.750 -17.621  13.036
  316   2H5*    A  30          2H5*        A  30   5.944 -19.196  12.894
  317    H4*    A  30           H4*        A  30   4.506 -17.114  13.516
  318    H3*    A  30           H3*        A  30   3.874 -19.240  11.455
  319    H2*    A  30           H2*        A  30   1.870 -18.107  10.858
  320   2HO*    A  30          2HO*        A  30   1.322 -16.134  12.163
  321    H1*    A  30           H1*        A  30   2.871 -15.598  10.750
  322    H8     A  30           H8         A  30   5.758 -17.418   9.451
  323   1H6     A  30          1H6         A  30   2.712 -18.563   4.225
  324   2H6     A  30          2H6         A  30   4.275 -18.591   5.010
  325    H2     A  30           H2         A  30  -0.244 -17.039   7.249
  326   1H5*    G  31          1H5*        G  31   0.591 -18.719  12.738
  327   2H5*    G  31          2H5*        G  31  -0.097 -19.830  13.940
  328    H4*    G  31           H4*        G  31  -1.906 -19.626  12.513
  329    H3*    G  31           H3*        G  31  -0.167 -21.875  11.431
  330    H2*    G  31           H2*        G  31  -1.663 -22.123   9.624
  331   2HO*    G  31          2HO*        G  31  -3.510 -21.993  11.225
  332    H1*    G  31           H1*        G  31  -2.363 -19.424   9.340
  333    H8     G  31           H8         G  31   1.341 -19.631   9.426
  334    H1     G  31           H1         G  31  -0.964 -21.883   3.931
  335   1H2     G  31          1H2         G  31  -3.164 -22.134   4.074
  336   2H2     G  31          2H2         G  31  -4.060 -21.748   5.525
  337   1H5*    G  32          1H5*        G  32  -4.277 -23.915  12.530
  338   2H5*    G  32          2H5*        G  32  -3.930 -25.655  12.450
  339    H4*    G  32           H4*        G  32  -5.575 -24.541  10.705
  340    H3*    G  32           H3*        G  32  -3.447 -26.649  10.254
  341    H2*    G  32           H2*        G  32  -3.871 -26.634   7.923
  342   2HO*    G  32          2HO*        G  32  -5.794 -25.115   7.312
  343    H1*    G  32           H1*        G  32  -4.151 -23.940   7.582
  344    H8     G  32           H8         G  32  -1.353 -24.252   9.995
  345    H1     G  32           H1         G  32   0.392 -26.158   4.169
  346   1H2     G  32          1H2         G  32  -1.397 -26.372   2.873
  347   2H2     G  32          2H2         G  32  -3.017 -26.044   3.447
  348   1H5*    U  33          1H5*        U  33  -5.919 -28.121   7.884
  349   2H5*    U  33          2H5*        U  33  -6.351 -29.815   8.192
  350    H4*    U  33           H4*        U  33  -5.306 -29.648   5.999
  351    H3*    U  33           H3*        U  33  -3.828 -31.046   8.222
  352    H2*    U  33           H2*        U  33  -1.841 -31.087   7.072
  353   2HO*    U  33          2HO*        U  33  -2.161 -31.112   4.557
  354    H1*    U  33           H1*        U  33  -2.481 -29.177   4.996
  355    H3     U  33           H3         U  33   1.936 -28.701   6.016
  356    H5     U  33           H5         U  33  -0.115 -27.138   9.351
  357    H6     U  33           H6         U  33  -2.181 -27.949   8.374
  358   1H5*    C  34          1H5*        C  34  -4.050 -33.437   4.663
  359   2H5*    C  34          2H5*        C  34  -4.663 -35.091   4.858
  360    H4*    C  34           H4*        C  34  -2.719 -35.503   3.660
  361    H3*    C  34           H3*        C  34  -2.009 -35.476   6.607
  362    H2*    C  34           H2*        C  34   0.222 -35.914   6.074
  363   2HO*    C  34          2HO*        C  34  -0.083 -37.643   4.653
  364    H1*    C  34           H1*        C  34   0.295 -34.429   3.696
  365   1H4     C  34          1H4         C  34   3.432 -30.899   7.939
  366   2H4     C  34          2H4         C  34   1.978 -30.652   8.877
  367    H5     C  34           H5         C  34  -0.132 -31.670   8.334
  368    H6     C  34           H6         C  34  -1.310 -33.147   6.774
  369    H3T    C  34           H3T        C  34  -3.238 -37.225   5.944
  370   1H5*    U  35          1H5*        U  35  -5.529 -12.791   4.955
  371   2H5*    U  35          2H5*        U  35  -5.277 -11.327   3.984
  372    H4*    U  35           H4*        U  35  -4.338 -11.147   6.298
  373    H3*    U  35           H3*        U  35  -2.621 -10.913   3.821
  374    H2*    U  35           H2*        U  35  -0.659 -10.696   5.111
  375   2HO*    U  35          2HO*        U  35  -1.308  -9.181   6.616
  376    H1*    U  35           H1*        U  35  -1.212 -12.526   7.063
  377    H3     U  35           H3         U  35   2.119 -14.360   4.601
  378    H5     U  35           H5         U  35  -1.272 -14.678   2.120
  379    H6     U  35           H6         U  35  -2.511 -13.394   3.765
  380    H5T    U  35           H5T        U  35  -4.593 -13.787   3.389
  381   1H5*    U  36          1H5*        U  36  -2.151  -7.294   6.680
  382   2H5*    U  36          2H5*        U  36  -1.196  -6.022   5.891
  383    H4*    U  36           H4*        U  36  -0.241  -7.288   8.006
  384    H3*    U  36           H3*        U  36   1.188  -6.443   5.471
  385    H2*    U  36           H2*        U  36   3.196  -7.466   6.229
  386   2HO*    U  36          2HO*        U  36   2.847  -6.686   8.469
  387    H1*    U  36           H1*        U  36   2.131  -9.783   7.112
  388    H3     U  36           H3         U  36   4.300 -10.352   3.105
  389    H5     U  36           H5         U  36   0.385  -9.161   2.100
  390    H6     U  36           H6         U  36  -0.008  -8.708   4.453
  391   1H5*    C  37          1H5*        C  37   3.535  -4.422   9.082
  392   2H5*    C  37          2H5*        C  37   4.377  -3.067   8.303
  393    H4*    C  37           H4*        C  37   5.783  -4.917   9.507
  394    H3*    C  37           H3*        C  37   6.286  -3.676   6.788
  395    H2*    C  37           H2*        C  37   8.180  -5.069   6.479
  396   2HO*    C  37          2HO*        C  37   9.250  -6.021   8.140
  397    H1*    C  37           H1*        C  37   7.119  -7.386   7.453
  398   1H4     C  37          1H4         C  37   6.285  -7.226   1.114
  399   2H4     C  37          2H4         C  37   4.701  -6.526   1.359
  400    H5     C  37           H5         C  37   3.875  -5.854   3.518
  401    H6     C  37           H6         C  37   4.392  -5.693   5.909
  402   1H5*    G  38          1H5*        G  38   9.948  -2.141   9.670
  403   2H5*    G  38          2H5*        G  38  10.621  -0.812   8.707
  404    H4*    G  38           H4*        G  38  12.161  -2.827   9.349
  405    H3*    G  38           H3*        G  38  11.918  -1.375   6.718
  406    H2*    G  38           H2*        G  38  13.311  -2.921   5.598
  407   2HO*    G  38          2HO*        G  38  14.756  -2.947   7.604
  408    H1*    G  38           H1*        G  38  12.362  -5.224   6.652
  409    H8     G  38           H8         G  38   9.295  -3.176   6.355
  410    H1     G  38           H1         G  38  11.476  -4.911   0.618
  411   1H2     G  38          1H2         G  38  13.524  -5.737   0.803
  412   2H2     G  38          2H2         G  38  14.353  -5.857   2.339
  413   1H5*    G  39          1H5*        G  39  16.541  -0.702   7.654
  414   2H5*    G  39          2H5*        G  39  16.760   0.908   6.941
  415    H4*    G  39           H4*        G  39  18.179  -1.029   5.986
  416    H3*    G  39           H3*        G  39  16.590   1.018   4.448
  417    H2*    G  39           H2*        G  39  16.976  -0.056   2.382
  418   2HO*    G  39          2HO*        G  39  19.316  -0.555   3.389
  419    H1*    G  39           H1*        G  39  16.712  -2.652   3.156
  420    H8     G  39           H8         G  39  14.086  -0.936   5.105
  421    H1     G  39           H1         G  39  12.586  -1.148  -1.088
  422   1H2     G  39          1H2         G  39  14.357  -1.755  -2.276
  423   2H2     G  39          2H2         G  39  15.905  -2.108  -1.543
  424   1H5*    C  40          1H5*        C  40  19.252   0.733   2.009
  425   2H5*    C  40          2H5*        C  40  20.559   1.930   2.107
  426    H4*    C  40           H4*        C  40  20.198   2.063  -0.149
  427    H3*    C  40           H3*        C  40  18.174   3.886   1.163
  428    H2*    C  40           H2*        C  40  17.083   4.269  -0.897
  429   2HO*    C  40          2HO*        C  40  18.111   4.173  -2.792
  430    H1*    C  40           H1*        C  40  17.227   1.734  -1.932
  431   1H4     C  40          1H4         C  40  11.494   2.116   0.794
  432   2H4     C  40          2H4         C  40  12.207   2.062   2.390
  433    H5     C  40           H5         C  40  14.585   2.027   2.775
  434    H6     C  40           H6         C  40  16.794   2.040   1.713
  435   1H5*    U  41          1H5*        U  41  17.810   6.863   1.929
  436   2H5*    U  41          2H5*        U  41  16.586   5.850   1.137
  437    H4*    U  41           H4*        U  41  16.216   8.476   1.548
  438    H3*    U  41           H3*        U  41  15.305   6.633  -0.663
  439    H2*    U  41           H2*        U  41  14.479   8.426  -1.950
  440   2HO*    U  41          2HO*        U  41  14.673  10.624  -0.601
  441    H1*    U  41           H1*        U  41  16.436  10.276  -1.452
  442    H3     U  41           H3         U  41  16.236   8.545  -5.785
  443    H5     U  41           H5         U  41  19.223   6.427  -3.698
  444    H6     U  41           H6         U  41  18.427   7.453  -1.648
  445   1H5*    C  42          1H5*        C  42  10.789   6.994   0.975
  446   2H5*    C  42          2H5*        C  42  10.355   5.455   0.205
  447    H4*    C  42           H4*        C  42   9.613   7.921  -0.732
  448    H3*    C  42           H3*        C  42   9.846   5.174  -1.914
  449    H2*    C  42           H2*        C  42   9.825   5.924  -4.143
  450   2HO*    C  42          2HO*        C  42   8.250   7.348  -4.410
  451    H1*    C  42           H1*        C  42  11.338   8.166  -3.933
  452   1H4     C  42          1H4         C  42  15.117   3.234  -5.489
  453   2H4     C  42          2H4         C  42  15.594   3.123  -3.811
  454    H5     C  42           H5         C  42  14.575   4.422  -2.058
  455    H6     C  42           H6         C  42  12.876   6.110  -1.534
  456   1H5*    U  43          1H5*        U  43   8.405   6.313   1.475
  457   2H5*    U  43          2H5*        U  43   7.547   4.788   1.775
  458    H4*    U  43           H4*        U  43   7.277   6.595   3.558
  459    H3*    U  43           H3*        U  43   5.055   5.095   2.187
  460    H2*    U  43           H2*        U  43   3.370   6.418   3.172
  461   2HO*    U  43          2HO*        U  43   4.050   7.956   4.914
  462    H1*    U  43           H1*        U  43   4.549   8.864   3.021
  463    H3     U  43           H3         U  43   1.144   8.691  -0.017
  464    H5     U  43           H5         U  43   4.416   6.856  -1.938
  465    H6     U  43           H6         U  43   5.616   6.943   0.169
  466   1H5*    U  44          1H5*        U  44   4.504   4.407   6.807
  467   2H5*    U  44          2H5*        U  44   3.469   2.973   6.968
  468    H4*    U  44           H4*        U  44   2.588   5.279   7.833
  469    H3*    U  44           H3*        U  44   1.128   3.176   6.230
  470    H2*    U  44           H2*        U  44  -0.775   4.553   5.985
  471   2HO*    U  44          2HO*        U  44  -0.564   6.715   7.285
  472    H1*    U  44           H1*        U  44   0.461   6.939   5.540
  473    H3     U  44           H3         U  44  -1.534   5.379   1.709
  474    H5     U  44           H5         U  44   2.292   3.612   1.793
  475    H6     U  44           H6         U  44   2.566   4.471   4.047
  476   1H5*    C  45          1H5*        C  45  -1.266   4.314   9.578
  477   2H5*    C  45          2H5*        C  45  -1.998   2.986  10.499
  478    H4*    C  45           H4*        C  45  -3.725   4.587   9.815
  479    H3*    C  45           H3*        C  45  -3.720   1.836   8.538
  480    H2*    C  45           H2*        C  45  -5.593   2.406   7.229
  481   2HO*    C  45          2HO*        C  45  -6.547   4.676   7.921
  482    H1*    C  45           H1*        C  45  -4.982   5.080   6.773
  483   1H4     C  45          1H4         C  45  -3.595   1.828   1.469
  484   2H4     C  45          2H4         C  45  -2.073   1.318   2.163
  485    H5     C  45           H5         C  45  -1.426   1.808   4.429
  486    H6     C  45           H6         C  45  -2.098   2.891   6.522
  487   1H5*    C  46          1H5*        C  46  -7.816   2.736  10.590
  488   2H5*    C  46          2H5*        C  46  -8.721   1.211  10.659
  489    H4*    C  46           H4*        C  46  -9.618   3.224   9.205
  490    H3*    C  46           H3*        C  46  -9.594   0.263   8.604
  491    H2*    C  46           H2*        C  46 -10.401   0.615   6.408
  492   2HO*    C  46          2HO*        C  46 -10.770   3.379   6.679
  493    H1*    C  46           H1*        C  46  -8.910   2.791   5.747
  494   1H4     C  46          1H4         C  46  -5.757  -2.411   3.813
  495   2H4     C  46          2H4         C  46  -4.982  -2.526   5.377
  496    H5     C  46           H5         C  46  -5.537  -1.092   7.233
  497    H6     C  46           H6         C  46  -6.953   0.761   7.987
  498   1H5*    U  47          1H5*        U  47 -14.214   1.595   8.467
  499   2H5*    U  47          2H5*        U  47 -15.080   0.048   8.556
  500    H4*    U  47           H4*        U  47 -15.321   1.582   6.423
  501    H3*    U  47           H3*        U  47 -15.034  -1.422   6.601
  502    H2*    U  47           H2*        U  47 -14.939  -1.618   4.250
  503   2HO*    U  47          2HO*        U  47 -15.528   0.170   2.889
  504    H1*    U  47           H1*        U  47 -13.398   0.577   3.700
  505    H3     U  47           H3         U  47 -11.152  -3.353   2.872
  506    H5     U  47           H5         U  47 -10.465  -2.463   6.936
  507    H6     U  47           H6         U  47 -12.125  -0.699   6.764
  508   1H5*    A  48          1H5*        A  48 -19.061  -0.710   4.268
  509   2H5*    A  48          2H5*        A  48 -19.864  -2.293   4.299
  510    H4*    A  48           H4*        A  48 -18.991  -1.296   2.018
  511    H3*    A  48           H3*        A  48 -18.877  -4.108   3.078
  512    H2*    A  48           H2*        A  48 -17.560  -4.878   1.294
  513   2HO*    A  48          2HO*        A  48 -18.166  -2.384   0.028
  514    H1*    A  48           H1*        A  48 -15.804  -2.833   1.186
  515    H8     A  48           H8         A  48 -16.538  -3.067   4.815
  516   1H6     A  48          1H6         A  48 -13.013  -8.108   5.094
  517   2H6     A  48          2H6         A  48 -13.855  -6.893   6.029
  518    H2     A  48           H2         A  48 -13.704  -7.127   0.762
  519    H3T    A  48           H3T        A  48 -20.723  -3.991   2.058
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  10.802 -28.631   4.741
    2   2H5*    G   1          2H5*        G   1  10.659 -27.634   3.278
    3    H4*    G   1           H4*        G   1  11.149 -29.683   2.321
    4    H3*    G   1           H3*        G   1   8.179 -29.290   2.539
    5    H2*    G   1           H2*        G   1   7.680 -31.560   2.014
    6   2HO*    G   1          2HO*        G   1  10.059 -31.393   0.713
    7    H1*    G   1           H1*        G   1   9.400 -32.748   3.626
    8    H8     G   1           H8         G   1   9.077 -29.996   5.865
    9    H1     G   1           H1         G   1   3.306 -32.577   5.043
   10   1H2     G   1          1H2         G   1   3.318 -33.916   3.276
   11   2H2     G   1          2H2         G   1   4.748 -34.174   2.301
   12    H5T    G   1           H5T        G   1   8.819 -28.184   5.149
   13   1H5*    G   2          1H5*        G   2   8.412 -30.528  -1.269
   14   2H5*    G   2          2H5*        G   2   7.796 -29.488  -2.569
   15    H4*    G   2           H4*        G   2   6.497 -31.528  -2.563
   16    H3*    G   2           H3*        G   2   5.110 -29.048  -1.497
   17    H2*    G   2           H2*        G   2   3.139 -30.323  -1.107
   18   2HO*    G   2          2HO*        G   2   4.384 -32.411  -2.616
   19    H1*    G   2           H1*        G   2   4.323 -32.547  -0.088
   20    H8     G   2           H8         G   2   6.355 -29.980   1.524
   21    H1     G   2           H1         G   2   0.382 -29.817   3.751
   22   1H2     G   2          1H2         G   2  -0.955 -30.989   2.424
   23   2H2     G   2          2H2         G   2  -0.374 -31.810   0.992
   24   1H5*    C   3          1H5*        C   3   2.329 -29.126  -4.792
   25   2H5*    C   3          2H5*        C   3   2.292 -27.425  -5.297
   26    H4*    C   3           H4*        C   3   0.172 -28.246  -4.175
   27    H3*    C   3           H3*        C   3   1.787 -25.914  -3.079
   28    H2*    C   3           H2*        C   3   0.198 -25.643  -1.373
   29   2HO*    C   3          2HO*        C   3  -1.483 -26.321  -3.356
   30    H1*    C   3           H1*        C   3  -0.583 -28.361  -1.166
   31   1H4     C   3          1H4         C   3   2.523 -26.516   4.115
   32   2H4     C   3          2H4         C   3   4.022 -27.047   3.387
   33    H5     C   3           H5         C   3   4.186 -27.805   1.105
   34    H6     C   3           H6         C   3   2.951 -28.215  -0.968
   35   1H5*    C   4          1H5*        C   4  -2.144 -23.859  -5.067
   36   2H5*    C   4          2H5*        C   4  -1.703 -22.139  -5.062
   37    H4*    C   4           H4*        C   4  -3.765 -22.986  -3.647
   38    H3*    C   4           H3*        C   4  -1.638 -20.961  -2.900
   39    H2*    C   4           H2*        C   4  -2.568 -20.729  -0.744
   40   2HO*    C   4          2HO*        C   4  -4.803 -20.763  -1.747
   41    H1*    C   4           H1*        C   4  -3.134 -23.334  -0.244
   42   1H4     C   4          1H4         C   4   2.567 -21.997   2.293
   43   2H4     C   4          2H4         C   4   3.339 -22.475   0.798
   44    H5     C   4           H5         C   4   2.110 -23.057  -1.195
   45    H6     C   4           H6         C   4  -0.121 -23.302  -2.181
   46   1H5*    U   5          1H5*        U   5  -5.687 -18.912  -1.814
   47   2H5*    U   5          2H5*        U   5  -5.290 -17.206  -2.102
   48    H4*    U   5           H4*        U   5  -6.010 -18.014   0.311
   49    H3*    U   5           H3*        U   5  -3.822 -16.073  -0.477
   50    H2*    U   5           H2*        U   5  -3.040 -15.963   1.711
   51   2HO*    U   5          2HO*        U   5  -5.124 -15.226   2.458
   52    H1*    U   5           H1*        U   5  -4.140 -18.451   2.657
   53    H3     U   5           H3         U   5   0.151 -18.025   4.223
   54    H5     U   5           H5         U   5   0.504 -19.284   0.214
   55    H6     U   5           H6         U   5  -1.871 -18.895  -0.046
   56   1H5*    U   6          1H5*        U   6  -6.893 -14.153  -2.788
   57   2H5*    U   6          2H5*        U   6  -5.798 -12.843  -2.305
   58    H4*    U   6           H4*        U   6  -8.229 -12.460  -3.519
   59    H3*    U   6           H3*        U   6  -6.505 -10.743  -1.718
   60    H2*    U   6           H2*        U   6  -8.235  -9.246  -1.364
   61   2HO*    U   6          2HO*        U   6  -9.778  -9.800  -3.593
   62    H1*    U   6           H1*        U   6 -10.416 -10.962  -2.202
   63    H3     U   6           H3         U   6 -11.967  -8.586   1.349
   64    H5     U   6           H5         U   6  -9.071 -11.166   2.997
   65    H6     U   6           H6         U   6  -8.486 -11.845   0.742
   66   1H5*    A   7          1H5*        A   7  -6.967  -8.663  -6.292
   67   2H5*    A   7          2H5*        A   7  -5.927  -7.231  -6.149
   68    H4*    A   7           H4*        A   7  -8.381  -6.897  -6.936
   69    H3*    A   7           H3*        A   7  -6.864  -5.314  -4.863
   70    H2*    A   7           H2*        A   7  -8.776  -4.068  -4.266
   71   2HO*    A   7          2HO*        A   7  -9.330  -3.781  -6.593
   72    H1*    A   7           H1*        A   7 -10.662  -6.042  -4.385
   73    H8     A   7           H8         A   7  -7.745  -7.696  -2.817
   74   1H6     A   7          1H6         A   7  -9.037  -4.765   2.442
   75   2H6     A   7          2H6         A   7  -8.088  -6.035   1.702
   76    H2     A   7           H2         A   7 -11.512  -2.919  -0.827
   77   1H5*    G   8          1H5*        G   8  -8.055  -2.058  -7.719
   78   2H5*    G   8          2H5*        G   8  -6.809  -0.799  -7.597
   79    H4*    G   8           H4*        G   8  -9.183  -0.261  -6.690
   80    H3*    G   8           H3*        G   8  -6.541   0.216  -5.292
   81    H2*    G   8           H2*        G   8  -7.631   0.978  -3.356
   82   2HO*    G   8          2HO*        G   8  -9.323   2.230  -3.548
   83    H1*    G   8           H1*        G   8  -9.871  -0.662  -3.432
   84    H8     G   8           H8         G   8  -6.958  -2.886  -3.933
   85    H1     G   8           H1         G   8  -7.232  -0.766   2.073
   86   1H2     G   8          1H2         G   8  -8.698   0.889   2.227
   87   2H2     G   8          2H2         G   8  -9.607   1.471   0.851
   88   1H5*    G   9          1H5*        G   9  -9.234   4.263  -6.167
   89   2H5*    G   9          2H5*        G   9  -8.183   5.616  -5.701
   90    H4*    G   9           H4*        G   9 -10.586   5.381  -4.641
   91    H3*    G   9           H3*        G   9  -7.981   6.239  -3.404
   92    H2*    G   9           H2*        G   9  -8.856   6.198  -1.199
   93   2HO*    G   9          2HO*        G   9 -11.215   6.627  -2.549
   94    H1*    G   9           H1*        G   9 -10.216   3.892  -1.305
   95    H8     G   9           H8         G   9  -7.382   3.140  -3.545
   96    H1     G   9           H1         G   9  -5.471   3.462   2.527
   97   1H2     G   9          1H2         G   9  -7.068   4.358   3.779
   98   2H2     G   9          2H2         G   9  -8.602   4.876   3.116
   99   1H5*    A  10          1H5*        A  10 -10.186   9.323  -1.989
  100   2H5*    A  10          2H5*        A  10  -9.442  10.917  -2.223
  101    H4*    A  10           H4*        A  10  -9.484  10.309   0.165
  102    H3*    A  10           H3*        A  10  -6.796  10.463  -1.244
  103    H2*    A  10           H2*        A  10  -5.721   9.961   0.793
  104   2HO*    A  10          2HO*        A  10  -6.600  11.331   2.243
  105    H1*    A  10           H1*        A  10  -7.653   8.221   1.822
  106    H8     A  10           H8         A  10  -6.938   7.079  -1.623
  107   1H6     A  10          1H6         A  10  -1.658   4.635   0.391
  108   2H6     A  10          2H6         A  10  -2.782   4.717  -0.946
  109    H2     A  10           H2         A  10  -3.306   7.267   3.641
  110   1H5*    A  11          1H5*        A  11  -6.858  14.274   1.700
  111   2H5*    A  11          2H5*        A  11  -5.462  15.215   1.138
  112    H4*    A  11           H4*        A  11  -5.477  14.180   3.569
  113    H3*    A  11           H3*        A  11  -3.212  14.309   1.562
  114    H2*    A  11           H2*        A  11  -1.792  13.120   3.064
  115   2HO*    A  11          2HO*        A  11  -2.787  14.401   4.924
  116    H1*    A  11           H1*        A  11  -3.575  11.246   3.853
  117    H8     A  11           H8         A  11  -4.422  11.642   0.276
  118   1H6     A  11          1H6         A  11   0.665   8.488  -1.175
  119   2H6     A  11          2H6         A  11  -0.839   9.141  -1.782
  120    H2     A  11           H2         A  11   0.883   9.549   3.186
  121   1H5*    A  12          1H5*        A  12  -0.764  15.549   4.812
  122   2H5*    A  12          2H5*        A  12   0.292  16.754   4.050
  123    H4*    A  12           H4*        A  12   1.442  14.607   4.781
  124    H3*    A  12           H3*        A  12   1.518  15.673   1.942
  125    H2*    A  12           H2*        A  12   2.868  13.835   1.297
  126   2HO*    A  12          2HO*        A  12   3.549  13.874   3.967
  127    H1*    A  12           H1*        A  12   1.581  11.887   2.626
  128    H8     A  12           H8         A  12  -1.055  14.164   1.348
  129   1H6     A  12          1H6         A  12  -0.174  11.820  -4.276
  130   2H6     A  12          2H6         A  12  -1.210  12.831  -3.294
  131    H2     A  12           H2         A  12   3.141  10.373  -1.612
  132   1H5*    C  13          1H5*        C  13   5.790  15.592   3.813
  133   2H5*    C  13          2H5*        C  13   6.804  16.780   2.971
  134    H4*    C  13           H4*        C  13   7.704  14.402   2.999
  135    H3*    C  13           H3*        C  13   7.231  15.995   0.460
  136    H2*    C  13           H2*        C  13   8.058  14.156  -0.827
  137   2HO*    C  13          2HO*        C  13   8.580  12.294   1.019
  138    H1*    C  13           H1*        C  13   6.642  12.232   0.391
  139   1H4     C  13          1H4         C  13   2.984  14.657  -4.258
  140   2H4     C  13          2H4         C  13   2.178  15.649  -3.067
  141    H5     C  13           H5         C  13   2.890  15.797  -0.780
  142    H6     C  13           H6         C  13   4.521  15.025   0.871
  143   1H5*    A  14          1H5*        A  14  11.613  15.096  -0.027
  144   2H5*    A  14          2H5*        A  14  12.144  16.305  -1.212
  145    H4*    A  14           H4*        A  14  11.948  13.761  -1.897
  146    H3*    A  14           H3*        A  14  11.018  16.162  -3.532
  147    H2*    A  14           H2*        A  14  10.537  14.596  -5.293
  148   2HO*    A  14          2HO*        A  14  12.473  13.312  -4.926
  149    H1*    A  14           H1*        A  14   9.326  12.759  -3.698
  150    H8     A  14           H8         A  14   7.974  15.779  -2.183
  151   1H6     A  14          1H6         A  14   4.428  16.675  -7.129
  152   2H6     A  14          2H6         A  14   4.717  17.137  -5.467
  153    H2     A  14           H2         A  14   7.533  13.600  -8.184
  154   1H5*    G  15          1H5*        G  15  13.779  14.534  -5.875
  155   2H5*    G  15          2H5*        G  15  15.081  15.528  -6.559
  156    H4*    G  15           H4*        G  15  13.907  14.668  -8.436
  157    H3*    G  15           H3*        G  15  13.003  17.501  -7.770
  158    H2*    G  15           H2*        G  15  11.710  17.419  -9.806
  159   2HO*    G  15          2HO*        G  15  13.604  15.756 -10.593
  160    H1*    G  15           H1*        G  15  10.644  14.964  -9.310
  161    H8     G  15           H8         G  15  10.885  16.519  -5.936
  162    H1     G  15           H1         G  15   6.317  19.245  -9.436
  163   1H2     G  15          1H2         G  15   6.488  18.599 -11.548
  164   2H2     G  15          2H2         G  15   7.730  17.497 -12.095
  165   1H5*    U  16          1H5*        U  16  13.668  17.547 -11.153
  166   2H5*    U  16          2H5*        U  16  14.604  18.699 -12.125
  167    H4*    U  16           H4*        U  16  12.410  18.960 -12.929
  168    H3*    U  16           H3*        U  16  12.934  21.031 -10.749
  169    H2*    U  16           H2*        U  16  10.809  21.943 -11.278
  170   2HO*    U  16          2HO*        U  16  10.862  20.315 -13.633
  171    H1*    U  16           H1*        U  16   9.541  19.493 -11.727
  172    H3     U  16           H3         U  16   7.528  21.570  -8.195
  173    H5     U  16           H5         U  16  11.075  19.916  -6.640
  174    H6     U  16           H6         U  16  11.738  19.364  -8.889
  175   1H5*    U  17          1H5*        U  17  13.239  25.333 -12.002
  176   2H5*    U  17          2H5*        U  17  11.743  24.414 -11.746
  177    H4*    U  17           H4*        U  17  12.146  26.817 -13.296
  178    H3*    U  17           H3*        U  17  10.114  25.867 -11.794
  179    H2*    U  17           H2*        U  17   9.618  23.935 -13.131
  180   2HO*    U  17          2HO*        U  17   8.067  25.959 -14.428
  181    H1*    U  17           H1*        U  17   9.733  25.474 -15.703
  182    H3     U  17           H3         U  17   8.711  21.253 -17.125
  183    H5     U  17           H5         U  17  12.414  20.856 -15.152
  184    H6     U  17           H6         U  17  12.252  23.173 -14.506
  185   1H5*    C  18          1H5*        C  18   6.544  25.655 -12.878
  186   2H5*    C  18          2H5*        C  18   6.185  27.386 -13.045
  187    H4*    C  18           H4*        C  18   4.419  26.393 -11.730
  188    H3*    C  18           H3*        C  18   5.750  28.597 -10.852
  189    H2*    C  18           H2*        C  18   7.416  27.452  -9.566
  190   2HO*    C  18          2HO*        C  18   6.059  28.882  -8.201
  191    H1*    C  18           H1*        C  18   5.363  25.590  -8.385
  192   1H4     C  18          1H4         C  18  10.829  22.822  -6.694
  193   2H4     C  18          2H4         C  18  11.341  22.743  -8.366
  194    H5     C  18           H5         C  18  10.079  23.688 -10.180
  195    H6     C  18           H6         C  18   8.048  24.910 -10.793
  196   1H5*    G  19          1H5*        G  19   1.000  26.563 -11.126
  197   2H5*    G  19          2H5*        G  19   2.505  25.636 -10.962
  198    H4*    G  19           H4*        G  19   0.772  26.052 -13.393
  199    H3*    G  19           H3*        G  19   2.120  23.721 -11.977
  200    H2*    G  19           H2*        G  19   2.225  22.574 -14.032
  201   2HO*    G  19          2HO*        G  19   0.800  24.106 -15.716
  202    H1*    G  19           H1*        G  19   2.587  24.818 -15.687
  203    H8     G  19           H8         G  19   4.760  23.937 -16.668
  204    H1     G  19           H1         G  19   7.118  22.139 -11.024
  205   1H2     G  19          1H2         G  19   5.671  22.621  -9.412
  206   2H2     G  19          2H2         G  19   4.129  23.384  -9.730
  207   1H5*    C  20          1H5*        C  20  -0.265  22.186 -14.272
  208   2H5*    C  20          2H5*        C  20  -1.040  20.638 -13.879
  209    H4*    C  20           H4*        C  20   0.702  20.436 -15.660
  210    H3*    C  20           H3*        C  20   0.897  18.959 -13.029
  211    H2*    C  20           H2*        C  20   3.003  18.036 -13.631
  212   2HO*    C  20          2HO*        C  20   3.459  19.029 -16.079
  213    H1*    C  20           H1*        C  20   4.147  20.273 -14.611
  214   1H4     C  20          1H4         C  20   5.247  20.131  -8.308
  215   2H4     C  20          2H4         C  20   3.801  21.084  -8.055
  216    H5     C  20           H5         C  20   2.269  21.653  -9.813
  217    H6     C  20           H6         C  20   1.785  21.445 -12.203
  218   1H5*    U  21          1H5*        U  21   2.011  16.270 -15.914
  219   2H5*    U  21          2H5*        U  21   1.011  14.804 -15.938
  220    H4*    U  21           H4*        U  21   3.349  14.152 -15.914
  221    H3*    U  21           H3*        U  21   1.779  13.700 -13.357
  222    H2*    U  21           H2*        U  21   3.715  12.717 -12.369
  223   2HO*    U  21          2HO*        U  21   4.203  11.851 -14.754
  224    H1*    U  21           H1*        U  21   5.526  14.555 -13.254
  225    H3     U  21           H3         U  21   4.969  15.364  -8.815
  226    H5     U  21           H5         U  21   1.681  17.241 -10.669
  227    H6     U  21           H6         U  21   2.328  16.170 -12.749
  228   1H5*    G  22          1H5*        G  22   3.658  10.202 -14.207
  229   2H5*    G  22          2H5*        G  22   2.898   8.732 -13.566
  230    H4*    G  22           H4*        G  22   5.093   9.448 -12.457
  231    H3*    G  22           H3*        G  22   2.502   8.939 -10.960
  232    H2*    G  22           H2*        G  22   3.480   9.636  -8.978
  233   2HO*    G  22          2HO*        G  22   5.272   7.938  -9.649
  234    H1*    G  22           H1*        G  22   5.659  11.127 -10.107
  235    H8     G  22           H8         G  22   2.338  12.677 -10.688
  236    H1     G  22           H1         G  22   4.260  13.508  -4.673
  237   1H2     G  22          1H2         G  22   6.034  12.247  -4.258
  238   2H2     G  22          2H2         G  22   6.744  11.201  -5.469
  239   1H5*    U  23          1H5*        U  23   5.401   5.185  -9.693
  240   2H5*    U  23          2H5*        U  23   4.240   4.159  -8.824
  241    H4*    U  23           H4*        U  23   6.319   5.184  -7.555
  242    H3*    U  23           H3*        U  23   3.448   4.951  -6.604
  243    H2*    U  23           H2*        U  23   4.012   6.027  -4.588
  244   2HO*    U  23          2HO*        U  23   6.270   4.672  -4.891
  245    H1*    U  23           H1*        U  23   5.912   7.798  -5.596
  246    H3     U  23           H3         U  23   2.319   9.930  -3.631
  247    H5     U  23           H5         U  23   1.285   9.310  -7.674
  248    H6     U  23           H6         U  23   3.244   7.894  -7.888
  249   1H5*    G  24          1H5*        G  24   4.780   0.374  -7.412
  250   2H5*    G  24          2H5*        G  24   5.496  -0.689  -6.184
  251    H4*    G  24           H4*        G  24   6.874   0.594  -8.227
  252    H3*    G  24           H3*        G  24   7.619  -0.809  -5.667
  253    H2*    G  24           H2*        G  24   9.777   0.113  -5.623
  254   2HO*    G  24          2HO*        G  24  10.861   0.632  -7.411
  255    H1*    G  24           H1*        G  24   9.268   2.620  -6.471
  256    H8     G  24           H8         G  24   6.398   1.834  -4.253
  257    H1     G  24           H1         G  24  11.791   2.540  -0.924
  258   1H2     G  24          1H2         G  24  13.530   2.585  -2.301
  259   2H2     G  24          2H2         G  24  13.358   2.441  -4.035
  260   1H5*    C  25          1H5*        C  25  11.339  -1.255  -8.261
  261   2H5*    C  25          2H5*        C  25  11.096  -2.962  -8.680
  262    H4*    C  25           H4*        C  25  13.400  -2.804  -8.163
  263    H3*    C  25           H3*        C  25  11.714  -3.922  -5.921
  264    H2*    C  25           H2*        C  25  13.564  -3.994  -4.447
  265   2HO*    C  25          2HO*        C  25  14.957  -4.154  -6.824
  266    H1*    C  25           H1*        C  25  14.676  -1.593  -5.044
  267   1H4     C  25          1H4         C  25  10.611  -0.602  -0.233
  268   2H4     C  25          2H4         C  25   9.271  -0.530  -1.356
  269    H5     C  25           H5         C  25   9.502  -0.948  -3.717
  270    H6     C  25           H6         C  25  11.069  -1.525  -5.513
  271   1H5*    C  26          1H5*        C  26  15.191  -5.662  -5.863
  272   2H5*    C  26          2H5*        C  26  15.240  -7.300  -6.548
  273    H4*    C  26           H4*        C  26  16.701  -7.498  -4.742
  274    H3*    C  26           H3*        C  26  13.903  -8.344  -3.964
  275    H2*    C  26           H2*        C  26  14.567  -8.656  -1.705
  276   2HO*    C  26          2HO*        C  26  17.071  -8.910  -2.881
  277    H1*    C  26           H1*        C  26  16.031  -6.414  -1.404
  278   1H4     C  26          1H4         C  26  10.155  -4.628   0.224
  279   2H4     C  26          2H4         C  26   9.630  -4.682  -1.445
  280    H5     C  26           H5         C  26  11.049  -5.409  -3.254
  281    H6     C  26           H6         C  26  13.276  -6.240  -3.851
  282   1H5*    G  27          1H5*        G  27  16.448 -11.437  -2.260
  283   2H5*    G  27          2H5*        G  27  15.420 -12.835  -1.893
  284    H4*    G  27           H4*        G  27  16.323 -11.292   0.057
  285    H3*    G  27           H3*        G  27  13.527 -12.448  -0.256
  286    H2*    G  27           H2*        G  27  12.916 -11.427   1.778
  287   2HO*    G  27          2HO*        G  27  15.550 -11.887   2.350
  288    H1*    G  27           H1*        G  27  14.503  -9.127   1.524
  289    H8     G  27           H8         G  27  12.561  -9.399  -1.605
  290    H1     G  27           H1         G  27   8.807  -7.787   3.289
  291   1H2     G  27          1H2         G  27   9.892  -8.075   5.201
  292   2H2     G  27          2H2         G  27  11.537  -8.663   5.270
  293   1H5*    A  28          1H5*        A  28  14.914 -14.840   3.525
  294   2H5*    A  28          2H5*        A  28  13.825 -16.240   3.454
  295    H4*    A  28           H4*        A  28  13.598 -14.468   5.408
  296    H3*    A  28           H3*        A  28  11.393 -15.819   3.816
  297    H2*    A  28           H2*        A  28   9.774 -14.586   4.986
  298   2HO*    A  28          2HO*        A  28  10.948 -13.351   6.970
  299    H1*    A  28           H1*        A  28  11.276 -12.248   5.414
  300    H8     A  28           H8         A  28  11.374 -12.981   1.786
  301   1H6     A  28          1H6         A  28   5.630 -10.818   1.300
  302   2H6     A  28          2H6         A  28   7.052 -11.324   0.416
  303    H2     A  28           H2         A  28   6.572 -11.299   5.669
  304   1H5*    A  29          1H5*        A  29  11.499 -17.238   8.654
  305   2H5*    A  29          2H5*        A  29  10.182 -18.426   8.730
  306    H4*    A  29           H4*        A  29  10.213 -16.371  10.389
  307    H3*    A  29           H3*        A  29   7.910 -17.671   8.938
  308    H2*    A  29           H2*        A  29   6.385 -15.987   9.623
  309   2HO*    A  29          2HO*        A  29   7.127 -15.861  11.812
  310    H1*    A  29           H1*        A  29   7.906 -13.826   9.135
  311    H8     A  29           H8         A  29   9.057 -16.064   6.444
  312   1H6     A  29          1H6         A  29   3.687 -15.270   3.535
  313   2H6     A  29          2H6         A  29   5.317 -15.891   3.393
  314    H2     A  29           H2         A  29   3.285 -13.594   7.685
  315   1H5*    A  30          1H5*        A  30   6.279 -18.502  13.246
  316   2H5*    A  30          2H5*        A  30   5.331 -19.962  12.899
  317    H4*    A  30           H4*        A  30   4.099 -17.721  13.515
  318    H3*    A  30           H3*        A  30   3.393 -19.714  11.340
  319    H2*    A  30           H2*        A  30   1.563 -18.347  10.674
  320   2HO*    A  30          2HO*        A  30   0.533 -17.166  12.102
  321    H1*    A  30           H1*        A  30   2.845 -15.959  10.740
  322    H8     A  30           H8         A  30   5.574 -18.015   9.473
  323   1H6     A  30          1H6         A  30   2.645 -18.658   4.099
  324   2H6     A  30          2H6         A  30   4.164 -18.870   4.941
  325    H2     A  30           H2         A  30  -0.268 -16.963   7.073
  326   1H5*    G  31          1H5*        G  31   0.145 -18.911  12.345
  327   2H5*    G  31          2H5*        G  31  -0.807 -19.974  13.400
  328    H4*    G  31           H4*        G  31  -2.381 -19.516  11.765
  329    H3*    G  31           H3*        G  31  -0.785 -21.929  10.831
  330    H2*    G  31           H2*        G  31  -2.041 -21.959   8.838
  331   2HO*    G  31          2HO*        G  31  -4.005 -21.255  10.459
  332    H1*    G  31           H1*        G  31  -2.400 -19.189   8.575
  333    H8     G  31           H8         G  31   1.217 -19.797   9.097
  334    H1     G  31           H1         G  31  -0.626 -21.655   3.284
  335   1H2     G  31          1H2         G  31  -2.842 -21.689   3.166
  336   2H2     G  31          2H2         G  31  -3.860 -21.255   4.521
  337   1H5*    G  32          1H5*        G  32  -5.216 -23.463  11.536
  338   2H5*    G  32          2H5*        G  32  -5.101 -25.234  11.542
  339    H4*    G  32           H4*        G  32  -6.463 -23.995   9.644
  340    H3*    G  32           H3*        G  32  -4.587 -26.364   9.402
  341    H2*    G  32           H2*        G  32  -4.875 -26.388   7.058
  342   2HO*    G  32          2HO*        G  32  -6.744 -25.886   6.180
  343    H1*    G  32           H1*        G  32  -4.994 -23.658   6.633
  344    H8     G  32           H8         G  32  -2.129 -24.145   8.919
  345    H1     G  32           H1         G  32  -0.795 -26.263   3.054
  346   1H2     G  32          1H2         G  32  -2.654 -26.385   1.852
  347   2H2     G  32          2H2         G  32  -4.221 -25.945   2.494
  348   1H5*    U  33          1H5*        U  33  -7.281 -28.274   7.332
  349   2H5*    U  33          2H5*        U  33  -7.366 -29.957   7.890
  350    H4*    U  33           H4*        U  33  -6.279 -29.737   5.652
  351    H3*    U  33           H3*        U  33  -4.785 -30.837   8.044
  352    H2*    U  33           H2*        U  33  -2.789 -30.864   6.891
  353   2HO*    U  33          2HO*        U  33  -4.371 -31.286   4.549
  354    H1*    U  33           H1*        U  33  -3.511 -29.054   4.758
  355    H3     U  33           H3         U  33   0.845 -28.319   5.927
  356    H5     U  33           H5         U  33  -1.430 -26.674   9.071
  357    H6     U  33           H6         U  33  -3.405 -27.659   8.063
  358   1H5*    C  34          1H5*        C  34  -5.137 -33.870   4.715
  359   2H5*    C  34          2H5*        C  34  -5.341 -35.531   5.306
  360    H4*    C  34           H4*        C  34  -3.489 -35.569   3.780
  361    H3*    C  34           H3*        C  34  -2.660 -35.542   6.698
  362    H2*    C  34           H2*        C  34  -0.424 -35.701   6.057
  363   2HO*    C  34          2HO*        C  34  -1.202 -37.417   4.374
  364    H1*    C  34           H1*        C  34  -0.661 -34.221   3.665
  365   1H4     C  34          1H4         C  34   2.550 -30.561   7.752
  366   2H4     C  34          2H4         C  34   1.098 -30.274   8.684
  367    H5     C  34           H5         C  34  -1.011 -31.331   8.204
  368    H6     C  34           H6         C  34  -2.186 -32.893   6.725
  369    H3T    C  34           H3T        C  34  -3.010 -37.474   4.629
  370   1H5*    U  35          1H5*        U  35  -5.064 -12.882   3.567
  371   2H5*    U  35          2H5*        U  35  -4.597 -11.374   2.755
  372    H4*    U  35           H4*        U  35  -4.344 -11.251   5.233
  373    H3*    U  35           H3*        U  35  -2.035 -10.897   3.332
  374    H2*    U  35           H2*        U  35  -0.452 -10.802   5.066
  375   2HO*    U  35          2HO*        U  35  -0.971 -10.250   7.154
  376    H1*    U  35           H1*        U  35  -1.462 -12.700   6.741
  377    H3     U  35           H3         U  35   2.330 -14.479   5.013
  378    H5     U  35           H5         U  35  -0.427 -14.661   1.830
  379    H6     U  35           H6         U  35  -1.991 -13.417   3.207
  380    H5T    U  35           H5T        U  35  -3.728 -13.154   1.685
  381   1H5*    U  36          1H5*        U  36  -2.002  -7.672   6.460
  382   2H5*    U  36          2H5*        U  36  -0.944  -6.337   5.960
  383    H4*    U  36           H4*        U  36  -0.276  -7.871   8.006
  384    H3*    U  36           H3*        U  36   1.470  -6.767   5.790
  385    H2*    U  36           H2*        U  36   3.357  -7.914   6.662
  386   2HO*    U  36          2HO*        U  36   3.411  -7.789   8.798
  387    H1*    U  36           H1*        U  36   2.154 -10.289   7.185
  388    H3     U  36           H3         U  36   4.869 -10.590   3.499
  389    H5     U  36           H5         U  36   1.164  -9.200   2.050
  390    H6     U  36           H6         U  36   0.440  -8.931   4.350
  391   1H5*    C  37          1H5*        C  37   3.343  -4.945   9.777
  392   2H5*    C  37          2H5*        C  37   4.102  -3.459   9.172
  393    H4*    C  37           H4*        C  37   5.627  -5.186  10.339
  394    H3*    C  37           H3*        C  37   6.140  -3.918   7.629
  395    H2*    C  37           H2*        C  37   8.177  -5.126   7.459
  396   2HO*    C  37          2HO*        C  37   8.310  -6.495   9.757
  397    H1*    C  37           H1*        C  37   7.263  -7.522   8.398
  398   1H4     C  37          1H4         C  37   6.878  -7.431   2.012
  399   2H4     C  37          2H4         C  37   5.235  -6.842   2.132
  400    H5     C  37           H5         C  37   4.201  -6.236   4.222
  401    H6     C  37           H6         C  37   4.521  -6.059   6.646
  402   1H5*    G  38          1H5*        G  38   9.522  -2.010  10.655
  403   2H5*    G  38          2H5*        G  38  10.080  -0.630   9.688
  404    H4*    G  38           H4*        G  38  11.818  -2.426  10.437
  405    H3*    G  38           H3*        G  38  11.499  -1.132   7.728
  406    H2*    G  38           H2*        G  38  13.168  -2.519   6.772
  407   2HO*    G  38          2HO*        G  38  14.719  -2.416   8.417
  408    H1*    G  38           H1*        G  38  12.415  -4.874   7.855
  409    H8     G  38           H8         G  38   9.169  -3.167   7.335
  410    H1     G  38           H1         G  38  11.805  -4.870   1.782
  411   1H2     G  38          1H2         G  38  13.912  -5.477   2.099
  412   2H2     G  38          2H2         G  38  14.668  -5.461   3.676
  413   1H5*    G  39          1H5*        G  39  15.772   0.039   9.017
  414   2H5*    G  39          2H5*        G  39  16.029   1.702   8.451
  415    H4*    G  39           H4*        G  39  17.676   0.021   7.538
  416    H3*    G  39           H3*        G  39  15.915   1.756   5.798
  417    H2*    G  39           H2*        G  39  16.736   0.733   3.828
  418   2HO*    G  39          2HO*        G  39  18.916   0.229   5.464
  419    H1*    G  39           H1*        G  39  16.773  -1.854   4.683
  420    H8     G  39           H8         G  39  13.695  -0.465   6.209
  421    H1     G  39           H1         G  39  13.050  -1.124  -0.100
  422   1H2     G  39          1H2         G  39  15.024  -1.537  -1.023
  423   2H2     G  39          2H2         G  39  16.495  -1.651  -0.085
  424   1H5*    C  40          1H5*        C  40  19.162   2.275   3.758
  425   2H5*    C  40          2H5*        C  40  19.874   3.892   3.925
  426    H4*    C  40           H4*        C  40  19.727   3.560   1.588
  427    H3*    C  40           H3*        C  40  17.408   5.191   2.672
  428    H2*    C  40           H2*        C  40  16.481   5.333   0.511
  429   2HO*    C  40          2HO*        C  40  17.890   4.592  -1.332
  430    H1*    C  40           H1*        C  40  17.217   2.807  -0.408
  431   1H4     C  40          1H4         C  40  11.022   2.466   0.975
  432   2H4     C  40          2H4         C  40  11.356   2.582   2.688
  433    H5     C  40           H5         C  40  13.570   2.904   3.581
  434    H6     C  40           H6         C  40  15.941   3.185   3.025
  435   1H5*    U  41          1H5*        U  41  16.287   7.671   1.581
  436   2H5*    U  41          2H5*        U  41  16.394   7.707  -0.191
  437    H4*    U  41           H4*        U  41  16.413  10.060   1.727
  438    H3*    U  41           H3*        U  41  14.506   8.927  -0.311
  439    H2*    U  41           H2*        U  41  14.011  11.042  -1.219
  440   2HO*    U  41          2HO*        U  41  13.593  12.294   0.523
  441    H1*    U  41           H1*        U  41  16.485  12.196  -1.108
  442    H3     U  41           H3         U  41  15.036  11.276  -5.409
  443    H5     U  41           H5         U  41  17.264   7.930  -4.143
  444    H6     U  41           H6         U  41  17.272   8.865  -1.904
  445   1H5*    C  42          1H5*        C  42  10.981   9.764  -0.417
  446   2H5*    C  42          2H5*        C  42  10.341   8.342   0.432
  447    H4*    C  42           H4*        C  42  10.047   8.434  -2.139
  448    H3*    C  42           H3*        C  42  11.103   6.125  -0.504
  449    H2*    C  42           H2*        C  42  11.815   4.977  -2.383
  450   2HO*    C  42          2HO*        C  42   9.576   4.871  -3.090
  451    H1*    C  42           H1*        C  42  11.718   7.195  -4.265
  452   1H4     C  42          1H4         C  42  17.718   5.236  -4.878
  453   2H4     C  42          2H4         C  42  17.795   4.746  -3.201
  454    H5     C  42           H5         C  42  15.962   5.017  -1.662
  455    H6     C  42           H6         C  42  13.659   5.814  -1.397
  456   1H5*    U  43          1H5*        U  43   9.162   5.233   1.830
  457   2H5*    U  43          2H5*        U  43   8.112   3.818   1.613
  458    H4*    U  43           H4*        U  43   7.825   5.371   3.728
  459    H3*    U  43           H3*        U  43   5.724   4.057   1.997
  460    H2*    U  43           H2*        U  43   3.977   5.149   3.151
  461   2HO*    U  43          2HO*        U  43   5.828   6.075   5.114
  462    H1*    U  43           H1*        U  43   5.126   7.607   3.455
  463    H3     U  43           H3         U  43   1.880   8.277   0.387
  464    H5     U  43           H5         U  43   4.806   6.090  -1.717
  465    H6     U  43           H6         U  43   6.028   5.848   0.367
  466   1H5*    U  44          1H5*        U  44   5.138   3.151   6.569
  467   2H5*    U  44          2H5*        U  44   3.937   1.854   6.737
  468    H4*    U  44           H4*        U  44   3.447   4.252   7.727
  469    H3*    U  44           H3*        U  44   1.603   2.353   6.266
  470    H2*    U  44           H2*        U  44  -0.144   3.940   6.251
  471   2HO*    U  44          2HO*        U  44   0.376   6.012   7.557
  472    H1*    U  44           H1*        U  44   1.321   6.195   5.743
  473    H3     U  44           H3         U  44  -1.254   5.200   2.100
  474    H5     U  44           H5         U  44   2.163   2.759   1.733
  475    H6     U  44           H6         U  44   2.820   3.455   3.962
  476   1H5*    C  45          1H5*        C  45  -0.898   3.879   9.765
  477   2H5*    C  45          2H5*        C  45  -1.316   2.351  10.565
  478    H4*    C  45           H4*        C  45  -3.349   3.634  10.290
  479    H3*    C  45           H3*        C  45  -2.992   1.219   8.502
  480    H2*    C  45           H2*        C  45  -5.039   1.658   7.409
  481   2HO*    C  45          2HO*        C  45  -5.570   3.278   9.691
  482    H1*    C  45           H1*        C  45  -4.870   4.396   7.284
  483   1H4     C  45          1H4         C  45  -2.824   2.247   1.658
  484   2H4     C  45          2H4         C  45  -1.311   1.729   2.368
  485    H5     C  45           H5         C  45  -0.838   1.880   4.724
  486    H6     C  45           H6         C  45  -1.714   2.560   6.910
  487   1H5*    C  46          1H5*        C  46  -6.966   1.663  10.663
  488   2H5*    C  46          2H5*        C  46  -7.890   0.147  10.667
  489    H4*    C  46           H4*        C  46  -8.897   2.269   9.496
  490    H3*    C  46           H3*        C  46  -8.869  -0.597   8.529
  491    H2*    C  46           H2*        C  46  -9.867   0.014   6.477
  492   2HO*    C  46          2HO*        C  46 -11.390   1.474   6.554
  493    H1*    C  46           H1*        C  46  -8.507   2.343   6.022
  494   1H4     C  46          1H4         C  46  -5.461  -2.299   2.885
  495   2H4     C  46          2H4         C  46  -4.620  -2.758   4.349
  496    H5     C  46           H5         C  46  -5.062  -1.757   6.494
  497    H6     C  46           H6         C  46  -6.409  -0.101   7.701
  498   1H5*    U  47          1H5*        U  47 -13.533   0.713   8.806
  499   2H5*    U  47          2H5*        U  47 -14.341  -0.867   8.745
  500    H4*    U  47           H4*        U  47 -14.806   0.934   6.874
  501    H3*    U  47           H3*        U  47 -14.424  -2.054   6.619
  502    H2*    U  47           H2*        U  47 -14.505  -1.939   4.264
  503   2HO*    U  47          2HO*        U  47 -15.167   0.136   3.259
  504    H1*    U  47           H1*        U  47 -13.090   0.377   3.891
  505    H3     U  47           H3         U  47 -10.685  -3.200   2.341
  506    H5     U  47           H5         U  47  -9.911  -3.046   6.482
  507    H6     U  47           H6         U  47 -11.632  -1.345   6.676
  508   1H5*    A  48          1H5*        A  48 -18.932  -1.531   5.028
  509   2H5*    A  48          2H5*        A  48 -19.488  -3.214   5.128
  510    H4*    A  48           H4*        A  48 -19.236  -2.040   2.780
  511    H3*    A  48           H3*        A  48 -18.527  -4.834   3.639
  512    H2*    A  48           H2*        A  48 -17.511  -5.354   1.586
  513   2HO*    A  48          2HO*        A  48 -19.247  -4.203   0.364
  514    H1*    A  48           H1*        A  48 -16.103  -3.077   1.255
  515    H8     A  48           H8         A  48 -16.064  -3.520   4.939
  516   1H6     A  48          1H6         A  48 -11.896  -7.998   4.258
  517   2H6     A  48          2H6         A  48 -12.723  -6.972   5.408
  518    H2     A  48           H2         A  48 -13.551  -7.008   0.198
  519    H3T    A  48           H3T        A  48 -20.701  -4.125   3.159
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  10.064 -30.129   4.784
    2   2H5*    G   1          2H5*        G   1  10.467 -29.461   3.190
    3    H4*    G   1           H4*        G   1  10.325 -31.663   2.573
    4    H3*    G   1           H3*        G   1   7.557 -30.480   2.450
    5    H2*    G   1           H2*        G   1   6.529 -32.599   2.168
    6   2HO*    G   1          2HO*        G   1   8.603 -33.202   0.799
    7    H1*    G   1           H1*        G   1   7.853 -33.967   4.052
    8    H8     G   1           H8         G   1   7.898 -30.900   5.908
    9    H1     G   1           H1         G   1   1.830 -32.609   4.954
   10   1H2     G   1          1H2         G   1   1.713 -34.163   3.381
   11   2H2     G   1          2H2         G   1   3.132 -34.782   2.564
   12    H5T    G   1           H5T        G   1   8.522 -28.634   3.013
   13   1H5*    G   2          1H5*        G   2   6.829 -32.818  -0.003
   14   2H5*    G   2          2H5*        G   2   7.131 -32.369  -1.693
   15    H4*    G   2           H4*        G   2   5.070 -33.328  -1.985
   16    H3*    G   2           H3*        G   2   4.505 -30.481  -1.075
   17    H2*    G   2           H2*        G   2   2.177 -30.978  -1.128
   18   2HO*    G   2          2HO*        G   2   1.376 -32.381  -2.512
   19    H1*    G   2           H1*        G   2   2.323 -33.490  -0.059
   20    H8     G   2           H8         G   2   4.671 -31.508   1.993
   21    H1     G   2           H1         G   2  -1.374 -29.908   3.207
   22   1H2     G   2          1H2         G   2  -2.712 -30.756   1.658
   23   2H2     G   2          2H2         G   2  -2.114 -31.718   0.326
   24   1H5*    C   3          1H5*        C   3   2.536 -29.524  -4.887
   25   2H5*    C   3          2H5*        C   3   3.091 -27.850  -5.081
   26    H4*    C   3           H4*        C   3   0.613 -28.216  -4.446
   27    H3*    C   3           H3*        C   3   2.540 -26.364  -3.005
   28    H2*    C   3           H2*        C   3   0.844 -25.758  -1.502
   29   2HO*    C   3          2HO*        C   3  -0.702 -26.122  -3.728
   30    H1*    C   3           H1*        C   3  -0.578 -28.196  -1.509
   31   1H4     C   3          1H4         C   3   2.313 -27.320   4.133
   32   2H4     C   3          2H4         C   3   3.684 -28.225   3.533
   33    H5     C   3           H5         C   3   3.882 -28.964   1.246
   34    H6     C   3           H6         C   3   2.817 -28.983  -0.953
   35   1H5*    C   4          1H5*        C   4  -0.959 -24.387  -5.221
   36   2H5*    C   4          2H5*        C   4  -0.739 -22.662  -5.586
   37    H4*    C   4           H4*        C   4  -2.875 -23.203  -4.354
   38    H3*    C   4           H3*        C   4  -0.791 -21.258  -3.360
   39    H2*    C   4           H2*        C   4  -1.960 -20.908  -1.335
   40   2HO*    C   4          2HO*        C   4  -4.110 -21.682  -2.886
   41    H1*    C   4           H1*        C   4  -2.653 -23.443  -0.780
   42   1H4     C   4          1H4         C   4   2.983 -22.291   1.994
   43   2H4     C   4          2H4         C   4   3.802 -22.853   0.554
   44    H5     C   4           H5         C   4   2.646 -23.449  -1.474
   45    H6     C   4           H6         C   4   0.457 -23.638  -2.560
   46   1H5*    U   5          1H5*        U   5  -4.788 -18.840  -2.989
   47   2H5*    U   5          2H5*        U   5  -4.194 -17.187  -3.247
   48    H4*    U   5           H4*        U   5  -5.339 -17.861  -0.950
   49    H3*    U   5           H3*        U   5  -2.870 -16.140  -1.379
   50    H2*    U   5           H2*        U   5  -2.622 -15.923   0.944
   51   2HO*    U   5          2HO*        U   5  -4.436 -16.309   2.367
   52    H1*    U   5           H1*        U   5  -3.782 -18.414   1.682
   53    H3     U   5           H3         U   5   0.386 -17.816   3.593
   54    H5     U   5           H5         U   5   1.041 -19.404  -0.259
   55    H6     U   5           H6         U   5  -1.301 -19.025  -0.740
   56   1H5*    U   6          1H5*        U   6  -7.664 -14.221  -0.271
   57   2H5*    U   6          2H5*        U   6  -8.514 -15.146  -1.525
   58    H4*    U   6           H4*        U   6  -9.236 -13.133  -2.635
   59    H3*    U   6           H3*        U   6  -7.126 -11.833  -0.906
   60    H2*    U   6           H2*        U   6  -8.528 -10.093  -0.324
   61   2HO*    U   6          2HO*        U   6  -8.546  -9.721  -2.792
   62    H1*    U   6           H1*        U   6 -11.019 -11.282  -1.294
   63    H3     U   6           H3         U   6 -12.280  -8.792   2.281
   64    H5     U   6           H5         U   6  -9.828 -11.795   3.933
   65    H6     U   6           H6         U   6  -9.312 -12.524   1.673
   66   1H5*    A   7          1H5*        A   7  -7.476  -9.468  -5.358
   67   2H5*    A   7          2H5*        A   7  -6.376  -8.088  -5.164
   68    H4*    A   7           H4*        A   7  -8.918  -7.685  -5.747
   69    H3*    A   7           H3*        A   7  -7.118  -6.175  -3.844
   70    H2*    A   7           H2*        A   7  -8.910  -4.833  -3.095
   71   2HO*    A   7          2HO*        A   7  -9.996  -4.164  -4.836
   72    H1*    A   7           H1*        A   7 -10.874  -6.739  -3.013
   73    H8     A   7           H8         A   7  -7.904  -8.479  -1.662
   74   1H6     A   7          1H6         A   7  -8.628  -5.394   3.620
   75   2H6     A   7          2H6         A   7  -7.798  -6.719   2.835
   76    H2     A   7           H2         A   7 -11.287  -3.506   0.525
   77   1H5*    G   8          1H5*        G   8  -8.405  -2.853  -6.884
   78   2H5*    G   8          2H5*        G   8  -7.143  -1.616  -6.711
   79    H4*    G   8           H4*        G   8  -9.618  -1.103  -5.950
   80    H3*    G   8           H3*        G   8  -6.998  -0.365  -4.643
   81    H2*    G   8           H2*        G   8  -8.068   0.474  -2.730
   82   2HO*    G   8          2HO*        G   8  -9.564   1.810  -3.763
   83    H1*    G   8           H1*        G   8 -10.185  -1.288  -2.562
   84    H8     G   8           H8         G   8  -7.226  -3.419  -3.150
   85    H1     G   8           H1         G   8  -7.150  -0.926   2.719
   86   1H2     G   8          1H2         G   8  -8.661   0.690   2.875
   87   2H2     G   8          2H2         G   8  -9.686   1.152   1.534
   88   1H5*    G   9          1H5*        G   9 -10.121   3.344  -5.539
   89   2H5*    G   9          2H5*        G   9  -9.165   4.810  -5.241
   90    H4*    G   9           H4*        G   9 -11.459   4.446  -3.989
   91    H3*    G   9           H3*        G   9  -8.860   5.604  -3.006
   92    H2*    G   9           H2*        G   9  -9.591   5.659  -0.747
   93   2HO*    G   9          2HO*        G   9 -11.648   5.917  -0.252
   94    H1*    G   9           H1*        G   9 -10.724   3.237  -0.600
   95    H8     G   9           H8         G   9  -7.975   2.633  -3.004
   96    H1     G   9           H1         G   9  -5.714   3.502   2.893
   97   1H2     G   9          1H2         G   9  -7.307   4.297   4.211
   98   2H2     G   9          2H2         G   9  -8.931   4.612   3.639
   99   1H5*    A  10          1H5*        A  10 -11.044   9.002  -1.604
  100   2H5*    A  10          2H5*        A  10 -10.093  10.395  -2.157
  101    H4*    A  10           H4*        A  10 -10.085  10.088   0.338
  102    H3*    A  10           H3*        A  10  -7.516   9.972  -1.284
  103    H2*    A  10           H2*        A  10  -6.293   9.706   0.725
  104   2HO*    A  10          2HO*        A  10  -7.293  10.103   2.780
  105    H1*    A  10           H1*        A  10  -8.086   8.053   2.033
  106    H8     A  10           H8         A  10  -7.824   6.699  -1.404
  107   1H6     A  10          1H6         A  10  -2.320   4.350   0.046
  108   2H6     A  10          2H6         A  10  -3.608   4.362  -1.138
  109    H2     A  10           H2         A  10  -3.542   7.169   3.328
  110   1H5*    A  11          1H5*        A  11  -7.307  13.930   1.372
  111   2H5*    A  11          2H5*        A  11  -5.911  14.826   0.740
  112    H4*    A  11           H4*        A  11  -5.883  13.889   3.210
  113    H3*    A  11           H3*        A  11  -3.691  14.015   1.145
  114    H2*    A  11           H2*        A  11  -2.214  12.723   2.468
  115   2HO*    A  11          2HO*        A  11  -4.049  13.057   4.641
  116    H1*    A  11           H1*        A  11  -3.961  10.872   3.402
  117    H8     A  11           H8         A  11  -5.119  11.352  -0.080
  118   1H6     A  11          1H6         A  11  -0.292   8.052  -2.017
  119   2H6     A  11          2H6         A  11  -1.824   8.757  -2.480
  120    H2     A  11           H2         A  11   0.357   9.061   2.312
  121   1H5*    A  12          1H5*        A  12  -1.327  14.527   4.213
  122   2H5*    A  12          2H5*        A  12  -0.174  15.838   3.891
  123    H4*    A  12           H4*        A  12   0.962  13.639   4.027
  124    H3*    A  12           H3*        A  12   0.904  15.131   1.385
  125    H2*    A  12           H2*        A  12   2.162  13.407   0.396
  126   2HO*    A  12          2HO*        A  12   3.479  12.048   1.539
  127    H1*    A  12           H1*        A  12   1.056  11.263   1.706
  128    H8     A  12           H8         A  12  -1.658  13.505   0.511
  129   1H6     A  12          1H6         A  12  -0.737  11.370  -5.189
  130   2H6     A  12          2H6         A  12  -1.789  12.329  -4.174
  131    H2     A  12           H2         A  12   2.604   9.889  -2.573
  132   1H5*    C  13          1H5*        C  13   5.176  14.750   3.198
  133   2H5*    C  13          2H5*        C  13   6.287  15.924   2.463
  134    H4*    C  13           H4*        C  13   7.011  13.490   2.312
  135    H3*    C  13           H3*        C  13   6.671  15.273  -0.129
  136    H2*    C  13           H2*        C  13   7.503  13.473  -1.471
  137   2HO*    C  13          2HO*        C  13   8.147  12.243   1.028
  138    H1*    C  13           H1*        C  13   5.969  11.545  -0.380
  139   1H4     C  13          1H4         C  13   2.693  14.175  -5.200
  140   2H4     C  13          2H4         C  13   1.858  15.189  -4.047
  141    H5     C  13           H5         C  13   2.435  15.280  -1.714
  142    H6     C  13           H6         C  13   3.931  14.420   0.021
  143   1H5*    A  14          1H5*        A  14  11.078  14.184  -0.452
  144   2H5*    A  14          2H5*        A  14  11.714  15.445  -1.526
  145    H4*    A  14           H4*        A  14  11.560  12.940  -2.352
  146    H3*    A  14           H3*        A  14  10.760  15.417  -3.943
  147    H2*    A  14           H2*        A  14  10.457  13.933  -5.808
  148   2HO*    A  14          2HO*        A  14  12.355  12.522  -4.557
  149    H1*    A  14           H1*        A  14   9.180  11.978  -4.383
  150    H8     A  14           H8         A  14   7.599  14.957  -2.978
  151   1H6     A  14          1H6         A  14   4.480  15.755  -8.217
  152   2H6     A  14          2H6         A  14   4.613  16.230  -6.539
  153    H2     A  14           H2         A  14   7.727  12.744  -8.980
  154   1H5*    G  15          1H5*        G  15  13.959  14.083  -6.009
  155   2H5*    G  15          2H5*        G  15  15.186  15.241  -6.561
  156    H4*    G  15           H4*        G  15  14.166  14.356  -8.534
  157    H3*    G  15           H3*        G  15  13.079  17.104  -7.795
  158    H2*    G  15           H2*        G  15  11.871  17.048  -9.884
  159   2HO*    G  15          2HO*        G  15  12.616  14.545 -10.722
  160    H1*    G  15           H1*        G  15  10.925  14.520  -9.546
  161    H8     G  15           H8         G  15  10.936  15.913  -6.094
  162    H1     G  15           H1         G  15   6.388  18.571  -9.680
  163   1H2     G  15          1H2         G  15   6.694  18.045 -11.811
  164   2H2     G  15          2H2         G  15   8.022  17.042 -12.348
  165   1H5*    U  16          1H5*        U  16  13.857  17.356 -11.125
  166   2H5*    U  16          2H5*        U  16  14.777  18.580 -12.018
  167    H4*    U  16           H4*        U  16  12.609  18.834 -12.873
  168    H3*    U  16           H3*        U  16  12.978  20.763 -10.538
  169    H2*    U  16           H2*        U  16  10.835  21.626 -11.060
  170   2HO*    U  16          2HO*        U  16  10.421  21.880 -13.117
  171    H1*    U  16           H1*        U  16   9.687  19.169 -11.763
  172    H3     U  16           H3         U  16   7.425  20.883  -8.189
  173    H5     U  16           H5         U  16  10.982  19.289  -6.597
  174    H6     U  16           H6         U  16  11.763  18.930  -8.843
  175   1H5*    U  17          1H5*        U  17  12.929  24.784 -11.116
  176   2H5*    U  17          2H5*        U  17  11.606  23.704 -11.589
  177    H4*    U  17           H4*        U  17  12.191  26.489 -12.454
  178    H3*    U  17           H3*        U  17  10.087  25.392 -11.179
  179    H2*    U  17           H2*        U  17   9.577  23.689 -12.782
  180   2HO*    U  17          2HO*        U  17   8.146  25.885 -13.912
  181    H1*    U  17           H1*        U  17   9.834  25.515 -15.139
  182    H3     U  17           H3         U  17   8.847  21.493 -17.052
  183    H5     U  17           H5         U  17  12.470  20.843 -14.999
  184    H6     U  17           H6         U  17  12.305  23.081 -14.120
  185   1H5*    C  18          1H5*        C  18   6.247  25.457 -12.982
  186   2H5*    C  18          2H5*        C  18   6.022  27.189 -12.667
  187    H4*    C  18           H4*        C  18   4.195  25.782 -11.705
  188    H3*    C  18           H3*        C  18   5.332  27.968 -10.528
  189    H2*    C  18           H2*        C  18   7.006  26.788  -9.285
  190   2HO*    C  18          2HO*        C  18   4.634  26.982  -7.716
  191    H1*    C  18           H1*        C  18   5.000  24.690  -8.456
  192   1H4     C  18          1H4         C  18  10.457  22.019  -6.600
  193   2H4     C  18          2H4         C  18  11.144  22.226  -8.196
  194    H5     C  18           H5         C  18  10.007  23.354  -9.988
  195    H6     C  18           H6         C  18   7.958  24.523 -10.646
  196   1H5*    G  19          1H5*        G  19   0.741  25.662 -11.225
  197   2H5*    G  19          2H5*        G  19   2.312  24.850 -11.072
  198    H4*    G  19           H4*        G  19   0.658  25.348 -13.544
  199    H3*    G  19           H3*        G  19   2.087  22.997 -12.249
  200    H2*    G  19           H2*        G  19   2.375  22.039 -14.379
  201   2HO*    G  19          2HO*        G  19   1.091  22.931 -16.201
  202    H1*    G  19           H1*        G  19   2.613  24.442 -15.833
  203    H8     G  19           H8         G  19   4.863  23.810 -16.826
  204    H1     G  19           H1         G  19   7.231  21.667 -11.308
  205   1H2     G  19          1H2         G  19   5.720  21.884  -9.701
  206   2H2     G  19          2H2         G  19   4.130  22.556  -9.987
  207   1H5*    C  20          1H5*        C  20  -0.061  21.476 -14.769
  208   2H5*    C  20          2H5*        C  20  -0.718  19.847 -14.519
  209    H4*    C  20           H4*        C  20   1.131  19.935 -16.212
  210    H3*    C  20           H3*        C  20   1.265  18.246 -13.711
  211    H2*    C  20           H2*        C  20   3.472  17.532 -14.221
  212   2HO*    C  20          2HO*        C  20   4.354  17.704 -16.245
  213    H1*    C  20           H1*        C  20   4.508  19.917 -14.943
  214   1H4     C  20          1H4         C  20   5.198  19.350  -8.600
  215   2H4     C  20          2H4         C  20   3.708  20.239  -8.387
  216    H5     C  20           H5         C  20   2.276  20.872 -10.207
  217    H6     C  20           H6         C  20   1.954  20.799 -12.631
  218   1H5*    U  21          1H5*        U  21   2.805  16.217 -16.211
  219   2H5*    U  21          2H5*        U  21   1.960  14.984 -17.168
  220    H4*    U  21           H4*        U  21   3.915  13.841 -16.822
  221    H3*    U  21           H3*        U  21   2.152  13.342 -14.418
  222    H2*    U  21           H2*        U  21   3.901  12.166 -13.324
  223   2HO*    U  21          2HO*        U  21   5.732  11.443 -14.419
  224    H1*    U  21           H1*        U  21   5.939  13.855 -13.918
  225    H3     U  21           H3         U  21   5.076  14.747  -9.570
  226    H5     U  21           H5         U  21   1.904  16.597 -11.637
  227    H6     U  21           H6         U  21   2.712  15.555 -13.675
  228   1H5*    G  22          1H5*        G  22   3.872   9.582 -15.146
  229   2H5*    G  22          2H5*        G  22   2.835   8.316 -14.459
  230    H4*    G  22           H4*        G  22   5.082   8.858 -13.259
  231    H3*    G  22           H3*        G  22   2.355   8.606 -11.947
  232    H2*    G  22           H2*        G  22   3.263   9.231  -9.905
  233   2HO*    G  22          2HO*        G  22   5.602   7.965 -10.900
  234    H1*    G  22           H1*        G  22   5.616  10.540 -10.905
  235    H8     G  22           H8         G  22   2.450  12.313 -11.715
  236    H1     G  22           H1         G  22   4.039  13.078  -5.594
  237   1H2     G  22          1H2         G  22   5.702  11.708  -5.063
  238   2H2     G  22          2H2         G  22   6.418  10.610  -6.222
  239   1H5*    U  23          1H5*        U  23   5.211   5.123 -10.425
  240   2H5*    U  23          2H5*        U  23   4.157   3.902  -9.684
  241    H4*    U  23           H4*        U  23   5.998   4.957  -8.203
  242    H3*    U  23           H3*        U  23   3.064   4.664  -7.498
  243    H2*    U  23           H2*        U  23   3.409   5.743  -5.438
  244   2HO*    U  23          2HO*        U  23   5.257   4.445  -4.884
  245    H1*    U  23           H1*        U  23   5.354   7.564  -6.236
  246    H3     U  23           H3         U  23   1.576   9.669  -4.670
  247    H5     U  23           H5         U  23   0.887   8.915  -8.762
  248    H6     U  23           H6         U  23   2.887   7.542  -8.778
  249   1H5*    G  24          1H5*        G  24   5.564  -0.591  -5.887
  250   2H5*    G  24          2H5*        G  24   5.453   0.511  -4.500
  251    H4*    G  24           H4*        G  24   6.772   1.303  -7.118
  252    H3*    G  24           H3*        G  24   7.845  -0.318  -4.816
  253    H2*    G  24           H2*        G  24   9.761   1.016  -4.599
  254   2HO*    G  24          2HO*        G  24   9.233   2.336  -7.058
  255    H1*    G  24           H1*        G  24   8.725   3.468  -5.133
  256    H8     G  24           H8         G  24   6.158   2.136  -2.915
  257    H1     G  24           H1         G  24  11.640   2.896   0.254
  258   1H2     G  24          1H2         G  24  13.303   3.217  -1.175
  259   2H2     G  24          2H2         G  24  13.061   3.242  -2.907
  260   1H5*    C  25          1H5*        C  25  11.351   0.108  -7.672
  261   2H5*    C  25          2H5*        C  25  11.471  -1.568  -8.244
  262    H4*    C  25           H4*        C  25  13.711  -0.878  -7.823
  263    H3*    C  25           H3*        C  25  12.498  -2.653  -5.701
  264    H2*    C  25           H2*        C  25  14.399  -2.452  -4.315
  265   2HO*    C  25          2HO*        C  25  16.081  -2.776  -5.691
  266    H1*    C  25           H1*        C  25  14.932   0.198  -4.681
  267   1H4     C  25          1H4         C  25  11.314  -0.350   0.545
  268   2H4     C  25          2H4         C  25   9.871  -0.309  -0.443
  269    H5     C  25           H5         C  25   9.920  -0.294  -2.851
  270    H6     C  25           H6         C  25  11.364  -0.314  -4.835
  271   1H5*    C  26          1H5*        C  26  16.609  -4.580  -6.146
  272   2H5*    C  26          2H5*        C  26  16.099  -6.177  -6.730
  273    H4*    C  26           H4*        C  26  17.658  -6.465  -4.881
  274    H3*    C  26           H3*        C  26  14.750  -7.168  -4.411
  275    H2*    C  26           H2*        C  26  15.222  -7.754  -2.159
  276   2HO*    C  26          2HO*        C  26  17.699  -7.505  -1.646
  277    H1*    C  26           H1*        C  26  16.829  -5.672  -1.538
  278   1H4     C  26          1H4         C  26  11.011  -3.648   0.010
  279   2H4     C  26          2H4         C  26  10.563  -3.504  -1.675
  280    H5     C  26           H5         C  26  12.018  -4.146  -3.486
  281    H6     C  26           H6         C  26  14.213  -5.065  -4.072
  282   1H5*    G  27          1H5*        G  27  17.176 -10.442  -2.769
  283   2H5*    G  27          2H5*        G  27  16.136 -11.869  -2.594
  284    H4*    G  27           H4*        G  27  16.999 -10.572  -0.454
  285    H3*    G  27           H3*        G  27  14.197 -11.655  -0.959
  286    H2*    G  27           H2*        G  27  13.567 -10.884   1.178
  287   2HO*    G  27          2HO*        G  27  15.260 -11.777   2.369
  288    H1*    G  27           H1*        G  27  15.206  -8.598   1.230
  289    H8     G  27           H8         G  27  13.237  -8.499  -1.908
  290    H1     G  27           H1         G  27   9.569  -7.297   3.163
  291   1H2     G  27          1H2         G  27  10.669  -7.787   5.025
  292   2H2     G  27          2H2         G  27  12.304  -8.407   5.018
  293   1H5*    A  28          1H5*        A  28  15.568 -14.208   2.629
  294   2H5*    A  28          2H5*        A  28  14.473 -15.605   2.599
  295    H4*    A  28           H4*        A  28  14.316 -13.830   4.553
  296    H3*    A  28           H3*        A  28  12.061 -15.185   3.040
  297    H2*    A  28           H2*        A  28  10.475 -13.950   4.261
  298   2HO*    A  28          2HO*        A  28  12.431 -14.102   6.191
  299    H1*    A  28           H1*        A  28  11.943 -11.588   4.563
  300    H8     A  28           H8         A  28  12.037 -12.443   0.963
  301   1H6     A  28          1H6         A  28   6.239 -10.428   0.444
  302   2H6     A  28          2H6         A  28   7.666 -10.930  -0.434
  303    H2     A  28           H2         A  28   7.221 -10.742   4.818
  304   1H5*    A  29          1H5*        A  29  12.103 -16.295   7.884
  305   2H5*    A  29          2H5*        A  29  10.893 -17.589   7.993
  306    H4*    A  29           H4*        A  29  10.668 -15.430   9.497
  307    H3*    A  29           H3*        A  29   8.554 -17.029   8.056
  308    H2*    A  29           H2*        A  29   6.862 -15.445   8.551
  309   2HO*    A  29          2HO*        A  29   8.004 -13.550   9.984
  310    H1*    A  29           H1*        A  29   8.218 -13.188   7.995
  311    H8     A  29           H8         A  29   9.638 -15.540   5.515
  312   1H6     A  29          1H6         A  29   4.411 -15.132   2.275
  313   2H6     A  29          2H6         A  29   6.069 -15.692   2.257
  314    H2     A  29           H2         A  29   3.716 -13.242   6.292
  315   1H5*    A  30          1H5*        A  30   6.809 -17.527  12.400
  316   2H5*    A  30          2H5*        A  30   5.913 -19.041  12.167
  317    H4*    A  30           H4*        A  30   4.605 -16.793  12.581
  318    H3*    A  30           H3*        A  30   3.985 -19.002  10.599
  319    H2*    A  30           H2*        A  30   2.112 -17.766   9.798
  320   2HO*    A  30          2HO*        A  30   1.078 -16.368  11.035
  321    H1*    A  30           H1*        A  30   3.331 -15.368   9.588
  322    H8     A  30           H8         A  30   6.149 -17.511   8.678
  323   1H6     A  30          1H6         A  30   3.470 -18.768   3.286
  324   2H6     A  30          2H6         A  30   4.950 -18.862   4.212
  325    H2     A  30           H2         A  30   0.406 -16.811   5.938
  326   1H5*    G  31          1H5*        G  31   0.782 -18.186  11.678
  327   2H5*    G  31          2H5*        G  31  -0.198 -19.108  12.835
  328    H4*    G  31           H4*        G  31  -1.768 -18.732  11.173
  329    H3*    G  31           H3*        G  31  -0.295 -21.293  10.452
  330    H2*    G  31           H2*        G  31  -1.606 -21.448   8.495
  331   2HO*    G  31          2HO*        G  31  -3.586 -20.956   9.785
  332    H1*    G  31           H1*        G  31  -1.805 -18.706   7.964
  333    H8     G  31           H8         G  31   1.774 -19.484   8.545
  334    H1     G  31           H1         G  31  -0.200 -21.757   2.928
  335   1H2     G  31          1H2         G  31  -2.411 -21.663   2.806
  336   2H2     G  31          2H2         G  31  -3.399 -21.039   4.108
  337   1H5*    G  32          1H5*        G  32  -4.815 -22.047  10.972
  338   2H5*    G  32          2H5*        G  32  -5.141 -23.793  11.002
  339    H4*    G  32           H4*        G  32  -6.050 -22.301   9.016
  340    H3*    G  32           H3*        G  32  -4.821 -25.067   8.919
  341    H2*    G  32           H2*        G  32  -4.968 -25.082   6.554
  342   2HO*    G  32          2HO*        G  32  -6.505 -24.023   5.495
  343    H1*    G  32           H1*        G  32  -4.311 -22.451   6.091
  344    H8     G  32           H8         G  32  -1.899 -23.600   8.662
  345    H1     G  32           H1         G  32  -0.634 -26.192   2.974
  346   1H2     G  32          1H2         G  32  -2.333 -25.843   1.587
  347   2H2     G  32          2H2         G  32  -3.773 -24.974   2.065
  348   1H5*    U  33          1H5*        U  33  -8.176 -26.648   6.941
  349   2H5*    U  33          2H5*        U  33  -8.265 -28.272   7.652
  350    H4*    U  33           H4*        U  33  -7.348 -28.052   5.234
  351    H3*    U  33           H3*        U  33  -6.140 -29.621   7.519
  352    H2*    U  33           H2*        U  33  -4.189 -30.008   6.361
  353   2HO*    U  33          2HO*        U  33  -4.224 -30.250   4.039
  354    H1*    U  33           H1*        U  33  -4.429 -27.957   4.365
  355    H3     U  33           H3         U  33  -0.067 -28.341   5.728
  356    H5     U  33           H5         U  33  -2.037 -26.249   8.813
  357    H6     U  33           H6         U  33  -4.138 -26.727   7.697
  358   1H5*    C  34          1H5*        C  34  -6.911 -32.811   4.049
  359   2H5*    C  34          2H5*        C  34  -7.328 -34.249   5.002
  360    H4*    C  34           H4*        C  34  -5.485 -34.775   3.481
  361    H3*    C  34           H3*        C  34  -4.798 -34.546   6.427
  362    H2*    C  34           H2*        C  34  -2.604 -35.180   5.957
  363   2HO*    C  34          2HO*        C  34  -3.804 -36.706   4.099
  364    H1*    C  34           H1*        C  34  -2.448 -33.963   3.418
  365   1H4     C  34          1H4         C  34   1.154 -30.441   7.282
  366   2H4     C  34          2H4         C  34  -0.264 -29.826   8.100
  367    H5     C  34           H5         C  34  -2.497 -30.579   7.618
  368    H6     C  34           H6         C  34  -3.864 -32.078   6.237
  369    H3T    C  34           H3T        C  34  -6.224 -36.227   5.240
  370   1H5*    U  35          1H5*        U  35  -4.621 -12.519   3.381
  371   2H5*    U  35          2H5*        U  35  -4.324 -10.876   2.774
  372    H4*    U  35           H4*        U  35  -3.407 -11.221   5.064
  373    H3*    U  35           H3*        U  35  -1.602 -10.588   2.717
  374    H2*    U  35           H2*        U  35   0.310 -10.722   4.076
  375   2HO*    U  35          2HO*        U  35  -1.322  -9.673   5.892
  376    H1*    U  35           H1*        U  35  -0.479 -12.789   5.736
  377    H3     U  35           H3         U  35   3.097 -14.336   3.433
  378    H5     U  35           H5         U  35  -0.021 -14.319   0.599
  379    H6     U  35           H6         U  35  -1.415 -13.200   2.242
  380    H5T    U  35           H5T        U  35  -2.419 -11.831   1.731
  381   1H5*    U  36          1H5*        U  36  -1.363  -7.394   6.210
  382   2H5*    U  36          2H5*        U  36  -0.335  -6.043   5.691
  383    H4*    U  36           H4*        U  36   0.378  -7.544   7.744
  384    H3*    U  36           H3*        U  36   2.090  -6.436   5.504
  385    H2*    U  36           H2*        U  36   4.001  -7.534   6.389
  386   2HO*    U  36          2HO*        U  36   2.380  -7.846   8.715
  387    H1*    U  36           H1*        U  36   2.848  -9.927   6.926
  388    H3     U  36           H3         U  36   5.554 -10.145   3.217
  389    H5     U  36           H5         U  36   1.780  -8.921   1.796
  390    H6     U  36           H6         U  36   1.071  -8.658   4.102
  391   1H5*    C  37          1H5*        C  37   4.023  -4.590   9.476
  392   2H5*    C  37          2H5*        C  37   4.854  -3.169   8.814
  393    H4*    C  37           H4*        C  37   6.257  -5.012  10.029
  394    H3*    C  37           H3*        C  37   6.885  -3.646   7.395
  395    H2*    C  37           H2*        C  37   8.868  -4.936   7.193
  396   2HO*    C  37          2HO*        C  37   9.571  -6.267   8.998
  397    H1*    C  37           H1*        C  37   7.833  -7.333   7.976
  398   1H4     C  37          1H4         C  37   7.474  -6.845   1.605
  399   2H4     C  37          2H4         C  37   5.845  -6.228   1.763
  400    H5     C  37           H5         C  37   4.826  -5.722   3.886
  401    H6     C  37           H6         C  37   5.152  -5.686   6.317
  402   1H5*    G  38          1H5*        G  38  10.103  -2.128  10.672
  403   2H5*    G  38          2H5*        G  38  10.905  -0.731   9.925
  404    H4*    G  38           H4*        G  38  12.354  -2.788  10.601
  405    H3*    G  38           H3*        G  38  12.435  -1.194   8.043
  406    H2*    G  38           H2*        G  38  13.979  -2.681   7.040
  407   2HO*    G  38          2HO*        G  38  14.317  -3.827   9.643
  408    H1*    G  38           H1*        G  38  12.897  -5.029   7.827
  409    H8     G  38           H8         G  38   9.881  -2.984   7.247
  410    H1     G  38           H1         G  38  12.848  -4.296   1.755
  411   1H2     G  38          1H2         G  38  14.866  -5.117   2.161
  412   2H2     G  38          2H2         G  38  15.480  -5.340   3.784
  413   1H5*    G  39          1H5*        G  39  16.801  -0.285   9.582
  414   2H5*    G  39          2H5*        G  39  16.893   1.454   9.236
  415    H4*    G  39           H4*        G  39  18.636   0.042   8.062
  416    H3*    G  39           H3*        G  39  16.710   1.898   6.666
  417    H2*    G  39           H2*        G  39  17.440   1.219   4.527
  418   2HO*    G  39          2HO*        G  39  19.762   0.657   5.927
  419    H1*    G  39           H1*        G  39  17.739  -1.456   4.978
  420    H8     G  39           H8         G  39  14.646  -0.611   6.819
  421    H1     G  39           H1         G  39  13.714  -0.382   0.516
  422   1H2     G  39          1H2         G  39  15.664  -0.435  -0.542
  423   2H2     G  39          2H2         G  39  17.191  -0.528   0.306
  424   1H5*    C  40          1H5*        C  40  19.421   2.188   3.824
  425   2H5*    C  40          2H5*        C  40  20.342   3.639   4.267
  426    H4*    C  40           H4*        C  40  19.946   4.005   1.996
  427    H3*    C  40           H3*        C  40  17.797   5.311   3.680
  428    H2*    C  40           H2*        C  40  16.602   5.957   1.762
  429   2HO*    C  40          2HO*        C  40  17.987   5.473  -0.357
  430    H1*    C  40           H1*        C  40  17.152   3.764   0.146
  431   1H4     C  40          1H4         C  40  11.258   2.694   2.232
  432   2H4     C  40          2H4         C  40  11.786   2.706   3.900
  433    H5     C  40           H5         C  40  14.064   3.124   4.564
  434    H6     C  40           H6         C  40  16.329   3.621   3.769
  435   1H5*    U  41          1H5*        U  41  17.284   8.164   5.348
  436   2H5*    U  41          2H5*        U  41  16.380   7.009   4.347
  437    H4*    U  41           H4*        U  41  15.331   9.356   5.147
  438    H3*    U  41           H3*        U  41  14.931   7.726   2.630
  439    H2*    U  41           H2*        U  41  13.606   9.420   1.666
  440   2HO*    U  41          2HO*        U  41  12.199  10.304   2.973
  441    H1*    U  41           H1*        U  41  14.986  11.620   2.586
  442    H3     U  41           H3         U  41  15.071  10.881  -2.022
  443    H5     U  41           H5         U  41  18.604   9.249  -0.403
  444    H6     U  41           H6         U  41  17.653   9.552   1.809
  445   1H5*    C  42          1H5*        C  42  10.768   8.892   3.085
  446   2H5*    C  42          2H5*        C  42   9.942   7.366   2.711
  447    H4*    C  42           H4*        C  42   9.512   9.275   1.082
  448    H3*    C  42           H3*        C  42  10.576   6.555   0.272
  449    H2*    C  42           H2*        C  42  10.711   7.234  -1.974
  450   2HO*    C  42          2HO*        C  42   8.771   9.143  -1.175
  451    H1*    C  42           H1*        C  42  11.378   9.913  -1.565
  452   1H4     C  42          1H4         C  42  16.743   7.063  -3.419
  453   2H4     C  42          2H4         C  42  16.848   6.187  -1.909
  454    H5     C  42           H5         C  42  15.160   6.307  -0.194
  455    H6     C  42           H6         C  42  13.008   7.292   0.443
  456   1H5*    U  43          1H5*        U  43   8.833   5.651   1.620
  457   2H5*    U  43          2H5*        U  43   8.148   4.037   1.897
  458    H4*    U  43           H4*        U  43   7.199   6.060   3.256
  459    H3*    U  43           H3*        U  43   5.633   3.894   1.827
  460    H2*    U  43           H2*        U  43   3.613   4.938   2.351
  461   2HO*    U  43          2HO*        U  43   4.815   6.532   4.370
  462    H1*    U  43           H1*        U  43   4.557   7.611   2.537
  463    H3     U  43           H3         U  43   1.071   7.931  -0.308
  464    H5     U  43           H5         U  43   3.899   5.649  -2.443
  465    H6     U  43           H6         U  43   5.274   5.604  -0.443
  466   1H5*    U  44          1H5*        U  44   5.081   4.714   6.385
  467   2H5*    U  44          2H5*        U  44   4.324   3.344   7.224
  468    H4*    U  44           H4*        U  44   3.273   5.579   7.736
  469    H3*    U  44           H3*        U  44   1.726   3.264   6.540
  470    H2*    U  44           H2*        U  44  -0.243   4.567   6.471
  471   2HO*    U  44          2HO*        U  44   0.993   6.637   7.982
  472    H1*    U  44           H1*        U  44   0.877   6.966   5.721
  473    H3     U  44           H3         U  44  -1.689   5.507   2.260
  474    H5     U  44           H5         U  44   1.846   3.228   1.994
  475    H6     U  44           H6         U  44   2.538   4.174   4.118
  476   1H5*    C  45          1H5*        C  45  -0.754   4.719   9.948
  477   2H5*    C  45          2H5*        C  45  -1.011   3.276  10.949
  478    H4*    C  45           H4*        C  45  -3.166   4.281  10.609
  479    H3*    C  45           H3*        C  45  -2.637   1.810   8.923
  480    H2*    C  45           H2*        C  45  -4.814   1.988   8.004
  481   2HO*    C  45          2HO*        C  45  -6.291   3.628   8.965
  482    H1*    C  45           H1*        C  45  -4.880   4.725   7.726
  483   1H4     C  45          1H4         C  45  -3.181   2.453   2.033
  484   2H4     C  45          2H4         C  45  -1.590   2.036   2.633
  485    H5     C  45           H5         C  45  -0.934   2.313   4.933
  486    H6     C  45           H6         C  45  -1.660   3.043   7.158
  487   1H5*    C  46          1H5*        C  46  -6.494   2.142  11.152
  488   2H5*    C  46          2H5*        C  46  -7.370   0.602  11.261
  489    H4*    C  46           H4*        C  46  -8.427   2.641   9.962
  490    H3*    C  46           H3*        C  46  -8.410  -0.296   9.243
  491    H2*    C  46           H2*        C  46  -9.461   0.139   7.171
  492   2HO*    C  46          2HO*        C  46 -10.658   1.946   6.788
  493    H1*    C  46           H1*        C  46  -8.126   2.423   6.486
  494   1H4     C  46          1H4         C  46  -5.131  -2.448   3.669
  495   2H4     C  46          2H4         C  46  -4.244  -2.775   5.141
  496    H5     C  46           H5         C  46  -4.639  -1.599   7.209
  497    H6     C  46           H6         C  46  -5.969   0.142   8.309
  498   1H5*    U  47          1H5*        U  47 -12.732   1.494   9.016
  499   2H5*    U  47          2H5*        U  47 -13.840   0.126   9.247
  500    H4*    U  47           H4*        U  47 -14.067   1.526   7.074
  501    H3*    U  47           H3*        U  47 -13.982  -1.485   7.322
  502    H2*    U  47           H2*        U  47 -14.012  -1.761   4.979
  503   2HO*    U  47          2HO*        U  47 -15.258  -0.479   3.857
  504    H1*    U  47           H1*        U  47 -12.367   0.308   4.271
  505    H3     U  47           H3         U  47 -10.190  -3.601   3.404
  506    H5     U  47           H5         U  47  -9.675  -2.971   7.540
  507    H6     U  47           H6         U  47 -11.241  -1.124   7.386
  508   1H5*    A  48          1H5*        A  48 -18.404  -0.667   5.505
  509   2H5*    A  48          2H5*        A  48 -19.150  -2.259   5.753
  510    H4*    A  48           H4*        A  48 -18.741  -1.348   3.307
  511    H3*    A  48           H3*        A  48 -18.356  -4.118   4.428
  512    H2*    A  48           H2*        A  48 -17.427  -4.924   2.420
  513   2HO*    A  48          2HO*        A  48 -18.906  -2.912   1.331
  514    H1*    A  48           H1*        A  48 -15.740  -2.881   1.946
  515    H8     A  48           H8         A  48 -15.831  -3.037   5.661
  516   1H6     A  48          1H6         A  48 -12.254  -8.043   5.433
  517   2H6     A  48          2H6         A  48 -12.991  -6.854   6.482
  518    H2     A  48           H2         A  48 -13.668  -7.151   1.261
  519    H3T    A  48           H3T        A  48 -19.923  -3.465   2.194
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1   7.825 -33.150   5.590
    2   2H5*    G   1          2H5*        G   1   8.196 -32.084   4.220
    3    H4*    G   1           H4*        G   1   8.030 -34.242   3.260
    4    H3*    G   1           H3*        G   1   5.648 -32.463   2.866
    5    H2*    G   1           H2*        G   1   4.261 -34.203   2.025
    6   2HO*    G   1          2HO*        G   1   5.774 -35.163   0.616
    7    H1*    G   1           H1*        G   1   4.822 -36.109   3.769
    8    H8     G   1           H8         G   1   5.238 -33.489   6.185
    9    H1     G   1           H1         G   1  -0.738 -33.307   3.973
   10   1H2     G   1          1H2         G   1  -0.904 -34.530   2.131
   11   2H2     G   1          2H2         G   1   0.458 -35.390   1.448
   12    H5T    G   1           H5T        G   1   6.532 -31.016   4.882
   13   1H5*    G   2          1H5*        G   2   6.704 -33.295  -1.373
   14   2H5*    G   2          2H5*        G   2   6.723 -31.773  -2.286
   15    H4*    G   2           H4*        G   2   4.937 -33.319  -3.063
   16    H3*    G   2           H3*        G   2   4.264 -30.625  -1.856
   17    H2*    G   2           H2*        G   2   1.937 -31.055  -2.111
   18   2HO*    G   2          2HO*        G   2   1.145 -32.554  -3.503
   19    H1*    G   2           H1*        G   2   1.919 -33.608  -1.241
   20    H8     G   2           H8         G   2   4.384 -32.326   1.090
   21    H1     G   2           H1         G   2  -1.263 -29.557   2.154
   22   1H2     G   2          1H2         G   2  -2.619 -29.918   0.437
   23   2H2     G   2          2H2         G   2  -2.132 -30.841  -0.968
   24   1H5*    C   3          1H5*        C   3   2.955 -29.094  -5.810
   25   2H5*    C   3          2H5*        C   3   3.647 -27.460  -5.730
   26    H4*    C   3           H4*        C   3   1.063 -27.762  -5.435
   27    H3*    C   3           H3*        C   3   2.927 -26.067  -3.746
   28    H2*    C   3           H2*        C   3   1.167 -25.486  -2.324
   29   2HO*    C   3          2HO*        C   3  -1.083 -25.768  -3.132
   30    H1*    C   3           H1*        C   3  -0.444 -27.802  -2.706
   31   1H4     C   3          1H4         C   3   1.669 -27.427   3.334
   32   2H4     C   3          2H4         C   3   2.919 -28.571   2.903
   33    H5     C   3           H5         C   3   3.317 -29.301   0.638
   34    H6     C   3           H6         C   3   2.607 -29.084  -1.692
   35   1H5*    C   4          1H5*        C   4  -0.335 -23.555  -6.067
   36   2H5*    C   4          2H5*        C   4   0.148 -21.847  -6.088
   37    H4*    C   4           H4*        C   4  -2.171 -22.410  -5.108
   38    H3*    C   4           H3*        C   4  -0.041 -20.667  -3.867
   39    H2*    C   4           H2*        C   4  -1.287 -20.403  -1.881
   40   2HO*    C   4          2HO*        C   4  -3.470 -20.695  -1.772
   41    H1*    C   4           H1*        C   4  -2.220 -22.916  -1.586
   42   1H4     C   4          1H4         C   4   3.203 -22.384   1.745
   43   2H4     C   4          2H4         C   4   4.090 -23.003   0.370
   44    H5     C   4           H5         C   4   3.075 -23.423  -1.775
   45    H6     C   4           H6         C   4   0.992 -23.338  -3.065
   46   1H5*    U   5          1H5*        U   5  -3.926 -18.271  -3.204
   47   2H5*    U   5          2H5*        U   5  -3.345 -16.609  -3.427
   48    H4*    U   5           H4*        U   5  -4.403 -17.283  -1.131
   49    H3*    U   5           H3*        U   5  -1.831 -15.735  -1.573
   50    H2*    U   5           H2*        U   5  -1.452 -15.662   0.734
   51   2HO*    U   5          2HO*        U   5  -3.222 -15.913   2.234
   52    H1*    U   5           H1*        U   5  -2.838 -18.050   1.437
   53    H3     U   5           H3         U   5   1.355 -18.064   3.305
   54    H5     U   5           H5         U   5   1.858 -19.315  -0.689
   55    H6     U   5           H6         U   5  -0.441 -18.682  -1.104
   56   1H5*    U   6          1H5*        U   6  -5.723 -13.439   1.399
   57   2H5*    U   6          2H5*        U   6  -5.617 -14.312  -0.144
   58    H4*    U   6           H4*        U   6  -6.864 -12.742  -1.273
   59    H3*    U   6           H3*        U   6  -5.506 -10.749   0.564
   60    H2*    U   6           H2*        U   6  -7.338  -9.325   0.464
   61   2HO*    U   6          2HO*        U   6  -7.725 -10.481  -2.107
   62    H1*    U   6           H1*        U   6  -9.330 -11.263  -0.240
   63    H3     U   6           H3         U   6 -11.105  -8.651   3.028
   64    H5     U   6           H5         U   6  -8.139 -10.914   4.990
   65    H6     U   6           H6         U   6  -7.454 -11.769   2.823
   66   1H5*    A   7          1H5*        A   7  -5.627  -9.180  -4.239
   67   2H5*    A   7          2H5*        A   7  -4.646  -7.704  -4.144
   68    H4*    A   7           H4*        A   7  -6.973  -7.539  -5.270
   69    H3*    A   7           H3*        A   7  -5.791  -5.695  -3.198
   70    H2*    A   7           H2*        A   7  -7.798  -4.477  -2.966
   71   2HO*    A   7          2HO*        A   7  -9.437  -5.541  -4.801
   72    H1*    A   7           H1*        A   7  -9.590  -6.527  -3.065
   73    H8     A   7           H8         A   7  -6.777  -7.920  -1.096
   74   1H6     A   7          1H6         A   7  -8.608  -4.559   3.728
   75   2H6     A   7          2H6         A   7  -7.559  -5.854   3.197
   76    H2     A   7           H2         A   7 -10.856  -3.135   0.104
   77   1H5*    G   8          1H5*        G   8  -6.847  -2.767  -6.467
   78   2H5*    G   8          2H5*        G   8  -5.741  -1.394  -6.262
   79    H4*    G   8           H4*        G   8  -8.304  -1.103  -5.726
   80    H3*    G   8           H3*        G   8  -5.902  -0.078  -4.205
   81    H2*    G   8           H2*        G   8  -7.240   0.723  -2.453
   82   2HO*    G   8          2HO*        G   8  -9.067   1.005  -4.513
   83    H1*    G   8           H1*        G   8  -9.233  -1.207  -2.473
   84    H8     G   8           H8         G   8  -6.039  -3.067  -2.515
   85    H1     G   8           H1         G   8  -7.038  -0.321   3.152
   86   1H2     G   8          1H2         G   8  -8.699   1.136   3.009
   87   2H2     G   8          2H2         G   8  -9.562   1.434   1.516
   88   1H5*    G   9          1H5*        G   9  -9.098   3.474  -5.693
   89   2H5*    G   9          2H5*        G   9  -8.175   4.954  -5.363
   90    H4*    G   9           H4*        G   9 -10.608   4.663  -4.383
   91    H3*    G   9           H3*        G   9  -8.139   5.880  -3.166
   92    H2*    G   9           H2*        G   9  -9.122   6.058  -1.013
   93   2HO*    G   9          2HO*        G   9 -11.615   5.123  -1.394
   94    H1*    G   9           H1*        G   9 -10.291   3.651  -0.864
   95    H8     G   9           H8         G   9  -7.295   2.859  -2.872
   96    H1     G   9           H1         G   9  -5.742   4.113   3.183
   97   1H2     G   9          1H2         G   9  -7.467   5.035   4.232
   98   2H2     G   9          2H2         G   9  -8.996   5.339   3.439
   99   1H5*    A  10          1H5*        A  10 -10.394   9.680  -2.506
  100   2H5*    A  10          2H5*        A  10  -9.064  10.828  -2.756
  101    H4*    A  10           H4*        A  10  -9.948  10.393  -0.324
  102    H3*    A  10           H3*        A  10  -7.051  10.519  -1.234
  103    H2*    A  10           H2*        A  10  -6.362  10.170   1.003
  104   2HO*    A  10          2HO*        A  10  -8.066  11.740   1.752
  105    H1*    A  10           H1*        A  10  -8.322   8.343   1.707
  106    H8     A  10           H8         A  10  -7.248   7.011  -1.502
  107   1H6     A  10          1H6         A  10  -1.896   5.261   0.987
  108   2H6     A  10          2H6         A  10  -2.952   5.105  -0.398
  109    H2     A  10           H2         A  10  -3.921   8.057   3.864
  110   1H5*    A  11          1H5*        A  11  -7.395  14.460   1.402
  111   2H5*    A  11          2H5*        A  11  -5.965  15.368   0.868
  112    H4*    A  11           H4*        A  11  -6.081  14.472   3.333
  113    H3*    A  11           H3*        A  11  -3.766  14.488   1.402
  114    H2*    A  11           H2*        A  11  -2.407  13.188   2.839
  115   2HO*    A  11          2HO*        A  11  -4.017  14.324   4.754
  116    H1*    A  11           H1*        A  11  -4.239  11.371   3.646
  117    H8     A  11           H8         A  11  -5.281  11.885   0.152
  118   1H6     A  11          1H6         A  11  -0.343   8.719  -1.730
  119   2H6     A  11          2H6         A  11  -1.876   9.407  -2.218
  120    H2     A  11           H2         A  11   0.171   9.641   2.637
  121   1H5*    A  12          1H5*        A  12  -1.388  15.371   4.494
  122   2H5*    A  12          2H5*        A  12  -0.309  16.684   3.980
  123    H4*    A  12           H4*        A  12   0.927  14.562   4.334
  124    H3*    A  12           H3*        A  12   0.732  15.706   1.525
  125    H2*    A  12           H2*        A  12   2.101  13.949   0.763
  126   2HO*    A  12          2HO*        A  12   3.262  12.607   2.311
  127    H1*    A  12           H1*        A  12   1.121  11.946   2.372
  128    H8     A  12           H8         A  12  -1.705  13.833   0.859
  129   1H6     A  12          1H6         A  12  -0.588  10.952  -4.470
  130   2H6     A  12          2H6         A  12  -1.710  11.983  -3.610
  131    H2     A  12           H2         A  12   2.800  10.072  -1.648
  132   1H5*    C  13          1H5*        C  13   5.013  16.015   3.386
  133   2H5*    C  13          2H5*        C  13   6.030  17.162   2.491
  134    H4*    C  13           H4*        C  13   7.001  14.832   2.725
  135    H3*    C  13           H3*        C  13   6.506  16.143   0.028
  136    H2*    C  13           H2*        C  13   7.501  14.235  -1.021
  137   2HO*    C  13          2HO*        C  13   8.030  12.647   1.094
  138    H1*    C  13           H1*        C  13   6.137  12.375   0.366
  139   1H4     C  13          1H4         C  13   2.645  14.036  -4.729
  140   2H4     C  13          2H4         C  13   1.718  15.111  -3.708
  141    H5     C  13           H5         C  13   2.281  15.559  -1.416
  142    H6     C  13           H6         C  13   3.842  15.070   0.403
  143   1H5*    A  14          1H5*        A  14  10.972  15.446  -0.213
  144   2H5*    A  14          2H5*        A  14  11.477  16.580  -1.480
  145    H4*    A  14           H4*        A  14  11.538  13.976  -1.918
  146    H3*    A  14           H3*        A  14  10.491  16.100  -3.842
  147    H2*    A  14           H2*        A  14  10.308  14.324  -5.451
  148   2HO*    A  14          2HO*        A  14  11.411  12.468  -5.279
  149    H1*    A  14           H1*        A  14   9.215  12.517  -3.720
  150    H8     A  14           H8         A  14   7.392  15.511  -2.719
  151   1H6     A  14          1H6         A  14   4.157  15.279  -7.950
  152   2H6     A  14          2H6         A  14   4.260  15.994  -6.357
  153    H2     A  14           H2         A  14   7.670  12.507  -8.362
  154   1H5*    G  15          1H5*        G  15  13.668  14.731  -5.885
  155   2H5*    G  15          2H5*        G  15  14.817  15.913  -6.544
  156    H4*    G  15           H4*        G  15  13.928  14.785  -8.437
  157    H3*    G  15           H3*        G  15  12.491  17.432  -7.969
  158    H2*    G  15           H2*        G  15  11.382  17.025 -10.078
  159   2HO*    G  15          2HO*        G  15  12.419  15.927 -11.561
  160    H1*    G  15           H1*        G  15  10.737  14.445  -9.503
  161    H8     G  15           H8         G  15  10.486  16.210  -6.228
  162    H1     G  15           H1         G  15   5.733  17.858 -10.133
  163   1H2     G  15          1H2         G  15   6.143  17.121 -12.187
  164   2H2     G  15          2H2         G  15   7.591  16.226 -12.590
  165   1H5*    U  16          1H5*        U  16  13.355  17.414 -11.319
  166   2H5*    U  16          2H5*        U  16  14.124  18.662 -12.315
  167    H4*    U  16           H4*        U  16  11.979  18.444 -13.261
  168    H3*    U  16           H3*        U  16  11.966  20.719 -11.226
  169    H2*    U  16           H2*        U  16   9.750  21.177 -11.938
  170   2HO*    U  16          2HO*        U  16   8.951  19.916 -13.860
  171    H1*    U  16           H1*        U  16   8.979  18.512 -12.245
  172    H3     U  16           H3         U  16   6.418  20.430  -8.988
  173    H5     U  16           H5         U  16  10.099  19.554  -7.139
  174    H6     U  16           H6         U  16  10.985  18.981  -9.303
  175   1H5*    U  17          1H5*        U  17  11.154  24.239 -12.404
  176   2H5*    U  17          2H5*        U  17  10.327  22.898 -13.215
  177    H4*    U  17           H4*        U  17  10.717  25.738 -14.202
  178    H3*    U  17           H3*        U  17   8.619  24.763 -12.838
  179    H2*    U  17           H2*        U  17   8.296  22.765 -14.122
  180   2HO*    U  17          2HO*        U  17   6.391  23.080 -15.159
  181    H1*    U  17           H1*        U  17   8.524  24.157 -16.760
  182    H3     U  17           H3         U  17   7.901  19.776 -17.905
  183    H5     U  17           H5         U  17  11.505  19.824 -15.725
  184    H6     U  17           H6         U  17  11.126  22.157 -15.261
  185   1H5*    C  18          1H5*        C  18   5.219  23.701 -13.785
  186   2H5*    C  18          2H5*        C  18   4.613  25.239 -14.429
  187    H4*    C  18           H4*        C  18   2.968  24.579 -12.867
  188    H3*    C  18           H3*        C  18   4.224  26.950 -12.422
  189    H2*    C  18           H2*        C  18   5.945  26.118 -10.980
  190   2HO*    C  18          2HO*        C  18   3.978  26.387  -8.971
  191    H1*    C  18           H1*        C  18   3.992  24.421  -9.440
  192   1H4     C  18          1H4         C  18   9.493  21.946  -7.476
  193   2H4     C  18          2H4         C  18  10.174  22.055  -9.083
  194    H5     C  18           H5         C  18   8.998  22.978 -10.960
  195    H6     C  18           H6         C  18   6.900  23.989 -11.718
  196   1H5*    G  19          1H5*        G  19  -0.433  24.554 -12.403
  197   2H5*    G  19          2H5*        G  19   1.013  23.604 -12.007
  198    H4*    G  19           H4*        G  19  -0.649  23.611 -14.476
  199    H3*    G  19           H3*        G  19   1.041  21.621 -12.909
  200    H2*    G  19           H2*        G  19   1.260  20.318 -14.857
  201   2HO*    G  19          2HO*        G  19  -1.183  21.511 -15.464
  202    H1*    G  19           H1*        G  19   1.332  22.406 -16.712
  203    H8     G  19           H8         G  19   3.635  21.794 -17.592
  204    H1     G  19           H1         G  19   6.107  20.815 -11.797
  205   1H2     G  19          1H2         G  19   4.575  21.214 -10.243
  206   2H2     G  19          2H2         G  19   2.948  21.721 -10.634
  207   1H5*    C  20          1H5*        C  20  -1.138  19.574 -15.031
  208   2H5*    C  20          2H5*        C  20  -1.651  17.963 -14.492
  209    H4*    C  20           H4*        C  20   0.076  17.917 -16.315
  210    H3*    C  20           H3*        C  20   0.481  16.627 -13.615
  211    H2*    C  20           H2*        C  20   2.704  15.993 -14.162
  212   2HO*    C  20          2HO*        C  20   1.708  16.167 -16.732
  213    H1*    C  20           H1*        C  20   3.520  18.302 -15.295
  214   1H4     C  20          1H4         C  20   4.638  18.734  -9.012
  215   2H4     C  20          2H4         C  20   3.079  19.501  -8.811
  216    H5     C  20           H5         C  20   1.483  19.736 -10.583
  217    H6     C  20           H6         C  20   1.025  19.295 -12.945
  218   1H5*    U  21          1H5*        U  21   1.887  14.095 -16.225
  219   2H5*    U  21          2H5*        U  21   1.094  12.519 -16.424
  220    H4*    U  21           H4*        U  21   3.405  12.021 -16.234
  221    H3*    U  21           H3*        U  21   1.862  11.598 -13.660
  222    H2*    U  21           H2*        U  21   3.855  10.941 -12.548
  223   2HO*    U  21          2HO*        U  21   5.533  11.097 -14.764
  224    H1*    U  21           H1*        U  21   5.507  12.852 -13.566
  225    H3     U  21           H3         U  21   4.772  14.084  -9.264
  226    H5     U  21           H5         U  21   1.286  15.283 -11.310
  227    H6     U  21           H6         U  21   2.109  14.102 -13.265
  228   1H5*    G  22          1H5*        G  22   4.202   8.394 -13.965
  229   2H5*    G  22          2H5*        G  22   3.560   6.897 -13.259
  230    H4*    G  22           H4*        G  22   5.516   7.902 -12.004
  231    H3*    G  22           H3*        G  22   2.814   7.404 -10.717
  232    H2*    G  22           H2*        G  22   3.496   8.479  -8.786
  233   2HO*    G  22          2HO*        G  22   5.204   6.796  -8.620
  234    H1*    G  22           H1*        G  22   5.801   9.837  -9.900
  235    H8     G  22           H8         G  22   2.503  11.248 -10.893
  236    H1     G  22           H1         G  22   4.035  12.926  -4.945
  237   1H2     G  22          1H2         G  22   5.798  11.769  -4.256
  238   2H2     G  22          2H2         G  22   6.595  10.584  -5.267
  239   1H5*    U  23          1H5*        U  23   5.938   4.337  -8.669
  240   2H5*    U  23          2H5*        U  23   4.899   3.217  -7.765
  241    H4*    U  23           H4*        U  23   6.627   4.696  -6.461
  242    H3*    U  23           H3*        U  23   3.729   4.153  -5.764
  243    H2*    U  23           H2*        U  23   3.845   5.604  -3.926
  244   2HO*    U  23          2HO*        U  23   5.564   5.612  -2.689
  245    H1*    U  23           H1*        U  23   5.700   7.442  -4.943
  246    H3     U  23           H3         U  23   1.764   9.477  -3.700
  247    H5     U  23           H5         U  23   1.193   8.109  -7.653
  248    H6     U  23           H6         U  23   3.280   6.890  -7.460
  249   1H5*    G  24          1H5*        G  24   5.436   0.086  -6.478
  250   2H5*    G  24          2H5*        G  24   6.490  -0.939  -5.481
  251    H4*    G  24           H4*        G  24   7.352   0.691  -7.529
  252    H3*    G  24           H3*        G  24   8.650  -0.636  -5.157
  253    H2*    G  24           H2*        G  24  10.614   0.682  -5.338
  254   2HO*    G  24          2HO*        G  24  10.887   2.091  -7.209
  255    H1*    G  24           H1*        G  24   9.498   3.074  -5.709
  256    H8     G  24           H8         G  24   6.962   1.434  -3.568
  257    H1     G  24           H1         G  24  12.252   2.764  -0.266
  258   1H2     G  24          1H2         G  24  13.892   3.317  -1.650
  259   2H2     G  24          2H2         G  24  13.683   3.359  -3.386
  260   1H5*    C  25          1H5*        C  25  11.994  -0.315  -7.142
  261   2H5*    C  25          2H5*        C  25  12.322  -1.885  -7.902
  262    H4*    C  25           H4*        C  25  14.383  -1.386  -6.925
  263    H3*    C  25           H3*        C  25  12.713  -3.048  -5.008
  264    H2*    C  25           H2*        C  25  14.429  -2.925  -3.398
  265   2HO*    C  25          2HO*        C  25  16.433  -3.082  -4.045
  266    H1*    C  25           H1*        C  25  15.264  -0.327  -3.900
  267   1H4     C  25          1H4         C  25  11.610  -0.246   1.327
  268   2H4     C  25          2H4         C  25  10.176  -0.180   0.330
  269    H5     C  25           H5         C  25  10.229  -0.348  -2.068
  270    H6     C  25           H6         C  25  11.667  -0.614  -4.032
  271   1H5*    C  26          1H5*        C  26  16.824  -4.842  -5.507
  272   2H5*    C  26          2H5*        C  26  16.547  -6.533  -5.969
  273    H4*    C  26           H4*        C  26  18.270  -6.527  -4.291
  274    H3*    C  26           H3*        C  26  15.536  -7.480  -3.418
  275    H2*    C  26           H2*        C  26  16.286  -7.766  -1.182
  276   2HO*    C  26          2HO*        C  26  18.274  -8.401  -0.848
  277    H1*    C  26           H1*        C  26  17.669  -5.471  -0.927
  278   1H4     C  26          1H4         C  26  11.771  -3.953   0.888
  279   2H4     C  26          2H4         C  26  11.227  -3.923  -0.774
  280    H5     C  26           H5         C  26  12.636  -4.521  -2.634
  281    H6     C  26           H6         C  26  14.870  -5.273  -3.305
  282   1H5*    G  27          1H5*        G  27  18.024 -10.815  -1.941
  283   2H5*    G  27          2H5*        G  27  16.883 -12.159  -1.737
  284    H4*    G  27           H4*        G  27  17.844 -10.895   0.377
  285    H3*    G  27           H3*        G  27  14.978 -11.788  -0.115
  286    H2*    G  27           H2*        G  27  14.385 -10.934   2.002
  287   2HO*    G  27          2HO*        G  27  15.841 -10.680   3.650
  288    H1*    G  27           H1*        G  27  16.110  -8.730   2.005
  289    H8     G  27           H8         G  27  14.310  -8.596  -1.214
  290    H1     G  27           H1         G  27  10.406  -7.219   3.635
  291   1H2     G  27          1H2         G  27  11.376  -7.737   5.560
  292   2H2     G  27          2H2         G  27  12.984  -8.421   5.650
  293   1H5*    A  28          1H5*        A  28  16.178 -14.521   3.581
  294   2H5*    A  28          2H5*        A  28  14.993 -15.829   3.395
  295    H4*    A  28           H4*        A  28  14.934 -14.273   5.530
  296    H3*    A  28           H3*        A  28  12.596 -15.271   3.867
  297    H2*    A  28           H2*        A  28  11.106 -14.110   5.287
  298   2HO*    A  28          2HO*        A  28  11.534 -13.738   7.367
  299    H1*    A  28           H1*        A  28  12.670 -11.861   5.726
  300    H8     A  28           H8         A  28  12.812 -12.474   2.077
  301   1H6     A  28          1H6         A  28   7.105 -10.213   1.575
  302   2H6     A  28          2H6         A  28   8.532 -10.712   0.695
  303    H2     A  28           H2         A  28   7.977 -10.842   5.938
  304   1H5*    A  29          1H5*        A  29  12.483 -17.409   8.236
  305   2H5*    A  29          2H5*        A  29  11.195 -18.626   8.125
  306    H4*    A  29           H4*        A  29  11.009 -16.668   9.880
  307    H3*    A  29           H3*        A  29   8.890 -17.903   8.124
  308    H2*    A  29           H2*        A  29   7.278 -16.281   8.746
  309   2HO*    A  29          2HO*        A  29   7.559 -14.924  10.528
  310    H1*    A  29           H1*        A  29   8.814 -14.076   8.572
  311    H8     A  29           H8         A  29  10.217 -16.155   5.857
  312   1H6     A  29          1H6         A  29   5.152 -15.087   2.514
  313   2H6     A  29          2H6         A  29   6.780 -15.729   2.484
  314    H2     A  29           H2         A  29   4.390 -13.652   6.702
  315   1H5*    A  30          1H5*        A  30   6.991 -18.950  12.371
  316   2H5*    A  30          2H5*        A  30   5.976 -20.327  11.894
  317    H4*    A  30           H4*        A  30   4.849 -18.087  12.690
  318    H3*    A  30           H3*        A  30   4.074 -19.895  10.390
  319    H2*    A  30           H2*        A  30   2.355 -18.386   9.724
  320   2HO*    A  30          2HO*        A  30   2.891 -16.930  12.131
  321    H1*    A  30           H1*        A  30   3.780 -16.116   9.853
  322    H8     A  30           H8         A  30   6.490 -18.329   8.827
  323   1H6     A  30          1H6         A  30   3.967 -18.889   3.240
  324   2H6     A  30          2H6         A  30   5.400 -19.172   4.202
  325    H2     A  30           H2         A  30   0.927 -16.995   5.954
  326   1H5*    G  31          1H5*        G  31   0.825 -18.820  11.448
  327   2H5*    G  31          2H5*        G  31  -0.229 -19.882  12.404
  328    H4*    G  31           H4*        G  31  -1.711 -19.070  10.796
  329    H3*    G  31           H3*        G  31  -0.478 -21.654   9.771
  330    H2*    G  31           H2*        G  31  -1.756 -21.435   7.793
  331   2HO*    G  31          2HO*        G  31  -3.359 -19.424   8.011
  332    H1*    G  31           H1*        G  31  -1.599 -18.667   7.555
  333    H8     G  31           H8         G  31   1.841 -19.869   8.243
  334    H1     G  31           H1         G  31  -0.012 -21.421   2.345
  335   1H2     G  31          1H2         G  31  -2.194 -21.078   2.120
  336   2H2     G  31          2H2         G  31  -3.187 -20.466   3.424
  337   1H5*    G  32          1H5*        G  32  -4.973 -21.753   9.817
  338   2H5*    G  32          2H5*        G  32  -5.612 -23.385   9.537
  339    H4*    G  32           H4*        G  32  -5.978 -21.483   7.737
  340    H3*    G  32           H3*        G  32  -5.271 -24.400   7.306
  341    H2*    G  32           H2*        G  32  -5.142 -24.044   4.961
  342   2HO*    G  32          2HO*        G  32  -6.012 -22.217   3.973
  343    H1*    G  32           H1*        G  32  -3.852 -21.641   5.000
  344    H8     G  32           H8         G  32  -2.206 -23.565   7.707
  345    H1     G  32           H1         G  32  -0.615 -25.829   1.963
  346   1H2     G  32          1H2         G  32  -1.948 -24.971   0.413
  347   2H2     G  32          2H2         G  32  -3.228 -23.840   0.793
  348   1H5*    U  33          1H5*        U  33  -8.055 -24.539   4.716
  349   2H5*    U  33          2H5*        U  33  -9.228 -25.847   4.967
  350    H4*    U  33           H4*        U  33  -7.977 -26.311   2.938
  351    H3*    U  33           H3*        U  33  -7.432 -28.040   5.360
  352    H2*    U  33           H2*        U  33  -5.649 -29.082   4.346
  353   2HO*    U  33          2HO*        U  33  -5.603 -29.444   2.078
  354    H1*    U  33           H1*        U  33  -5.044 -27.141   2.343
  355    H3     U  33           H3         U  33  -1.141 -28.639   4.146
  356    H5     U  33           H5         U  33  -2.824 -26.183   7.128
  357    H6     U  33           H6         U  33  -4.831 -26.028   5.772
  358   1H5*    C  34          1H5*        C  34  -8.594 -30.608   1.744
  359   2H5*    C  34          2H5*        C  34  -9.673 -31.892   2.323
  360    H4*    C  34           H4*        C  34  -7.965 -32.953   1.006
  361    H3*    C  34           H3*        C  34  -7.577 -33.202   4.002
  362    H2*    C  34           H2*        C  34  -5.684 -34.535   3.650
  363   2HO*    C  34          2HO*        C  34  -6.659 -35.899   2.048
  364    H1*    C  34           H1*        C  34  -4.723 -33.174   1.420
  365   1H4     C  34          1H4         C  34  -1.189 -31.237   6.339
  366   2H4     C  34          2H4         C  34  -2.514 -30.274   6.952
  367    H5     C  34           H5         C  34  -4.704 -30.259   5.957
  368    H6     C  34           H6         C  34  -6.101 -31.155   4.157
  369    H3T    C  34           H3T        C  34  -8.235 -35.184   2.071
  370   1H5*    U  35          1H5*        U  35  -3.973 -12.184   3.595
  371   2H5*    U  35          2H5*        U  35  -3.370 -10.760   2.723
  372    H4*    U  35           H4*        U  35  -2.785 -10.895   5.212
  373    H3*    U  35           H3*        U  35  -0.810 -10.475   2.961
  374    H2*    U  35           H2*        U  35   1.010 -10.494   4.461
  375   2HO*    U  35          2HO*        U  35  -0.910 -10.245   6.571
  376    H1*    U  35           H1*        U  35   0.165 -12.491   6.137
  377    H3     U  35           H3         U  35   3.682 -14.274   3.929
  378    H5     U  35           H5         U  35   0.653 -14.095   1.006
  379    H6     U  35           H6         U  35  -0.734 -12.920   2.614
  380    H5T    U  35           H5T        U  35  -3.068 -12.850   1.677
  381   1H5*    U  36          1H5*        U  36  -0.636  -7.229   6.259
  382   2H5*    U  36          2H5*        U  36   0.410  -5.880   5.771
  383    H4*    U  36           H4*        U  36   1.072  -7.399   7.829
  384    H3*    U  36           H3*        U  36   2.830  -6.274   5.634
  385    H2*    U  36           H2*        U  36   4.721  -7.398   6.526
  386   2HO*    U  36          2HO*        U  36   3.366  -7.106   8.839
  387    H1*    U  36           H1*        U  36   3.551  -9.791   7.016
  388    H3     U  36           H3         U  36   6.295  -9.975   3.337
  389    H5     U  36           H5         U  36   2.561  -8.664   1.889
  390    H6     U  36           H6         U  36   1.819  -8.450   4.191
  391   1H5*    C  37          1H5*        C  37   4.497  -4.568   9.672
  392   2H5*    C  37          2H5*        C  37   5.366  -3.083   9.237
  393    H4*    C  37           H4*        C  37   6.719  -4.965  10.376
  394    H3*    C  37           H3*        C  37   7.490  -3.539   7.809
  395    H2*    C  37           H2*        C  37   9.476  -4.834   7.700
  396   2HO*    C  37          2HO*        C  37  10.442  -5.235   9.539
  397    H1*    C  37           H1*        C  37   8.384  -7.240   8.392
  398   1H4     C  37          1H4         C  37   8.483  -6.707   2.017
  399   2H4     C  37          2H4         C  37   6.858  -6.059   2.062
  400    H5     C  37           H5         C  37   5.699  -5.547   4.110
  401    H6     C  37           H6         C  37   5.848  -5.534   6.559
  402   1H5*    G  38          1H5*        G  38  10.600  -1.873  11.249
  403   2H5*    G  38          2H5*        G  38  11.258  -0.436  10.443
  404    H4*    G  38           H4*        G  38  12.916  -2.282  11.211
  405    H3*    G  38           H3*        G  38  12.823  -0.871   8.541
  406    H2*    G  38           H2*        G  38  14.562  -2.233   7.674
  407   2HO*    G  38          2HO*        G  38  15.515  -3.832   9.314
  408    H1*    G  38           H1*        G  38  13.699  -4.621   8.583
  409    H8     G  38           H8         G  38  10.511  -2.892   7.873
  410    H1     G  38           H1         G  38  13.618  -4.273   2.480
  411   1H2     G  38          1H2         G  38  15.698  -4.889   2.938
  412   2H2     G  38          2H2         G  38  16.320  -4.956   4.572
  413   1H5*    G  39          1H5*        G  39  17.051   0.589  10.109
  414   2H5*    G  39          2H5*        G  39  17.080   2.247   9.476
  415    H4*    G  39           H4*        G  39  18.931   0.699   8.643
  416    H3*    G  39           H3*        G  39  17.080   2.335   6.913
  417    H2*    G  39           H2*        G  39  17.920   1.390   4.921
  418   2HO*    G  39          2HO*        G  39  20.022   0.118   6.367
  419    H1*    G  39           H1*        G  39  18.172  -1.199   5.718
  420    H8     G  39           H8         G  39  15.022  -0.125   7.328
  421    H1     G  39           H1         G  39  14.324  -0.613   1.012
  422   1H2     G  39          1H2         G  39  16.310  -0.814   0.042
  423   2H2     G  39          2H2         G  39  17.803  -0.829   0.953
  424   1H5*    C  40          1H5*        C  40  19.503   2.740   4.229
  425   2H5*    C  40          2H5*        C  40  20.344   4.287   4.445
  426    H4*    C  40           H4*        C  40  19.660   4.481   2.236
  427    H3*    C  40           H3*        C  40  17.484   5.597   4.033
  428    H2*    C  40           H2*        C  40  16.105   5.968   2.172
  429   2HO*    C  40          2HO*        C  40  16.969   6.829   0.451
  430    H1*    C  40           H1*        C  40  17.007   3.834   0.566
  431   1H4     C  40          1H4         C  40  11.163   2.191   2.416
  432   2H4     C  40          2H4         C  40  11.642   2.180   4.099
  433    H5     C  40           H5         C  40  13.853   2.785   4.846
  434    H6     C  40           H6         C  40  16.080   3.530   4.140
  435   1H5*    U  41          1H5*        U  41  15.837   7.981   3.609
  436   2H5*    U  41          2H5*        U  41  15.452   8.117   1.882
  437    H4*    U  41           H4*        U  41  14.717   9.946   3.791
  438    H3*    U  41           H3*        U  41  15.044  10.009   0.801
  439    H2*    U  41           H2*        U  41  14.990  12.361   0.697
  440   2HO*    U  41          2HO*        U  41  13.500  13.253   1.906
  441    H1*    U  41           H1*        U  41  16.438  12.971   2.922
  442    H3     U  41           H3         U  41  19.084  14.021  -0.610
  443    H5     U  41           H5         U  41  19.324   9.821  -0.345
  444    H6     U  41           H6         U  41  17.601   9.896   1.360
  445   1H5*    C  42          1H5*        C  42   9.807   9.596   1.170
  446   2H5*    C  42          2H5*        C  42  10.180   7.925   1.638
  447    H4*    C  42           H4*        C  42   8.573   8.653  -0.480
  448    H3*    C  42           H3*        C  42  10.063   6.165   0.321
  449    H2*    C  42           H2*        C  42   9.883   5.187  -1.810
  450   2HO*    C  42          2HO*        C  42   7.665   6.900  -1.997
  451    H1*    C  42           H1*        C  42  10.237   7.386  -3.384
  452   1H4     C  42          1H4         C  42  15.994   4.736  -2.869
  453   2H4     C  42          2H4         C  42  16.168   5.347  -1.239
  454    H5     C  42           H5         C  42  14.421   6.538  -0.083
  455    H6     C  42           H6         C  42  12.132   7.400  -0.239
  456   1H5*    U  43          1H5*        U  43   8.506   6.370   2.153
  457   2H5*    U  43          2H5*        U  43   8.644   5.155   3.441
  458    H4*    U  43           H4*        U  43   7.049   6.613   4.333
  459    H3*    U  43           H3*        U  43   5.697   4.360   2.824
  460    H2*    U  43           H2*        U  43   3.619   5.369   3.059
  461   2HO*    U  43          2HO*        U  43   3.303   6.894   4.899
  462    H1*    U  43           H1*        U  43   4.529   8.063   3.516
  463    H3     U  43           H3         U  43   1.122   8.594   0.603
  464    H5     U  43           H5         U  43   4.011   6.464  -1.606
  465    H6     U  43           H6         U  43   5.327   6.274   0.425
  466   1H5*    U  44          1H5*        U  44   4.613   5.049   7.664
  467   2H5*    U  44          2H5*        U  44   3.516   3.705   8.038
  468    H4*    U  44           H4*        U  44   2.774   6.142   8.619
  469    H3*    U  44           H3*        U  44   1.156   3.953   7.301
  470    H2*    U  44           H2*        U  44  -0.680   5.403   6.988
  471   2HO*    U  44          2HO*        U  44   0.466   6.697   9.166
  472    H1*    U  44           H1*        U  44   0.684   7.681   6.306
  473    H3     U  44           H3         U  44  -1.640   6.087   2.695
  474    H5     U  44           H5         U  44   1.978   3.923   2.739
  475    H6     U  44           H6         U  44   2.460   4.902   4.906
  476   1H5*    C  45          1H5*        C  45  -1.558   5.776  10.262
  477   2H5*    C  45          2H5*        C  45  -1.962   4.446  11.365
  478    H4*    C  45           H4*        C  45  -4.032   5.506  10.788
  479    H3*    C  45           H3*        C  45  -3.487   2.864   9.417
  480    H2*    C  45           H2*        C  45  -5.488   3.028   8.175
  481   2HO*    C  45          2HO*        C  45  -6.985   3.592   9.679
  482    H1*    C  45           H1*        C  45  -5.434   5.720   7.635
  483   1H4     C  45          1H4         C  45  -2.997   2.909   2.484
  484   2H4     C  45          2H4         C  45  -1.510   2.554   3.333
  485    H5     C  45           H5         C  45  -1.174   3.046   5.670
  486    H6     C  45           H6         C  45  -2.195   3.982   7.693
  487   1H5*    C  46          1H5*        C  46  -7.575   3.040  11.484
  488   2H5*    C  46          2H5*        C  46  -8.313   1.426  11.539
  489    H4*    C  46           H4*        C  46  -9.418   3.334  10.093
  490    H3*    C  46           H3*        C  46  -9.050   0.402   9.468
  491    H2*    C  46           H2*        C  46  -9.871   0.677   7.270
  492   2HO*    C  46          2HO*        C  46 -11.655   2.064   8.028
  493    H1*    C  46           H1*        C  46  -8.660   3.035   6.646
  494   1H4     C  46          1H4         C  46  -4.863  -1.656   4.579
  495   2H4     C  46          2H4         C  46  -4.139  -1.784   6.167
  496    H5     C  46           H5         C  46  -4.910  -0.530   8.074
  497    H6     C  46           H6         C  46  -6.542   1.117   8.871
  498   1H5*    U  47          1H5*        U  47 -13.491   1.627   8.911
  499   2H5*    U  47          2H5*        U  47 -14.493   0.176   9.115
  500    H4*    U  47           H4*        U  47 -14.687   1.432   6.872
  501    H3*    U  47           H3*        U  47 -14.188  -1.539   7.206
  502    H2*    U  47           H2*        U  47 -14.079  -1.817   4.860
  503   2HO*    U  47          2HO*        U  47 -14.744  -0.072   3.444
  504    H1*    U  47           H1*        U  47 -12.682   0.461   4.247
  505    H3     U  47           H3         U  47 -10.048  -3.195   3.468
  506    H5     U  47           H5         U  47  -9.714  -2.459   7.606
  507    H6     U  47           H6         U  47 -11.480  -0.808   7.389
  508   1H5*    A  48          1H5*        A  48 -18.649  -1.436   5.265
  509   2H5*    A  48          2H5*        A  48 -19.148  -3.115   5.553
  510    H4*    A  48           H4*        A  48 -18.849  -2.228   3.087
  511    H3*    A  48           H3*        A  48 -18.050  -4.865   4.302
  512    H2*    A  48           H2*        A  48 -16.967  -5.578   2.339
  513   2HO*    A  48          2HO*        A  48 -17.580  -3.317   0.816
  514    H1*    A  48           H1*        A  48 -15.630  -3.300   1.794
  515    H8     A  48           H8         A  48 -15.715  -3.333   5.507
  516   1H6     A  48          1H6         A  48 -11.353  -7.679   5.463
  517   2H6     A  48          2H6         A  48 -12.276  -6.584   6.468
  518    H2     A  48           H2         A  48 -12.895  -7.206   1.266
  519    H3T    A  48           H3T        A  48 -19.594  -4.931   2.095
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  12.060 -27.170   4.696
    2   2H5*    G   1          2H5*        G   1  11.696 -26.403   3.138
    3    H4*    G   1           H4*        G   1  12.408 -28.463   2.383
    4    H3*    G   1           H3*        G   1   9.441 -28.495   2.842
    5    H2*    G   1           H2*        G   1   9.275 -30.863   2.639
    6   2HO*    G   1          2HO*        G   1  11.941 -31.387   2.113
    7    H1*    G   1           H1*        G   1  11.295 -31.558   4.192
    8    H8     G   1           H8         G   1  10.684 -28.641   6.137
    9    H1     G   1           H1         G   1   5.387 -32.186   6.156
   10   1H2     G   1          1H2         G   1   5.490 -33.711   4.551
   11   2H2     G   1          2H2         G   1   6.863 -33.855   3.478
   12    H5T    G   1           H5T        G   1  10.031 -27.121   5.184
   13   1H5*    G   2          1H5*        G   2   9.594 -30.009  -0.978
   14   2H5*    G   2          2H5*        G   2   8.735 -29.135  -2.261
   15    H4*    G   2           H4*        G   2   7.734 -31.319  -2.074
   16    H3*    G   2           H3*        G   2   6.121 -29.007  -0.962
   17    H2*    G   2           H2*        G   2   4.395 -30.503  -0.301
   18   2HO*    G   2          2HO*        G   2   4.674 -32.824  -0.983
   19    H1*    G   2           H1*        G   2   5.955 -32.488   0.687
   20    H8     G   2           H8         G   2   7.798 -29.561   1.878
   21    H1     G   2           H1         G   2   2.167 -30.009   4.830
   22   1H2     G   2          1H2         G   2   0.865 -31.456   3.767
   23   2H2     G   2          2H2         G   2   1.386 -32.311   2.331
   24   1H5*    C   3          1H5*        C   3   3.289 -30.047  -3.494
   25   2H5*    C   3          2H5*        C   3   2.738 -28.751  -4.575
   26    H4*    C   3           H4*        C   3   0.925 -29.274  -3.062
   27    H3*    C   3           H3*        C   3   2.402 -26.680  -2.502
   28    H2*    C   3           H2*        C   3   1.028 -26.282  -0.652
   29   2HO*    C   3          2HO*        C   3  -0.819 -27.416  -2.294
   30    H1*    C   3           H1*        C   3   0.451 -28.991  -0.007
   31   1H4     C   3          1H4         C   3   3.873 -26.421   4.722
   32   2H4     C   3          2H4         C   3   5.344 -26.801   3.855
   33    H5     C   3           H5         C   3   5.362 -27.700   1.615
   34    H6     C   3           H6         C   3   3.977 -28.422  -0.267
   35   1H5*    C   4          1H5*        C   4  -2.223 -25.716  -4.105
   36   2H5*    C   4          2H5*        C   4  -2.087 -23.979  -4.451
   37    H4*    C   4           H4*        C   4  -4.009 -24.745  -2.901
   38    H3*    C   4           H3*        C   4  -2.055 -22.491  -2.380
   39    H2*    C   4           H2*        C   4  -3.008 -22.092  -0.254
   40   2HO*    C   4          2HO*        C   4  -5.083 -23.966  -0.631
   41    H1*    C   4           H1*        C   4  -3.320 -24.647   0.559
   42   1H4     C   4          1H4         C   4   2.349 -22.612   2.668
   43   2H4     C   4          2H4         C   4   3.096 -23.142   1.177
   44    H5     C   4           H5         C   4   1.843 -24.005  -0.692
   45    H6     C   4           H6         C   4  -0.395 -24.544  -1.536
   46   1H5*    U   5          1H5*        U   5  -6.210 -20.397  -1.773
   47   2H5*    U   5          2H5*        U   5  -5.809 -18.743  -2.277
   48    H4*    U   5           H4*        U   5  -6.609 -19.231   0.200
   49    H3*    U   5           H3*        U   5  -4.363 -17.397  -0.711
   50    H2*    U   5           H2*        U   5  -3.844 -16.922   1.520
   51   2HO*    U   5          2HO*        U   5  -5.533 -17.346   3.186
   52    H1*    U   5           H1*        U   5  -4.845 -19.359   2.658
   53    H3     U   5           H3         U   5  -0.618 -18.358   4.249
   54    H5     U   5           H5         U   5  -0.083 -20.316   0.553
   55    H6     U   5           H6         U   5  -2.466 -20.115   0.175
   56   1H5*    U   6          1H5*        U   6  -8.343 -14.247   0.865
   57   2H5*    U   6          2H5*        U   6  -9.367 -15.290  -0.141
   58    H4*    U   6           H4*        U   6  -9.774 -13.412  -1.692
   59    H3*    U   6           H3*        U   6  -7.697 -12.084   0.041
   60    H2*    U   6           H2*        U   6  -9.016 -10.239   0.436
   61   2HO*    U   6          2HO*        U   6 -10.428  -9.539  -1.466
   62    H1*    U   6           H1*        U   6 -11.483 -11.301  -0.773
   63    H3     U   6           H3         U   6 -13.075  -8.414   2.333
   64    H5     U   6           H5         U   6 -10.929 -11.252   4.593
   65    H6     U   6           H6         U   6 -10.189 -12.254   2.509
   66   1H5*    A   7          1H5*        A   7  -7.996 -10.066  -4.561
   67   2H5*    A   7          2H5*        A   7  -6.826  -8.732  -4.505
   68    H4*    A   7           H4*        A   7  -9.354  -8.260  -5.111
   69    H3*    A   7           H3*        A   7  -7.483  -6.661  -3.349
   70    H2*    A   7           H2*        A   7  -9.217  -5.156  -2.798
   71   2HO*    A   7          2HO*        A   7 -11.106  -6.192  -4.581
   72    H1*    A   7           H1*        A   7 -11.303  -6.956  -2.641
   73    H8     A   7           H8         A   7  -8.477  -8.557  -0.853
   74   1H6     A   7          1H6         A   7  -9.478  -4.779   3.905
   75   2H6     A   7          2H6         A   7  -8.623  -6.204   3.361
   76    H2     A   7           H2         A   7 -11.904  -3.303   0.419
   77   1H5*    G   8          1H5*        G   8  -8.656  -3.718  -6.642
   78   2H5*    G   8          2H5*        G   8  -7.370  -2.495  -6.716
   79    H4*    G   8           H4*        G   8  -9.770  -1.812  -5.881
   80    H3*    G   8           H3*        G   8  -7.082  -1.044  -4.706
   81    H2*    G   8           H2*        G   8  -8.133   0.110  -2.955
   82   2HO*    G   8          2HO*        G   8  -9.795   1.328  -3.414
   83    H1*    G   8           H1*        G   8 -10.396  -1.508  -2.676
   84    H8     G   8           H8         G   8  -7.456  -3.751  -2.600
   85    H1     G   8           H1         G   8  -7.868  -0.301   2.746
   86   1H2     G   8          1H2         G   8  -9.353   1.326   2.485
   87   2H2     G   8          2H2         G   8 -10.241   1.559   0.995
   88   1H5*    G   9          1H5*        G   9  -9.800   2.836  -6.370
   89   2H5*    G   9          2H5*        G   9  -8.631   4.165  -6.235
   90    H4*    G   9           H4*        G   9 -11.004   4.385  -5.114
   91    H3*    G   9           H3*        G   9  -8.294   5.236  -4.110
   92    H2*    G   9           H2*        G   9  -9.131   5.785  -1.958
   93   2HO*    G   9          2HO*        G   9 -11.582   5.530  -1.720
   94    H1*    G   9           H1*        G   9 -10.662   3.630  -1.536
   95    H8     G   9           H8         G   9  -7.944   2.196  -3.594
   96    H1     G   9           H1         G   9  -5.858   3.692   2.242
   97   1H2     G   9          1H2         G   9  -7.361   4.940   3.289
   98   2H2     G   9          2H2         G   9  -8.878   5.405   2.550
   99   1H5*    A  10          1H5*        A  10 -10.519   8.170  -2.699
  100   2H5*    A  10          2H5*        A  10  -9.871   9.797  -2.991
  101    H4*    A  10           H4*        A  10 -10.025   9.276  -0.567
  102    H3*    A  10           H3*        A  10  -7.302   9.705  -1.847
  103    H2*    A  10           H2*        A  10  -6.286   9.423   0.270
  104   2HO*    A  10          2HO*        A  10  -7.291   9.898   2.129
  105    H1*    A  10           H1*        A  10  -7.967   7.439   1.236
  106    H8     A  10           H8         A  10  -7.067   6.383  -2.185
  107   1H6     A  10          1H6         A  10  -1.518   4.707  -0.107
  108   2H6     A  10          2H6         A  10  -2.633   4.618  -1.454
  109    H2     A  10           H2         A  10  -3.537   7.128   3.097
  110   1H5*    A  11          1H5*        A  11  -7.967  13.593   0.957
  111   2H5*    A  11          2H5*        A  11  -6.634  14.648   0.444
  112    H4*    A  11           H4*        A  11  -6.713  13.711   2.913
  113    H3*    A  11           H3*        A  11  -4.351  14.029   1.049
  114    H2*    A  11           H2*        A  11  -2.903  12.983   2.626
  115   2HO*    A  11          2HO*        A  11  -3.367  12.845   4.754
  116    H1*    A  11           H1*        A  11  -4.503  10.939   3.331
  117    H8     A  11           H8         A  11  -5.322  11.295  -0.259
  118   1H6     A  11          1H6         A  11   0.079   8.688  -1.647
  119   2H6     A  11          2H6         A  11  -1.473   9.195  -2.274
  120    H2     A  11           H2         A  11   0.112   9.707   2.731
  121   1H5*    A  12          1H5*        A  12  -2.251  15.350   4.511
  122   2H5*    A  12          2H5*        A  12  -1.239  16.664   3.875
  123    H4*    A  12           H4*        A  12   0.009  14.577   4.646
  124    H3*    A  12           H3*        A  12   0.267  15.826   1.903
  125    H2*    A  12           H2*        A  12   1.748  14.118   1.219
  126   2HO*    A  12          2HO*        A  12   2.606  14.233   3.670
  127    H1*    A  12           H1*        A  12   0.531  11.994   2.333
  128    H8     A  12           H8         A  12  -2.169  14.187   1.029
  129   1H6     A  12          1H6         A  12  -0.769  12.316  -4.664
  130   2H6     A  12          2H6         A  12  -1.928  13.189  -3.689
  131    H2     A  12           H2         A  12   2.449  10.874  -1.876
  132   1H5*    C  13          1H5*        C  13   4.325  15.862   4.230
  133   2H5*    C  13          2H5*        C  13   5.467  16.984   3.460
  134    H4*    C  13           H4*        C  13   6.174  14.509   3.629
  135    H3*    C  13           H3*        C  13   6.227  16.190   1.101
  136    H2*    C  13           H2*        C  13   7.126  14.316  -0.085
  137   2HO*    C  13          2HO*        C  13   7.966  13.614   2.405
  138    H1*    C  13           H1*        C  13   5.402  12.486   0.831
  139   1H4     C  13          1H4         C  13   2.823  15.263  -4.321
  140   2H4     C  13          2H4         C  13   1.857  16.262  -3.260
  141    H5     C  13           H5         C  13   2.133  16.294  -0.871
  142    H6     C  13           H6         C  13   3.385  15.373   1.019
  143   1H5*    A  14          1H5*        A  14  10.638  14.805   1.324
  144   2H5*    A  14          2H5*        A  14  11.429  16.116   0.429
  145    H4*    A  14           H4*        A  14  11.504  13.688  -0.539
  146    H3*    A  14           H3*        A  14  10.776  16.194  -2.118
  147    H2*    A  14           H2*        A  14  10.781  14.787  -4.070
  148   2HO*    A  14          2HO*        A  14  11.368  12.475  -3.705
  149    H1*    A  14           H1*        A  14   9.361  12.771  -2.951
  150    H8     A  14           H8         A  14   7.731  15.739  -1.491
  151   1H6     A  14          1H6         A  14   4.991  16.805  -6.895
  152   2H6     A  14          2H6         A  14   5.026  17.222  -5.196
  153    H2     A  14           H2         A  14   8.189  13.717  -7.543
  154   1H5*    G  15          1H5*        G  15  13.923  14.649  -3.966
  155   2H5*    G  15          2H5*        G  15  15.297  15.669  -4.434
  156    H4*    G  15           H4*        G  15  14.446  14.637  -6.436
  157    H3*    G  15           H3*        G  15  13.687  17.566  -6.118
  158    H2*    G  15           H2*        G  15  12.697  17.453  -8.307
  159   2HO*    G  15          2HO*        G  15  13.308  15.996  -9.753
  160    H1*    G  15           H1*        G  15  11.391  15.101  -7.905
  161    H8     G  15           H8         G  15  11.158  16.746  -4.590
  162    H1     G  15           H1         G  15   7.444  19.644  -8.878
  163   1H2     G  15          1H2         G  15   7.943  18.943 -10.918
  164   2H2     G  15          2H2         G  15   9.196  17.761 -11.224
  165   1H5*    U  16          1H5*        U  16  14.844  17.329  -9.353
  166   2H5*    U  16          2H5*        U  16  16.005  18.348 -10.222
  167    H4*    U  16           H4*        U  16  13.990  18.750 -11.357
  168    H3*    U  16           H3*        U  16  14.347  20.866  -9.188
  169    H2*    U  16           H2*        U  16  12.414  21.914 -10.067
  170   2HO*    U  16          2HO*        U  16  11.862  21.777 -12.135
  171    H1*    U  16           H1*        U  16  11.038  19.549 -10.654
  172    H3     U  16           H3         U  16   8.609  21.879  -7.583
  173    H5     U  16           H5         U  16  11.754  20.126  -5.398
  174    H6     U  16           H6         U  16  12.740  19.430  -7.481
  175   1H5*    U  17          1H5*        U  17  15.199  25.070 -10.466
  176   2H5*    U  17          2H5*        U  17  13.643  24.225 -10.373
  177    H4*    U  17           H4*        U  17  14.330  26.567 -11.907
  178    H3*    U  17           H3*        U  17  12.080  25.711 -10.676
  179    H2*    U  17           H2*        U  17  11.678  23.788 -12.048
  180   2HO*    U  17          2HO*        U  17   9.847  25.266 -12.170
  181    H1*    U  17           H1*        U  17  12.223  25.266 -14.599
  182    H3     U  17           H3         U  17  11.240  21.078 -16.117
  183    H5     U  17           H5         U  17  14.568  20.539 -13.590
  184    H6     U  17           H6         U  17  14.430  22.875 -13.006
  185   1H5*    C  18          1H5*        C  18   8.216  25.993 -12.636
  186   2H5*    C  18          2H5*        C  18   8.293  27.766 -12.575
  187    H4*    C  18           H4*        C  18   6.246  26.808 -11.480
  188    H3*    C  18           H3*        C  18   7.673  28.973 -10.645
  189    H2*    C  18           H2*        C  18   9.170  27.803  -9.185
  190   2HO*    C  18          2HO*        C  18   8.372  29.240  -7.751
  191    H1*    C  18           H1*        C  18   6.919  26.154  -8.048
  192   1H4     C  18          1H4         C  18  12.013  23.072  -5.829
  193   2H4     C  18          2H4         C  18  12.634  22.869  -7.453
  194    H5     C  18           H5         C  18  11.588  23.821  -9.395
  195    H6     C  18           H6         C  18   9.713  25.164 -10.213
  196   1H5*    G  19          1H5*        G  19   2.819  27.248 -11.324
  197   2H5*    G  19          2H5*        G  19   4.163  26.153 -10.941
  198    H4*    G  19           H4*        G  19   2.796  26.660 -13.566
  199    H3*    G  19           H3*        G  19   3.838  24.265 -12.004
  200    H2*    G  19           H2*        G  19   4.118  23.102 -14.029
  201   2HO*    G  19          2HO*        G  19   2.783  24.971 -15.633
  202    H1*    G  19           H1*        G  19   4.813  25.291 -15.633
  203    H8     G  19           H8         G  19   7.031  24.257 -16.317
  204    H1     G  19           H1         G  19   8.563  22.477 -10.388
  205   1H2     G  19          1H2         G  19   6.957  23.078  -8.979
  206   2H2     G  19          2H2         G  19   5.513  23.918  -9.501
  207   1H5*    C  20          1H5*        C  20   1.694  22.804 -14.596
  208   2H5*    C  20          2H5*        C  20   0.847  21.278 -14.273
  209    H4*    C  20           H4*        C  20   2.799  21.040 -15.835
  210    H3*    C  20           H3*        C  20   2.583  19.541 -13.220
  211    H2*    C  20           H2*        C  20   4.731  18.573 -13.510
  212   2HO*    C  20          2HO*        C  20   5.723  19.368 -15.760
  213    H1*    C  20           H1*        C  20   6.067  20.768 -14.323
  214   1H4     C  20          1H4         C  20   6.257  20.579  -7.922
  215   2H4     C  20          2H4         C  20   4.826  21.583  -7.873
  216    H5     C  20           H5         C  20   3.583  22.206  -9.824
  217    H6     C  20           H6         C  20   3.436  22.020 -12.259
  218   1H5*    U  21          1H5*        U  21   4.120  17.221 -15.543
  219   2H5*    U  21          2H5*        U  21   3.254  15.892 -16.339
  220    H4*    U  21           H4*        U  21   5.258  14.856 -15.760
  221    H3*    U  21           H3*        U  21   3.210  14.452 -13.564
  222    H2*    U  21           H2*        U  21   4.817  13.283 -12.263
  223   2HO*    U  21          2HO*        U  21   6.878  13.365 -14.132
  224    H1*    U  21           H1*        U  21   6.941  14.931 -12.713
  225    H3     U  21           H3         U  21   5.694  15.758  -8.428
  226    H5     U  21           H5         U  21   2.854  17.827 -10.756
  227    H6     U  21           H6         U  21   3.796  16.767 -12.728
  228   1H5*    G  22          1H5*        G  22   5.010  10.908 -14.128
  229   2H5*    G  22          2H5*        G  22   4.074   9.470 -13.673
  230    H4*    G  22           H4*        G  22   6.030  10.069 -12.138
  231    H3*    G  22           H3*        G  22   3.172   9.686 -11.198
  232    H2*    G  22           H2*        G  22   3.746  10.371  -9.066
  233   2HO*    G  22          2HO*        G  22   6.076  10.000  -8.389
  234    H1*    G  22           H1*        G  22   6.252  11.657  -9.735
  235    H8     G  22           H8         G  22   3.213  13.498 -10.823
  236    H1     G  22           H1         G  22   4.169  14.122  -4.558
  237   1H2     G  22          1H2         G  22   5.742  12.712  -3.880
  238   2H2     G  22          2H2         G  22   6.557  11.620  -4.979
  239   1H5*    U  23          1H5*        U  23   5.735   5.942  -9.347
  240   2H5*    U  23          2H5*        U  23   4.444   4.933  -8.663
  241    H4*    U  23           H4*        U  23   6.293   5.971  -7.087
  242    H3*    U  23           H3*        U  23   3.303   5.769  -6.618
  243    H2*    U  23           H2*        U  23   3.539   6.871  -4.548
  244   2HO*    U  23          2HO*        U  23   5.348   5.554  -3.874
  245    H1*    U  23           H1*        U  23   5.536   8.659  -5.275
  246    H3     U  23           H3         U  23   1.586  10.722  -4.054
  247    H5     U  23           H5         U  23   1.324   9.980  -8.199
  248    H6     U  23           H6         U  23   3.324   8.623  -8.014
  249   1H5*    G  24          1H5*        G  24   4.280   1.406  -7.791
  250   2H5*    G  24          2H5*        G  24   5.338   0.278  -6.924
  251    H4*    G  24           H4*        G  24   6.120   2.069  -8.915
  252    H3*    G  24           H3*        G  24   7.509   0.322  -6.897
  253    H2*    G  24           H2*        G  24   9.550   1.519  -7.034
  254   2HO*    G  24          2HO*        G  24   9.802   1.775  -9.223
  255    H1*    G  24           H1*        G  24   8.617   4.017  -6.997
  256    H8     G  24           H8         G  24   6.059   2.637  -4.836
  257    H1     G  24           H1         G  24  11.742   2.218  -1.978
  258   1H2     G  24          1H2         G  24  13.362   2.548  -3.460
  259   2H2     G  24          2H2         G  24  13.040   2.869  -5.149
  260   1H5*    C  25          1H5*        C  25   9.899  -0.270  -9.488
  261   2H5*    C  25          2H5*        C  25  10.195  -1.783 -10.371
  262    H4*    C  25           H4*        C  25  12.178  -1.561  -9.170
  263    H3*    C  25           H3*        C  25  10.195  -3.201  -7.564
  264    H2*    C  25           H2*        C  25  11.686  -3.292  -5.764
  265   2HO*    C  25          2HO*        C  25  13.960  -2.963  -6.078
  266    H1*    C  25           H1*        C  25  13.022  -0.838  -6.207
  267   1H4     C  25          1H4         C  25   9.641  -0.370  -0.823
  268   2H4     C  25          2H4         C  25   8.222   0.051  -1.754
  269    H5     C  25           H5         C  25   8.167   0.019  -4.163
  270    H6     C  25           H6         C  25   9.455  -0.434  -6.194
  271   1H5*    C  26          1H5*        C  26  13.865  -4.999  -7.542
  272   2H5*    C  26          2H5*        C  26  13.952  -6.451  -8.561
  273    H4*    C  26           H4*        C  26  15.189  -7.220  -6.788
  274    H3*    C  26           H3*        C  26  12.276  -7.738  -6.163
  275    H2*    C  26           H2*        C  26  12.808  -8.455  -3.969
  276   2HO*    C  26          2HO*        C  26  15.388  -8.371  -3.677
  277    H1*    C  26           H1*        C  26  14.617  -6.545  -3.339
  278   1H4     C  26          1H4         C  26   9.069  -4.114  -1.420
  279   2H4     C  26          2H4         C  26   8.557  -3.865  -3.074
  280    H5     C  26           H5         C  26   9.861  -4.549  -4.977
  281    H6     C  26           H6         C  26  11.942  -5.617  -5.711
  282   1H5*    G  27          1H5*        G  27  14.804 -10.793  -4.591
  283   2H5*    G  27          2H5*        G  27  13.905 -12.285  -4.253
  284    H4*    G  27           H4*        G  27  14.824 -10.799  -2.266
  285    H3*    G  27           H3*        G  27  12.090 -12.123  -2.475
  286    H2*    G  27           H2*        G  27  11.569 -11.272  -0.344
  287   2HO*    G  27          2HO*        G  27  13.923 -10.273   0.524
  288    H1*    G  27           H1*        G  27  13.093  -8.899  -0.526
  289    H8     G  27           H8         G  27  10.793  -9.007  -3.424
  290    H1     G  27           H1         G  27   7.646  -7.775   1.981
  291   1H2     G  27          1H2         G  27   8.961  -8.158   3.727
  292   2H2     G  27          2H2         G  27  10.610  -8.716   3.557
  293   1H5*    A  28          1H5*        A  28  13.816 -14.127   1.245
  294   2H5*    A  28          2H5*        A  28  12.855 -15.611   1.397
  295    H4*    A  28           H4*        A  28  12.611 -13.671   3.181
  296    H3*    A  28           H3*        A  28  10.408 -15.337   1.908
  297    H2*    A  28           H2*        A  28   8.806 -14.133   3.131
  298   2HO*    A  28          2HO*        A  28  10.148 -14.478   5.123
  299    H1*    A  28           H1*        A  28  10.184 -11.670   3.245
  300    H8     A  28           H8         A  28   9.890 -12.669  -0.310
  301   1H6     A  28          1H6         A  28   3.996 -10.874  -0.208
  302   2H6     A  28          2H6         A  28   5.327 -11.365  -1.232
  303    H2     A  28           H2         A  28   5.501 -10.969   4.025
  304   1H5*    A  29          1H5*        A  29  11.150 -16.513   6.680
  305   2H5*    A  29          2H5*        A  29   9.940 -17.753   7.064
  306    H4*    A  29           H4*        A  29  10.016 -15.502   8.443
  307    H3*    A  29           H3*        A  29   7.676 -17.130   7.480
  308    H2*    A  29           H2*        A  29   6.097 -15.466   8.056
  309   2HO*    A  29          2HO*        A  29   6.424 -14.106   9.676
  310    H1*    A  29           H1*        A  29   7.401 -13.282   7.166
  311    H8     A  29           H8         A  29   8.445 -15.716   4.624
  312   1H6     A  29          1H6         A  29   2.767 -15.627   2.242
  313   2H6     A  29          2H6         A  29   4.422 -16.135   1.988
  314    H2     A  29           H2         A  29   2.638 -13.566   6.235
  315   1H5*    A  30          1H5*        A  30   6.580 -16.916  12.059
  316   2H5*    A  30          2H5*        A  30   5.871 -18.530  12.269
  317    H4*    A  30           H4*        A  30   4.330 -16.527  12.723
  318    H3*    A  30           H3*        A  30   3.709 -18.864  10.903
  319    H2*    A  30           H2*        A  30   1.614 -17.892  10.305
  320   2HO*    A  30          2HO*        A  30   1.178 -15.717  11.434
  321    H1*    A  30           H1*        A  30   2.498 -15.408   9.805
  322    H8     A  30           H8         A  30   5.461 -17.401   8.854
  323   1H6     A  30          1H6         A  30   2.566 -19.197   3.735
  324   2H6     A  30          2H6         A  30   4.096 -19.143   4.577
  325    H2     A  30           H2         A  30  -0.457 -17.211   6.416
  326   1H5*    G  31          1H5*        G  31   0.679 -18.553  12.399
  327   2H5*    G  31          2H5*        G  31  -0.059 -19.520  13.692
  328    H4*    G  31           H4*        G  31  -1.787 -19.584  12.174
  329    H3*    G  31           H3*        G  31   0.102 -21.823  11.349
  330    H2*    G  31           H2*        G  31  -1.347 -22.300   9.543
  331   2HO*    G  31          2HO*        G  31  -3.435 -22.210   9.848
  332    H1*    G  31           H1*        G  31  -2.133 -19.660   9.012
  333    H8     G  31           H8         G  31   1.578 -19.760   9.213
  334    H1     G  31           H1         G  31  -0.524 -22.488   3.851
  335   1H2     G  31          1H2         G  31  -2.721 -22.777   3.958
  336   2H2     G  31          2H2         G  31  -3.665 -22.297   5.350
  337   1H5*    G  32          1H5*        G  32  -3.888 -23.998  12.565
  338   2H5*    G  32          2H5*        G  32  -3.435 -25.711  12.688
  339    H4*    G  32           H4*        G  32  -5.090 -24.901  10.791
  340    H3*    G  32           H3*        G  32  -2.800 -26.883  10.572
  341    H2*    G  32           H2*        G  32  -3.281 -27.164   8.267
  342   2HO*    G  32          2HO*        G  32  -5.787 -26.024   8.976
  343    H1*    G  32           H1*        G  32  -3.856 -24.534   7.681
  344    H8     G  32           H8         G  32  -0.837 -24.407   9.831
  345    H1     G  32           H1         G  32   0.533 -26.699   4.040
  346   1H2     G  32          1H2         G  32  -1.339 -27.172   2.949
  347   2H2     G  32          2H2         G  32  -2.924 -26.922   3.648
  348   1H5*    U  33          1H5*        U  33  -5.248 -29.074   8.905
  349   2H5*    U  33          2H5*        U  33  -5.387 -30.756   9.452
  350    H4*    U  33           H4*        U  33  -4.411 -30.748   7.230
  351    H3*    U  33           H3*        U  33  -2.622 -31.466   9.556
  352    H2*    U  33           H2*        U  33  -0.721 -31.360   8.273
  353   2HO*    U  33          2HO*        U  33  -1.375 -33.142   7.007
  354    H1*    U  33           H1*        U  33  -1.827 -29.959   5.988
  355    H3     U  33           H3         U  33   2.491 -28.594   6.499
  356    H5     U  33           H5         U  33   0.420 -26.859   9.734
  357    H6     U  33           H6         U  33  -1.526 -28.156   9.096
  358   1H5*    C  34          1H5*        C  34  -2.754 -34.938   6.474
  359   2H5*    C  34          2H5*        C  34  -2.572 -36.467   7.357
  360    H4*    C  34           H4*        C  34  -0.901 -36.367   5.586
  361    H3*    C  34           H3*        C  34   0.107 -35.977   8.418
  362    H2*    C  34           H2*        C  34   2.295 -35.846   7.631
  363   2HO*    C  34          2HO*        C  34   2.119 -36.476   5.030
  364    H1*    C  34           H1*        C  34   1.697 -34.615   5.166
  365   1H4     C  34          1H4         C  34   4.463 -30.151   8.743
  366   2H4     C  34          2H4         C  34   3.044 -30.040   9.760
  367    H5     C  34           H5         C  34   1.127 -31.473   9.511
  368    H6     C  34           H6         C  34   0.151 -33.323   8.235
  369    H3T    C  34           H3T        C  34   0.733 -38.166   8.028
  370   1H5*    U  35          1H5*        U  35  -6.359 -13.360   4.003
  371   2H5*    U  35          2H5*        U  35  -6.041 -11.926   3.007
  372    H4*    U  35           H4*        U  35  -5.281 -11.726   5.409
  373    H3*    U  35           H3*        U  35  -3.472 -11.371   3.016
  374    H2*    U  35           H2*        U  35  -1.571 -11.102   4.373
  375   2HO*    U  35          2HO*        U  35  -3.374 -10.008   6.055
  376    H1*    U  35           H1*        U  35  -2.130 -12.951   6.314
  377    H3     U  35           H3         U  35   1.403 -14.615   4.019
  378    H5     U  35           H5         U  35  -1.859 -15.154   1.406
  379    H6     U  35           H6         U  35  -3.231 -13.910   2.975
  380    H5T    U  35           H5T        U  35  -5.170 -14.461   2.703
  381   1H5*    U  36          1H5*        U  36  -3.053  -8.162   6.044
  382   2H5*    U  36          2H5*        U  36  -2.193  -6.732   5.437
  383    H4*    U  36           H4*        U  36  -1.095  -8.255   7.294
  384    H3*    U  36           H3*        U  36   0.195  -6.968   4.872
  385    H2*    U  36           H2*        U  36   2.275  -7.975   5.415
  386   2HO*    U  36          2HO*        U  36   1.113  -8.764   7.909
  387    H1*    U  36           H1*        U  36   1.349 -10.446   6.064
  388    H3     U  36           H3         U  36   3.518 -10.522   2.025
  389    H5     U  36           H5         U  36  -0.452  -9.421   1.145
  390    H6     U  36           H6         U  36  -0.849  -9.206   3.531
  391   1H5*    C  37          1H5*        C  37   2.502  -5.460   8.625
  392   2H5*    C  37          2H5*        C  37   3.169  -3.878   8.173
  393    H4*    C  37           H4*        C  37   4.859  -5.657   8.908
  394    H3*    C  37           H3*        C  37   5.004  -4.123   6.293
  395    H2*    C  37           H2*        C  37   7.005  -5.261   5.741
  396   2HO*    C  37          2HO*        C  37   8.378  -5.822   7.256
  397    H1*    C  37           H1*        C  37   6.278  -7.754   6.602
  398   1H4     C  37          1H4         C  37   5.140  -7.320   0.333
  399   2H4     C  37          2H4         C  37   3.550  -6.673   0.668
  400    H5     C  37           H5         C  37   2.782  -6.141   2.888
  401    H6     C  37           H6         C  37   3.377  -6.103   5.268
  402   1H5*    G  38          1H5*        G  38   8.658  -2.628   9.233
  403   2H5*    G  38          2H5*        G  38   9.426  -1.315   8.320
  404    H4*    G  38           H4*        G  38  10.820  -3.449   9.000
  405    H3*    G  38           H3*        G  38  10.839  -1.851   6.440
  406    H2*    G  38           H2*        G  38  12.271  -3.404   5.365
  407   2HO*    G  38          2HO*        G  38  12.658  -4.565   7.955
  408    H1*    G  38           H1*        G  38  11.090  -5.692   6.167
  409    H8     G  38           H8         G  38   8.194  -3.413   5.814
  410    H1     G  38           H1         G  38  10.658  -4.907   0.125
  411   1H2     G  38          1H2         G  38  12.625  -5.892   0.383
  412   2H2     G  38          2H2         G  38  13.333  -6.181   1.957
  413   1H5*    G  39          1H5*        G  39  15.397  -1.515   7.789
  414   2H5*    G  39          2H5*        G  39  15.774   0.119   7.206
  415    H4*    G  39           H4*        G  39  17.178  -1.832   6.266
  416    H3*    G  39           H3*        G  39  15.845   0.384   4.721
  417    H2*    G  39           H2*        G  39  16.364  -0.586   2.635
  418   2HO*    G  39          2HO*        G  39  18.063  -2.477   3.934
  419    H1*    G  39           H1*        G  39  15.892  -3.202   3.212
  420    H8     G  39           H8         G  39  13.197  -1.448   5.038
  421    H1     G  39           H1         G  39  12.243  -1.210  -1.262
  422   1H2     G  39          1H2         G  39  14.076  -1.853  -2.331
  423   2H2     G  39          2H2         G  39  15.532  -2.340  -1.492
  424   1H5*    C  40          1H5*        C  40  19.031   0.197   2.193
  425   2H5*    C  40          2H5*        C  40  20.060   1.563   2.668
  426    H4*    C  40           H4*        C  40  19.894   1.847   0.352
  427    H3*    C  40           H3*        C  40  17.830   3.497   1.823
  428    H2*    C  40           H2*        C  40  16.846   4.200  -0.197
  429   2HO*    C  40          2HO*        C  40  18.281   3.382  -2.191
  430    H1*    C  40           H1*        C  40  17.131   1.874  -1.660
  431   1H4     C  40          1H4         C  40  11.112   1.836   0.369
  432   2H4     C  40          2H4         C  40  11.625   1.555   2.018
  433    H5     C  40           H5         C  40  13.938   1.473   2.685
  434    H6     C  40           H6         C  40  16.259   1.643   1.917
  435   1H5*    U  41          1H5*        U  41  17.671   6.521   2.621
  436   2H5*    U  41          2H5*        U  41  16.270   5.630   1.995
  437    H4*    U  41           H4*        U  41  16.109   8.232   2.382
  438    H3*    U  41           H3*        U  41  15.052   6.560   0.097
  439    H2*    U  41           H2*        U  41  14.351   8.471  -1.087
  440   2HO*    U  41          2HO*        U  41  14.451   9.690   1.472
  441    H1*    U  41           H1*        U  41  16.429  10.166  -0.466
  442    H3     U  41           H3         U  41  16.148   8.927  -4.937
  443    H5     U  41           H5         U  41  18.835   6.266  -3.075
  444    H6     U  41           H6         U  41  18.132   7.160  -0.932
  445   1H5*    C  42          1H5*        C  42  10.638   8.621   0.831
  446   2H5*    C  42          2H5*        C  42   9.999   6.965   0.795
  447    H4*    C  42           H4*        C  42   9.201   8.696  -1.009
  448    H3*    C  42           H3*        C  42   9.941   5.790  -1.329
  449    H2*    C  42           H2*        C  42   9.817   5.891  -3.677
  450   2HO*    C  42          2HO*        C  42   8.816   8.469  -3.911
  451    H1*    C  42           H1*        C  42  10.880   8.379  -4.097
  452   1H4     C  42          1H4         C  42  15.791   4.428  -4.859
  453   2H4     C  42          2H4         C  42  15.766   3.991  -3.165
  454    H5     C  42           H5         C  42  14.123   4.822  -1.612
  455    H6     C  42           H6         C  42  12.149   6.251  -1.346
  456   1H5*    U  43          1H5*        U  43   8.421   5.052   1.277
  457   2H5*    U  43          2H5*        U  43   7.069   3.956   1.629
  458    H4*    U  43           H4*        U  43   7.817   5.753   3.410
  459    H3*    U  43           H3*        U  43   5.074   4.803   2.622
  460    H2*    U  43           H2*        U  43   3.974   6.494   3.838
  461   2HO*    U  43          2HO*        U  43   6.420   6.581   5.253
  462    H1*    U  43           H1*        U  43   5.623   8.598   3.335
  463    H3     U  43           H3         U  43   1.502   8.812   1.206
  464    H5     U  43           H5         U  43   4.211   7.100  -1.531
  465    H6     U  43           H6         U  43   5.815   6.902   0.279
  466   1H5*    U  44          1H5*        U  44   4.695   4.905   7.083
  467   2H5*    U  44          2H5*        U  44   3.628   3.537   7.459
  468    H4*    U  44           H4*        U  44   2.788   5.942   7.985
  469    H3*    U  44           H3*        U  44   1.286   3.704   6.622
  470    H2*    U  44           H2*        U  44  -0.569   5.099   6.189
  471   2HO*    U  44          2HO*        U  44  -0.573   7.286   7.217
  472    H1*    U  44           H1*        U  44   0.755   7.393   5.517
  473    H3     U  44           H3         U  44  -1.294   5.559   1.841
  474    H5     U  44           H5         U  44   2.468   3.676   2.108
  475    H6     U  44           H6         U  44   2.761   4.715   4.281
  476   1H5*    C  45          1H5*        C  45  -1.308   5.494   9.349
  477   2H5*    C  45          2H5*        C  45  -1.947   4.369  10.565
  478    H4*    C  45           H4*        C  45  -3.825   5.581   9.689
  479    H3*    C  45           H3*        C  45  -3.535   2.745   8.652
  480    H2*    C  45           H2*        C  45  -5.462   3.017   7.322
  481   2HO*    C  45          2HO*        C  45  -6.645   5.211   7.788
  482    H1*    C  45           H1*        C  45  -5.089   5.674   6.611
  483   1H4     C  45          1H4         C  45  -3.318   2.172   1.604
  484   2H4     C  45          2H4         C  45  -1.823   1.737   2.400
  485    H5     C  45           H5         C  45  -1.295   2.382   4.662
  486    H6     C  45           H6         C  45  -2.087   3.582   6.646
  487   1H5*    C  46          1H5*        C  46  -7.648   3.674  10.627
  488   2H5*    C  46          2H5*        C  46  -8.550   2.161  10.844
  489    H4*    C  46           H4*        C  46  -9.494   4.047   9.261
  490    H3*    C  46           H3*        C  46  -9.471   1.050   8.901
  491    H2*    C  46           H2*        C  46 -10.318   1.210   6.703
  492   2HO*    C  46          2HO*        C  46 -11.951   2.788   7.284
  493    H1*    C  46           H1*        C  46  -8.892   3.365   5.836
  494   1H4     C  46          1H4         C  46  -5.686  -1.880   4.126
  495   2H4     C  46          2H4         C  46  -4.906  -1.922   5.690
  496    H5     C  46           H5         C  46  -5.459  -0.411   7.483
  497    H6     C  46           H6         C  46  -6.882   1.465   8.163
  498   1H5*    U  47          1H5*        U  47 -13.818   2.537   8.387
  499   2H5*    U  47          2H5*        U  47 -14.905   1.173   8.721
  500    H4*    U  47           H4*        U  47 -14.965   2.225   6.351
  501    H3*    U  47           H3*        U  47 -14.788  -0.717   7.040
  502    H2*    U  47           H2*        U  47 -14.636  -1.301   4.758
  503   2HO*    U  47          2HO*        U  47 -15.645  -0.178   3.257
  504    H1*    U  47           H1*        U  47 -13.024   0.748   3.901
  505    H3     U  47           H3         U  47 -10.769  -3.235   3.678
  506    H5     U  47           H5         U  47 -10.359  -1.941   7.670
  507    H6     U  47           H6         U  47 -11.958  -0.178   7.194
  508   1H5*    A  48          1H5*        A  48 -18.991  -0.046   4.732
  509   2H5*    A  48          2H5*        A  48 -19.843  -1.586   4.954
  510    H4*    A  48           H4*        A  48 -19.168  -0.783   2.533
  511    H3*    A  48           H3*        A  48 -19.046  -3.523   3.771
  512    H2*    A  48           H2*        A  48 -17.955  -4.460   1.910
  513   2HO*    A  48          2HO*        A  48 -17.603  -2.933   0.018
  514    H1*    A  48           H1*        A  48 -16.136  -2.513   1.507
  515    H8     A  48           H8         A  48 -16.544  -2.481   5.198
  516   1H6     A  48          1H6         A  48 -13.193  -7.637   5.509
  517   2H6     A  48          2H6         A  48 -13.959  -6.367   6.436
  518    H2     A  48           H2         A  48 -14.233  -6.908   1.196
  519    H3T    A  48           H3T        A  48 -20.805  -2.054   2.469
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  11.037 -25.965   3.861
    2   2H5*    G   1          2H5*        G   1  10.807 -25.185   2.283
    3    H4*    G   1           H4*        G   1  11.378 -27.374   1.681
    4    H3*    G   1           H3*        G   1   8.402 -26.915   1.712
    5    H2*    G   1           H2*        G   1   7.916 -29.218   1.393
    6   2HO*    G   1          2HO*        G   1   9.388 -30.660   0.623
    7    H1*    G   1           H1*        G   1   9.576 -30.245   3.205
    8    H8     G   1           H8         G   1   8.966 -27.139   4.981
    9    H1     G   1           H1         G   1   3.527 -30.436   4.539
   10   1H2     G   1          1H2         G   1   3.745 -32.067   3.053
   11   2H2     G   1          2H2         G   1   5.231 -32.343   2.172
   12    H5T    G   1           H5T        G   1   9.101 -24.693   3.668
   13   1H5*    G   2          1H5*        G   2   8.284 -29.270  -1.153
   14   2H5*    G   2          2H5*        G   2   8.258 -28.508  -2.755
   15    H4*    G   2           H4*        G   2   6.559 -30.057  -3.017
   16    H3*    G   2           H3*        G   2   5.302 -27.541  -1.852
   17    H2*    G   2           H2*        G   2   3.194 -28.654  -1.920
   18   2HO*    G   2          2HO*        G   2   3.161 -29.614  -3.899
   19    H1*    G   2           H1*        G   2   4.077 -31.100  -1.061
   20    H8     G   2           H8         G   2   5.846 -28.697   1.118
   21    H1     G   2           H1         G   2  -0.359 -28.964   2.548
   22   1H2     G   2          1H2         G   2  -1.460 -30.041   0.949
   23   2H2     G   2          2H2         G   2  -0.664 -30.693  -0.466
   24   1H5*    C   3          1H5*        C   3   2.820 -27.099  -5.427
   25   2H5*    C   3          2H5*        C   3   2.868 -25.336  -5.622
   26    H4*    C   3           H4*        C   3   0.624 -26.340  -4.889
   27    H3*    C   3           H3*        C   3   2.076 -24.119  -3.414
   28    H2*    C   3           H2*        C   3   0.370 -24.053  -1.807
   29   2HO*    C   3          2HO*        C   3  -1.376 -25.576  -3.455
   30    H1*    C   3           H1*        C   3  -0.392 -26.773  -1.929
   31   1H4     C   3          1H4         C   3   2.384 -25.602   3.702
   32   2H4     C   3          2H4         C   3   3.932 -26.012   2.998
   33    H5     C   3           H5         C   3   4.239 -26.457   0.647
   34    H6     C   3           H6         C   3   3.132 -26.596  -1.527
   35   1H5*    C   4          1H5*        C   4  -1.734 -21.941  -5.672
   36   2H5*    C   4          2H5*        C   4  -1.212 -20.246  -5.613
   37    H4*    C   4           H4*        C   4  -3.494 -20.861  -4.538
   38    H3*    C   4           H3*        C   4  -1.294 -19.161  -3.341
   39    H2*    C   4           H2*        C   4  -2.481 -18.941  -1.314
   40   2HO*    C   4          2HO*        C   4  -4.586 -18.764  -1.380
   41    H1*    C   4           H1*        C   4  -3.372 -21.479  -1.054
   42   1H4     C   4          1H4         C   4   2.155 -21.105   2.093
   43   2H4     C   4          2H4         C   4   3.035 -21.414   0.613
   44    H5     C   4           H5         C   4   1.969 -21.586  -1.544
   45    H6     C   4           H6         C   4  -0.168 -21.497  -2.742
   46   1H5*    U   5          1H5*        U   5  -5.248 -17.133  -2.253
   47   2H5*    U   5          2H5*        U   5  -4.844 -15.421  -2.488
   48    H4*    U   5           H4*        U   5  -5.694 -16.122  -0.155
   49    H3*    U   5           H3*        U   5  -3.159 -14.543  -0.695
   50    H2*    U   5           H2*        U   5  -2.655 -14.523   1.587
   51   2HO*    U   5          2HO*        U   5  -5.195 -13.961   1.790
   52    H1*    U   5           H1*        U   5  -4.037 -16.920   2.313
   53    H3     U   5           H3         U   5   0.147 -17.249   4.099
   54    H5     U   5           H5         U   5   0.657 -17.927  -0.035
   55    H6     U   5           H6         U   5  -1.648 -17.273  -0.362
   56   1H5*    U   6          1H5*        U   6  -7.623 -14.212  -2.407
   57   2H5*    U   6          2H5*        U   6  -6.138 -13.848  -3.307
   58    H4*    U   6           H4*        U   6  -7.682 -13.043  -4.812
   59    H3*    U   6           H3*        U   6  -6.956 -10.833  -2.888
   60    H2*    U   6           H2*        U   6  -8.633  -9.403  -3.765
   61   2HO*    U   6          2HO*        U   6  -9.285 -11.225  -5.834
   62    H1*    U   6           H1*        U   6 -10.641 -11.197  -3.998
   63    H3     U   6           H3         U   6 -11.622  -8.619  -0.370
   64    H5     U   6           H5         U   6  -8.810 -11.426   1.041
   65    H6     U   6           H6         U   6  -8.494 -12.163  -1.248
   66   1H5*    A   7          1H5*        A   7  -7.368  -8.746  -6.543
   67   2H5*    A   7          2H5*        A   7  -6.306  -7.325  -6.484
   68    H4*    A   7           H4*        A   7  -8.900  -6.981  -6.365
   69    H3*    A   7           H3*        A   7  -6.788  -5.678  -4.617
   70    H2*    A   7           H2*        A   7  -8.459  -4.553  -3.412
   71   2HO*    A   7          2HO*        A   7 -10.676  -4.488  -4.361
   72    H1*    A   7           H1*        A   7 -10.477  -6.495  -3.611
   73    H8     A   7           H8         A   7  -7.599  -8.292  -2.230
   74   1H6     A   7          1H6         A   7  -8.546  -5.544   3.197
   75   2H6     A   7          2H6         A   7  -7.695  -6.829   2.368
   76    H2     A   7           H2         A   7 -11.018  -3.415   0.106
   77   1H5*    G   8          1H5*        G   8  -8.611  -2.081  -7.022
   78   2H5*    G   8          2H5*        G   8  -7.408  -0.788  -6.838
   79    H4*    G   8           H4*        G   8  -9.796  -0.553  -5.727
   80    H3*    G   8           H3*        G   8  -7.084   0.182  -4.592
   81    H2*    G   8           H2*        G   8  -8.058   0.784  -2.540
   82   2HO*    G   8          2HO*        G   8 -10.065   1.587  -2.383
   83    H1*    G   8           H1*        G   8 -10.101  -1.104  -2.467
   84    H8     G   8           H8         G   8  -6.984  -2.944  -3.261
   85    H1     G   8           H1         G   8  -7.023  -0.948   2.795
   86   1H2     G   8          1H2         G   8  -8.670   0.503   3.104
   87   2H2     G   8          2H2         G   8  -9.757   0.979   1.819
   88   1H5*    G   9          1H5*        G   9 -10.340   3.986  -4.947
   89   2H5*    G   9          2H5*        G   9  -9.254   5.367  -4.685
   90    H4*    G   9           H4*        G   9 -11.457   5.152  -3.265
   91    H3*    G   9           H3*        G   9  -8.697   6.022  -2.439
   92    H2*    G   9           H2*        G   9  -9.239   6.022  -0.132
   93   2HO*    G   9          2HO*        G   9 -11.161   6.840   0.264
   94    H1*    G   9           H1*        G   9 -10.606   3.718   0.004
   95    H8     G   9           H8         G   9  -8.107   2.957  -2.617
   96    H1     G   9           H1         G   9  -5.379   3.333   3.133
   97   1H2     G   9          1H2         G   9  -6.796   4.225   4.587
   98   2H2     G   9          2H2         G   9  -8.411   4.726   4.140
   99   1H5*    A  10          1H5*        A  10 -10.639   9.152  -0.701
  100   2H5*    A  10          2H5*        A  10  -9.877  10.712  -1.071
  101    H4*    A  10           H4*        A  10  -9.614  10.110   1.318
  102    H3*    A  10           H3*        A  10  -7.151  10.237  -0.459
  103    H2*    A  10           H2*        A  10  -5.805   9.741   1.411
  104   2HO*    A  10          2HO*        A  10  -7.604   9.850   3.449
  105    H1*    A  10           H1*        A  10  -7.608   8.045   2.728
  106    H8     A  10           H8         A  10  -7.330   6.822  -0.756
  107   1H6     A  10          1H6         A  10  -1.850   4.384   0.642
  108   2H6     A  10          2H6         A  10  -3.128   4.449  -0.550
  109    H2     A  10           H2         A  10  -3.080   7.080   4.021
  110   1H5*    A  11          1H5*        A  11  -6.760  13.941   2.522
  111   2H5*    A  11          2H5*        A  11  -5.440  14.903   1.824
  112    H4*    A  11           H4*        A  11  -5.146  13.759   4.187
  113    H3*    A  11           H3*        A  11  -3.160  13.970   1.909
  114    H2*    A  11           H2*        A  11  -1.570  12.713   3.154
  115   2HO*    A  11          2HO*        A  11  -1.536  12.759   5.284
  116    H1*    A  11           H1*        A  11  -3.258  10.810   4.106
  117    H8     A  11           H8         A  11  -4.538  11.371   0.679
  118   1H6     A  11          1H6         A  11   0.290   8.239  -1.526
  119   2H6     A  11          2H6         A  11  -1.268   8.932  -1.917
  120    H2     A  11           H2         A  11   1.046   9.096   2.820
  121   1H5*    A  12          1H5*        A  12  -0.321  14.793   4.814
  122   2H5*    A  12          2H5*        A  12   0.675  16.068   4.085
  123    H4*    A  12           H4*        A  12   1.862  13.858   4.373
  124    H3*    A  12           H3*        A  12   1.512  15.171   1.657
  125    H2*    A  12           H2*        A  12   2.717  13.398   0.667
  126   2HO*    A  12          2HO*        A  12   4.027  11.999   1.857
  127    H1*    A  12           H1*        A  12   1.696  11.338   2.119
  128    H8     A  12           H8         A  12  -1.112  13.594   1.222
  129   1H6     A  12          1H6         A  12  -0.878  11.390  -4.522
  130   2H6     A  12          2H6         A  12  -1.801  12.364  -3.400
  131    H2     A  12           H2         A  12   2.747   9.928  -2.301
  132   1H5*    C  13          1H5*        C  13   5.906  15.063   3.132
  133   2H5*    C  13          2H5*        C  13   6.954  16.200   2.260
  134    H4*    C  13           H4*        C  13   7.704  13.776   2.195
  135    H3*    C  13           H3*        C  13   7.162  15.421  -0.300
  136    H2*    C  13           H2*        C  13   7.849  13.556  -1.632
  137   2HO*    C  13          2HO*        C  13   9.536  13.036   0.142
  138    H1*    C  13           H1*        C  13   6.413  11.688  -0.339
  139   1H4     C  13          1H4         C  13   2.698  14.261  -4.869
  140   2H4     C  13          2H4         C  13   1.968  15.277  -3.649
  141    H5     C  13           H5         C  13   2.757  15.387  -1.382
  142    H6     C  13           H6         C  13   4.409  14.545   0.214
  143   1H5*    A  14          1H5*        A  14  11.507  14.281  -1.016
  144   2H5*    A  14          2H5*        A  14  12.028  15.512  -2.181
  145    H4*    A  14           H4*        A  14  11.788  12.988  -2.924
  146    H3*    A  14           H3*        A  14  10.831  15.425  -4.489
  147    H2*    A  14           H2*        A  14  10.336  13.886  -6.272
  148   2HO*    A  14          2HO*        A  14  12.111  12.538  -6.233
  149    H1*    A  14           H1*        A  14   9.173  12.006  -4.679
  150    H8     A  14           H8         A  14   7.812  15.028  -3.154
  151   1H6     A  14          1H6         A  14   4.192  15.872  -8.053
  152   2H6     A  14          2H6         A  14   4.506  16.351  -6.401
  153    H2     A  14           H2         A  14   7.279  12.782  -9.121
  154   1H5*    G  15          1H5*        G  15  13.624  13.887  -6.846
  155   2H5*    G  15          2H5*        G  15  14.891  14.901  -7.563
  156    H4*    G  15           H4*        G  15  13.665  14.035  -9.406
  157    H3*    G  15           H3*        G  15  12.774  16.860  -8.699
  158    H2*    G  15           H2*        G  15  11.407  16.788 -10.684
  159   2HO*    G  15          2HO*        G  15  12.118  14.187 -11.400
  160    H1*    G  15           H1*        G  15  10.375  14.318 -10.175
  161    H8     G  15           H8         G  15  10.700  15.843  -6.797
  162    H1     G  15           H1         G  15   6.018  18.571 -10.143
  163   1H2     G  15          1H2         G  15   6.141  17.956 -12.269
  164   2H2     G  15          2H2         G  15   7.379  16.873 -12.862
  165   1H5*    U  16          1H5*        U  16  13.295  16.956 -12.093
  166   2H5*    U  16          2H5*        U  16  14.194  18.130 -13.074
  167    H4*    U  16           H4*        U  16  11.973  18.418 -13.785
  168    H3*    U  16           H3*        U  16  12.591  20.427 -11.572
  169    H2*    U  16           H2*        U  16  10.450  21.360 -11.988
  170   2HO*    U  16          2HO*        U  16   9.620  21.386 -13.944
  171    H1*    U  16           H1*        U  16   9.158  18.925 -12.471
  172    H3     U  16           H3         U  16   7.254  20.889  -8.819
  173    H5     U  16           H5         U  16  10.843  19.183  -7.428
  174    H6     U  16           H6         U  16  11.439  18.709  -9.710
  175   1H5*    U  17          1H5*        U  17  12.755  24.514 -12.417
  176   2H5*    U  17          2H5*        U  17  11.323  23.483 -12.590
  177    H4*    U  17           H4*        U  17  11.890  26.141 -13.752
  178    H3*    U  17           H3*        U  17   9.863  25.179 -12.255
  179    H2*    U  17           H2*        U  17   9.189  23.403 -13.710
  180   2HO*    U  17          2HO*        U  17   7.542  24.805 -15.216
  181    H1*    U  17           H1*        U  17   9.322  25.082 -16.184
  182    H3     U  17           H3         U  17   8.074  20.971 -17.751
  183    H5     U  17           H5         U  17  11.848  20.357 -15.978
  184    H6     U  17           H6         U  17  11.797  22.642 -15.217
  185   1H5*    C  18          1H5*        C  18   5.976  25.375 -13.604
  186   2H5*    C  18          2H5*        C  18   5.818  27.126 -13.355
  187    H4*    C  18           H4*        C  18   4.028  25.853 -12.196
  188    H3*    C  18           H3*        C  18   5.375  27.992 -11.157
  189    H2*    C  18           H2*        C  18   7.064  26.749 -10.001
  190   2HO*    C  18          2HO*        C  18   4.815  27.048  -8.269
  191    H1*    C  18           H1*        C  18   5.026  24.762  -9.001
  192   1H4     C  18          1H4         C  18  10.453  21.796  -7.555
  193   2H4     C  18          2H4         C  18  11.070  22.044  -9.172
  194    H5     C  18           H5         C  18   9.887  23.277 -10.863
  195    H6     C  18           H6         C  18   7.849  24.536 -11.377
  196   1H5*    G  19          1H5*        G  19   0.633  25.895 -11.427
  197   2H5*    G  19          2H5*        G  19   2.179  25.027 -11.365
  198    H4*    G  19           H4*        G  19   0.365  25.513 -13.730
  199    H3*    G  19           H3*        G  19   1.753  23.135 -12.434
  200    H2*    G  19           H2*        G  19   1.784  22.067 -14.536
  201   2HO*    G  19          2HO*        G  19  -0.001  23.990 -15.630
  202    H1*    G  19           H1*        G  19   2.109  24.381 -16.101
  203    H8     G  19           H8         G  19   4.238  23.514 -17.191
  204    H1     G  19           H1         G  19   6.771  21.482 -11.704
  205   1H2     G  19          1H2         G  19   5.382  21.911 -10.027
  206   2H2     G  19          2H2         G  19   3.837  22.697 -10.263
  207   1H5*    C  20          1H5*        C  20  -0.695  21.666 -14.685
  208   2H5*    C  20          2H5*        C  20  -1.461  20.107 -14.320
  209    H4*    C  20           H4*        C  20   0.232  19.955 -16.150
  210    H3*    C  20           H3*        C  20   0.485  18.403 -13.572
  211    H2*    C  20           H2*        C  20   2.593  17.526 -14.204
  212   2HO*    C  20          2HO*        C  20   3.362  17.986 -16.437
  213    H1*    C  20           H1*        C  20   3.701  19.775 -15.214
  214   1H4     C  20          1H4         C  20   5.041  19.498  -8.961
  215   2H4     C  20          2H4         C  20   3.621  20.463  -8.632
  216    H5     C  20           H5         C  20   2.028  21.087 -10.322
  217    H6     C  20           H6         C  20   1.450  20.927 -12.696
  218   1H5*    U  21          1H5*        U  21   1.836  16.078 -16.189
  219   2H5*    U  21          2H5*        U  21   0.802  14.750 -16.751
  220    H4*    U  21           H4*        U  21   2.867  13.688 -16.555
  221    H3*    U  21           H3*        U  21   1.279  13.362 -13.999
  222    H2*    U  21           H2*        U  21   3.095  12.195 -13.000
  223   2HO*    U  21          2HO*        U  21   5.019  12.005 -14.711
  224    H1*    U  21           H1*        U  21   5.097  13.826 -13.840
  225    H3     U  21           H3         U  21   4.606  14.864  -9.467
  226    H5     U  21           H5         U  21   1.325  16.739 -11.336
  227    H6     U  21           H6         U  21   1.940  15.610 -13.396
  228   1H5*    G  22          1H5*        G  22   2.849   9.633 -14.840
  229   2H5*    G  22          2H5*        G  22   1.947   8.300 -14.093
  230    H4*    G  22           H4*        G  22   4.266   8.900 -13.098
  231    H3*    G  22           H3*        G  22   1.687   8.515 -11.553
  232    H2*    G  22           H2*        G  22   2.684   9.257  -9.603
  233   2HO*    G  22          2HO*        G  22   4.149   7.585  -9.419
  234    H1*    G  22           H1*        G  22   4.987  10.541 -10.797
  235    H8     G  22           H8         G  22   1.775  12.344 -11.293
  236    H1     G  22           H1         G  22   3.971  13.124  -5.364
  237   1H2     G  22          1H2         G  22   5.657  11.737  -4.985
  238   2H2     G  22          2H2         G  22   6.244  10.621  -6.199
  239   1H5*    U  23          1H5*        U  23   4.822   5.167 -10.238
  240   2H5*    U  23          2H5*        U  23   3.879   3.932  -9.379
  241    H4*    U  23           H4*        U  23   5.791   5.146  -8.093
  242    H3*    U  23           H3*        U  23   2.965   4.634  -7.139
  243    H2*    U  23           H2*        U  23   3.352   5.824  -5.155
  244   2HO*    U  23          2HO*        U  23   5.915   4.878  -5.563
  245    H1*    U  23           H1*        U  23   5.157   7.723  -6.128
  246    H3     U  23           H3         U  23   1.449   9.702  -4.265
  247    H5     U  23           H5         U  23   0.433   8.841  -8.269
  248    H6     U  23           H6         U  23   2.477   7.547  -8.438
  249   1H5*    G  24          1H5*        G  24   5.106   0.606  -7.181
  250   2H5*    G  24          2H5*        G  24   5.596  -0.466  -5.855
  251    H4*    G  24           H4*        G  24   7.298   0.807  -7.670
  252    H3*    G  24           H3*        G  24   7.628  -0.666  -5.055
  253    H2*    G  24           H2*        G  24   9.807   0.141  -4.751
  254   2HO*    G  24          2HO*        G  24  11.132   0.504  -6.395
  255    H1*    G  24           H1*        G  24   9.538   2.664  -5.742
  256    H8     G  24           H8         G  24   6.523   2.230  -3.665
  257    H1     G  24           H1         G  24  11.771   2.549  -0.055
  258   1H2     G  24          1H2         G  24  13.576   2.346  -1.324
  259   2H2     G  24          2H2         G  24  13.487   2.131  -3.058
  260   1H5*    C  25          1H5*        C  25  11.316  -1.313  -7.425
  261   2H5*    C  25          2H5*        C  25  11.154  -3.017  -7.899
  262    H4*    C  25           H4*        C  25  13.435  -2.798  -7.337
  263    H3*    C  25           H3*        C  25  11.752  -4.006  -5.143
  264    H2*    C  25           H2*        C  25  13.552  -4.005  -3.614
  265   2HO*    C  25          2HO*        C  25  15.099  -3.833  -5.974
  266    H1*    C  25           H1*        C  25  14.631  -1.578  -4.197
  267   1H4     C  25          1H4         C  25  10.526  -0.622   0.578
  268   2H4     C  25          2H4         C  25   9.192  -0.566  -0.553
  269    H5     C  25           H5         C  25   9.442  -0.998  -2.912
  270    H6     C  25           H6         C  25  11.027  -1.574  -4.695
  271   1H5*    C  26          1H5*        C  26  15.257  -5.753  -5.232
  272   2H5*    C  26          2H5*        C  26  15.362  -7.408  -5.867
  273    H4*    C  26           H4*        C  26  16.812  -7.520  -4.047
  274    H3*    C  26           H3*        C  26  14.023  -8.355  -3.195
  275    H2*    C  26           H2*        C  26  14.787  -8.646  -0.963
  276   2HO*    C  26          2HO*        C  26  16.792  -9.223  -0.554
  277    H1*    C  26           H1*        C  26  16.285  -6.390  -0.784
  278   1H4     C  26          1H4         C  26  10.552  -4.653   1.328
  279   2H4     C  26          2H4         C  26   9.882  -4.738  -0.286
  280    H5     C  26           H5         C  26  11.145  -5.472  -2.203
  281    H6     C  26           H6         C  26  13.323  -6.280  -2.985
  282   1H5*    G  27          1H5*        G  27  16.466 -11.588  -1.511
  283   2H5*    G  27          2H5*        G  27  15.320 -12.908  -1.200
  284    H4*    G  27           H4*        G  27  16.315 -11.501   0.808
  285    H3*    G  27           H3*        G  27  13.426 -12.388   0.429
  286    H2*    G  27           H2*        G  27  12.915 -11.407   2.514
  287   2HO*    G  27          2HO*        G  27  14.300 -11.475   4.126
  288    H1*    G  27           H1*        G  27  14.725  -9.261   2.337
  289    H8     G  27           H8         G  27  12.711  -9.214  -0.761
  290    H1     G  27           H1         G  27   9.213  -7.457   4.272
  291   1H2     G  27          1H2         G  27  10.302  -7.914   6.149
  292   2H2     G  27          2H2         G  27  11.889  -8.651   6.159
  293   1H5*    A  28          1H5*        A  28  14.835 -15.171   4.049
  294   2H5*    A  28          2H5*        A  28  13.572 -16.418   4.035
  295    H4*    A  28           H4*        A  28  13.800 -14.776   6.095
  296    H3*    A  28           H3*        A  28  11.271 -15.724   4.706
  297    H2*    A  28           H2*        A  28   9.970 -14.419   6.182
  298   2HO*    A  28          2HO*        A  28  12.330 -14.345   7.789
  299    H1*    A  28           H1*        A  28  11.657 -12.227   6.351
  300    H8     A  28           H8         A  28  11.487 -13.062   2.747
  301   1H6     A  28          1H6         A  28   5.860 -10.569   2.538
  302   2H6     A  28          2H6         A  28   7.192 -11.186   1.586
  303    H2     A  28           H2         A  28   7.042 -10.982   6.856
  304   1H5*    A  29          1H5*        A  29  11.354 -17.848   9.145
  305   2H5*    A  29          2H5*        A  29  10.026 -19.020   9.030
  306    H4*    A  29           H4*        A  29   9.936 -17.133  10.856
  307    H3*    A  29           H3*        A  29   7.739 -18.193   9.078
  308    H2*    A  29           H2*        A  29   6.209 -16.536   9.814
  309   2HO*    A  29          2HO*        A  29   6.550 -16.507  12.010
  310    H1*    A  29           H1*        A  29   7.833 -14.394   9.694
  311    H8     A  29           H8         A  29   9.140 -16.355   6.868
  312   1H6     A  29          1H6         A  29   4.069 -15.020   3.639
  313   2H6     A  29          2H6         A  29   5.687 -15.682   3.561
  314    H2     A  29           H2         A  29   3.354 -13.827   7.913
  315   1H5*    A  30          1H5*        A  30   5.822 -19.433  13.227
  316   2H5*    A  30          2H5*        A  30   4.809 -20.780  12.671
  317    H4*    A  30           H4*        A  30   3.675 -18.577  13.546
  318    H3*    A  30           H3*        A  30   2.937 -20.207  11.094
  319    H2*    A  30           H2*        A  30   1.185 -18.665  10.616
  320   2HO*    A  30          2HO*        A  30   1.471 -18.093  13.324
  321    H1*    A  30           H1*        A  30   2.596 -16.388  11.032
  322    H8     A  30           H8         A  30   5.208 -18.454   9.520
  323   1H6     A  30          1H6         A  30   2.386 -18.058   4.069
  324   2H6     A  30          2H6         A  30   3.859 -18.516   4.892
  325    H2     A  30           H2         A  30  -0.461 -16.576   7.216
  326   1H5*    G  31          1H5*        G  31  -0.284 -19.356  12.217
  327   2H5*    G  31          2H5*        G  31  -1.315 -20.502  13.096
  328    H4*    G  31           H4*        G  31  -2.846 -19.681  11.570
  329    H3*    G  31           H3*        G  31  -1.415 -22.003  10.220
  330    H2*    G  31           H2*        G  31  -2.732 -21.629   8.294
  331   2HO*    G  31          2HO*        G  31  -4.782 -21.403   8.880
  332    H1*    G  31           H1*        G  31  -2.824 -18.840   8.463
  333    H8     G  31           H8         G  31   0.721 -19.863   8.872
  334    H1     G  31           H1         G  31  -1.236 -20.639   2.857
  335   1H2     G  31          1H2         G  31  -3.443 -20.426   2.744
  336   2H2     G  31          2H2         G  31  -4.427 -20.093   4.151
  337   1H5*    G  32          1H5*        G  32  -5.925 -23.620  10.616
  338   2H5*    G  32          2H5*        G  32  -5.672 -25.349  10.303
  339    H4*    G  32           H4*        G  32  -7.128 -23.895   8.646
  340    H3*    G  32           H3*        G  32  -5.076 -26.031   7.991
  341    H2*    G  32           H2*        G  32  -5.445 -25.659   5.659
  342   2HO*    G  32          2HO*        G  32  -7.177 -23.958   5.179
  343    H1*    G  32           H1*        G  32  -5.412 -22.970   5.721
  344    H8     G  32           H8         G  32  -2.895 -23.818   8.291
  345    H1     G  32           H1         G  32  -0.766 -25.170   2.437
  346   1H2     G  32          1H2         G  32  -2.440 -25.090   0.983
  347   2H2     G  32          2H2         G  32  -4.079 -24.703   1.458
  348   1H5*    U  33          1H5*        U  33  -8.042 -27.929   6.083
  349   2H5*    U  33          2H5*        U  33  -8.297 -29.597   6.634
  350    H4*    U  33           H4*        U  33  -7.513 -29.738   4.376
  351    H3*    U  33           H3*        U  33  -5.403 -30.371   6.472
  352    H2*    U  33           H2*        U  33  -3.844 -30.783   4.757
  353   2HO*    U  33          2HO*        U  33  -5.327 -30.537   2.514
  354    H1*    U  33           H1*        U  33  -4.613 -28.790   3.026
  355    H3     U  33           H3         U  33  -0.369 -27.983   4.517
  356    H5     U  33           H5         U  33  -2.894 -26.535   7.564
  357    H6     U  33           H6         U  33  -4.770 -27.531   6.394
  358   1H5*    C  34          1H5*        C  34  -4.449 -32.706   3.432
  359   2H5*    C  34          2H5*        C  34  -4.862 -34.381   3.851
  360    H4*    C  34           H4*        C  34  -2.707 -34.716   3.100
  361    H3*    C  34           H3*        C  34  -2.479 -33.884   6.008
  362    H2*    C  34           H2*        C  34  -0.154 -34.030   5.862
  363   2HO*    C  34          2HO*        C  34   0.761 -35.053   3.854
  364    H1*    C  34           H1*        C  34   0.066 -33.160   3.199
  365   1H4     C  34          1H4         C  34   2.029 -28.236   6.687
  366   2H4     C  34          2H4         C  34   0.447 -28.054   7.412
  367    H5     C  34           H5         C  34  -1.393 -29.542   6.957
  368    H6     C  34           H6         C  34  -2.113 -31.523   5.712
  369    H3T    C  34           H3T        C  34  -1.616 -36.352   5.183
  370   1H5*    U  35          1H5*        U  35  -4.563 -12.524   4.014
  371   2H5*    U  35          2H5*        U  35  -4.285 -10.842   3.518
  372    H4*    U  35           H4*        U  35  -3.784 -11.114   5.904
  373    H3*    U  35           H3*        U  35  -1.579 -10.479   3.949
  374    H2*    U  35           H2*        U  35   0.097 -10.674   5.593
  375   2HO*    U  35          2HO*        U  35  -1.401 -11.078   7.840
  376    H1*    U  35           H1*        U  35  -0.851 -12.827   6.968
  377    H3     U  35           H3         U  35   2.764 -14.414   4.768
  378    H5     U  35           H5         U  35  -0.108 -13.885   1.728
  379    H6     U  35           H6         U  35  -1.565 -12.858   3.377
  380    H5T    U  35           H5T        U  35  -2.531 -11.429   2.418
  381   1H5*    U  36          1H5*        U  36  -1.633  -7.201   7.470
  382   2H5*    U  36          2H5*        U  36  -0.556  -5.911   6.895
  383    H4*    U  36           H4*        U  36   0.027  -7.245   9.100
  384    H3*    U  36           H3*        U  36   1.846  -6.310   6.871
  385    H2*    U  36           H2*        U  36   3.714  -7.399   7.856
  386   2HO*    U  36          2HO*        U  36   3.690  -8.154   9.970
  387    H1*    U  36           H1*        U  36   2.535  -9.750   8.430
  388    H3     U  36           H3         U  36   5.145 -10.147   4.681
  389    H5     U  36           H5         U  36   1.422  -8.744   3.293
  390    H6     U  36           H6         U  36   0.751  -8.437   5.605
  391   1H5*    C  37          1H5*        C  37   3.830  -4.279  10.692
  392   2H5*    C  37          2H5*        C  37   4.683  -2.927   9.920
  393    H4*    C  37           H4*        C  37   6.063  -4.757  11.190
  394    H3*    C  37           H3*        C  37   6.654  -3.548   8.471
  395    H2*    C  37           H2*        C  37   8.590  -4.912   8.290
  396   2HO*    C  37          2HO*        C  37   8.447  -6.189  10.727
  397    H1*    C  37           H1*        C  37   7.495  -7.228   9.206
  398   1H4     C  37          1H4         C  37   6.963  -7.006   2.831
  399   2H4     C  37          2H4         C  37   5.363  -6.319   3.008
  400    H5     C  37           H5         C  37   4.428  -5.684   5.134
  401    H6     C  37           H6         C  37   4.829  -5.553   7.551
  402   1H5*    G  38          1H5*        G  38  10.054  -1.704  11.511
  403   2H5*    G  38          2H5*        G  38  10.644  -0.321  10.569
  404    H4*    G  38           H4*        G  38  12.366  -2.112  11.297
  405    H3*    G  38           H3*        G  38  12.021  -0.921   8.540
  406    H2*    G  38           H2*        G  38  13.687  -2.350   7.638
  407   2HO*    G  38          2HO*        G  38  15.249  -2.198   9.257
  408    H1*    G  38           H1*        G  38  12.923  -4.655   8.822
  409    H8     G  38           H8         G  38   9.674  -2.997   8.235
  410    H1     G  38           H1         G  38  12.333  -4.852   2.740
  411   1H2     G  38          1H2         G  38  14.450  -5.418   3.077
  412   2H2     G  38          2H2         G  38  15.205  -5.337   4.654
  413   1H5*    G  39          1H5*        G  39  16.192   0.206   9.769
  414   2H5*    G  39          2H5*        G  39  16.621   1.813   9.151
  415    H4*    G  39           H4*        G  39  18.060  -0.052   8.261
  416    H3*    G  39           H3*        G  39  16.458   1.815   6.513
  417    H2*    G  39           H2*        G  39  17.051   0.647   4.551
  418   2HO*    G  39          2HO*        G  39  18.876  -1.078   5.804
  419    H1*    G  39           H1*        G  39  16.909  -1.913   5.492
  420    H8     G  39           H8         G  39  13.994  -0.265   7.054
  421    H1     G  39           H1         G  39  13.113  -1.052   0.787
  422   1H2     G  39          1H2         G  39  15.029  -1.600  -0.185
  423   2H2     G  39          2H2         G  39  16.522  -1.771   0.711
  424   1H5*    C  40          1H5*        C  40  19.142   1.601   4.379
  425   2H5*    C  40          2H5*        C  40  20.412   2.839   4.316
  426    H4*    C  40           H4*        C  40  19.969   2.657   2.061
  427    H3*    C  40           H3*        C  40  18.015   4.671   3.213
  428    H2*    C  40           H2*        C  40  16.939   4.853   1.131
  429   2HO*    C  40          2HO*        C  40  18.946   3.431  -0.257
  430    H1*    C  40           H1*        C  40  17.282   2.214   0.262
  431   1H4     C  40          1H4         C  40  11.169   2.725   1.909
  432   2H4     C  40          2H4         C  40  11.593   2.921   3.595
  433    H5     C  40           H5         C  40  13.869   3.026   4.380
  434    H6     C  40           H6         C  40  16.228   2.968   3.718
  435   1H5*    U  41          1H5*        U  41  17.615   7.035   3.681
  436   2H5*    U  41          2H5*        U  41  16.348   6.293   2.683
  437    H4*    U  41           H4*        U  41  16.143   8.802   3.606
  438    H3*    U  41           H3*        U  41  15.180   7.507   1.056
  439    H2*    U  41           H2*        U  41  14.534   9.573   0.126
  440   2HO*    U  41          2HO*        U  41  13.393  10.510   1.760
  441    H1*    U  41           H1*        U  41  16.593  11.140   1.023
  442    H3     U  41           H3         U  41  16.990  10.723  -3.497
  443    H5     U  41           H5         U  41  18.631   7.167  -1.937
  444    H6     U  41           H6         U  41  17.831   7.838   0.254
  445   1H5*    C  42          1H5*        C  42  12.496   8.680   1.251
  446   2H5*    C  42          2H5*        C  42  10.820   8.140   1.472
  447    H4*    C  42           H4*        C  42  11.122   8.552  -0.877
  448    H3*    C  42           H3*        C  42  10.756   5.786   0.096
  449    H2*    C  42           H2*        C  42  12.156   4.797  -1.450
  450   2HO*    C  42          2HO*        C  42  11.483   4.952  -3.640
  451    H1*    C  42           H1*        C  42  12.524   7.284  -3.080
  452   1H4     C  42          1H4         C  42  18.035   4.351  -4.208
  453   2H4     C  42          2H4         C  42  18.031   3.601  -2.627
  454    H5     C  42           H5         C  42  16.279   3.940  -1.009
  455    H6     C  42           H6         C  42  14.150   5.072  -0.558
  456   1H5*    U  43          1H5*        U  43   9.254   5.718   1.780
  457   2H5*    U  43          2H5*        U  43   8.529   4.114   1.547
  458    H4*    U  43           H4*        U  43   7.610   5.728   3.427
  459    H3*    U  43           H3*        U  43   6.060   3.961   1.513
  460    H2*    U  43           H2*        U  43   4.024   4.766   2.366
  461   2HO*    U  43          2HO*        U  43   5.590   5.218   4.654
  462    H1*    U  43           H1*        U  43   4.822   7.382   2.950
  463    H3     U  43           H3         U  43   1.564   8.081  -0.059
  464    H5     U  43           H5         U  43   4.475   5.985  -2.268
  465    H6     U  43           H6         U  43   5.757   5.743  -0.222
  466   1H5*    U  44          1H5*        U  44   5.504   3.386   6.401
  467   2H5*    U  44          2H5*        U  44   4.385   2.020   6.592
  468    H4*    U  44           H4*        U  44   3.846   4.339   7.729
  469    H3*    U  44           H3*        U  44   1.997   2.420   6.302
  470    H2*    U  44           H2*        U  44   0.177   3.916   6.490
  471   2HO*    U  44          2HO*        U  44   0.317   5.778   7.876
  472    H1*    U  44           H1*        U  44   1.479   6.241   5.926
  473    H3     U  44           H3         U  44  -1.210   5.143   2.400
  474    H5     U  44           H5         U  44   2.290   2.858   1.851
  475    H6     U  44           H6         U  44   3.030   3.587   4.045
  476   1H5*    C  45          1H5*        C  45  -0.214   3.479  10.131
  477   2H5*    C  45          2H5*        C  45  -0.729   1.897  10.750
  478    H4*    C  45           H4*        C  45  -2.631   3.480  10.568
  479    H3*    C  45           H3*        C  45  -2.547   0.976   8.861
  480    H2*    C  45           H2*        C  45  -4.592   1.558   7.842
  481   2HO*    C  45          2HO*        C  45  -5.758   3.486   8.851
  482    H1*    C  45           H1*        C  45  -4.226   4.296   7.703
  483   1H4     C  45          1H4         C  45  -2.935   1.979   1.920
  484   2H4     C  45          2H4         C  45  -1.366   1.428   2.462
  485    H5     C  45           H5         C  45  -0.628   1.592   4.750
  486    H6     C  45           H6         C  45  -1.237   2.316   7.011
  487   1H5*    C  46          1H5*        C  46  -6.431   1.111  11.422
  488   2H5*    C  46          2H5*        C  46  -7.230  -0.469  11.294
  489    H4*    C  46           H4*        C  46  -8.380   1.686  10.291
  490    H3*    C  46           H3*        C  46  -8.224  -1.114   9.158
  491    H2*    C  46           H2*        C  46  -9.278  -0.435   7.153
  492   2HO*    C  46          2HO*        C  46 -10.968   0.783   7.992
  493    H1*    C  46           H1*        C  46  -8.016   1.956   6.800
  494   1H4     C  46          1H4         C  46  -4.807  -2.473   3.513
  495   2H4     C  46          2H4         C  46  -3.862  -2.849   4.936
  496    H5     C  46           H5         C  46  -4.287  -1.876   7.098
  497    H6     C  46           H6         C  46  -5.711  -0.332   8.362
  498   1H5*    U  47          1H5*        U  47 -12.819   0.173   9.029
  499   2H5*    U  47          2H5*        U  47 -13.623  -1.409   8.961
  500    H4*    U  47           H4*        U  47 -13.929   0.324   6.991
  501    H3*    U  47           H3*        U  47 -13.516  -2.675   6.846
  502    H2*    U  47           H2*        U  47 -13.510  -2.587   4.477
  503   2HO*    U  47          2HO*        U  47 -14.198  -0.731   3.344
  504    H1*    U  47           H1*        U  47 -11.965  -0.373   4.170
  505    H3     U  47           H3         U  47  -9.648  -4.161   3.016
  506    H5     U  47           H5         U  47  -9.179  -3.794   7.187
  507    H6     U  47           H6         U  47 -10.818  -2.003   7.147
  508   1H5*    A  48          1H5*        A  48 -18.044  -1.800   5.093
  509   2H5*    A  48          2H5*        A  48 -18.702  -3.447   5.025
  510    H4*    A  48           H4*        A  48 -18.534  -2.000   2.829
  511    H3*    A  48           H3*        A  48 -17.915  -4.914   3.267
  512    H2*    A  48           H2*        A  48 -17.127  -5.193   1.069
  513   2HO*    A  48          2HO*        A  48 -17.416  -3.576  -0.526
  514    H1*    A  48           H1*        A  48 -15.614  -2.961   0.928
  515    H8     A  48           H8         A  48 -15.268  -3.912   4.488
  516   1H6     A  48          1H6         A  48 -11.476  -8.463   2.816
  517   2H6     A  48          2H6         A  48 -12.073  -7.512   4.156
  518    H2     A  48           H2         A  48 -13.428  -6.843  -0.899
  519    H3T    A  48           H3T        A  48 -20.085  -3.964   3.075
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  11.007 -27.566   4.629
    2   2H5*    G   1          2H5*        G   1  10.595 -26.767   3.099
    3    H4*    G   1           H4*        G   1  11.429 -28.798   2.331
    4    H3*    G   1           H3*        G   1   8.443 -28.834   2.603
    5    H2*    G   1           H2*        G   1   8.267 -31.194   2.356
    6   2HO*    G   1          2HO*        G   1  10.054 -31.058   0.636
    7    H1*    G   1           H1*        G   1  10.199 -31.952   3.981
    8    H8     G   1           H8         G   1   9.525 -29.070   5.963
    9    H1     G   1           H1         G   1   4.202 -32.564   5.647
   10   1H2     G   1          1H2         G   1   4.370 -34.055   4.012
   11   2H2     G   1          2H2         G   1   5.793 -34.187   3.004
   12    H5T    G   1           H5T        G   1   8.821 -26.540   4.316
   13   1H5*    G   2          1H5*        G   2   8.867 -30.046  -1.534
   14   2H5*    G   2          2H5*        G   2   7.946 -29.018  -2.650
   15    H4*    G   2           H4*        G   2   7.099 -31.311  -2.741
   16    H3*    G   2           H3*        G   2   5.341 -29.160  -1.531
   17    H2*    G   2           H2*        G   2   3.641 -30.766  -1.091
   18   2HO*    G   2          2HO*        G   2   3.367 -32.382  -2.426
   19    H1*    G   2           H1*        G   2   5.213 -32.743  -0.138
   20    H8     G   2           H8         G   2   6.962 -29.899   1.331
   21    H1     G   2           H1         G   2   1.169 -30.523   3.926
   22   1H2     G   2          1H2         G   2  -0.072 -31.890   2.694
   23   2H2     G   2          2H2         G   2   0.529 -32.648   1.236
   24   1H5*    C   3          1H5*        C   3   2.621 -30.395  -3.452
   25   2H5*    C   3          2H5*        C   3   2.106 -29.518  -4.907
   26    H4*    C   3           H4*        C   3   0.103 -29.532  -3.768
   27    H3*    C   3           H3*        C   3   1.665 -27.124  -2.768
   28    H2*    C   3           H2*        C   3  -0.076 -26.638  -1.254
   29   2HO*    C   3          2HO*        C   3  -1.786 -26.820  -2.768
   30    H1*    C   3           H1*        C   3  -0.782 -29.264  -0.633
   31   1H4     C   3          1H4         C   3   2.559 -26.841   4.230
   32   2H4     C   3          2H4         C   3   4.053 -27.237   3.411
   33    H5     C   3           H5         C   3   4.137 -28.132   1.175
   34    H6     C   3           H6         C   3   2.806 -28.840  -0.755
   35   1H5*    C   4          1H5*        C   4  -2.177 -25.161  -5.033
   36   2H5*    C   4          2H5*        C   4  -1.602 -23.493  -5.233
   37    H4*    C   4           H4*        C   4  -3.758 -23.947  -3.813
   38    H3*    C   4           H3*        C   4  -1.449 -22.090  -3.197
   39    H2*    C   4           H2*        C   4  -2.362 -21.557  -1.091
   40   2HO*    C   4          2HO*        C   4  -4.452 -21.214  -1.135
   41    H1*    C   4           H1*        C   4  -3.252 -24.011  -0.356
   42   1H4     C   4          1H4         C   4   2.511 -23.185   2.232
   43   2H4     C   4          2H4         C   4   3.264 -23.769   0.764
   44    H5     C   4           H5         C   4   2.024 -24.296  -1.237
   45    H6     C   4           H6         C   4  -0.203 -24.376  -2.258
   46   1H5*    U   5          1H5*        U   5  -5.316 -19.668  -2.273
   47   2H5*    U   5          2H5*        U   5  -4.796 -18.015  -2.663
   48    H4*    U   5           H4*        U   5  -5.565 -18.625  -0.207
   49    H3*    U   5           H3*        U   5  -3.265 -16.885  -1.120
   50    H2*    U   5           H2*        U   5  -2.425 -16.716   1.039
   51   2HO*    U   5          2HO*        U   5  -4.210 -17.241   2.794
   52    H1*    U   5           H1*        U   5  -3.699 -19.046   2.161
   53    H3     U   5           H3         U   5   0.617 -18.932   3.672
   54    H5     U   5           H5         U   5   0.844 -20.312  -0.306
   55    H6     U   5           H6         U   5  -1.496 -19.751  -0.561
   56   1H5*    U   6          1H5*        U   6  -6.647 -12.970  -0.485
   57   2H5*    U   6          2H5*        U   6  -8.087 -13.971  -0.215
   58    H4*    U   6           H4*        U   6  -7.985 -13.295  -3.005
   59    H3*    U   6           H3*        U   6  -7.342 -11.010  -1.118
   60    H2*    U   6           H2*        U   6  -8.902  -9.617  -2.236
   61   2HO*    U   6          2HO*        U   6  -9.957 -10.775  -4.217
   62    H1*    U   6           H1*        U   6 -10.902 -11.423  -2.537
   63    H3     U   6           H3         U   6 -12.057  -8.373   0.702
   64    H5     U   6           H5         U   6  -9.812 -11.337   2.689
   65    H6     U   6           H6         U   6  -9.260 -12.281   0.524
   66   1H5*    A   7          1H5*        A   7  -7.912  -9.344  -4.822
   67   2H5*    A   7          2H5*        A   7  -6.766  -8.021  -5.116
   68    H4*    A   7           H4*        A   7  -9.244  -7.376  -5.043
   69    H3*    A   7           H3*        A   7  -7.091  -6.087  -3.332
   70    H2*    A   7           H2*        A   7  -8.701  -4.680  -2.355
   71   2HO*    A   7          2HO*        A   7 -10.499  -5.370  -4.468
   72    H1*    A   7           H1*        A   7 -10.872  -6.454  -2.416
   73    H8     A   7           H8         A   7  -8.102  -8.260  -0.778
   74   1H6     A   7          1H6         A   7  -9.086  -4.975   4.334
   75   2H6     A   7          2H6         A   7  -8.259  -6.358   3.655
   76    H2     A   7           H2         A   7 -11.416  -3.079   0.988
   77   1H5*    G   8          1H5*        G   8  -8.586  -2.742  -6.295
   78   2H5*    G   8          2H5*        G   8  -7.357  -1.462  -6.234
   79    H4*    G   8           H4*        G   8  -9.805  -1.001  -5.350
   80    H3*    G   8           H3*        G   8  -7.148  -0.140  -4.186
   81    H2*    G   8           H2*        G   8  -8.187   0.753  -2.283
   82   2HO*    G   8          2HO*        G   8  -9.762   1.891  -3.707
   83    H1*    G   8           H1*        G   8 -10.324  -1.023  -2.055
   84    H8     G   8           H8         G   8  -7.240  -3.058  -2.389
   85    H1     G   8           H1         G   8  -7.549  -0.232   3.319
   86   1H2     G   8          1H2         G   8  -9.160   1.294   3.322
   87   2H2     G   8          2H2         G   8 -10.154   1.613   1.919
   88   1H5*    G   9          1H5*        G   9 -10.279   3.501  -5.325
   89   2H5*    G   9          2H5*        G   9  -9.367   5.002  -5.059
   90    H4*    G   9           H4*        G   9 -11.672   4.616  -3.834
   91    H3*    G   9           H3*        G   9  -9.121   5.873  -2.849
   92    H2*    G   9           H2*        G   9  -9.896   5.985  -0.604
   93   2HO*    G   9          2HO*        G   9 -12.015   6.736  -1.081
   94    H1*    G   9           H1*        G   9 -10.958   3.541  -0.396
   95    H8     G   9           H8         G   9  -8.165   2.895  -2.722
   96    H1     G   9           H1         G   9  -6.025   4.087   3.164
   97   1H2     G   9          1H2         G   9  -7.660   4.924   4.409
   98   2H2     G   9          2H2         G   9  -9.275   5.187   3.788
   99   1H5*    A  10          1H5*        A  10 -11.430   9.581  -1.852
  100   2H5*    A  10          2H5*        A  10 -10.241  10.803  -2.342
  101    H4*    A  10           H4*        A  10 -10.699  10.498   0.195
  102    H3*    A  10           H3*        A  10  -7.986  10.616  -1.155
  103    H2*    A  10           H2*        A  10  -6.905  10.278   0.911
  104   2HO*    A  10          2HO*        A  10  -9.004  10.383   2.649
  105    H1*    A  10           H1*        A  10  -8.725   8.524   2.050
  106    H8     A  10           H8         A  10  -8.225   7.123  -1.296
  107   1H6     A  10          1H6         A  10  -2.640   5.163   0.397
  108   2H6     A  10          2H6         A  10  -3.893   5.049  -0.820
  109    H2     A  10           H2         A  10  -4.116   8.040   3.519
  110   1H5*    A  11          1H5*        A  11  -7.938  14.236   1.758
  111   2H5*    A  11          2H5*        A  11  -6.603  15.255   1.179
  112    H4*    A  11           H4*        A  11  -6.418  14.017   3.506
  113    H3*    A  11           H3*        A  11  -4.321  14.404   1.360
  114    H2*    A  11           H2*        A  11  -2.764  13.088   2.568
  115   2HO*    A  11          2HO*        A  11  -3.652  12.359   4.809
  116    H1*    A  11           H1*        A  11  -4.452  11.119   3.400
  117    H8     A  11           H8         A  11  -5.600  11.758  -0.053
  118   1H6     A  11          1H6         A  11  -0.651   8.736  -2.139
  119   2H6     A  11          2H6         A  11  -2.204   9.412  -2.573
  120    H2     A  11           H2         A  11  -0.057   9.529   2.241
  121   1H5*    A  12          1H5*        A  12  -1.987  14.770   4.367
  122   2H5*    A  12          2H5*        A  12  -0.869  16.142   4.220
  123    H4*    A  12           H4*        A  12   0.370  14.021   4.149
  124    H3*    A  12           H3*        A  12   0.215  15.682   1.614
  125    H2*    A  12           H2*        A  12   1.522  14.088   0.491
  126   2HO*    A  12          2HO*        A  12   2.182  12.849   2.972
  127    H1*    A  12           H1*        A  12   0.542  11.807   1.678
  128    H8     A  12           H8         A  12  -2.278  14.004   0.657
  129   1H6     A  12          1H6         A  12  -1.359  12.265  -5.176
  130   2H6     A  12          2H6         A  12  -2.436  13.115  -4.090
  131    H2     A  12           H2         A  12   2.076  10.768  -2.696
  132   1H5*    C  13          1H5*        C  13   4.563  15.483   3.492
  133   2H5*    C  13          2H5*        C  13   5.647  16.620   2.664
  134    H4*    C  13           H4*        C  13   6.295  14.110   2.672
  135    H3*    C  13           H3*        C  13   6.243  15.956   0.267
  136    H2*    C  13           H2*        C  13   6.953  14.155  -1.129
  137   2HO*    C  13          2HO*        C  13   8.281  13.369   0.933
  138    H1*    C  13           H1*        C  13   5.280  12.276  -0.169
  139   1H4     C  13          1H4         C  13   2.282  15.292  -4.938
  140   2H4     C  13          2H4         C  13   1.415  16.236  -3.751
  141    H5     C  13           H5         C  13   1.903  16.158  -1.400
  142    H6     C  13           H6         C  13   3.317  15.160   0.327
  143   1H5*    A  14          1H5*        A  14  10.129  14.276  -0.014
  144   2H5*    A  14          2H5*        A  14  11.242  15.455  -0.736
  145    H4*    A  14           H4*        A  14  10.755  13.395  -2.152
  146    H3*    A  14           H3*        A  14  10.270  16.231  -3.131
  147    H2*    A  14           H2*        A  14   9.615  15.346  -5.225
  148   2HO*    A  14          2HO*        A  14   9.967  12.825  -5.314
  149    H1*    A  14           H1*        A  14   8.290  13.126  -4.304
  150    H8     A  14           H8         A  14   7.110  15.961  -2.224
  151   1H6     A  14          1H6         A  14   3.662  17.863  -6.951
  152   2H6     A  14          2H6         A  14   3.995  18.064  -5.244
  153    H2     A  14           H2         A  14   6.455  14.678  -8.456
  154   1H5*    G  15          1H5*        G  15  13.386  14.184  -5.693
  155   2H5*    G  15          2H5*        G  15  14.657  15.344  -6.128
  156    H4*    G  15           H4*        G  15  13.846  14.235  -8.146
  157    H3*    G  15           H3*        G  15  13.052  17.147  -7.777
  158    H2*    G  15           H2*        G  15  12.112  17.069 -10.003
  159   2HO*    G  15          2HO*        G  15  13.929  15.262 -10.459
  160    H1*    G  15           H1*        G  15  10.673  14.839  -9.560
  161    H8     G  15           H8         G  15  10.930  16.458  -6.210
  162    H1     G  15           H1         G  15   7.045  19.722 -10.056
  163   1H2     G  15          1H2         G  15   7.207  18.954 -12.132
  164   2H2     G  15          2H2         G  15   8.276  17.639 -12.566
  165   1H5*    U  16          1H5*        U  16  14.246  17.009 -10.982
  166   2H5*    U  16          2H5*        U  16  15.441  18.006 -11.836
  167    H4*    U  16           H4*        U  16  13.433  18.469 -12.969
  168    H3*    U  16           H3*        U  16  13.920  20.563 -10.809
  169    H2*    U  16           H2*        U  16  11.997  21.700 -11.610
  170   2HO*    U  16          2HO*        U  16  11.434  21.632 -13.662
  171    H1*    U  16           H1*        U  16  10.467  19.431 -12.085
  172    H3     U  16           H3         U  16   8.551  21.928  -8.763
  173    H5     U  16           H5         U  16  11.618  19.731  -6.893
  174    H6     U  16           H6         U  16  12.362  19.021  -9.076
  175   1H5*    U  17          1H5*        U  17  15.304  24.726 -12.103
  176   2H5*    U  17          2H5*        U  17  13.693  24.038 -11.831
  177    H4*    U  17           H4*        U  17  14.419  26.299 -13.450
  178    H3*    U  17           H3*        U  17  12.229  25.641 -12.017
  179    H2*    U  17           H2*        U  17  11.586  23.726 -13.322
  180   2HO*    U  17          2HO*        U  17  10.262  26.088 -14.113
  181    H1*    U  17           H1*        U  17  11.965  25.188 -15.920
  182    H3     U  17           H3         U  17  10.542  21.109 -17.382
  183    H5     U  17           H5         U  17  14.051  20.296 -15.192
  184    H6     U  17           H6         U  17  14.121  22.621 -14.559
  185   1H5*    C  18          1H5*        C  18   8.265  26.341 -13.988
  186   2H5*    C  18          2H5*        C  18   8.445  28.086 -13.711
  187    H4*    C  18           H4*        C  18   6.366  27.084 -12.686
  188    H3*    C  18           H3*        C  18   7.894  29.099 -11.671
  189    H2*    C  18           H2*        C  18   9.371  27.718 -10.379
  190   2HO*    C  18          2HO*        C  18   7.192  28.024  -8.560
  191    H1*    C  18           H1*        C  18   7.052  26.073  -9.369
  192   1H4     C  18          1H4         C  18  12.029  22.615  -7.450
  193   2H4     C  18          2H4         C  18  12.676  22.583  -9.074
  194    H5     C  18           H5         C  18  11.681  23.759 -10.917
  195    H6     C  18           H6         C  18   9.845  25.223 -11.612
  196   1H5*    G  19          1H5*        G  19   2.901  27.708 -11.815
  197   2H5*    G  19          2H5*        G  19   4.432  26.815 -11.705
  198    H4*    G  19           H4*        G  19   2.705  27.272 -14.162
  199    H3*    G  19           H3*        G  19   3.641  24.844 -12.576
  200    H2*    G  19           H2*        G  19   3.634  23.604 -14.572
  201   2HO*    G  19          2HO*        G  19   2.324  24.106 -16.299
  202    H1*    G  19           H1*        G  19   4.260  25.749 -16.320
  203    H8     G  19           H8         G  19   6.254  24.578 -17.369
  204    H1     G  19           H1         G  19   8.474  22.364 -11.817
  205   1H2     G  19          1H2         G  19   7.163  23.026 -10.157
  206   2H2     G  19          2H2         G  19   5.741  24.013 -10.417
  207   1H5*    C  20          1H5*        C  20   1.093  23.652 -14.934
  208   2H5*    C  20          2H5*        C  20   0.057  22.265 -14.546
  209    H4*    C  20           H4*        C  20   1.769  21.748 -16.292
  210    H3*    C  20           H3*        C  20   1.653  20.284 -13.653
  211    H2*    C  20           H2*        C  20   3.590  19.022 -14.183
  212   2HO*    C  20          2HO*        C  20   4.483  19.487 -16.470
  213    H1*    C  20           H1*        C  20   5.115  21.007 -15.180
  214   1H4     C  20          1H4         C  20   6.089  20.761  -8.863
  215   2H4     C  20          2H4         C  20   4.781  21.901  -8.633
  216    H5     C  20           H5         C  20   3.368  22.667 -10.408
  217    H6     C  20           H6         C  20   2.900  22.531 -12.804
  218   1H5*    U  21          1H5*        U  21   2.475  17.723 -16.347
  219   2H5*    U  21          2H5*        U  21   1.379  16.383 -16.735
  220    H4*    U  21           H4*        U  21   3.558  15.425 -16.498
  221    H3*    U  21           H3*        U  21   1.724  14.982 -14.124
  222    H2*    U  21           H2*        U  21   3.443  13.757 -13.032
  223   2HO*    U  21          2HO*        U  21   5.211  12.937 -14.117
  224    H1*    U  21           H1*        U  21   5.537  15.385 -13.681
  225    H3     U  21           H3         U  21   4.794  15.998  -9.235
  226    H5     U  21           H5         U  21   1.917  18.410 -11.153
  227    H6     U  21           H6         U  21   2.547  17.374 -13.255
  228   1H5*    G  22          1H5*        G  22   3.414  11.369 -15.086
  229   2H5*    G  22          2H5*        G  22   2.501   9.938 -14.565
  230    H4*    G  22           H4*        G  22   4.692  10.480 -13.303
  231    H3*    G  22           H3*        G  22   1.997   9.891 -12.059
  232    H2*    G  22           H2*        G  22   2.741  10.517  -9.969
  233   2HO*    G  22          2HO*        G  22   5.349  10.231  -9.887
  234    H1*    G  22           H1*        G  22   5.134  11.929 -10.784
  235    H8     G  22           H8         G  22   1.952  13.713 -11.487
  236    H1     G  22           H1         G  22   3.454  14.022  -5.306
  237   1H2     G  22          1H2         G  22   5.126  12.640  -4.856
  238   2H2     G  22          2H2         G  22   5.872  11.641  -6.084
  239   1H5*    U  23          1H5*        U  23   5.001   6.325 -10.599
  240   2H5*    U  23          2H5*        U  23   3.860   5.177  -9.869
  241    H4*    U  23           H4*        U  23   5.743   6.304  -8.394
  242    H3*    U  23           H3*        U  23   2.837   5.794  -7.698
  243    H2*    U  23           H2*        U  23   3.106   6.869  -5.623
  244   2HO*    U  23          2HO*        U  23   5.334   5.630  -5.537
  245    H1*    U  23           H1*        U  23   4.939   8.823  -6.402
  246    H3     U  23           H3         U  23   1.013  10.622  -4.779
  247    H5     U  23           H5         U  23   0.409   9.966  -8.902
  248    H6     U  23           H6         U  23   2.490   8.723  -8.938
  249   1H5*    G  24          1H5*        G  24   5.236   0.767  -6.020
  250   2H5*    G  24          2H5*        G  24   5.166   2.416  -5.367
  251    H4*    G  24           H4*        G  24   6.880   2.165  -7.757
  252    H3*    G  24           H3*        G  24   7.304   0.360  -5.381
  253    H2*    G  24           H2*        G  24   9.541   1.005  -5.128
  254   2HO*    G  24          2HO*        G  24  10.550   0.929  -7.007
  255    H1*    G  24           H1*        G  24   9.381   3.645  -5.787
  256    H8     G  24           H8         G  24   6.471   3.114  -3.581
  257    H1     G  24           H1         G  24  11.928   2.643  -0.315
  258   1H2     G  24          1H2         G  24  13.643   2.525  -1.718
  259   2H2     G  24          2H2         G  24  13.440   2.562  -3.455
  260   1H5*    C  25          1H5*        C  25  10.788  -0.415  -8.468
  261   2H5*    C  25          2H5*        C  25  10.511  -2.150  -8.723
  262    H4*    C  25           H4*        C  25  12.895  -1.757  -8.418
  263    H3*    C  25           H3*        C  25  11.378  -3.215  -6.248
  264    H2*    C  25           H2*        C  25  13.303  -3.338  -4.878
  265   2HO*    C  25          2HO*        C  25  15.067  -2.215  -6.739
  266    H1*    C  25           H1*        C  25  14.278  -0.830  -5.290
  267   1H4     C  25          1H4         C  25  10.578  -0.593  -0.099
  268   2H4     C  25          2H4         C  25   9.164  -0.361  -1.105
  269    H5     C  25           H5         C  25   9.230  -0.441  -3.511
  270    H6     C  25           H6         C  25  10.665  -0.760  -5.477
  271   1H5*    C  26          1H5*        C  26  14.875  -5.348  -6.646
  272   2H5*    C  26          2H5*        C  26  14.573  -6.901  -7.450
  273    H4*    C  26           H4*        C  26  16.020  -7.477  -5.689
  274    H3*    C  26           H3*        C  26  13.114  -7.956  -4.992
  275    H2*    C  26           H2*        C  26  13.710  -8.629  -2.794
  276   2HO*    C  26          2HO*        C  26  16.377  -8.463  -2.760
  277    H1*    C  26           H1*        C  26  15.535  -6.707  -2.266
  278   1H4     C  26          1H4         C  26  10.057  -4.211  -0.231
  279   2H4     C  26          2H4         C  26   9.494  -3.997  -1.873
  280    H5     C  26           H5         C  26  10.737  -4.731  -3.802
  281    H6     C  26           H6         C  26  12.789  -5.827  -4.573
  282   1H5*    G  27          1H5*        G  27  15.494 -11.126  -3.424
  283   2H5*    G  27          2H5*        G  27  14.489 -12.538  -3.041
  284    H4*    G  27           H4*        G  27  15.486 -11.044  -1.099
  285    H3*    G  27           H3*        G  27  12.681 -12.203  -1.304
  286    H2*    G  27           H2*        G  27  12.167 -11.234   0.782
  287   2HO*    G  27          2HO*        G  27  14.138 -12.064   1.770
  288    H1*    G  27           H1*        G  27  13.746  -8.929   0.517
  289    H8     G  27           H8         G  27  11.644  -9.105  -2.513
  290    H1     G  27           H1         G  27   8.147  -7.643   2.612
  291   1H2     G  27          1H2         G  27   9.326  -7.987   4.457
  292   2H2     G  27          2H2         G  27  10.972  -8.577   4.425
  293   1H5*    A  28          1H5*        A  28  14.580 -14.806   2.239
  294   2H5*    A  28          2H5*        A  28  13.443 -16.167   2.320
  295    H4*    A  28           H4*        A  28  13.647 -14.479   4.345
  296    H3*    A  28           H3*        A  28  11.137 -15.687   3.136
  297    H2*    A  28           H2*        A  28   9.810 -14.480   4.669
  298   2HO*    A  28          2HO*        A  28  11.655 -13.317   6.272
  299    H1*    A  28           H1*        A  28  11.313 -12.147   4.740
  300    H8     A  28           H8         A  28  10.953 -13.015   1.156
  301   1H6     A  28          1H6         A  28   5.143 -10.990   1.352
  302   2H6     A  28          2H6         A  28   6.448 -11.502   0.307
  303    H2     A  28           H2         A  28   6.660 -11.273   5.573
  304   1H5*    A  29          1H5*        A  29  11.682 -17.525   7.625
  305   2H5*    A  29          2H5*        A  29  10.486 -18.835   7.684
  306    H4*    A  29           H4*        A  29  10.319 -16.839   9.389
  307    H3*    A  29           H3*        A  29   8.150 -18.289   7.883
  308    H2*    A  29           H2*        A  29   6.479 -16.756   8.546
  309   2HO*    A  29          2HO*        A  29   6.609 -15.591  10.365
  310    H1*    A  29           H1*        A  29   7.842 -14.442   8.235
  311    H8     A  29           H8         A  29   9.153 -16.451   5.429
  312   1H6     A  29          1H6         A  29   3.782 -15.725   2.493
  313   2H6     A  29          2H6         A  29   5.441 -16.258   2.335
  314    H2     A  29           H2         A  29   3.256 -14.339   6.734
  315   1H5*    A  30          1H5*        A  30   6.742 -19.121  12.386
  316   2H5*    A  30          2H5*        A  30   5.784 -20.592  12.128
  317    H4*    A  30           H4*        A  30   4.585 -18.407  12.943
  318    H3*    A  30           H3*        A  30   3.685 -20.359  10.810
  319    H2*    A  30           H2*        A  30   1.782 -19.009  10.331
  320   2HO*    A  30          2HO*        A  30   2.425 -17.211  12.432
  321    H1*    A  30           H1*        A  30   3.031 -16.621  10.259
  322    H8     A  30           H8         A  30   5.679 -18.776   8.895
  323   1H6     A  30          1H6         A  30   2.487 -19.345   3.664
  324   2H6     A  30          2H6         A  30   4.030 -19.618   4.438
  325    H2     A  30           H2         A  30  -0.210 -17.486   6.738
  326   1H5*    G  31          1H5*        G  31   0.599 -19.659  12.227
  327   2H5*    G  31          2H5*        G  31  -0.309 -20.739  13.303
  328    H4*    G  31           H4*        G  31  -1.954 -20.169  11.762
  329    H3*    G  31           H3*        G  31  -0.526 -22.655  10.743
  330    H2*    G  31           H2*        G  31  -1.911 -22.629   8.831
  331   2HO*    G  31          2HO*        G  31  -3.932 -21.896   8.880
  332    H1*    G  31           H1*        G  31  -2.100 -19.857   8.542
  333    H8     G  31           H8         G  31   1.492 -20.673   8.967
  334    H1     G  31           H1         G  31  -0.654 -22.542   3.262
  335   1H2     G  31          1H2         G  31  -2.869 -22.421   3.212
  336   2H2     G  31          2H2         G  31  -3.812 -21.883   4.583
  337   1H5*    G  32          1H5*        G  32  -4.866 -24.450  11.980
  338   2H5*    G  32          2H5*        G  32  -4.476 -26.180  12.029
  339    H4*    G  32           H4*        G  32  -6.209 -25.266  10.264
  340    H3*    G  32           H3*        G  32  -4.021 -27.329   9.900
  341    H2*    G  32           H2*        G  32  -4.518 -27.515   7.596
  342   2HO*    G  32          2HO*        G  32  -6.699 -25.899   7.374
  343    H1*    G  32           H1*        G  32  -5.021 -24.869   7.063
  344    H8     G  32           H8         G  32  -2.030 -24.787   9.227
  345    H1     G  32           H1         G  32  -0.613 -27.063   3.447
  346   1H2     G  32          1H2         G  32  -2.470 -27.529   2.334
  347   2H2     G  32          2H2         G  32  -4.062 -27.281   3.016
  348   1H5*    U  33          1H5*        U  33  -6.593 -29.592   8.051
  349   2H5*    U  33          2H5*        U  33  -6.538 -31.248   8.689
  350    H4*    U  33           H4*        U  33  -5.674 -31.120   6.364
  351    H3*    U  33           H3*        U  33  -3.886 -31.948   8.656
  352    H2*    U  33           H2*        U  33  -1.995 -31.853   7.350
  353   2HO*    U  33          2HO*        U  33  -2.022 -33.173   5.712
  354    H1*    U  33           H1*        U  33  -3.082 -30.322   5.144
  355    H3     U  33           H3         U  33   1.290 -29.122   5.749
  356    H5     U  33           H5         U  33  -0.790 -27.392   8.982
  357    H6     U  33           H6         U  33  -2.760 -28.620   8.285
  358   1H5*    C  34          1H5*        C  34  -4.030 -35.360   5.498
  359   2H5*    C  34          2H5*        C  34  -3.950 -36.891   6.393
  360    H4*    C  34           H4*        C  34  -2.211 -36.904   4.700
  361    H3*    C  34           H3*        C  34  -1.272 -36.452   7.547
  362    H2*    C  34           H2*        C  34   0.943 -36.423   6.817
  363   2HO*    C  34          2HO*        C  34   0.448 -38.397   5.432
  364    H1*    C  34           H1*        C  34   0.463 -35.220   4.323
  365   1H4     C  34          1H4         C  34   3.204 -30.783   7.957
  366   2H4     C  34          2H4         C  34   1.748 -30.618   8.908
  367    H5     C  34           H5         C  34  -0.197 -31.996   8.598
  368    H6     C  34           H6         C  34  -1.176 -33.828   7.299
  369    H3T    C  34           H3T        C  34  -0.589 -38.692   7.088
  370   1H5*    U  35          1H5*        U  35  -4.700 -13.841   3.883
  371   2H5*    U  35          2H5*        U  35  -5.346 -12.187   3.865
  372    H4*    U  35           H4*        U  35  -4.111 -12.039   5.794
  373    H3*    U  35           H3*        U  35  -2.291 -11.403   3.472
  374    H2*    U  35           H2*        U  35  -0.378 -11.397   4.843
  375   2HO*    U  35          2HO*        U  35  -0.455 -10.754   6.878
  376    H1*    U  35           H1*        U  35  -0.989 -13.496   6.486
  377    H3     U  35           H3         U  35   2.440 -14.971   3.934
  378    H5     U  35           H5         U  35  -0.833 -14.907   1.283
  379    H6     U  35           H6         U  35  -2.147 -13.866   3.040
  380    H5T    U  35           H5T        U  35  -4.270 -11.823   2.122
  381   1H5*    U  36          1H5*        U  36  -2.114  -7.980   6.786
  382   2H5*    U  36          2H5*        U  36  -1.182  -6.638   6.092
  383    H4*    U  36           H4*        U  36  -0.277  -7.924   8.214
  384    H3*    U  36           H3*        U  36   1.226  -6.924   5.784
  385    H2*    U  36           H2*        U  36   3.246  -7.886   6.578
  386   2HO*    U  36          2HO*        U  36   2.465  -7.246   8.896
  387    H1*    U  36           H1*        U  36   2.261 -10.285   7.328
  388    H3     U  36           H3         U  36   4.560 -10.613   3.371
  389    H5     U  36           H5         U  36   0.640  -9.504   2.294
  390    H6     U  36           H6         U  36   0.158  -9.175   4.650
  391   1H5*    C  37          1H5*        C  37   3.330  -4.639   9.482
  392   2H5*    C  37          2H5*        C  37   4.144  -3.319   8.620
  393    H4*    C  37           H4*        C  37   5.558  -5.078   9.981
  394    H3*    C  37           H3*        C  37   6.129  -3.893   7.249
  395    H2*    C  37           H2*        C  37   8.095  -5.213   7.075
  396   2HO*    C  37          2HO*        C  37   8.069  -6.519   9.463
  397    H1*    C  37           H1*        C  37   7.065  -7.547   8.015
  398   1H4     C  37          1H4         C  37   6.471  -7.378   1.645
  399   2H4     C  37          2H4         C  37   4.843  -6.769   1.836
  400    H5     C  37           H5         C  37   3.902  -6.166   3.968
  401    H6     C  37           H6         C  37   4.322  -6.001   6.379
  402   1H5*    G  38          1H5*        G  38   9.573  -2.329  10.265
  403   2H5*    G  38          2H5*        G  38  10.424  -1.071   9.348
  404    H4*    G  38           H4*        G  38  11.719  -3.222  10.131
  405    H3*    G  38           H3*        G  38  11.862  -1.723   7.519
  406    H2*    G  38           H2*        G  38  13.242  -3.369   6.521
  407   2HO*    G  38          2HO*        G  38  14.728  -4.202   7.778
  408    H1*    G  38           H1*        G  38  11.971  -5.584   7.390
  409    H8     G  38           H8         G  38   9.125  -3.293   6.893
  410    H1     G  38           H1         G  38  11.746  -4.911   1.305
  411   1H2     G  38          1H2         G  38  13.706  -5.894   1.644
  412   2H2     G  38          2H2         G  38  14.366  -6.147   3.245
  413   1H5*    G  39          1H5*        G  39  16.134  -1.302   9.036
  414   2H5*    G  39          2H5*        G  39  16.623   0.384   8.772
  415    H4*    G  39           H4*        G  39  18.039  -1.233   7.512
  416    H3*    G  39           H3*        G  39  16.361   0.852   6.105
  417    H2*    G  39           H2*        G  39  17.008   0.043   3.981
  418   2HO*    G  39          2HO*        G  39  18.851  -1.838   4.931
  419    H1*    G  39           H1*        G  39  16.916  -2.638   4.499
  420    H8     G  39           H8         G  39  13.957  -1.318   6.278
  421    H1     G  39           H1         G  39  13.126  -1.101  -0.039
  422   1H2     G  39          1H2         G  39  15.057  -1.453  -1.071
  423   2H2     G  39          2H2         G  39  16.548  -1.742  -0.203
  424   1H5*    C  40          1H5*        C  40  19.341   0.749   3.706
  425   2H5*    C  40          2H5*        C  40  20.415   2.142   3.948
  426    H4*    C  40           H4*        C  40  20.198   2.077   1.618
  427    H3*    C  40           H3*        C  40  18.189   3.981   2.848
  428    H2*    C  40           H2*        C  40  17.240   4.414   0.732
  429   2HO*    C  40          2HO*        C  40  19.419   4.646  -0.236
  430    H1*    C  40           H1*        C  40  17.422   1.875  -0.337
  431   1H4     C  40          1H4         C  40  11.432   2.494   1.702
  432   2H4     C  40          2H4         C  40  11.949   2.381   3.370
  433    H5     C  40           H5         C  40  14.262   2.230   4.028
  434    H6     C  40           H6         C  40  16.577   2.156   3.230
  435   1H5*    U  41          1H5*        U  41  17.797   5.929   3.782
  436   2H5*    U  41          2H5*        U  41  16.582   5.730   2.503
  437    H4*    U  41           H4*        U  41  16.701   7.838   4.296
  438    H3*    U  41           H3*        U  41  15.327   7.331   1.662
  439    H2*    U  41           H2*        U  41  14.801   9.607   1.355
  440   2HO*    U  41          2HO*        U  41  13.979  10.286   3.247
  441    H1*    U  41           H1*        U  41  17.103  10.743   2.272
  442    H3     U  41           H3         U  41  17.203  11.371  -2.207
  443    H5     U  41           H5         U  41  18.121   7.285  -1.730
  444    H6     U  41           H6         U  41  17.645   7.521   0.638
  445   1H5*    C  42          1H5*        C  42  11.516   8.265   2.887
  446   2H5*    C  42          2H5*        C  42  10.603   6.806   2.456
  447    H4*    C  42           H4*        C  42  10.404   8.993   0.979
  448    H3*    C  42           H3*        C  42  10.581   6.099   0.102
  449    H2*    C  42           H2*        C  42  10.619   6.736  -2.158
  450   2HO*    C  42          2HO*        C  42   8.759   8.256  -1.660
  451    H1*    C  42           H1*        C  42  12.012   9.144  -1.899
  452   1H4     C  42          1H4         C  42  16.132   4.989  -4.370
  453   2H4     C  42          2H4         C  42  16.237   4.129  -2.850
  454    H5     C  42           H5         C  42  14.905   4.693  -0.922
  455    H6     C  42           H6         C  42  13.187   6.201  -0.037
  456   1H5*    U  43          1H5*        U  43   8.358   6.063   1.796
  457   2H5*    U  43          2H5*        U  43   7.604   4.468   2.001
  458    H4*    U  43           H4*        U  43   6.632   6.556   3.287
  459    H3*    U  43           H3*        U  43   5.144   4.341   1.854
  460    H2*    U  43           H2*        U  43   3.106   5.416   2.169
  461   2HO*    U  43          2HO*        U  43   3.284   7.201   4.018
  462    H1*    U  43           H1*        U  43   4.084   8.090   2.474
  463    H3     U  43           H3         U  43   0.640   8.492  -0.427
  464    H5     U  43           H5         U  43   3.544   6.330  -2.584
  465    H6     U  43           H6         U  43   4.863   6.204  -0.550
  466   1H5*    U  44          1H5*        U  44   4.486   5.579   6.262
  467   2H5*    U  44          2H5*        U  44   3.759   4.294   7.249
  468    H4*    U  44           H4*        U  44   2.731   6.533   7.663
  469    H3*    U  44           H3*        U  44   1.128   4.200   6.600
  470    H2*    U  44           H2*        U  44  -0.815   5.525   6.417
  471   2HO*    U  44          2HO*        U  44  -0.312   7.881   7.407
  472    H1*    U  44           H1*        U  44   0.327   7.855   5.532
  473    H3     U  44           H3         U  44  -2.216   6.067   2.190
  474    H5     U  44           H5         U  44   1.442   3.982   2.009
  475    H6     U  44           H6         U  44   2.085   5.065   4.084
  476   1H5*    C  45          1H5*        C  45  -1.389   5.543  10.331
  477   2H5*    C  45          2H5*        C  45  -1.772   3.947  11.006
  478    H4*    C  45           H4*        C  45  -3.802   5.343  10.577
  479    H3*    C  45           H3*        C  45  -3.366   2.693   9.178
  480    H2*    C  45           H2*        C  45  -5.376   2.943   7.975
  481   2HO*    C  45          2HO*        C  45  -7.032   4.283   8.654
  482    H1*    C  45           H1*        C  45  -5.277   5.675   7.548
  483   1H4     C  45          1H4         C  45  -3.343   2.921   2.151
  484   2H4     C  45          2H4         C  45  -1.775   2.592   2.851
  485    H5     C  45           H5         C  45  -1.228   3.062   5.149
  486    H6     C  45           H6         C  45  -2.070   3.950   7.274
  487   1H5*    C  46          1H5*        C  46  -7.356   2.867  11.589
  488   2H5*    C  46          2H5*        C  46  -8.109   1.259  11.618
  489    H4*    C  46           H4*        C  46  -9.301   3.262  10.379
  490    H3*    C  46           H3*        C  46  -9.054   0.361   9.574
  491    H2*    C  46           H2*        C  46 -10.056   0.768   7.470
  492   2HO*    C  46          2HO*        C  46 -11.687   2.115   7.468
  493    H1*    C  46           H1*        C  46  -8.824   3.109   6.852
  494   1H4     C  46          1H4         C  46  -5.376  -1.665   4.378
  495   2H4     C  46          2H4         C  46  -4.490  -1.808   5.880
  496    H5     C  46           H5         C  46  -5.029  -0.540   7.856
  497    H6     C  46           H6         C  46  -6.535   1.136   8.820
  498   1H5*    U  47          1H5*        U  47 -13.637   1.419   9.307
  499   2H5*    U  47          2H5*        U  47 -14.434  -0.167   9.309
  500    H4*    U  47           H4*        U  47 -14.605   1.403   7.193
  501    H3*    U  47           H3*        U  47 -14.200  -1.594   7.333
  502    H2*    U  47           H2*        U  47 -13.987  -1.724   4.974
  503   2HO*    U  47          2HO*        U  47 -14.365   0.333   3.739
  504    H1*    U  47           H1*        U  47 -12.385   0.430   4.602
  505    H3     U  47           H3         U  47 -10.059  -3.509   4.133
  506    H5     U  47           H5         U  47  -9.919  -2.588   8.243
  507    H6     U  47           H6         U  47 -11.529  -0.820   7.833
  508   1H5*    A  48          1H5*        A  48 -18.195  -0.581   4.996
  509   2H5*    A  48          2H5*        A  48 -19.149  -2.071   4.862
  510    H4*    A  48           H4*        A  48 -18.366  -0.869   2.680
  511    H3*    A  48           H3*        A  48 -18.253  -3.802   3.351
  512    H2*    A  48           H2*        A  48 -17.136  -4.333   1.353
  513   2HO*    A  48          2HO*        A  48 -17.475  -1.651   0.442
  514    H1*    A  48           H1*        A  48 -15.347  -2.304   1.361
  515    H8     A  48           H8         A  48 -15.685  -3.082   4.965
  516   1H6     A  48          1H6         A  48 -12.233  -8.109   4.094
  517   2H6     A  48          2H6         A  48 -12.946  -7.044   5.285
  518    H2     A  48           H2         A  48 -13.418  -6.516   0.056
  519    H3T    A  48           H3T        A  48 -19.977  -3.815   2.000