*HEADER    DNA                                     07-MAR-03   1OQ2              
*TITLE     NMR STRUCTURE OF HEMIMETHYLATED GATC SITE                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-D(*GP*CP*GP*AP*GP*AP*TP*CP*TP*GP*CP*G)-3';              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MOL_ID: 2;                                                           
*COMPND   6 MOLECULE: 5'-D(*CP*GP*CP*AP*GP*(6MC)P*TP*CP*TP*CP*GP*C)-3';          
*COMPND   7 CHAIN: B;                                                            
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: CHEMICAL SYNTHESIS;                                   
*SOURCE   4 MOL_ID: 2;                                                           
*SOURCE   5 SYNTHETIC: YES;                                                      
*SOURCE   6 OTHER_DETAILS: CHEMICAL SYNTHESIS                                    
*KEYWDS    GATC, AGATCT, HEMIMETHYLATION, SEQA, MUTH, N6-METHYL, DAM             
*KEYWDS   2 (DNA ADENINE METHYLTRANSFERASE)                                      
*EXPDTA    NMR, 17 STRUCTURES                                                    
*AUTHOR    S.-H.BAE, H.-K.CHEONG, S.KANG, D.S.HWANG, C.CHEONG, B.-               
*AUTHOR   2 S.CHOI                                                               
*REVDAT   1   27-APR-04 1OQ2    0                                                

ccdih.tbl0100644000076500007640000004320107613225347011663 0ustar  shbaeusersset echo=off message=off end
!***** NMA18 Methyl configuration : cis
assign (resid  18 and name N1 ) (resid  18 and name C6 )
       (resid  18 and name N6 ) (resid  18 and name C10)
       1 0 0 2

! G1 alpha is unconstrained

! G1 beta is unconstrained

! G1 gamma
assign (resid   1 and name O5') (resid   1 and name C5')
       (resid   1 and name C4') (resid   1 and name C3')
       1 60 30 2

! G1 delta
assign (resid   1 and name C5') (resid   1 and name C4')
       (resid   1 and name C3') (resid   1 and name O3')
       1 156 15 2

! G1 eps
assign (resid   1 and name C4') (resid   1 and name C3')
       (resid   1 and name O3') (resid   2 and name P  )
       1 230 70 2

! G1 zeta is unconstrained

! G1 CHI
assign (resid   1 and name O4') (resid   1 and name C1')
       (resid   1 and name N9 ) (resid   1 and name C4 )
       1 220 45 2

! C2 alpha is unconstrained

! C2 beta
assign (resid   2 and name P  ) (resid   2 and name O5')
       (resid   2 and name C5') (resid   2 and name C4')
       1 180 30 2

! C2 gamma
assign (resid   2 and name O5') (resid   2 and name C5')
       (resid   2 and name C4') (resid   2 and name C3')
       1 60 30 2

! C2 delta
assign (resid   2 and name C5') (resid   2 and name C4')
       (resid   2 and name C3') (resid   2 and name O3')
       1 156 15 2

! C2 eps
assign (resid   2 and name C4') (resid   2 and name C3')
       (resid   2 and name O3') (resid   3 and name P  )
       1 230 70 2

! C2 zeta is unconstrained

! C2 chi
assign (resid   2 and name O4') (resid   2 and name C1')
       (resid   2 and name N1 ) (resid   2 and name C2 )
       1 220 45 2

! G3 alpha is unconstrained

! G3 beta
assign (resid   3 and name P  ) (resid   3 and name O5')
       (resid   3 and name C5') (resid   3 and name C4')
       1 180 30 2

! G3 gamma
assign (resid   3 and name O5') (resid   3 and name C5')
       (resid   3 and name C4') (resid   3 and name C3')
       1 60 30 2

! G3 delta
assign (resid   3 and name C5') (resid   3 and name C4')
       (resid   3 and name C3') (resid   3 and name O3')
       1 156 15 2

! G3 eps
assign (resid   3 and name C4') (resid   3 and name C3')
       (resid   3 and name O3') (resid   4 and name P  )
       1 230 70 2

! G3 zeta is unconstrained

! G3 CHI
assign (resid   3 and name O4') (resid   3 and name C1')
       (resid   3 and name N9 ) (resid   3 and name C4 )
       1 220 45 2

! A4 alpha is unconstrained

! A4 beta
assign (resid   4 and name P  ) (resid   4 and name O5')
       (resid   4 and name C5') (resid   4 and name C4')
       1 180 30 2

! A4 gamma
assign (resid   4 and name O5') (resid   4 and name C5')
       (resid   4 and name C4') (resid   4 and name C3')
       1 60 30 2

! A4 delta
assign (resid   4 and name C5') (resid   4 and name C4')
       (resid   4 and name C3') (resid   4 and name O3')
       1 156 15 2

! A4 eps
assign (resid   4 and name C4') (resid   4 and name C3')
       (resid   4 and name O3') (resid   5 and name P  )
       1 230 70 2

! A4 zeta is unconstrained

! A4 CHI
assign (resid   4 and name O4') (resid   4 and name C1')
       (resid   4 and name N9 ) (resid   4 and name C4 )
       1 220 45 2

! G5 alpha is unconstrained

! G5 beta
assign (resid   5 and name P  ) (resid   5 and name O5')
       (resid   5 and name C5') (resid   5 and name C4')
       1 180 30 2

! G5 gamma
assign (resid   5 and name O5') (resid   5 and name C5')
       (resid   5 and name C4') (resid   5 and name C3')
       1 60 30 2

! G5 delta
assign (resid   5 and name C5') (resid   5 and name C4')
       (resid   5 and name C3') (resid   5 and name O3')
       1 156 15 2

! G5 eps
assign (resid   5 and name C4') (resid   5 and name C3')
       (resid   5 and name O3') (resid   6 and name P  )
       1 230 70 2

! G5 zeta is unconstrained

! G5 CHI
assign (resid   5 and name O4') (resid   5 and name C1')
       (resid   5 and name N9 ) (resid   5 and name C4 )
       1 220 45 2

! A6 alpha is unconstrained

! A6 beta
assign (resid   6 and name P  ) (resid   6 and name O5')
       (resid   6 and name C5') (resid   6 and name C4')
       1 180 30 2

! A6 gamma
assign (resid   6 and name O5') (resid   6 and name C5')
       (resid   6 and name C4') (resid   6 and name C3')
       1 60 30 2

! A6 delta
assign (resid   6 and name C5') (resid   6 and name C4')
       (resid   6 and name C3') (resid   6 and name O3')
       1 156 15 2

! A6 eps
assign (resid   6 and name C4') (resid   6 and name C3')
       (resid   6 and name O3') (resid   7 and name P  )
       1 230 70 2

! A6 zeta is unconstrained

! A6 CHI
assign (resid   6 and name O4') (resid   6 and name C1')
       (resid   6 and name N9 ) (resid   6 and name C4 )
       1 220 45 2

! T7 alpha is unconstrained

! T7 beta
assign (resid   7 and name P  ) (resid   7 and name O5')
       (resid   7 and name C5') (resid   7 and name C4')
       1 180 30 2

! T7 gamma
assign (resid   7 and name O5') (resid   7 and name C5')
       (resid   7 and name C4') (resid   7 and name C3')
       1 60 30 2

! T7 delta
assign (resid   7 and name C5') (resid   7 and name C4')
       (resid   7 and name C3') (resid   7 and name O3')
       1 156 15 2

! T7 eps
assign (resid   7 and name C4') (resid   7 and name C3')
       (resid   7 and name O3') (resid   8 and name P  )
       1 230 70 2

! T7 zeta is unconstrained

! T7 chi
assign (resid   7 and name O4') (resid   7 and name C1')
       (resid   7 and name N1 ) (resid   7 and name C2 )
       1 220 45 2

! C8 alpha is unconstrained

! C8 beta
assign (resid   8 and name P  ) (resid   8 and name O5')
       (resid   8 and name C5') (resid   8 and name C4')
       1 180 30 2

! C8 gamma
assign (resid   8 and name O5') (resid   8 and name C5')
       (resid   8 and name C4') (resid   8 and name C3')
       1 60 30 2

! C8 delta
assign (resid   8 and name C5') (resid   8 and name C4')
       (resid   8 and name C3') (resid   8 and name O3')
       1 156 15 2

! C8 eps
assign (resid   8 and name C4') (resid   8 and name C3')
       (resid   8 and name O3') (resid   9 and name P  )
       1 230 70 2

! C8 zeta is unconstrained

! C8 chi
assign (resid   8 and name O4') (resid   8 and name C1')
       (resid   8 and name N1 ) (resid   8 and name C2 )
       1 220 45 2

! T9 alpha is unconstrained

! T9 beta
assign (resid   9 and name P  ) (resid   9 and name O5')
       (resid   9 and name C5') (resid   9 and name C4')
       1 180 30 2

! T9 gamma
assign (resid   9 and name O5') (resid   9 and name C5')
       (resid   9 and name C4') (resid   9 and name C3')
       1 60 30 2

! T9 delta
assign (resid   9 and name C5') (resid   9 and name C4')
       (resid   9 and name C3') (resid   9 and name O3')
       1 156 15 2

! T9 eps
assign (resid   9 and name C4') (resid   9 and name C3')
       (resid   9 and name O3') (resid  10 and name P  )
       1 230 70 2

! T9 zeta is unconstrained

! T9 chi
assign (resid   9 and name O4') (resid   9 and name C1')
       (resid   9 and name N1 ) (resid   9 and name C2 )
       1 220 45 2

! G10 alpha is unconstrained

! G10 beta
assign (resid  10 and name P  ) (resid  10 and name O5')
       (resid  10 and name C5') (resid  10 and name C4')
       1 180 30 2

! G10 gamma
assign (resid  10 and name O5') (resid  10 and name C5')
       (resid  10 and name C4') (resid  10 and name C3')
       1 60 30 2

! G10 delta
assign (resid  10 and name C5') (resid  10 and name C4')
       (resid  10 and name C3') (resid  10 and name O3')
       1 156 15 2

! G10 eps
assign (resid  10 and name C4') (resid  10 and name C3')
       (resid  10 and name O3') (resid  11 and name P  )
       1 230 70 2

! G10 zeta is unconstrained

! G10 CHI
assign (resid  10 and name O4') (resid  10 and name C1')
       (resid  10 and name N9 ) (resid  10 and name C4 )
       1 220 45 2

! C11 alpha is unconstrained

! C11 beta
assign (resid  11 and name P  ) (resid  11 and name O5')
       (resid  11 and name C5') (resid  11 and name C4')
       1 180 30 2

! C11 gamma
assign (resid  11 and name O5') (resid  11 and name C5')
       (resid  11 and name C4') (resid  11 and name C3')
       1 60 30 2

! C11 delta
assign (resid  11 and name C5') (resid  11 and name C4')
       (resid  11 and name C3') (resid  11 and name O3')
       1 156 15 2

! C11 eps
assign (resid  11 and name C4') (resid  11 and name C3')
       (resid  11 and name O3') (resid  12 and name P  )
       1 230 70 2

! C11 zeta is unconstrained

! C11 chi
assign (resid  11 and name O4') (resid  11 and name C1')
       (resid  11 and name N1 ) (resid  11 and name C2 )
       1 220 45 2

! G12 alpha is unconstrained

! G12 beta
assign (resid  12 and name P  ) (resid  12 and name O5')
       (resid  12 and name C5') (resid  12 and name C4')
       1 180 30 2

! G12 gamma
assign (resid  12 and name O5') (resid  12 and name C5')
       (resid  12 and name C4') (resid  12 and name C3')
       1 60 30 2

! G12 delta
assign (resid  12 and name C5') (resid  12 and name C4')
       (resid  12 and name C3') (resid  12 and name O3')
       1 156 15 2

! G12 eps is unconstrained

! G12 zeta is unconstrained

! G12 chi is unconstrained

! C13 alpha is unconstrained

! C13 beta is unconstrained

! C13 gamma
assign (resid  13 and name O5') (resid  13 and name C5')
       (resid  13 and name C4') (resid  13 and name C3')
       1 60 30 2

! C13 delta
assign (resid  13 and name C5') (resid  13 and name C4')
       (resid  13 and name C3') (resid  13 and name O3')
       1 156 15 2

! C13 eps
assign (resid  13 and name C4') (resid  13 and name C3')
       (resid  13 and name O3') (resid  14 and name P  )
       1 230 70 2

! C13 zeta is unconstrained

! C13 chi is unconstrained

! G14 alpha is unconstrained

! G14 beta
assign (resid  14 and name P  ) (resid  14 and name O5')
       (resid  14 and name C5') (resid  14 and name C4')
       1 180 30 2

! G14 gamma
assign (resid  14 and name O5') (resid  14 and name C5')
       (resid  14 and name C4') (resid  14 and name C3')
       1 60 30 2

! G14 delta
assign (resid  14 and name C5') (resid  14 and name C4')
       (resid  14 and name C3') (resid  14 and name O3')
       1 156 15 2

! G14 eps
assign (resid  14 and name C4') (resid  14 and name C3')
       (resid  14 and name O3') (resid  15 and name P  )
       1 230 70 2

! G14 zeta is unconstrained

! G14 CHI
assign (resid  14 and name O4') (resid  14 and name C1')
       (resid  14 and name N9 ) (resid  14 and name C4 )
       1 220 45 2

! C15 alpha is unconstrained

! C15 beta
assign (resid  15 and name P  ) (resid  15 and name O5')
       (resid  15 and name C5') (resid  15 and name C4')
       1 180 30 2

! C15 gamma
assign (resid  15 and name O5') (resid  15 and name C5')
       (resid  15 and name C4') (resid  15 and name C3')
       1 60 30 2

! C15 delta
assign (resid  15 and name C5') (resid  15 and name C4')
       (resid  15 and name C3') (resid  15 and name O3')
       1 156 15 2

! C15 eps
assign (resid  15 and name C4') (resid  15 and name C3')
       (resid  15 and name O3') (resid  16 and name P  )
       1 230 70 2

! C15 zeta is unconstrained

! C15 chi
assign (resid  15 and name O4') (resid  15 and name C1')
       (resid  15 and name N1 ) (resid  15 and name C2 )
       1 220 45 2

! A16 alpha is unconstrained

! A16 beta
assign (resid  16 and name P  ) (resid  16 and name O5')
       (resid  16 and name C5') (resid  16 and name C4')
       1 180 30 2

! A16 gamma
assign (resid  16 and name O5') (resid  16 and name C5')
       (resid  16 and name C4') (resid  16 and name C3')
       1 60 30 2

! A16 delta
assign (resid  16 and name C5') (resid  16 and name C4')
       (resid  16 and name C3') (resid  16 and name O3')
       1 156 15 2

! A16 eps
assign (resid  16 and name C4') (resid  16 and name C3')
       (resid  16 and name O3') (resid  17 and name P  )
       1 230 70 2

! A16 zeta is unconstrained

! A16 CHI
assign (resid  16 and name O4') (resid  16 and name C1')
       (resid  16 and name N9 ) (resid  16 and name C4 )
       1 220 45 2

! G17 alpha is unconstrained

! G17 beta
assign (resid  17 and name P  ) (resid  17 and name O5')
       (resid  17 and name C5') (resid  17 and name C4')
       1 180 30 2

! G17 gamma
assign (resid  17 and name O5') (resid  17 and name C5')
       (resid  17 and name C4') (resid  17 and name C3')
       1 60 30 2

! G17 delta
assign (resid  17 and name C5') (resid  17 and name C4')
       (resid  17 and name C3') (resid  17 and name O3')
       1 156 15 2

! G17 eps
assign (resid  17 and name C4') (resid  17 and name C3')
       (resid  17 and name O3') (resid  18 and name P  )
       1 230 70 2

! G17 zeta is unconstrained

! G17 CHI
assign (resid  17 and name O4') (resid  17 and name C1')
       (resid  17 and name N9 ) (resid  17 and name C4 )
       1 220 45 2

! A18 alpha is unconstrained

! A18 beta
assign (resid  18 and name P  ) (resid  18 and name O5')
       (resid  18 and name C5') (resid  18 and name C4')
       1 180 30 2

! A18 gamma - unconstrained
!assign (resid  18 and name O5') (resid  18 and name C5')
!       (resid  18 and name C4') (resid  18 and name C3')
!       1 60 30 2

! A18 delta
assign (resid  18 and name C5') (resid  18 and name C4')
       (resid  18 and name C3') (resid  18 and name O3')
       1 156 15 2

! A18 eps
assign (resid  18 and name C4') (resid  18 and name C3')
       (resid  18 and name O3') (resid  19 and name P  )
       1 230 70 2

! A18 zeta is unconstrained

! A18 CHI
assign (resid  18 and name O4') (resid  18 and name C1')
       (resid  18 and name N9 ) (resid  18 and name C4 )
       1 220 45 2

! T19 alpha is unconstrained

! T19 beta
assign (resid  19 and name P  ) (resid  19 and name O5')
       (resid  19 and name C5') (resid  19 and name C4')
       1 180 30 2

! T19 gamma
assign (resid  19 and name O5') (resid  19 and name C5')
       (resid  19 and name C4') (resid  19 and name C3')
       1 60 30 2

! T19 delta
assign (resid  19 and name C5') (resid  19 and name C4')
       (resid  19 and name C3') (resid  19 and name O3')
       1 156 15 2

! T19 eps
assign (resid  19 and name C4') (resid  19 and name C3')
       (resid  19 and name O3') (resid  20 and name P  )
       1 230 70 2

! T19 zeta is unconstrained

! T19 chi
assign (resid  19 and name O4') (resid  19 and name C1')
       (resid  19 and name N1 ) (resid  19 and name C2 )
       1 220 45 2

! C20 alpha is unconstrained

! C20 beta
assign (resid  20 and name P  ) (resid  20 and name O5')
       (resid  20 and name C5') (resid  20 and name C4')
       1 180 30 2

! C20 gamma
assign (resid  20 and name O5') (resid  20 and name C5')
       (resid  20 and name C4') (resid  20 and name C3')
       1 60 30 2

! C20 delta
assign (resid  20 and name C5') (resid  20 and name C4')
       (resid  20 and name C3') (resid  20 and name O3')
       1 156 15 2

! C20 eps
assign (resid  20 and name C4') (resid  20 and name C3')
       (resid  20 and name O3') (resid  21 and name P  )
       1 230 70 2

! C20 zeta is unconstrained

! C20 chi
assign (resid  20 and name O4') (resid  20 and name C1')
       (resid  20 and name N1 ) (resid  20 and name C2 )
       1 220 45 2

! T21 alpha is unconstrained

! T21 beta
assign (resid  21 and name P  ) (resid  21 and name O5')
       (resid  21 and name C5') (resid  21 and name C4')
       1 180 30 2

! T21 gamma
assign (resid  21 and name O5') (resid  21 and name C5')
       (resid  21 and name C4') (resid  21 and name C3')
       1 60 30 2

! T21 delta
assign (resid  21 and name C5') (resid  21 and name C4')
       (resid  21 and name C3') (resid  21 and name O3')
       1 156 15 2

! T21 eps
assign (resid  21 and name C4') (resid  21 and name C3')
       (resid  21 and name O3') (resid  22 and name P  )
       1 230 70 2

! T21 zeta is unconstrained

! T21 chi
assign (resid  21 and name O4') (resid  21 and name C1')
       (resid  21 and name N1 ) (resid  21 and name C2 )
       1 220 45 2

! C22 alpha is unconstrained

! C22 beta
assign (resid  22 and name P  ) (resid  22 and name O5')
       (resid  22 and name C5') (resid  22 and name C4')
       1 180 30 2

! C22 gamma
assign (resid  22 and name O5') (resid  22 and name C5')
       (resid  22 and name C4') (resid  22 and name C3')
       1 60 30 2

! C22 delta
assign (resid  22 and name C5') (resid  22 and name C4')
       (resid  22 and name C3') (resid  22 and name O3')
       1 156 15 2

! C22 eps
assign (resid  22 and name C4') (resid  22 and name C3')
       (resid  22 and name O3') (resid  23 and name P  )
       1 230 70 2

! C22 zeta is unconstrained

! C22 chi
assign (resid  22 and name O4') (resid  22 and name C1')
       (resid  22 and name N1 ) (resid  22 and name C2 )
       1 220 45 2

! G23 alpha is unconstrained

! G23 beta
assign (resid  23 and name P  ) (resid  23 and name O5')
       (resid  23 and name C5') (resid  23 and name C4')
       1 180 30 2

! G23 gamma
assign (resid  23 and name O5') (resid  23 and name C5')
       (resid  23 and name C4') (resid  23 and name C3')
       1 60 30 2

! G23 delta
assign (resid  23 and name C5') (resid  23 and name C4')
       (resid  23 and name C3') (resid  23 and name O3')
       1 156 15 2

! G23 eps
assign (resid  23 and name C4') (resid  23 and name C3')
       (resid  23 and name O3') (resid  24 and name P  )
       1 230 70 2

! G23 zeta is unconstrained

! G23 CHI
assign (resid  23 and name O4') (resid  23 and name C1')
       (resid  23 and name N9 ) (resid  23 and name C4 )
       1 220 45 2

! C24 alpha is unconstrained

! C24 beta
assign (resid  24 and name P  ) (resid  24 and name O5')
       (resid  24 and name C5') (resid  24 and name C4')
       1 180 30 2

! C24 gamma
assign (resid  24 and name O5') (resid  24 and name C5')
       (resid  24 and name C4') (resid  24 and name C3')
       1 60 30 2

! C24 delta
assign (resid  24 and name C5') (resid  24 and name C4')
       (resid  24 and name C3') (resid  24 and name O3')
       1 156 15 2

! C24 eps is unconstrained

! C24 zeta is unconstrained

! C24 chi is unconstrained

set echo=on message=on end
chbond.tbl0100644000076500007640000001135207612672147012053 0ustar  shbaeusersset message=off echo=off end

! Watson-Crick geometry : 
!   Wolfram Saenger, Principles of Nucleic Acid Structure
! pp 118, Springer-Verlag New York Inc.

! sequence :  1-GCGAGATCTGCG-12
!            24-CGCTCTAGACGC-13
!         ^^^^^^^^^^^^

!G1-C24
assign ( resid 1 and name O6 ) ( resid 24 and name N4 ) 2.95 0.4 0.4
assign ( resid 1 and name O6 ) ( resid 24 and name H42) 1.95 0.4 0.4
assign ( resid 1 and name N1 ) ( resid 24 and name N3 ) 2.90 0.4 0.4
assign ( resid 1 and name H1 ) ( resid 24 and name N3 ) 1.99 0.4 0.4
assign ( resid 1 and name N2 ) ( resid 24 and name O2 ) 2.95 0.4 0.4
assign ( resid 1 and name H22) ( resid 24 and name O2 ) 1.95 0.4 0.4

!G23-C2
assign ( resid 23 and name O6 ) ( resid 2 and name N4 ) 2.95 0.2 0.2
assign ( resid 23 and name O6 ) ( resid 2 and name H42) 1.95 0.2 0.2
assign ( resid 23 and name N1 ) ( resid 2 and name N3 ) 2.90 0.2 0.2
assign ( resid 23 and name H1 ) ( resid 2 and name N3 ) 1.99 0.2 0.2
assign ( resid 23 and name N2 ) ( resid 2 and name O2 ) 2.95 0.2 0.2
assign ( resid 23 and name H22) ( resid 2 and name O2 ) 1.95 0.2 0.2

!G3-C22
assign ( resid 3 and name O6 ) ( resid 22 and name N4 ) 2.95 0.2 0.2
assign ( resid 3 and name O6 ) ( resid 22 and name H42) 1.95 0.2 0.2
assign ( resid 3 and name N1 ) ( resid 22 and name N3 ) 2.90 0.2 0.2
assign ( resid 3 and name H1 ) ( resid 22 and name N3 ) 1.99 0.2 0.2
assign ( resid 3 and name N2 ) ( resid 22 and name O2 ) 2.95 0.2 0.2
assign ( resid 3 and name H22) ( resid 22 and name O2 ) 1.95 0.2 0.2

!A4-T21
assign ( resid  4 and name N6 ) ( resid 21 and name O4 ) 2.95 0.2 0.2
assign ( resid  4 and name H62) ( resid 21 and name O4 ) 1.95 0.2 0.2
assign ( resid  4 and name N1 ) ( resid 21 and name N3 ) 2.90 0.2 0.2
assign ( resid  4 and name N1 ) ( resid 21 and name H3 ) 1.99 0.2 0.2

!G5-C20
assign ( resid 5 and name O6 ) ( resid 20 and name N4 ) 2.95 0.2 0.2
assign ( resid 5 and name O6 ) ( resid 20 and name H42) 1.95 0.2 0.2
assign ( resid 5 and name N1 ) ( resid 20 and name N3 ) 2.90 0.2 0.2
assign ( resid 5 and name H1 ) ( resid 20 and name N3 ) 1.99 0.2 0.2
assign ( resid 5 and name N2 ) ( resid 20 and name O2 ) 2.95 0.2 0.2
assign ( resid 5 and name H22) ( resid 20 and name O2 ) 1.95 0.2 0.2

!A6-T19
assign ( resid  6 and name N6 ) ( resid 19 and name O4 ) 2.95 0.2 0.2
assign ( resid  6 and name H62) ( resid 19 and name O4 ) 1.95 0.2 0.2
assign ( resid  6 and name N1 ) ( resid 19 and name N3 ) 2.90 0.2 0.2
assign ( resid  6 and name N1 ) ( resid 19 and name H3 ) 1.99 0.2 0.2

!*** Methylated A18 - T7 *** Watson-Crick
!assign ( resid  18 and name N1 ) ( resid 7 and name N3 ) 2.90 0.2 0.2
!assign ( resid  18 and name N1 ) ( resid 7 and name H3 ) 1.99 0.2 0.2
!assign ( resid  18 and name N6 ) ( resid 7 and name O4 ) 2.95 0.2 0.0
!assign ( resid  18 and name H61) ( resid 7 and name O4 ) 1.95 0.2 0.0

!G17-C8
assign ( resid 17 and name O6 ) ( resid 8 and name N4 ) 2.95 0.2 0.2
assign ( resid 17 and name O6 ) ( resid 8 and name H42) 1.95 0.2 0.2
assign ( resid 17 and name N1 ) ( resid 8 and name N3 ) 2.90 0.2 0.2
assign ( resid 17 and name H1 ) ( resid 8 and name N3 ) 1.99 0.2 0.2
assign ( resid 17 and name N2 ) ( resid 8 and name O2 ) 2.95 0.2 0.2
assign ( resid 17 and name H22) ( resid 8 and name O2 ) 1.95 0.2 0.2

!A16-T9
assign ( resid  16 and name N6 ) ( resid 9 and name O4 ) 2.95 0.2 0.2
assign ( resid  16 and name H62) ( resid 9 and name O4 ) 1.95 0.2 0.2
assign ( resid  16 and name N1 ) ( resid 9 and name N3 ) 2.90 0.2 0.2
assign ( resid  16 and name N1 ) ( resid 9 and name H3 ) 1.99 0.2 0.2

!G10-C15
assign ( resid 10 and name O6 ) ( resid 15 and name N4 ) 2.95 0.2 0.2
assign ( resid 10 and name O6 ) ( resid 15 and name H42) 1.95 0.2 0.2
assign ( resid 10 and name N1 ) ( resid 15 and name N3 ) 2.90 0.2 0.2
assign ( resid 10 and name H1 ) ( resid 15 and name N3 ) 1.99 0.2 0.2
assign ( resid 10 and name N2 ) ( resid 15 and name O2 ) 2.95 0.2 0.2
assign ( resid 10 and name H22) ( resid 15 and name O2 ) 1.95 0.2 0.2

!G14-C11
assign ( resid 14 and name O6 ) ( resid 11 and name N4 ) 2.95 0.2 0.2
assign ( resid 14 and name O6 ) ( resid 11 and name H42) 1.95 0.2 0.2
assign ( resid 14 and name N1 ) ( resid 11 and name N3 ) 2.90 0.2 0.2
assign ( resid 14 and name H1 ) ( resid 11 and name N3 ) 1.99 0.2 0.2
assign ( resid 14 and name N2 ) ( resid 11 and name O2 ) 2.95 0.2 0.2
assign ( resid 14 and name H22) ( resid 11 and name O2 ) 1.95 0.2 0.2

!G12-C13
assign ( resid 12 and name O6 ) ( resid 13 and name N4 ) 2.95 0.4 0.4
assign ( resid 12 and name O6 ) ( resid 13 and name H42) 1.95 0.4 0.4
assign ( resid 12 and name N1 ) ( resid 13 and name N3 ) 2.90 0.4 0.4
assign ( resid 12 and name H1 ) ( resid 13 and name N3 ) 1.99 0.4 0.4
assign ( resid 12 and name N2 ) ( resid 13 and name O2 ) 2.95 0.4 0.4
assign ( resid 12 and name H22) ( resid 13 and name O2 ) 1.95 0.4 0.4
cplan.tbl0100644000076500007640000000745007612672105011711 0ustar  shbaeusersset message=off echo=off end

! base pair planarity
! 2002. 6. 15
! sequence :  1-GCGAGATCTGCG-12
!            24-CGCTCTAGACGC-13
!
! G1-C24
!--------------------------------------------------------------------
group
selection=     ((resid 1 and name N1) or (resid 1 and name N3) or
                (resid 1 and name C5) or (resid 24 and name N1) or
               (resid 24 and name N3) or (resid 24 and name C5))
weight = $pscale end

! C2-G23
!--------------------------------------------------------------------
group
selection=     ((resid 2 and name N1) or (resid 2 and name N3) or
                (resid 2 and name C5) or (resid 23 and name N1) or
               (resid 23 and name N3) or (resid 23 and name C5))
weight = $pscale end

! G3-C22
!--------------------------------------------------------------------
group
selection=     ((resid 3 and name N1) or (resid 3 and name N3) or
                (resid 3 and name C5) or (resid 22 and name N1) or
               (resid 22 and name N3) or (resid 22 and name C5))
weight = $pscale end

! A4-T21
!--------------------------------------------------------------------
group
selection=     ((resid 4 and name N1) or (resid 4 and name N3) or
                (resid 4 and name C5) or (resid 21 and name N1) or
               (resid 21 and name N3) or (resid 21 and name C5))
weight = $pscale end

! G5-C20
!--------------------------------------------------------------------
group
selection=     ((resid 5 and name N1) or (resid 5 and name N3) or
                (resid 5 and name C5) or (resid 20 and name N1) or
               (resid 20 and name N3) or (resid 20 and name C5))
weight = $pscale end

! A6-T19
!--------------------------------------------------------------------
group
selection=     ((resid 6 and name N1) or (resid 6 and name N3) or
                (resid 6 and name C5) or (resid 19 and name N1) or
               (resid 19 and name N3) or (resid 19 and name C5))
weight = $pscale end

! T7-A18
!--------------------------------------------------------------------
!group
!selection=     ((resid 7 and name N1) or (resid 7 and name N3) or
!                (resid 7 and name C5) or (resid 18 and name N1) or
!               (resid 18 and name N3) or (resid 18 and name C5) or
!               (resid 18 and name N6) or (resid 18 and name C10))
!weight = $pscale end

! C8-G17
!--------------------------------------------------------------------
group
selection=     ((resid 8 and name N1) or (resid 8 and name N3) or
                (resid 8 and name C5) or (resid 17 and name N1) or
               (resid 17 and name N3) or (resid 17 and name C5))
weight = $pscale end

! T9-A16
!--------------------------------------------------------------------
group
selection=     ((resid 9 and name N1) or (resid 9 and name N3) or
                (resid 9 and name C5) or (resid 16 and name N1) or
               (resid 16 and name N3) or (resid 16 and name C5))
weight = $pscale end

! G10-C15
!--------------------------------------------------------------------
group
selection=     ((resid 10 and name N1) or (resid 10 and name N3) or
                (resid 10 and name C5) or (resid 15 and name N1) or
                (resid 15 and name N3) or (resid 15 and name C5))
weight = $pscale end

! C11-G14
!--------------------------------------------------------------------
group
selection=     ((resid 11 and name N1) or (resid 11 and name N3) or
                (resid 11 and name C5) or (resid 14 and name N1) or
                (resid 14 and name N3) or (resid 14 and name C5))
weight = $pscale end

! G12-C13
!--------------------------------------------------------------------
group
selection=     ((resid 12 and name N1) or (resid 12 and name N3) or
                (resid 12 and name C5) or (resid 13 and name N1) or
                (resid 13 and name N3) or (resid 13 and name C5))
weight = $pscale end
cwater.tbl0100644000076500007640000000754707612745063012114 0ustar  shbaeusersset message=off echo=off end

! sequence :  1-GCGAGATCTGCG-12
!            24-CGCTCTAGACGC-13
!         ^^^^^^^^^^^^
!====================================================================
!exchangeable proton NOEs
! NH-NH : Upper bound 4.2 A
! NH-NH2 : Upper bound 5 / 6 A
! TNH-ANH2 : Upper bound 2.5 / 4.0 A
! TNH-AH2 : Upper bound 3 A

!imino-imino
assign ( resid  3 and name H1 ) ( resid 21 and name H3 ) 4.2 1.0 0.0
assign ( resid  5 and name H1 ) ( resid 21 and name H3 ) 4.2 1.0 0.0
assign ( resid  5 and name H1 ) ( resid 19 and name H3 ) 4.2 1.0 0.0
assign ( resid  7 and name H3 ) ( resid 17 and name H1 ) 4.2 1.0 0.0
assign ( resid  9 and name H3 ) ( resid 17 and name H1 ) 4.2 1.0 0.0
assign ( resid  9 and name H3 ) ( resid 10 and name H1 ) 4.2 1.0 0.0 !vw

!====================================================================
!imino-others
assign ( resid  9 and name H3 ) ( resid  8 and name H42) 4.0 1.0 1.0
assign ( resid  9 and name H3 ) ( resid  8 and name H41) 5.0 1.0 1.0
assign ( resid  9 and name H3 ) ( resid 15 and name H42) 4.0 1.0 1.0 !vw
assign ( resid  9 and name H3 ) ( resid 15 and name H41) 5.0 1.0 1.0
assign ( resid  9 and name H3 ) ( resid 16 and name H62) 5.0 5.0 0.0
assign ( resid  9 and name H3 ) ( resid 16 and name H61) 4.0 1.0 0.0
assign ( resid  9 and name H3 ) ( resid 16 and name H2 ) 3.0 1.0 0.0

assign ( resid 21 and name H3 ) ( resid  4 and name H2 ) 3.0 1.0 0.0
assign ( resid 21 and name H3 ) ( resid  4 and name H62) 2.5 1.0 0.0
assign ( resid 21 and name H3 ) ( resid  4 and name H61) 4.0 1.0 0.0
assign ( resid 21 and name H3 ) ( resid 20 and name H42) 4.0 1.0 1.0
assign ( resid 21 and name H3 ) ( resid 20 and name H41) 5.0 1.0 1.0 !vvw
assign ( resid 21 and name H3 ) ( resid 22 and name H42) 4.0 1.0 1.0 !vw
assign ( resid 21 and name H3 ) ( resid 22 and name H41) 5.0 1.0 1.0 !vvw

assign ( resid 19 and name H3 ) ( resid  6 and name H2 ) 3.0 1.0 0.0
assign ( resid 19 and name H3 ) ( resid  6 and name H62) 2.5 1.0 0.0 !??
assign ( resid 19 and name H3 ) ( resid  6 and name H61) 4.0 1.0 0.0 !??
assign ( resid 19 and name H3 ) ( resid 20 and name H42) 4.0 1.0 1.0
assign ( resid 19 and name H3 ) ( resid 20 and name H41) 5.0 1.0 1.0

!assign ( resid  7 and name H3 ) ( resid 18 and name H61) 2.5 1.0 0.0 !!?
assign ( resid  7 and name H3 ) ( resid 18 and name H2 ) 4.0 1.0 0.0
assign ( resid  7 and name H3 ) ( resid  8 and name H42) 4.0 1.0 1.0
assign ( resid  7 and name H3 ) ( resid  8 and name H41) 5.0 1.0 1.0

assign ( resid 14 and name H1 ) ( resid 11 and name H42) 2.5 1.0 0.0
assign ( resid 14 and name H1 ) ( resid 11 and name H41) 4.0 1.0 0.0

assign ( resid  3 and name H1 ) ( resid 22 and name H42) 2.5 1.0 0.0
assign ( resid  3 and name H1 ) ( resid  4 and name H2 ) 4.0 1.0 1.0
assign ( resid  3 and name H1 ) ( resid 22 and name H41) 4.0 1.0 0.0
assign ( resid  3 and name H1 ) ( resid 22 and name H5 ) 5.0 1.0 1.0

assign ( resid 10 and name H1 ) ( resid 15 and name H42) 2.5 1.0 0.0
assign ( resid 10 and name H1 ) ( resid 16 and name H2 ) 4.0 1.0 1.0
assign ( resid 10 and name H1 ) ( resid 15 and name H41) 4.0 1.0 0.0
assign ( resid 10 and name H1 ) ( resid 11 and name H5 ) 5.0 1.0 1.0

assign ( resid  5 and name H1 ) ( resid 20 and name H42) 2.5 1.0 0.0
assign ( resid  5 and name H1 ) ( resid  6 and name H2 ) 4.0 1.0 1.0
assign ( resid  5 and name H1 ) ( resid  4 and name H2 ) 4.0 1.0 1.0
assign ( resid  5 and name H1 ) ( resid 20 and name H41) 4.0 1.0 0.0
assign ( resid  5 and name H1 ) ( resid 20 and name H5 ) 5.0 1.0 1.0

assign ( resid 17 and name H1 ) ( resid  8 and name H42) 2.5 1.0 0.0
assign ( resid 17 and name H1 ) ( resid 18 and name H2 ) 4.0 1.0 1.0  
assign ( resid 17 and name H1 ) ( resid  8 and name H41) 4.0 1.0 0.0  

!assign ( resid 17 and name H1 ) ( resid 18 and name H61) 4.0 4.0 0.0 !
!assign ( resid 17 and name H1 ) ( resid 16 and name H61) 6.0 6.0 0.0 !
!assign ( resid 17 and name H1 ) ( resid 18 and name H1') 6.0 6.0 0.0 !
noe.tbl0100644000076500007640000005612307552011304011365 0ustar  shbaeusers set echo=off message=off end
!=========================================================================
! w:weak, m:medium, s:strong, a:absent, ov:overlap
! strong   : 1.5 - 3.0 [2.0  0.5  1.0]
! medium   : 2.0 - 4.0 [3.0  1.0  1.0]
! weak     : 3.0 - 5.0 [4.0  1.0  1.0]
! very weak  : 4.0 - 6.0 [5.0  1.0  1.0]
! absent but there : 5.0 - 6.0 [6.0  1.0  1.0]
!=========================================================================
!i H8/H6 - H1' < 5
 assign (resid  1 and name H8   ) (resid  1 and name H1'  )  3.4  0.5  0.5
 assign (resid  2 and name H6   ) (resid  2 and name H1'  )  3.5  1.0  1.0 !m
 assign (resid  3 and name H8   ) (resid  3 and name H1'  )  5.0  2.0  0.0 !vw
 assign (resid  4 and name H8   ) (resid  4 and name H1'  )  4.6  1.6  0.6
 assign (resid  5 and name H8   ) (resid  5 and name H1'  )  3.2  0.5  1.0
 assign (resid  6 and name H8   ) (resid  6 and name H1'  )  4.1  0.8  0.8
 assign (resid  7 and name H6   ) (resid  7 and name H1'  )  4.5  1.0  1.0
 assign (resid  8 and name H6   ) (resid  8 and name H1'  )  5.0  2.0  0.0 !ov
 assign (resid  9 and name H6   ) (resid  9 and name H1'  )  3.8  0.6  0.6
 assign (resid 10 and name H8   ) (resid 10 and name H1'  )  5.0  2.0  0.0 !vw
 assign (resid 11 and name H6   ) (resid 11 and name H1'  )  4.7  1.3  1.3
 assign (resid 12 and name H8   ) (resid 12 and name H1'  )  3.4  0.5  0.5

 assign (resid 13 and name H6   ) (resid 13 and name H1'  )  3.0  0.5  1.0
 assign (resid 14 and name H8   ) (resid 14 and name H1'  )  5.0  2.0  0.0 !ov
 assign (resid 15 and name H6   ) (resid 15 and name H1'  )  4.0  0.6  0.6
 assign (resid 16 and name H8   ) (resid 16 and name H1'  )  4.1  0.5  0.5
 assign (resid 17 and name H8   ) (resid 17 and name H1'  )  4.8  1.4  0.7
 assign (resid 18 and name H8   ) (resid 18 and name H1'  )  3.2  0.5  1.0
 assign (resid 19 and name H6   ) (resid 19 and name H1'  )  4.1  0.9  0.9
 assign (resid 20 and name H6   ) (resid 20 and name H1'  )  5.0  2.0  0.0 !ov,m
 assign (resid 21 and name H6   ) (resid 21 and name H1'  )  5.0  2.0  0.0 !ov,m
 assign (resid 22 and name H6   ) (resid 22 and name H1'  )  5.0  2.0  0.0 !ov
 assign (resid 23 and name H8   ) (resid 23 and name H1'  )  5.0  2.0  0.0 !w
 assign (resid 24 and name H6   ) (resid 24 and name H1'  )  4.3  1.0  0.5

!s H8/H6 - H1'
 assign (resid  2 and name H6   ) (resid  1 and name H1'  )  4.0  1.0  1.0 !w
 assign (resid  3 and name H8   ) (resid  2 and name H1'  )  6.0  3.0  0.0 !a
 assign (resid  4 and name H8   ) (resid  3 and name H1'  )  4.9  1.9  0.8 !vw
 assign (resid  5 and name H8   ) (resid  4 and name H1'  )  6.0  3.0  0.0 !ov
 assign (resid  6 and name H8   ) (resid  5 and name H1'  )  3.3  0.5  0.5
 assign (resid  7 and name H6   ) (resid  6 and name H1'  )  4.2  1.4  0.9
 assign (resid  8 and name H6   ) (resid  7 and name H1'  )  6.0  3.0  0.0 !ov
 assign (resid  9 and name H6   ) (resid  8 and name H1'  )  5.0  2.0  1.0 !w
 assign (resid 10 and name H8   ) (resid  9 and name H1'  )  5.7  2.7  1.1 !vw
 assign (resid 11 and name H6   ) (resid 10 and name H1'  )  3.6  0.6  0.5 !ov,m
 assign (resid 12 and name H8   ) (resid 11 and name H1'  )  6.0  3.0  0.0 !ov

 assign (resid 14 and name H8   ) (resid 13 and name H1'  )  6.0  3.0  0.0 !a
 assign (resid 15 and name H6   ) (resid 14 and name H1'  )  3.1  0.5  0.5
 assign (resid 16 and name H8   ) (resid 15 and name H1'  )  5.0  2.0  1.0 !vw
 assign (resid 17 and name H8   ) (resid 16 and name H1'  )  6.0  3.0  0.0 !ov
 assign (resid 18 and name H8   ) (resid 17 and name H1'  )  3.0  0.5  0.5
 assign (resid 19 and name H6   ) (resid 18 and name H1'  )  3.9  0.7  0.7
 assign (resid 20 and name H6   ) (resid 19 and name H1'  )  3.9  0.7  0.7
 assign (resid 21 and name H6   ) (resid 20 and name H1'  )  6.0  3.0  0.0 !ov
 assign (resid 22 and name H6   ) (resid 21 and name H1'  )  6.0  3.0  0.0 !ov
 assign (resid 23 and name H8   ) (resid 22 and name H1'  )  5.3  2.5  0.5 !vw
 assign (resid 24 and name H6   ) (resid 23 and name H1'  )  6.0  3.0  0.0 !ov

!s base - base
!v,vw 4.5-6
 assign (resid  3 and name H8   ) (resid  2 and name H6   )  6.0  2.0  0.0 !a
 assign (resid  5 and name H8   ) (resid  4 and name H8   )  6.0  2.0  0.0 !a
 assign (resid  6 and name H8   ) (resid  5 and name H8   )  6.0  2.0  0.0 !w
 assign (resid  7 and name H6   ) (resid  6 and name H8   )  4.4  0.6  0.6
 assign (resid  8 and name H6   ) (resid  7 and name H6   )  6.0  2.0  0.0 !w
 assign (resid  9 and name H6   ) (resid  8 and name H6   )  5.7  1.5  0.5
 assign (resid 10 and name H8   ) (resid  9 and name H6   )  6.0  2.0  0.0 !vw
 assign (resid 11 and name H6   ) (resid 10 and name H8   )  6.0  2.0  0.0 !vw
 assign (resid 15 and name H6   ) (resid 14 and name H8   )  6.0  2.0  0.0 !a
 assign (resid 17 and name H8   ) (resid 16 and name H8   )  6.0  2.0  0.0 !a
 assign (resid 18 and name H8   ) (resid 17 and name H8   )  6.0  2.0  0.0 !vw
 assign (resid 19 and name H6   ) (resid 18 and name H8   )  5.0  1.5  0.9
 assign (resid 20 and name H6   ) (resid 19 and name H6   )  6.0  2.0  0.0 !a
 assign (resid 21 and name H6   ) (resid 20 and name H6   )  6.0  2.0  0.0 !vw
 assign (resid 23 and name H8   ) (resid 22 and name H6   )  6.0  2.0  0.0 !a
 assign (resid 24 and name H6   ) (resid 23 and name H8   )  6.0  2.0  0.0 !a

 assign (resid  8 and name H5   ) (resid  7 and name H6   )  4.3  1.5  1.0
 assign (resid 11 and name H5   ) (resid 10 and name H8   )  4.4  1.0  0.5 !w
 assign (resid 15 and name H5   ) (resid 14 and name H8   )  5.0  1.5  1.0 !vw
 assign (resid 20 and name H5   ) (resid 19 and name H6   )  4.5  1.5  0.9
 assign (resid 22 and name H5   ) (resid 21 and name H6   )  3.4  0.5  1.0
 assign (resid 24 and name H5   ) (resid 23 and name H8   )  5.0  1.5  1.0 !vw

!l Ade-H2
 assign (resid  4 and name H2   ) (resid  5 and name H1'  )  4.7  0.5  1.0 !vw
 assign (resid  4 and name H2   ) (resid 22 and name H1'  )  4.0  0.5  1.0 !w
 assign (resid  6 and name H2   ) (resid  6 and name H1'  )  4.2  0.5  0.5 !vw
 assign (resid  6 and name H2   ) (resid  7 and name H1'  )  4.0  1.0  1.0 !w,ov
 assign (resid  6 and name H2   ) (resid 20 and name H1'  )  5.0  1.5  1.0 !vw,ov
 assign (resid 18 and name H2   ) (resid  8 and name H1'  )  5.0  1.5  1.0 !w,ov
 assign (resid 18 and name H2   ) (resid 19 and name H1'  )  4.3  0.5  1.0 !vw

!=========================================================================
!i H8/H6 - H2'
 assign (resid  1 and name H2'  ) (resid  1 and name H8   )  2.0  1.0  1.0 !s
 assign (resid  2 and name H2'  ) (resid  2 and name H6   )  1.9  0.5  1.0
 assign (resid  3 and name H2'  ) (resid  3 and name H8   )  2.0  1.0  1.0 !ov,a
 assign (resid  4 and name H2'  ) (resid  4 and name H8   )  2.2  0.5  0.5
 assign (resid  5 and name H2'  ) (resid  5 and name H8   )  2.0  1.0  1.0 !s
 assign (resid  6 and name H2'  ) (resid  6 and name H8   )  2.0  1.0  1.0 !s
 assign (resid  7 and name H2'  ) (resid  7 and name H6   )  1.9  0.5  0.5
 assign (resid  8 and name H2'  ) (resid  8 and name H6   )  2.0  1.0  1.0 !s
 assign (resid  9 and name H2'  ) (resid  9 and name H6   )  2.0  1.0  1.0 !s
 assign (resid 10 and name H2'  ) (resid 10 and name H8   )  2.0  1.0  1.0 !s
 assign (resid 11 and name H2'  ) (resid 11 and name H6   )  2.0  1.0  1.0 !s
 assign (resid 12 and name H2'  ) (resid 12 and name H8   )  2.0  1.0  1.0 !s

 assign (resid 13 and name H2'  ) (resid 13 and name H6   )  2.2  0.5  0.5
 assign (resid 14 and name H2'  ) (resid 14 and name H8   )  2.0  1.0  1.0 !s
 assign (resid 15 and name H2'  ) (resid 15 and name H6   )  2.1  0.5  0.5
 assign (resid 16 and name H2'  ) (resid 16 and name H8   )  2.1  0.5  0.5
 assign (resid 17 and name H2'  ) (resid 17 and name H8   )  2.2  0.5  0.5
 assign (resid 18 and name H2'  ) (resid 18 and name H8   )  2.0  1.0  1.0 !s
 assign (resid 19 and name H2'  ) (resid 19 and name H6   )  1.9  0.5  0.5
 assign (resid 20 and name H2'  ) (resid 20 and name H6   )  2.0  1.0  1.0 !s 
 assign (resid 21 and name H2'  ) (resid 21 and name H6   )  1.9  0.5  1.0
 assign (resid 22 and name H2'  ) (resid 22 and name H6   )  2.0  1.0  1.0 !s
 assign (resid 23 and name H2'  ) (resid 23 and name H8   )  2.0  1.0  1.0 !s
 assign (resid 24 and name H2'  ) (resid 24 and name H6   )  2.0  1.0  1.0 !s

!i H8/H6 - H2'' 
 assign (resid  1 and name H2'' ) (resid  1 and name H8   )  4.5  1.5  0.0 !ov
 assign (resid  2 and name H2'' ) (resid  2 and name H6   )  4.0  1.0  1.0
 assign (resid  3 and name H2'' ) (resid  3 and name H8   )  4.5  1.5  0.0 !ov
 assign (resid  4 and name H2'' ) (resid  4 and name H8   )  4.1  0.9  0.9
 assign (resid  5 and name H2'' ) (resid  5 and name H8   )  4.5  1.5  0.0 !w
 assign (resid  6 and name H2'' ) (resid  6 and name H8   )  3.7  0.9  0.9
 assign (resid  7 and name H2'' ) (resid  7 and name H6   )  3.0  1.0  1.0
 assign (resid  8 and name H2'' ) (resid  8 and name H6   )  3.0  1.0  1.0 !m,ov
 assign (resid  9 and name H2'' ) (resid  9 and name H6   )  2.3  0.5  1.0
 assign (resid 10 and name H2'' ) (resid 10 and name H8   )  3.0  1.0  1.0 !m.ov
 assign (resid 11 and name H2'' ) (resid 11 and name H6   )  2.7  0.5  1.0
 assign (resid 12 and name H2'' ) (resid 12 and name H8   )  3.0  1.0  1.0 !m,ov

 assign (resid 13 and name H2'' ) (resid 13 and name H6   )  4.8  1.0  0.5
 assign (resid 14 and name H2'' ) (resid 14 and name H8   )  3.0  1.0  1.0 !m,ov
 assign (resid 15 and name H2'' ) (resid 15 and name H6   )  4.0  1.0  0.5
 assign (resid 16 and name H2'' ) (resid 16 and name H8   )  4.1  1.0  0.5
 assign (resid 17 and name H2'' ) (resid 17 and name H8   )  3.0  1.0  1.0 !m,ov
 assign (resid 18 and name H2'' ) (resid 18 and name H8   )  3.0  0.5  1.0
 assign (resid 19 and name H2'' ) (resid 19 and name H6   )  4.2  1.4  0.7
 assign (resid 20 and name H2'' ) (resid 20 and name H6   )  3.0  1.0  1.0 !m,ov
 assign (resid 21 and name H2'' ) (resid 21 and name H6   )  3.3  0.9  0.9
 assign (resid 22 and name H2'' ) (resid 22 and name H6   )  3.5  1.2  1.2
 assign (resid 23 and name H2'' ) (resid 23 and name H8   )  3.0  1.0  1.0 !m,ov
 assign (resid 24 and name H2'' ) (resid 24 and name H6   )  3.0  1.0  1.0

!s H8/H6 - H2'
 assign (resid  2 and name H6   ) (resid  1 and name H2'  )  4.5  2.0  0.0 !ov
 assign (resid  3 and name H8   ) (resid  2 and name H2'  )  4.5  2.0  0.0 !a
 assign (resid  4 and name H8   ) (resid  3 and name H2'  )  4.5  2.0  0.0 !ov
 assign (resid  5 and name H8   ) (resid  4 and name H2'  )  4.5  2.0  0.0 !w
 assign (resid  6 and name H8   ) (resid  5 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid  7 and name H6   ) (resid  6 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid  8 and name H6   ) (resid  7 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid  9 and name H6   ) (resid  8 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid 10 and name H8   ) (resid  9 and name H2'  )  3.4  1.0  0.5 
 assign (resid 11 and name H6   ) (resid 10 and name H2'  )  4.5  2.0  0.0 !ov
 assign (resid 12 and name H8   ) (resid 11 and name H2'  )  3.5  1.0  0.5 

 assign (resid 14 and name H8   ) (resid 13 and name H2'  )  4.5  2.3  0.7 !a,vw
 assign (resid 15 and name H6   ) (resid 14 and name H2'  )  4.5  2.0  0.0 !a,vw
 assign (resid 16 and name H8   ) (resid 15 and name H2'  )  4.0  1.5  0.5 !vw
 assign (resid 17 and name H8   ) (resid 16 and name H2'  )  4.5  2.0  0.0 !ov
 assign (resid 18 and name H8   ) (resid 17 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid 19 and name H6   ) (resid 18 and name H2'  )  3.4  1.2  0.8
 assign (resid 20 and name H6   ) (resid 19 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid 21 and name H6   ) (resid 20 and name H2'  )  4.5  2.0  0.0 !ov
 assign (resid 22 and name H6   ) (resid 21 and name H2'  )  4.5  2.0  0.0 !ov,m
 assign (resid 23 and name H8   ) (resid 22 and name H2'  )  4.4  2.0  0.7
 assign (resid 24 and name H6   ) (resid 23 and name H2'  )  4.5  2.0  0.0 !a

!s H8/H6 - H2''
 assign (resid  2 and name H6   ) (resid  1 and name H2'' )  2.7  0.6  0.3
 assign (resid  3 and name H8   ) (resid  2 and name H2'' )  3.5  2.0  0.0 !a
 assign (resid  4 and name H8   ) (resid  3 and name H2'' )  3.5  2.0  0.0 !a
 assign (resid  5 and name H8   ) (resid  4 and name H2'' )  3.5  2.0  0.0 !a
 assign (resid  6 and name H8   ) (resid  5 and name H2'' )  2.1  0.3  0.3 !s
 assign (resid  7 and name H6   ) (resid  6 and name H2'' )  2.3  0.6  0.3
 assign (resid  8 and name H6   ) (resid  7 and name H2'' )  2.0  1.0  1.0 !s
 assign (resid  9 and name H6   ) (resid  8 and name H2'' )  2.3  0.3  0.3
 assign (resid 10 and name H8   ) (resid  9 and name H2'' )  2.9  0.6  0.3 !w
 assign (resid 11 and name H6   ) (resid 10 and name H2'' )  2.3  0.3  0.3
 assign (resid 12 and name H8   ) (resid 11 and name H2'' )  3.5  2.0  0.0 !a

 assign (resid 14 and name H8   ) (resid 13 and name H2'' )  2.7  0.6  0.3 !w
 assign (resid 15 and name H6   ) (resid 14 and name H2'' )  2.6  0.6  0.3
 assign (resid 16 and name H8   ) (resid 15 and name H2'' )  3.2  0.9  0.3
 assign (resid 17 and name H8   ) (resid 16 and name H2'' )  2.6  0.6  0.3
 assign (resid 18 and name H8   ) (resid 17 and name H2'' )  2.0  1.0  1.0 !s
 assign (resid 19 and name H6   ) (resid 18 and name H2'' )  2.2  0.3  0.6
 assign (resid 20 and name H6   ) (resid 19 and name H2'' )  2.0  1.0  1.0 !ov,s
 assign (resid 21 and name H6   ) (resid 20 and name H2'' )  2.3  0.3  0.3
 assign (resid 22 and name H6   ) (resid 21 and name H2'' )  2.5  0.6  0.3 !s
 assign (resid 23 and name H8   ) (resid 22 and name H2'' )  3.5  2.0  0.0 !a
 assign (resid 24 and name H6   ) (resid 23 and name H2'' )  3.5  1.5  0.0 !a

!=========================================================================
!i H8/H6 - H3'
 assign (resid  1 and name H3'  ) (resid  1 and name H8   )  5.5  2.0  0.0 !a
 assign (resid  2 and name H3'  ) (resid  2 and name H6   )  3.5  0.5  1.0
 assign (resid  3 and name H3'  ) (resid  3 and name H8   )  5.5  2.0  0.0 !a
 assign (resid  4 and name H3'  ) (resid  4 and name H8   )  5.1  1.6  1.1 !a
 assign (resid  5 and name H3'  ) (resid  5 and name H8   )  5.5  2.0  0.0 !a
 assign (resid  6 and name H3'  ) (resid  6 and name H8   )  4.2  1.0  1.0 !w
 assign (resid  7 and name H3'  ) (resid  7 and name H6   )  4.0  0.9  0.9
 assign (resid  8 and name H3'  ) (resid  8 and name H6   )  3.7  0.7  0.7
 assign (resid  9 and name H3'  ) (resid  9 and name H6   )  4.3  1.0  1.0
 assign (resid 10 and name H3'  ) (resid 10 and name H8   )  4.8  1.5  1.0
 assign (resid 11 and name H3'  ) (resid 11 and name H6   )  4.1  0.9  0.9
 assign (resid 12 and name H3'  ) (resid 12 and name H8   )  5.5  2.0  0.0 !a
 assign (resid 13 and name H3'  ) (resid 13 and name H6   )  4.6  1.4  1.4 !a
 assign (resid 14 and name H3'  ) (resid 14 and name H8   )  5.5  2.0  0.0 !a
 assign (resid 15 and name H3'  ) (resid 15 and name H6   )  4.6  1.0  1.0
 assign (resid 16 and name H3'  ) (resid 16 and name H8   )  4.4  1.0  1.0
 assign (resid 17 and name H3'  ) (resid 17 and name H8   )  5.5  2.0  0.0 !a
 assign (resid 18 and name H3'  ) (resid 18 and name H8   )  2.7  0.5  1.2
 assign (resid 19 and name H3'  ) (resid 19 and name H6   )  4.1  1.0  1.0
 assign (resid 20 and name H3'  ) (resid 20 and name H6   )  3.0  0.5  1.0
 assign (resid 21 and name H3'  ) (resid 21 and name H6   )  4.0  1.1  1.1
 assign (resid 22 and name H3'  ) (resid 22 and name H6   )  3.8  0.6  0.6
 assign (resid 23 and name H3'  ) (resid 23 and name H8   )  4.4  0.6  0.6
 assign (resid 24 and name H3'  ) (resid 24 and name H6   )  5.5  2.5  0.0 !a

!s H8/H6 - H3'
!w/vw 4.5-6.0
 assign (resid  2 and name H6   ) (resid  1 and name H3'  )  6.2  2.0  0.0 !a
 assign (resid  3 and name H8   ) (resid  2 and name H3'  )  3.6  0.5  1.0
 assign (resid  4 and name H8   ) (resid  3 and name H3'  )  5.0  1.0  1.0 !w
 assign (resid  5 and name H8   ) (resid  4 and name H3'  )  6.0  2.0  0.0 !a
 assign (resid  6 and name H8   ) (resid  5 and name H3'  )  4.7  1.3  1.3
 assign (resid  7 and name H6   ) (resid  6 and name H3'  )  4.4  1.0  1.0
 assign (resid  8 and name H6   ) (resid  7 and name H3'  )  4.5  1.0  1.0 !m
 assign (resid  9 and name H6   ) (resid  8 and name H3'  )  4.5  0.9  0.9 !m
 assign (resid 10 and name H8   ) (resid  9 and name H3'  )  3.9  0.5  1.0
 assign (resid 11 and name H6   ) (resid 10 and name H3'  )  5.3  1.1  1.1
 assign (resid 12 and name H8   ) (resid 11 and name H3'  )  6.0  2.0  0.0 !vw

 assign (resid 14 and name H8   ) (resid 13 and name H3'  )  5.6  1.6  1.1
 assign (resid 15 and name H6   ) (resid 14 and name H3'  )  4.7  0.8  0.8
 assign (resid 16 and name H8   ) (resid 15 and name H3'  )  5.7  0.8  0.8
 assign (resid 17 and name H8   ) (resid 16 and name H3'  )  5.0  1.0  1.0 !w
 assign (resid 18 and name H8   ) (resid 17 and name H3'  )  4.5  1.0  1.0 !m
 assign (resid 19 and name H6   ) (resid 18 and name H3'  )  5.0  1.0  1.0
 assign (resid 20 and name H6   ) (resid 19 and name H3'  )  4.5  1.0  1.0 !m
 assign (resid 21 and name H6   ) (resid 20 and name H3'  )  4.5  1.0  1.0 !m
 assign (resid 22 and name H6   ) (resid 21 and name H3'  )  4.5  1.0  1.0 !m
 assign (resid 23 and name H8   ) (resid 22 and name H3'  )  4.2  0.5  1.0
 assign (resid 24 and name H6   ) (resid 23 and name H3'  )  6.0  2.0  0.0 !a

!=========================================================================
!H8/H6 - H4'/H5'/H5''
 assign (resid  7 and name H6   ) (resid  6 and name H4'  )  4.9  0.7  1.4
 assign (resid 11 and name H6   ) (resid 10 and name H4'  )  6.0  1.5  0.5
 assign (resid 15 and name H6   ) (resid 14 and name H4'  )  6.0  1.5  0.5
 assign (resid 19 and name H6   ) (resid 18 and name H4'  )  4.7  1.3  2.0

!assign (resid  2 and name H6   ) (resid  2 and name H4'  )  3.7  0.5  0.5
!assign (resid  2 and name H6   ) (resid  2 and name H5'' )  4.7  1.8  1.8
!assign (resid  6 and name H8   ) (resid  6 and name H4'  )  4.9  0.7  0.7
!assign (resid  6 and name H8   ) (resid  6 and name H5'  )  3.5  1.3  1.3
!assign (resid  6 and name H8   ) (resid  6 and name H5'' )  4.0  1.0  1.0
!assign (resid  6 and name H8   ) (resid  6 and name H5'' )  3.2  0.5  0.5
!assign (resid  7 and name H6   ) (resid  7 and name H5'  )  3.2  0.5  0.5
!assign (resid  7 and name H6   ) (resid  7 and name H4'  )  5.0  0.8  0.8
!assign (resid  9 and name H6   ) (resid  9 and name H4'  )  5.3  1.0  1.0
!assign (resid  9 and name H6   ) (resid  9 and name H5'' )  3.5  0.5  0.5
!assign (resid 10 and name H4'  ) (resid 10 and name H8   )  5.6  0.7  0.7
!assign (resid 11 and name H6   ) (resid 11 and name H4'  )  5.0  1.0  1.0
!assign (resid 11 and name H6   ) (resid 11 and name H5'' )  3.0  0.5  0.5
!assign (resid 13 and name H5'' ) (resid 13 and name H6   )  3.1  0.5  0.5
!assign (resid 15 and name H6   ) (resid 15 and name H5'' )  5.0  1.0  0.0
!assign (resid 18 and name H8   ) (resid 18 and name H5'' )  3.1  0.5  0.5
!assign (resid 19 and name H6   ) (resid 19 and name H5'  )  4.6  1.4  1.4
!assign (resid 19 and name H6   ) (resid 19 and name H4'  )  5.0  0.9  0.9
!assign (resid 21 and name H6   ) (resid 21 and name H4'  )  5.0  1.0  1.0
!assign (resid 21 and name H6   ) (resid 21 and name H5'' )  3.5  0.5  0.5
!assign (resid 22 and name H6   ) (resid 22 and name H5'' )  3.0  0.5  0.5

!=========================================================================
!seq H1'-H1'
 assign (resid  5 and name H1'  ) (resid  6 and name H1'  )  6.0  1.5  0.0
 assign (resid 17 and name H1'  ) (resid 18 and name H1'  )  6.0  1.5  0.0
 assign (resid 18 and name H1'  ) (resid 19 and name H1'  )  6.0  1.5  0.0

!seq H1'-H3'
 assign (resid  7 and name H3'  ) (resid  6 and name H1'  )  4.8  0.5  0.5
 assign (resid 11 and name H3'  ) (resid 10 and name H1'  )  4.4  0.5  1.0
 assign (resid 19 and name H3'  ) (resid 18 and name H1'  )  4.4  0.5  1.0

!=========================================================================
!H5 - H1'/H2'/H2''
 assign (resid  8 and name H5   ) (resid  7 and name H1'  )  4.0  1.0  1.0 !ov,w
 assign (resid 11 and name H5   ) (resid 10 and name H1'  )  4.0  1.0  1.0 !w
 assign (resid 15 and name H5   ) (resid 14 and name H1'  )  4.0  1.0  1.0 !w
 assign (resid 20 and name H5   ) (resid 19 and name H1'  )  4.0  1.0  1.0 !w
 assign (resid 22 and name H5   ) (resid 21 and name H1'  )  4.0  1.0  1.0 !ov,w
 assign (resid 24 and name H5   ) (resid 23 and name H1'  )  4.0  1.0  1.0 !ov,w

 assign (resid  2 and name H5   ) (resid  1 and name H2'' )  2.5  0.5  0.5
 assign (resid  8 and name H5   ) (resid  7 and name H2'' )  2.2  0.5  1.0
 assign (resid 11 and name H5   ) (resid 10 and name H2'' )  2.5  0.5  1.0
 assign (resid 15 and name H5   ) (resid 14 and name H2'' )  3.2  1.0  0.5
 assign (resid 20 and name H5   ) (resid 19 and name H2'' )  2.8  0.5  1.0
 assign (resid 24 and name H5   ) (resid 23 and name H2'' )  3.1  1.0  0.5

!s H1' - H5'
 assign (resid  2 and name H1'  ) (resid  3 and name H5'  )  2.0  1.0  1.5 !a
 assign (resid  3 and name H1'  ) (resid  4 and name H5'  )  3.1  1.0  0.5
 assign (resid  4 and name H1'  ) (resid  5 and name H5'  )  2.0  1.0  1.5 !s,ov
 assign (resid  5 and name H1'  ) (resid  6 and name H5'  )  2.9  1.0  0.5
 assign (resid  6 and name H1'  ) (resid  7 and name H5'  )  2.0  1.0  1.5 !s,ov
 assign (resid  9 and name H1'  ) (resid 10 and name H5'  )  2.0  1.0  1.5 !s
 assign (resid 10 and name H1'  ) (resid 11 and name H5'  )  2.0  1.0  1.5 !s
 assign (resid 11 and name H1'  ) (resid 12 and name H5'  )  2.0  1.0  1.5 !s
 assign (resid 13 and name H1'  ) (resid 14 and name H5'  )  2.0  1.0  1.5 !w
 assign (resid 14 and name H1'  ) (resid 15 and name H5'  )  2.8  1.0  0.5 
 assign (resid 15 and name H1'  ) (resid 16 and name H5'  )  2.0  1.0  1.5 !a
 assign (resid 16 and name H1'  ) (resid 17 and name H5'  )  2.7  1.0  1.0 
 assign (resid 17 and name H1'  ) (resid 18 and name H5'  )  2.6  1.0  0.5
 assign (resid 18 and name H1'  ) (resid 19 and name H5'  )  2.0  1.0  1.5 !s
 assign (resid 19 and name H1'  ) (resid 20 and name H5'  )  2.0  1.0  1.5 !s
 assign (resid 22 and name H1'  ) (resid 23 and name H5'  )  2.0  1.0  1.5 !s,ov
 assign (resid 23 and name H1'  ) (resid 24 and name H5'  )  2.0  1.0  1.5 !s,ov

!s H1' - H5''
 assign (resid  5 and name H1'  ) (resid  6 and name H5'' )  3.3  0.5  1.0
 assign (resid  6 and name H1'  ) (resid  7 and name H5'' )  3.0  1.0  1.5 !ov,m
 assign (resid  7 and name H1'  ) (resid  8 and name H5'' )  5.0  2.0  0.0 !ov
 assign (resid  8 and name H1'  ) (resid  9 and name H5'' )  5.0  2.0  0.0 !ov
 assign (resid  9 and name H1'  ) (resid 10 and name H5'' )  3.1  0.5  0.5 !w
 assign (resid 10 and name H1'  ) (resid 11 and name H5'' )  4.0  1.0  1.0 !w
 assign (resid 11 and name H1'  ) (resid 12 and name H5'' )  4.0  1.0  1.0 !vw

 assign (resid 13 and name H1'  ) (resid 14 and name H5'' )  3.4  0.5  1.0 !vw
 assign (resid 14 and name H1'  ) (resid 15 and name H5'' )  4.0  1.0  1.0 !vw
 assign (resid 16 and name H1'  ) (resid 17 and name H5'' )  5.0  2.0  0.0 !ov
 assign (resid 17 and name H1'  ) (resid 18 and name H5'' )  2.8  0.5  0.5
 assign (resid 18 and name H1'  ) (resid 19 and name H5'' )  3.0  1.0  1.0 !ov,m
 assign (resid 20 and name H1'  ) (resid 21 and name H5'' )  5.0  2.0  0.0 !ov
 assign (resid 22 and name H1'  ) (resid 23 and name H5'' )  3.0  1.0  1.0 !m

!s H2' - H5''
 assign (resid  5 and name H2'  ) (resid  6 and name H5'  )  3.7  0.8  1.2
 assign (resid 17 and name H2'  ) (resid 18 and name H5'  )  3.4  0.5  1.0

!s H2'' - H2' (landmark of B-DNA)
 assign (resid  6 and name H2'' ) (resid  7 and name H2'  )  6.0  2.5  0.0 !vw
 assign (resid 10 and name H2'' ) (resid 11 and name H2'  )  6.0  2.5  0.0 !vw

 set echo=on message=on end
sani.tbl0100644000076500007640000002063307611223261011536 0ustar  shbaeusers! NOTE : terminal residues are excluded

!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 C1' )
!       ( resid 1    and name H1' )  0.00  1.00

!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 C4' )
!       ( resid 1    and name H4' )  0.00  1.00

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 C5  )
       ( resid 2    and name H5  )  -3.62  1.00

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 C6  )
       ( resid 2    and name H6  )  -3.31  1.00

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 C8  )
       ( resid 3    and name H8  )  -3.92  1.00

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 C2  )
       ( resid 4    and name H2  )  -1.06  1.00

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 C3' )
       ( resid 4    and name H3' )  1.82  1.00

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 C8  )
       ( resid 4    and name H8  )  -1.51  1.00

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 C2  )
       ( resid 6    and name H2  )  -5.28  1.00

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 C8  )
       ( resid 6    and name H8  )  -0.60  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 7    and name C6  )
       ( resid 7    and name H6  )  -5.72  1.00

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 C5  )
       ( resid 8    and name H5  )  2.27  1.00

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 C6  )
       ( resid 9    and name H6  )  -3.47  1.00

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 C8  )
       ( resid 10   and name H8  )  4.53  1.00

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 C5  )
       ( resid 11   and name H5  )  4.08  1.00

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 C6  )
       ( resid 11   and name H6  )  0.91  1.00

!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 C1' )
!       ( resid 12   and name H1' )  4.67  1.00

!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 C8  )
!       ( resid 12   and name H8  )  25.20  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 13   and name C1' )
!       ( resid 13   and name H1' )  0.46  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 13   and name C3' )
!       ( resid 13   and name H3' )  -2.10  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 13   and name C4' )
!       ( resid 13   and name H4' )  0.75  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 13   and name C5  )
!       ( resid 13   and name H5  )  1.36  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 14   and name C8  )
       ( resid 14   and name H8  )  0.45  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name C5  )
       ( resid 15   and name H5  )  -9.51  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 15   and name C6  )
       ( resid 15   and name H6  )  0.76  1.00

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 C3' )
       ( resid 16   and name H3' )  -2.87  1.00

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 C8  )
       ( resid 16   and name H8  )  -0.95  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name C2  )
       ( resid 18   and name H2  )  -1.80  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 18   and name C8  )
       ( resid 18   and name H8  )  -2.12  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 19   and name C6  )
       ( resid 19   and name H6  )  3.77  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name C3' )
       ( resid 20   and name H3' )  -2.71  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 20   and name C5  )
       ( resid 20   and name H5  )  4.22  1.00

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 C6  )
       ( resid 21   and name H6  )  -3.77  1.00

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 22   and name C5  )
       ( resid 22   and name H5  )  -2.73  1.00

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 C8  )
       ( resid 23   and name H8  )  10.70  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 24   and name C1' )
!       ( resid 24   and name H1' )  4.97  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 24   and name C4' )
!       ( resid 24   and name H4' )  -2.26  1.00

!assign ( resid 500  and name OO  )
!       ( resid 500  and name Z   )
!       ( resid 500  and name X   )
!       ( resid 500  and name Y   )
!       ( resid 24   and name C5  )
!       ( resid 24   and name H5  )  -6.79  1.00

methyl.tbl0100644000076500007640000000444607552223345012121 0ustar  shbaeusers!=========================================================================
!s Methyls (noe average = R-3)
 assign (resid  7 and name H7#  ) (resid  6 and name H1'  )  4.0  0.5  0.5
 assign (resid  7 and name H7#  ) (resid  6 and name H2'' )  4.0  0.5  0.5
 assign (resid  7 and name H7#  ) (resid  6 and name H3'  )  4.1  0.5  0.5
 assign (resid  7 and name H7#  ) (resid  6 and name H8   )  3.7  0.5  0.5
 assign (resid  7 and name H7#  ) (resid  8 and name H5   )  4.1  0.5  0.5

 assign (resid  9 and name H7#  ) (resid  8 and name H1'  )  4.3  0.5  0.5
 assign (resid  9 and name H7#  ) (resid  8 and name H2'' )  4.0  1.0  1.0 !w
 assign (resid  9 and name H7#  ) (resid  8 and name H3'  )  3.8  0.5  0.5
 assign (resid  9 and name H7#  ) (resid  8 and name H5   )  3.6  0.5  0.5
 assign (resid  9 and name H7#  ) (resid  8 and name H6   )  3.2  0.5  0.5

 assign (resid 19 and name H7#  ) (resid 18 and name H8   )  3.6  0.5  0.5
 assign (resid 19 and name H7#  ) (resid 18 and name H1'  )  5.2  0.8  0.8
 assign (resid 19 and name H7#  ) (resid 18 and name H2'' )  6.0  1.2  1.2
 assign (resid 19 and name H7#  ) (resid 18 and name H3'  )  4.3  0.5  0.5
 assign (resid 19 and name H7#  ) (resid 20 and name H5   )  4.2  0.5  0.5
 assign (resid 19 and name H7#  ) (resid 20 and name H6   )  4.7  1.0  1.0

 assign (resid 21 and name H7#  ) (resid 20 and name H1'  )  4.9  0.9  0.9
 assign (resid 21 and name H7#  ) (resid 20 and name H2'' )  4.0  1.0  1.0 !w
 assign (resid 21 and name H7#  ) (resid 20 and name H3'  )  3.9  0.5  0.5
 assign (resid 21 and name H7#  ) (resid 20 and name H5   )  3.9  0.5  0.5
 assign (resid 21 and name H7#  ) (resid 20 and name H6   )  3.7  0.5  0.5
 assign (resid 21 and name H7#  ) (resid 22 and name H5   )  5.1  1.4  1.4

!=========================================================================
!***** N6-Me A
assign (resid 17 and name H8   ) (resid 18 and name H7#  )  4.0  1.0  1.0
assign (resid 17 and name H1'  ) (resid 18 and name H7#  )  5.0  1.0  1.0
!assign (resid 19 and name H7#  ) (resid 18 and name H7#  )  6.0  1.0  1.0

! exchangeable NOEs in water NOESY
assign (resid 19 and name H3   ) (resid 18 and name H7#  )  5.0  1.0  1.0
assign (resid 17 and name H1   ) (resid 18 and name H7#  )  5.0  1.0  1.0
assign (resid  7 and name H3   ) (resid 18 and name H7#  )  4.0  1.0  1.0 !!?

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1   0.684 -20.253   7.674
    2   2H5*    G   1          2H5*        G   1   1.545 -21.653   7.007
    3    H4*    G   1           H4*        G   1   3.660 -20.195   7.442
    4    H3*    G   1           H3*        G   1   2.010 -18.284   8.413
    5    H1*    G   1           H1*        G   1   3.285 -18.162   4.785
    6    H8     G   1           H8         G   1  -0.515 -18.717   4.948
    7    H1     G   1           H1         G   1   2.068 -18.983  -0.915
    8   1H2     G   1          1H2         G   1   5.094 -18.768   0.746
    9   2H2     G   1          2H2         G   1   4.264 -18.902  -0.791
   10    H5T    G   1           H5T        G   1   2.510 -21.994   8.894
   11   1H2*    G   1          1H2*        G   1   0.718 -17.911   6.427
   12   2H2*    G   1          2H2*        G   1   1.989 -16.718   6.216
   13   1H5*    C   2          1H5*        C   2   4.951 -13.790   7.462
   14   2H5*    C   2          2H5*        C   2   3.342 -13.459   6.785
   15    H4*    C   2           H4*        C   2   5.965 -13.841   5.420
   16    H3*    C   2           H3*        C   2   4.653 -11.553   5.781
   17    H1*    C   2           H1*        C   2   3.967 -13.533   2.477
   18   1H4     C   2          1H4         C   2  -1.909 -16.454   3.397
   19   2H4     C   2          2H4         C   2  -1.811 -15.983   1.713
   20    H5     C   2           H5         C   2  -0.148 -15.943   5.001
   21    H6     C   2           H6         C   2   2.013 -14.862   5.302
   22   1H2*    C   2          1H2*        C   2   2.553 -12.151   4.789
   23   2H2*    C   2          2H2*        C   2   3.365 -11.431   3.407
   24   1H5*    G   3          1H5*        G   3   6.269 -12.585   1.732
   25   2H5*    G   3          2H5*        G   3   7.430 -11.357   1.187
   26    H4*    G   3           H4*        G   3   6.499 -12.604  -0.677
   27    H3*    G   3           H3*        G   3   6.810  -9.908  -0.740
   28    H1*    G   3           H1*        G   3   3.704 -11.641  -2.032
   29    H8     G   3           H8         G   3   2.824 -10.818   1.632
   30    H1     G   3           H1         G   3  -2.073 -10.862  -2.503
   31   1H2     G   3          1H2         G   3   0.380 -11.352  -4.903
   32   2H2     G   3          2H2         G   3  -1.325 -11.179  -4.559
   33   1H2*    G   3          1H2*        G   3   4.532  -9.344  -0.178
   34   2H2*    G   3          2H2*        G   3   4.477  -9.327  -1.935
   35   1H5*    A   4          1H5*        A   4   4.147  -9.947  -3.891
   36   2H5*    A   4          2H5*        A   4   4.415 -11.544  -4.621
   37    H4*    A   4           H4*        A   4   4.111 -10.728  -6.796
   38    H3*    A   4           H3*        A   4   5.372  -8.459  -6.253
   39    H1*    A   4           H1*        A   4   1.504  -8.324  -6.665
   40    H8     A   4           H8         A   4   2.656  -7.982  -2.994
   41   1H6     A   4          1H6         A   4  -1.760  -7.592  -0.995
   42   2H6     A   4          2H6         A   4  -3.382  -7.684  -1.656
   43    H2     A   4           H2         A   4  -2.972  -8.402  -6.051
   44   1H2*    A   4          1H2*        A   4   3.744  -7.473  -4.778
   45   2H2*    A   4          2H2*        A   4   3.277  -6.756  -6.314
   46   1H5*    G   5          1H5*        G   5   2.587  -8.477  -9.925
   47   2H5*    G   5          2H5*        G   5   3.505  -7.912 -11.337
   48    H4*    G   5           H4*        G   5   1.320  -7.383 -11.856
   49    H3*    G   5           H3*        G   5   2.995  -5.241 -11.629
   50    H1*    G   5           H1*        G   5  -0.595  -5.248 -10.169
   51    H8     G   5           H8         G   5   2.166  -5.348  -7.452
   52    H1     G   5           H1         G   5  -3.860  -4.769  -5.338
   53   1H2     G   5          1H2         G   5  -4.730  -5.030  -8.675
   54   2H2     G   5          2H2         G   5  -5.269  -4.857  -7.020
   55   1H2*    G   5          1H2*        G   5   2.268  -4.423  -9.510
   56   2H2*    G   5          2H2*        G   5   1.099  -3.607 -10.541
   57   1H5*    A   6          1H5*        A   6  -0.600  -2.993 -11.727
   58   2H5*    A   6          2H5*        A   6  -1.254  -4.318 -12.713
   59    H4*    A   6           H4*        A   6  -2.593  -2.863 -13.975
   60    H3*    A   6           H3*        A   6  -0.739  -0.912 -13.839
   61    H1*    A   6           H1*        A   6  -3.900  -0.583 -11.312
   62    H8     A   6           H8         A   6  -0.328  -1.621 -10.205
   63   1H6     A   6          1H6         A   6  -1.245  -1.932  -5.454
   64   2H6     A   6          2H6         A   6  -2.686  -1.719  -4.495
   65    H2     A   6           H2         A   6  -5.996  -0.688  -7.333
   66   1H2*    A   6          1H2*        A   6  -1.039   0.039 -11.715
   67   2H2*    A   6          2H2*        A   6  -2.487   0.760 -12.414
   68   1H5*    T   7          1H5*        T   7  -4.950  -0.154 -13.909
   69   2H5*    T   7          2H5*        T   7  -5.620   0.897 -15.175
   70    H4*    T   7           H4*        T   7  -7.097   1.067 -13.380
   71    H3*    T   7           H3*        T   7  -5.910   3.391 -14.213
   72   1H2*    T   7          1H2*        T   7  -4.367   3.659 -12.410
   73   2H2*    T   7          2H2*        T   7  -5.769   4.450 -11.709
   74    H1*    T   7           H1*        T   7  -6.459   2.482 -10.516
   75    H3     T   7           H3         T   7  -3.778   1.647  -7.049
   76   1H5M    T   7          1H5M        T   7  -0.609   2.888 -11.191
   77   2H5M    T   7          2H5M        T   7  -0.234   1.310 -10.453
   78   3H5M    T   7          3H5M        T   7  -0.025   2.806  -9.511
   79    H6     T   7           H6         T   7  -2.931   2.605 -11.631
   80   1H5*    C   8          1H5*        C   8  -9.519   6.624 -11.486
   81   2H5*    C   8          2H5*        C   8  -7.966   7.243 -10.887
   82    H4*    C   8           H4*        C   8 -10.045   5.601  -9.506
   83    H3*    C   8           H3*        C   8  -9.588   8.214  -9.218
   84    H1*    C   8           H1*        C   8  -7.746   5.764  -6.803
   85   1H4     C   8          1H4         C   8  -1.519   5.468  -9.036
   86   2H4     C   8          2H4         C   8  -1.433   5.473  -7.290
   87    H5     C   8           H5         C   8  -3.608   5.662 -10.246
   88    H6     C   8           H6         C   8  -6.015   6.010 -10.028
   89   1H2*    C   8          1H2*        C   8  -7.267   8.130  -8.651
   90   2H2*    C   8          2H2*        C   8  -7.987   8.108  -7.052
   91   1H5*    T   9          1H5*        T   9  -8.770   6.275  -4.890
   92   2H5*    T   9          2H5*        T   9 -10.283   6.875  -4.177
   93    H4*    T   9           H4*        T   9  -8.765   7.044  -2.445
   94    H3*    T   9           H3*        T   9  -9.834   9.397  -3.245
   95   1H2*    T   9          1H2*        T   9  -8.002  10.092  -4.641
   96   2H2*    T   9          2H2*        T   9  -7.604  10.875  -3.126
   97    H1*    T   9           H1*        T   9  -6.138   9.037  -2.445
   98    H3     T   9           H3         T   9  -2.299   9.506  -4.665
   99   1H5M    T   9          1H5M        T   9  -4.554  10.141  -8.714
  100   2H5M    T   9          2H5M        T   9  -5.024   8.428  -8.603
  101   3H5M    T   9          3H5M        T   9  -6.237   9.705  -8.336
  102    H6     T   9           H6         T   9  -6.844   9.311  -6.068
  103   1H5*    G  10          1H5*        G  10  -6.334  10.298  -0.533
  104   2H5*    G  10          2H5*        G  10  -7.317   9.738   0.837
  105    H4*    G  10           H4*        G  10  -6.240  11.056   2.232
  106    H3*    G  10           H3*        G  10  -7.665  13.042   1.175
  107    H1*    G  10           H1*        G  10  -3.704  13.256   0.731
  108    H8     G  10           H8         G  10  -5.855  11.928  -2.208
  109    H1     G  10           H1         G  10   0.357  12.727  -3.465
  110   1H2     G  10          1H2         G  10   0.642  13.455  -0.086
  111   2H2     G  10          2H2         G  10   1.458  13.247  -1.620
  112   1H2*    G  10          1H2*        G  10  -6.331  13.634  -0.698
  113   2H2*    G  10          2H2*        G  10  -5.553  14.653   0.504
  114   1H5*    C  11          1H5*        C  11  -3.407  14.006   2.760
  115   2H5*    C  11          2H5*        C  11  -4.170  14.264   4.343
  116    H4*    C  11           H4*        C  11  -2.233  15.288   4.795
  117    H3*    C  11           H3*        C  11  -4.053  17.208   4.433
  118    H1*    C  11           H1*        C  11  -0.751  17.404   2.164
  119   1H4     C  11          1H4         C  11  -3.438  15.514  -3.594
  120   2H4     C  11          2H4         C  11  -1.742  15.837  -3.879
  121    H5     C  11           H5         C  11  -4.459  15.724  -1.406
  122    H6     C  11           H6         C  11  -4.048  16.214   0.948
  123   1H2*    C  11          1H2*        C  11  -3.731  17.793   2.165
  124   2H2*    C  11          2H2*        C  11  -2.465  18.803   2.848
  125   1H5*    G  12          1H5*        G  12   0.206  18.821   4.809
  126   2H5*    G  12          2H5*        G  12   0.293  19.976   6.156
  127    H4*    G  12           H4*        G  12   1.820  20.797   4.630
  128    H3*    G  12           H3*        G  12  -0.293  22.450   5.145
  129    H1*    G  12           H1*        G  12   1.128  21.898   1.609
  130    H8     G  12           H8         G  12  -2.489  20.609   1.954
  131    H1     G  12           H1         G  12   0.280  19.659  -3.752
  132   1H2     G  12          1H2         G  12   3.124  20.912  -2.245
  133   2H2     G  12          2H2         G  12   2.385  20.268  -3.692
  134    H3T    G  12           H3T        G  12   2.026  22.852   3.559
  135   1H2*    G  12          1H2*        G  12  -1.518  22.096   3.127
  136   2H2*    G  12          2H2*        G  12  -0.462  23.401   2.606
  137   1H5*    C  13          1H5*        C  13   1.507  20.951 -11.377
  138   2H5*    C  13          2H5*        C  13   1.552  22.694 -11.048
  139    H4*    C  13           H4*        C  13   4.092  22.365 -10.824
  140    H3*    C  13           H3*        C  13   3.795  19.805 -11.570
  141    H1*    C  13           H1*        C  13   3.789  20.645  -7.705
  142   1H4     C  13          1H4         C  13  -2.611  19.811  -6.163
  143   2H4     C  13          2H4         C  13  -1.704  19.856  -4.673
  144    H5     C  13           H5         C  13  -1.563  20.012  -8.341
  145    H6     C  13           H6         C  13   0.550  20.320  -9.516
  146    H5T    C  13           H5T        C  13   2.212  22.961 -13.012
  147   1H2*    C  13          1H2*        C  13   2.398  18.991  -9.827
  148   2H2*    C  13          2H2*        C  13   3.961  18.737  -9.060
  149   1H5*    G  14          1H5*        G  14   6.177  19.903  -7.809
  150   2H5*    G  14          2H5*        G  14   7.848  19.488  -8.244
  151    H4*    G  14           H4*        G  14   7.768  18.501  -6.223
  152    H3*    G  14           H3*        G  14   7.653  16.586  -8.168
  153    H1*    G  14           H1*        G  14   5.484  16.509  -5.003
  154    H8     G  14           H8         G  14   3.344  16.930  -8.187
  155    H1     G  14           H1         G  14   0.135  16.928  -2.635
  156   1H2     G  14          1H2         G  14   3.267  16.882  -1.174
  157   2H2     G  14          2H2         G  14   1.533  16.907  -0.944
  158   1H2*    G  14          1H2*        G  14   5.314  16.108  -8.031
  159   2H2*    G  14          2H2*        G  14   5.923  14.987  -6.822
  160   1H5*    C  15          1H5*        C  15   7.896  15.303  -3.672
  161   2H5*    C  15          2H5*        C  15   9.418  14.390  -3.637
  162    H4*    C  15           H4*        C  15   8.221  13.582  -1.826
  163    H3*    C  15           H3*        C  15   8.860  11.734  -3.703
  164    H1*    C  15           H1*        C  15   5.375  11.858  -2.093
  165   1H4     C  15          1H4         C  15   1.075  13.761  -6.770
  166   2H4     C  15          2H4         C  15   0.148  13.273  -5.372
  167    H5     C  15           H5         C  15   3.487  13.760  -6.817
  168    H6     C  15           H6         C  15   5.513  13.151  -5.585
  169   1H2*    C  15          1H2*        C  15   6.739  11.646  -4.822
  170   2H2*    C  15          2H2*        C  15   6.522  10.384  -3.619
  171   1H5*    A  16          1H5*        A  16   6.102   8.395  -2.293
  172   2H5*    A  16          2H5*        A  16   6.001   9.976  -1.493
  173    H4*    A  16           H4*        A  16   5.904   8.568   0.688
  174    H3*    A  16           H3*        A  16   6.196   6.343  -0.717
  175    H1*    A  16           H1*        A  16   2.408   7.668  -0.403
  176    H8     A  16           H8         A  16   4.623   8.998  -3.302
  177   1H6     A  16          1H6         A  16   1.015  10.270  -6.281
  178   2H6     A  16          2H6         A  16  -0.728  10.170  -6.166
  179    H2     A  16           H2         A  16  -1.658   8.319  -2.189
  180   1H2*    A  16          1H2*        A  16   4.435   6.511  -2.287
  181   2H2*    A  16          2H2*        A  16   3.536   5.728  -0.994
  182   1H5*    G  17          1H5*        G  17   2.394   6.898   1.553
  183   2H5*    G  17          2H5*        G  17   2.562   5.805   2.942
  184    H4*    G  17           H4*        G  17   0.258   6.263   2.641
  185    H3*    G  17           H3*        G  17   1.067   3.692   2.828
  186    H1*    G  17           H1*        G  17  -1.469   4.782   0.141
  187    H8     G  17           H8         G  17   2.007   4.010  -1.388
  188    H1     G  17           H1         G  17  -2.666   5.444  -5.547
  189   1H2     G  17          1H2         G  17  -4.574   5.999  -2.721
  190   2H2     G  17          2H2         G  17  -4.502   5.992  -4.468
  191   1H2*    G  17          1H2*        G  17   1.104   3.174   0.484
  192   2H2*    G  17          2H2*        G  17  -0.536   2.701   0.893
  193   1H5*  6MC  18          1H5*      6MC  18  -3.440   4.908   3.038
  194   2H5*  6MC  18          2H5*      6MC  18  -3.147   4.010   1.543
  195    H4*  6MC  18           H4*      6MC  18  -5.608   4.539   2.929
  196    H3*  6MC  18           H3*      6MC  18  -4.990   1.953   3.558
  197   1H2*  6MC  18          1H2*      6MC  18  -6.854   1.244   1.468
  198   2H2*  6MC  18          2H2*      6MC  18  -5.187   0.701   1.614
  199    H1*  6MC  18           H1*      6MC  18  -6.281   2.484  -0.324
  200    H8   6MC  18           H8       6MC  18  -2.943   1.979   1.346
  201   1H6   6MC  18          1H6       6MC  18  -0.296   1.577  -2.592
  202    H2   6MC  18           H2       6MC  18  -4.982   2.032  -4.490
  203   1H1   6MC  18          1H1       6MC  18   0.427   0.972  -4.679
  204   2H1   6MC  18          2H1       6MC  18  -0.076   2.401  -4.967
  205   3H1   6MC  18          3H1       6MC  18  -0.985   1.190  -5.257
  206   1H5*    T  19          1H5*        T  19  -8.222   2.627   0.938
  207   2H5*    T  19          2H5*        T  19  -9.786   2.380   1.740
  208    H4*    T  19           H4*        T  19 -10.295   1.704  -0.363
  209    H3*    T  19           H3*        T  19 -10.213  -0.417   1.366
  210   1H2*    T  19          1H2*        T  19  -8.080  -1.270   0.649
  211   2H2*    T  19          2H2*        T  19  -9.172  -2.165  -0.393
  212    H1*    T  19           H1*        T  19  -8.962  -0.499  -2.190
  213    H3     T  19           H3         T  19  -5.112  -1.159  -4.368
  214   1H5M    T  19          1H5M        T  19  -2.696  -1.770  -0.541
  215   2H5M    T  19          2H5M        T  19  -3.971  -2.368   0.545
  216   3H5M    T  19          3H5M        T  19  -3.487  -0.656   0.598
  217    H6     T  19           H6         T  19  -6.181  -0.684   0.264
  218   1H5*    C  20          1H5*        C  20 -10.206  -3.781  -1.635
  219   2H5*    C  20          2H5*        C  20 -10.005  -2.092  -2.135
  220    H4*    C  20           H4*        C  20 -11.629  -2.766  -4.056
  221    H3*    C  20           H3*        C  20 -11.734  -5.231  -3.009
  222    H1*    C  20           H1*        C  20  -8.815  -4.507  -5.661
  223   1H4     C  20          1H4         C  20  -3.728  -4.252  -1.411
  224   2H4     C  20          2H4         C  20  -3.088  -4.677  -2.982
  225    H5     C  20           H5         C  20  -6.088  -3.899  -1.013
  226    H6     C  20           H6         C  20  -8.294  -3.860  -2.031
  227   1H2*    C  20          1H2*        C  20  -9.481  -5.912  -3.091
  228   2H2*    C  20          2H2*        C  20  -9.904  -6.334  -4.743
  229   1H5*    T  21          1H5*        T  21 -12.347  -9.163  -5.358
  230   2H5*    T  21          2H5*        T  21 -11.094  -8.187  -4.561
  231    H4*    T  21           H4*        T  21 -10.820  -8.802  -7.465
  232    H3*    T  21           H3*        T  21 -11.265 -11.011  -6.006
  233   1H2*    T  21          1H2*        T  21  -9.611 -10.585  -4.300
  234   2H2*    T  21          2H2*        T  21  -8.736 -11.637  -5.399
  235    H1*    T  21           H1*        T  21  -7.701  -9.748  -6.546
  236    H3     T  21           H3         T  21  -4.404  -8.625  -3.765
  237   1H5M    T  21          1H5M        T  21  -7.848  -8.038  -0.382
  238   2H5M    T  21          2H5M        T  21  -9.045  -7.208  -1.403
  239   3H5M    T  21          3H5M        T  21  -7.508  -6.405  -1.001
  240    H6     T  21           H6         T  21  -9.150  -8.314  -3.450
  241   1H5*    C  22          1H5*        C  22  -7.758 -13.618  -6.353
  242   2H5*    C  22          2H5*        C  22  -7.573 -11.923  -6.847
  243    H4*    C  22           H4*        C  22  -6.266 -13.041  -8.858
  244    H3*    C  22           H3*        C  22  -6.636 -15.400  -7.695
  245    H1*    C  22           H1*        C  22  -3.436 -13.347  -6.544
  246   1H4     C  22          1H4         C  22  -5.440 -10.924  -0.698
  247   2H4     C  22          2H4         C  22  -3.711 -11.164  -0.618
  248    H5     C  22           H5         C  22  -6.743 -11.487  -2.687
  249    H6     C  22           H6         C  22  -6.644 -12.464  -4.915
  250   1H2*    C  22          1H2*        C  22  -5.773 -14.965  -5.515
  251   2H2*    C  22          2H2*        C  22  -4.297 -15.511  -6.297
  252   1H5*    G  23          1H5*        G  23  -2.501 -14.178  -8.426
  253   2H5*    G  23          2H5*        G  23  -1.919 -15.088  -9.835
  254    H4*    G  23           H4*        G  23   0.010 -14.368  -8.760
  255    H3*    G  23           H3*        G  23  -0.293 -17.074  -8.979
  256    H1*    G  23           H1*        G  23   1.029 -15.354  -5.821
  257    H8     G  23           H8         G  23  -2.516 -16.819  -5.232
  258    H1     G  23           H1         G  23   0.464 -14.430  -0.081
  259   1H2     G  23          1H2         G  23   2.966 -13.572  -2.314
  260   2H2     G  23          2H2         G  23   2.401 -13.565  -0.655
  261   1H2*    G  23          1H2*        G  23  -0.934 -17.523  -6.717
  262   2H2*    G  23          2H2*        G  23   0.813 -17.638  -6.571
  263   1H5*    C  24          1H5*        C  24   4.102 -15.838  -7.435
  264   2H5*    C  24          2H5*        C  24   5.092 -16.524  -8.740
  265    H4*    C  24           H4*        C  24   6.371 -16.620  -6.760
  266    H3*    C  24           H3*        C  24   6.034 -18.897  -8.181
  267    H1*    C  24           H1*        C  24   5.574 -18.884  -4.310
  268   1H4     C  24          1H4         C  24  -0.916 -19.933  -3.431
  269   2H4     C  24          2H4         C  24  -0.173 -19.874  -1.851
  270    H5     C  24           H5         C  24   0.329 -19.597  -5.481
  271    H6     C  24           H6         C  24   2.528 -19.133  -6.424
  272    H3T    C  24           H3T        C  24   7.915 -19.303  -7.337
  273   1H2*    C  24          1H2*        C  24   4.315 -19.919  -6.885
  274   2H2*    C  24          2H2*        C  24   5.723 -20.526  -6.024
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1   0.684 -20.253   7.674
    2   2H5*    G   1          2H5*        G   1   1.545 -21.653   7.007
    3    H4*    G   1           H4*        G   1   3.660 -20.195   7.442
    4    H3*    G   1           H3*        G   1   2.010 -18.284   8.413
    5    H1*    G   1           H1*        G   1   3.285 -18.162   4.785
    6    H8     G   1           H8         G   1  -0.515 -18.717   4.948
    7    H1     G   1           H1         G   1   2.068 -18.983  -0.915
    8   1H2     G   1          1H2         G   1   5.094 -18.768   0.746
    9   2H2     G   1          2H2         G   1   4.264 -18.902  -0.791
   10    H5T    G   1           H5T        G   1   2.510 -21.994   8.894
   11   1H2*    G   1          1H2*        G   1   0.718 -17.911   6.427
   12   2H2*    G   1          2H2*        G   1   1.989 -16.718   6.216
   13   1H5*    C   2          1H5*        C   2   4.951 -13.790   7.462
   14   2H5*    C   2          2H5*        C   2   3.342 -13.459   6.785
   15    H4*    C   2           H4*        C   2   5.965 -13.841   5.420
   16    H3*    C   2           H3*        C   2   4.653 -11.553   5.781
   17    H1*    C   2           H1*        C   2   3.967 -13.533   2.477
   18   1H4     C   2          1H4         C   2  -1.909 -16.454   3.397
   19   2H4     C   2          2H4         C   2  -1.811 -15.983   1.713
   20    H5     C   2           H5         C   2  -0.148 -15.943   5.001
   21    H6     C   2           H6         C   2   2.013 -14.862   5.302
   22   1H2*    C   2          1H2*        C   2   2.553 -12.151   4.789
   23   2H2*    C   2          2H2*        C   2   3.365 -11.431   3.407
   24   1H5*    G   3          1H5*        G   3   6.269 -12.585   1.732
   25   2H5*    G   3          2H5*        G   3   7.430 -11.357   1.187
   26    H4*    G   3           H4*        G   3   6.499 -12.604  -0.677
   27    H3*    G   3           H3*        G   3   6.810  -9.908  -0.740
   28    H1*    G   3           H1*        G   3   3.704 -11.641  -2.032
   29    H8     G   3           H8         G   3   2.824 -10.818   1.632
   30    H1     G   3           H1         G   3  -2.073 -10.862  -2.503
   31   1H2     G   3          1H2         G   3   0.380 -11.352  -4.903
   32   2H2     G   3          2H2         G   3  -1.325 -11.179  -4.559
   33   1H2*    G   3          1H2*        G   3   4.532  -9.344  -0.178
   34   2H2*    G   3          2H2*        G   3   4.477  -9.327  -1.935
   35   1H5*    A   4          1H5*        A   4   4.147  -9.947  -3.891
   36   2H5*    A   4          2H5*        A   4   4.415 -11.544  -4.621
   37    H4*    A   4           H4*        A   4   4.111 -10.728  -6.796
   38    H3*    A   4           H3*        A   4   5.372  -8.459  -6.253
   39    H1*    A   4           H1*        A   4   1.504  -8.324  -6.665
   40    H8     A   4           H8         A   4   2.656  -7.982  -2.994
   41   1H6     A   4          1H6         A   4  -1.760  -7.592  -0.995
   42   2H6     A   4          2H6         A   4  -3.382  -7.684  -1.656
   43    H2     A   4           H2         A   4  -2.972  -8.402  -6.051
   44   1H2*    A   4          1H2*        A   4   3.744  -7.473  -4.778
   45   2H2*    A   4          2H2*        A   4   3.277  -6.756  -6.314
   46   1H5*    G   5          1H5*        G   5   2.587  -8.477  -9.925
   47   2H5*    G   5          2H5*        G   5   3.505  -7.912 -11.337
   48    H4*    G   5           H4*        G   5   1.320  -7.383 -11.856
   49    H3*    G   5           H3*        G   5   2.995  -5.241 -11.629
   50    H1*    G   5           H1*        G   5  -0.595  -5.248 -10.169
   51    H8     G   5           H8         G   5   2.166  -5.348  -7.452
   52    H1     G   5           H1         G   5  -3.860  -4.769  -5.338
   53   1H2     G   5          1H2         G   5  -4.730  -5.030  -8.675
   54   2H2     G   5          2H2         G   5  -5.269  -4.857  -7.020
   55   1H2*    G   5          1H2*        G   5   2.268  -4.423  -9.510
   56   2H2*    G   5          2H2*        G   5   1.099  -3.607 -10.541
   57   1H5*    A   6          1H5*        A   6  -0.600  -2.993 -11.727
   58   2H5*    A   6          2H5*        A   6  -1.254  -4.318 -12.713
   59    H4*    A   6           H4*        A   6  -2.593  -2.863 -13.975
   60    H3*    A   6           H3*        A   6  -0.739  -0.912 -13.839
   61    H1*    A   6           H1*        A   6  -3.900  -0.583 -11.312
   62    H8     A   6           H8         A   6  -0.328  -1.621 -10.205
   63   1H6     A   6          1H6         A   6  -1.245  -1.932  -5.454
   64   2H6     A   6          2H6         A   6  -2.686  -1.719  -4.495
   65    H2     A   6           H2         A   6  -5.996  -0.688  -7.333
   66   1H2*    A   6          1H2*        A   6  -1.039   0.039 -11.715
   67   2H2*    A   6          2H2*        A   6  -2.487   0.760 -12.414
   68   1H5*    T   7          1H5*        T   7  -4.950  -0.154 -13.909
   69   2H5*    T   7          2H5*        T   7  -5.620   0.897 -15.175
   70    H4*    T   7           H4*        T   7  -7.097   1.067 -13.380
   71    H3*    T   7           H3*        T   7  -5.910   3.391 -14.213
   72   1H2*    T   7          1H2*        T   7  -4.367   3.659 -12.410
   73   2H2*    T   7          2H2*        T   7  -5.769   4.450 -11.709
   74    H1*    T   7           H1*        T   7  -6.459   2.482 -10.516
   75    H3     T   7           H3         T   7  -3.778   1.647  -7.049
   76   1H5M    T   7          1H5M        T   7  -0.609   2.888 -11.191
   77   2H5M    T   7          2H5M        T   7  -0.234   1.310 -10.453
   78   3H5M    T   7          3H5M        T   7  -0.025   2.806  -9.511
   79    H6     T   7           H6         T   7  -2.931   2.605 -11.631
   80   1H5*    C   8          1H5*        C   8  -9.519   6.624 -11.486
   81   2H5*    C   8          2H5*        C   8  -7.966   7.243 -10.887
   82    H4*    C   8           H4*        C   8 -10.045   5.601  -9.506
   83    H3*    C   8           H3*        C   8  -9.588   8.214  -9.218
   84    H1*    C   8           H1*        C   8  -7.746   5.764  -6.803
   85   1H4     C   8          1H4         C   8  -1.519   5.468  -9.036
   86   2H4     C   8          2H4         C   8  -1.433   5.473  -7.290
   87    H5     C   8           H5         C   8  -3.608   5.662 -10.246
   88    H6     C   8           H6         C   8  -6.015   6.010 -10.028
   89   1H2*    C   8          1H2*        C   8  -7.267   8.130  -8.651
   90   2H2*    C   8          2H2*        C   8  -7.987   8.108  -7.052
   91   1H5*    T   9          1H5*        T   9  -8.770   6.275  -4.890
   92   2H5*    T   9          2H5*        T   9 -10.283   6.875  -4.177
   93    H4*    T   9           H4*        T   9  -8.765   7.044  -2.445
   94    H3*    T   9           H3*        T   9  -9.834   9.397  -3.245
   95   1H2*    T   9          1H2*        T   9  -8.002  10.092  -4.641
   96   2H2*    T   9          2H2*        T   9  -7.604  10.875  -3.126
   97    H1*    T   9           H1*        T   9  -6.138   9.037  -2.445
   98    H3     T   9           H3         T   9  -2.299   9.506  -4.665
   99   1H5M    T   9          1H5M        T   9  -4.554  10.141  -8.714
  100   2H5M    T   9          2H5M        T   9  -5.024   8.428  -8.603
  101   3H5M    T   9          3H5M        T   9  -6.237   9.705  -8.336
  102    H6     T   9           H6         T   9  -6.844   9.311  -6.068
  103   1H5*    G  10          1H5*        G  10  -6.334  10.298  -0.533
  104   2H5*    G  10          2H5*        G  10  -7.317   9.738   0.837
  105    H4*    G  10           H4*        G  10  -6.240  11.056   2.232
  106    H3*    G  10           H3*        G  10  -7.665  13.042   1.175
  107    H1*    G  10           H1*        G  10  -3.704  13.256   0.731
  108    H8     G  10           H8         G  10  -5.855  11.928  -2.208
  109    H1     G  10           H1         G  10   0.357  12.727  -3.465
  110   1H2     G  10          1H2         G  10   0.642  13.455  -0.086
  111   2H2     G  10          2H2         G  10   1.458  13.247  -1.620
  112   1H2*    G  10          1H2*        G  10  -6.331  13.634  -0.698
  113   2H2*    G  10          2H2*        G  10  -5.553  14.653   0.504
  114   1H5*    C  11          1H5*        C  11  -3.407  14.006   2.760
  115   2H5*    C  11          2H5*        C  11  -4.170  14.264   4.343
  116    H4*    C  11           H4*        C  11  -2.233  15.288   4.795
  117    H3*    C  11           H3*        C  11  -4.053  17.208   4.433
  118    H1*    C  11           H1*        C  11  -0.751  17.404   2.164
  119   1H4     C  11          1H4         C  11  -3.438  15.514  -3.594
  120   2H4     C  11          2H4         C  11  -1.742  15.837  -3.879
  121    H5     C  11           H5         C  11  -4.459  15.724  -1.406
  122    H6     C  11           H6         C  11  -4.048  16.214   0.948
  123   1H2*    C  11          1H2*        C  11  -3.731  17.793   2.165
  124   2H2*    C  11          2H2*        C  11  -2.465  18.803   2.848
  125   1H5*    G  12          1H5*        G  12   0.206  18.821   4.809
  126   2H5*    G  12          2H5*        G  12   0.293  19.976   6.156
  127    H4*    G  12           H4*        G  12   1.820  20.797   4.630
  128    H3*    G  12           H3*        G  12  -0.293  22.450   5.145
  129    H1*    G  12           H1*        G  12   1.128  21.898   1.609
  130    H8     G  12           H8         G  12  -2.489  20.609   1.954
  131    H1     G  12           H1         G  12   0.280  19.659  -3.752
  132   1H2     G  12          1H2         G  12   3.124  20.912  -2.245
  133   2H2     G  12          2H2         G  12   2.385  20.268  -3.692
  134    H3T    G  12           H3T        G  12   2.026  22.852   3.559
  135   1H2*    G  12          1H2*        G  12  -1.518  22.096   3.127
  136   2H2*    G  12          2H2*        G  12  -0.462  23.401   2.606
  137   1H5*    C  13          1H5*        C  13   1.507  20.951 -11.377
  138   2H5*    C  13          2H5*        C  13   1.552  22.694 -11.048
  139    H4*    C  13           H4*        C  13   4.092  22.365 -10.824
  140    H3*    C  13           H3*        C  13   3.795  19.805 -11.570
  141    H1*    C  13           H1*        C  13   3.789  20.645  -7.705
  142   1H4     C  13          1H4         C  13  -2.611  19.811  -6.163
  143   2H4     C  13          2H4         C  13  -1.704  19.856  -4.673
  144    H5     C  13           H5         C  13  -1.563  20.012  -8.341
  145    H6     C  13           H6         C  13   0.550  20.320  -9.516
  146    H5T    C  13           H5T        C  13   2.212  22.961 -13.012
  147   1H2*    C  13          1H2*        C  13   2.398  18.991  -9.827
  148   2H2*    C  13          2H2*        C  13   3.961  18.737  -9.060
  149   1H5*    G  14          1H5*        G  14   6.177  19.903  -7.809
  150   2H5*    G  14          2H5*        G  14   7.848  19.488  -8.244
  151    H4*    G  14           H4*        G  14   7.768  18.501  -6.223
  152    H3*    G  14           H3*        G  14   7.653  16.586  -8.168
  153    H1*    G  14           H1*        G  14   5.484  16.509  -5.003
  154    H8     G  14           H8         G  14   3.344  16.930  -8.187
  155    H1     G  14           H1         G  14   0.135  16.928  -2.635
  156   1H2     G  14          1H2         G  14   3.267  16.882  -1.174
  157   2H2     G  14          2H2         G  14   1.533  16.907  -0.944
  158   1H2*    G  14          1H2*        G  14   5.314  16.108  -8.031
  159   2H2*    G  14          2H2*        G  14   5.923  14.987  -6.822
  160   1H5*    C  15          1H5*        C  15   7.896  15.303  -3.672
  161   2H5*    C  15          2H5*        C  15   9.418  14.390  -3.637
  162    H4*    C  15           H4*        C  15   8.221  13.582  -1.826
  163    H3*    C  15           H3*        C  15   8.860  11.734  -3.703
  164    H1*    C  15           H1*        C  15   5.375  11.858  -2.093
  165   1H4     C  15          1H4         C  15   1.075  13.761  -6.770
  166   2H4     C  15          2H4         C  15   0.148  13.273  -5.372
  167    H5     C  15           H5         C  15   3.487  13.760  -6.817
  168    H6     C  15           H6         C  15   5.513  13.151  -5.585
  169   1H2*    C  15          1H2*        C  15   6.739  11.646  -4.822
  170   2H2*    C  15          2H2*        C  15   6.522  10.384  -3.619
  171   1H5*    A  16          1H5*        A  16   6.102   8.395  -2.293
  172   2H5*    A  16          2H5*        A  16   6.001   9.976  -1.493
  173    H4*    A  16           H4*        A  16   5.904   8.568   0.688
  174    H3*    A  16           H3*        A  16   6.196   6.343  -0.717
  175    H1*    A  16           H1*        A  16   2.408   7.668  -0.403
  176    H8     A  16           H8         A  16   4.623   8.998  -3.302
  177   1H6     A  16          1H6         A  16   1.015  10.270  -6.281
  178   2H6     A  16          2H6         A  16  -0.728  10.170  -6.166
  179    H2     A  16           H2         A  16  -1.658   8.319  -2.189
  180   1H2*    A  16          1H2*        A  16   4.435   6.511  -2.287
  181   2H2*    A  16          2H2*        A  16   3.536   5.728  -0.994
  182   1H5*    G  17          1H5*        G  17   2.394   6.898   1.553
  183   2H5*    G  17          2H5*        G  17   2.562   5.805   2.942
  184    H4*    G  17           H4*        G  17   0.258   6.263   2.641
  185    H3*    G  17           H3*        G  17   1.067   3.692   2.828
  186    H1*    G  17           H1*        G  17  -1.469   4.782   0.141
  187    H8     G  17           H8         G  17   2.007   4.010  -1.388
  188    H1     G  17           H1         G  17  -2.666   5.444  -5.547
  189   1H2     G  17          1H2         G  17  -4.574   5.999  -2.721
  190   2H2     G  17          2H2         G  17  -4.502   5.992  -4.468
  191   1H2*    G  17          1H2*        G  17   1.104   3.174   0.484
  192   2H2*    G  17          2H2*        G  17  -0.536   2.701   0.893
  193   1H5*  6MC  18          1H5*      6MC  18  -3.440   4.908   3.038
  194   2H5*  6MC  18          2H5*      6MC  18  -3.147   4.010   1.543
  195    H4*  6MC  18           H4*      6MC  18  -5.608   4.539   2.929
  196    H3*  6MC  18           H3*      6MC  18  -4.990   1.953   3.558
  197   1H2*  6MC  18          1H2*      6MC  18  -6.854   1.244   1.468
  198   2H2*  6MC  18          2H2*      6MC  18  -5.187   0.701   1.614
  199    H1*  6MC  18           H1*      6MC  18  -6.281   2.484  -0.324
  200    H8   6MC  18           H8       6MC  18  -2.943   1.979   1.346
  201   1H6   6MC  18          1H6       6MC  18  -0.296   1.577  -2.592
  202    H2   6MC  18           H2       6MC  18  -4.982   2.032  -4.490
  203   1H1   6MC  18          1H1       6MC  18   0.427   0.972  -4.679
  204   2H1   6MC  18          2H1       6MC  18  -0.076   2.401  -4.967
  205   3H1   6MC  18          3H1       6MC  18  -0.985   1.190  -5.257
  206   1H5*    T  19          1H5*        T  19  -8.222   2.627   0.938
  207   2H5*    T  19          2H5*        T  19  -9.786   2.380   1.740
  208    H4*    T  19           H4*        T  19 -10.295   1.704  -0.363
  209    H3*    T  19           H3*        T  19 -10.213  -0.417   1.366
  210   1H2*    T  19          1H2*        T  19  -8.080  -1.270   0.649
  211   2H2*    T  19          2H2*        T  19  -9.172  -2.165  -0.393
  212    H1*    T  19           H1*        T  19  -8.962  -0.499  -2.190
  213    H3     T  19           H3         T  19  -5.112  -1.159  -4.368
  214   1H5M    T  19          1H5M        T  19  -2.696  -1.770  -0.541
  215   2H5M    T  19          2H5M        T  19  -3.971  -2.368   0.545
  216   3H5M    T  19          3H5M        T  19  -3.487  -0.656   0.598
  217    H6     T  19           H6         T  19  -6.181  -0.684   0.264
  218   1H5*    C  20          1H5*        C  20 -10.206  -3.781  -1.635
  219   2H5*    C  20          2H5*        C  20 -10.005  -2.092  -2.135
  220    H4*    C  20           H4*        C  20 -11.629  -2.766  -4.056
  221    H3*    C  20           H3*        C  20 -11.734  -5.231  -3.009
  222    H1*    C  20           H1*        C  20  -8.815  -4.507  -5.661
  223   1H4     C  20          1H4         C  20  -3.728  -4.252  -1.411
  224   2H4     C  20          2H4         C  20  -3.088  -4.677  -2.982
  225    H5     C  20           H5         C  20  -6.088  -3.899  -1.013
  226    H6     C  20           H6         C  20  -8.294  -3.860  -2.031
  227   1H2*    C  20          1H2*        C  20  -9.481  -5.912  -3.091
  228   2H2*    C  20          2H2*        C  20  -9.904  -6.334  -4.743
  229   1H5*    T  21          1H5*        T  21 -12.347  -9.163  -5.358
  230   2H5*    T  21          2H5*        T  21 -11.094  -8.187  -4.561
  231    H4*    T  21           H4*        T  21 -10.820  -8.802  -7.465
  232    H3*    T  21           H3*        T  21 -11.265 -11.011  -6.006
  233   1H2*    T  21          1H2*        T  21  -9.611 -10.585  -4.300
  234   2H2*    T  21          2H2*        T  21  -8.736 -11.637  -5.399
  235    H1*    T  21           H1*        T  21  -7.701  -9.748  -6.546
  236    H3     T  21           H3         T  21  -4.404  -8.625  -3.765
  237   1H5M    T  21          1H5M        T  21  -7.848  -8.038  -0.382
  238   2H5M    T  21          2H5M        T  21  -9.045  -7.208  -1.403
  239   3H5M    T  21          3H5M        T  21  -7.508  -6.405  -1.001
  240    H6     T  21           H6         T  21  -9.150  -8.314  -3.450
  241   1H5*    C  22          1H5*        C  22  -7.758 -13.618  -6.353
  242   2H5*    C  22          2H5*        C  22  -7.573 -11.923  -6.847
  243    H4*    C  22           H4*        C  22  -6.266 -13.041  -8.858
  244    H3*    C  22           H3*        C  22  -6.636 -15.400  -7.695
  245    H1*    C  22           H1*        C  22  -3.436 -13.347  -6.544
  246   1H4     C  22          1H4         C  22  -5.440 -10.924  -0.698
  247   2H4     C  22          2H4         C  22  -3.711 -11.164  -0.618
  248    H5     C  22           H5         C  22  -6.743 -11.487  -2.687
  249    H6     C  22           H6         C  22  -6.644 -12.464  -4.915
  250   1H2*    C  22          1H2*        C  22  -5.773 -14.965  -5.515
  251   2H2*    C  22          2H2*        C  22  -4.297 -15.511  -6.297
  252   1H5*    G  23          1H5*        G  23  -2.501 -14.178  -8.426
  253   2H5*    G  23          2H5*        G  23  -1.919 -15.088  -9.835
  254    H4*    G  23           H4*        G  23   0.010 -14.368  -8.760
  255    H3*    G  23           H3*        G  23  -0.293 -17.074  -8.979
  256    H1*    G  23           H1*        G  23   1.029 -15.354  -5.821
  257    H8     G  23           H8         G  23  -2.516 -16.819  -5.232
  258    H1     G  23           H1         G  23   0.464 -14.430  -0.081
  259   1H2     G  23          1H2         G  23   2.966 -13.572  -2.314
  260   2H2     G  23          2H2         G  23   2.401 -13.565  -0.655
  261   1H2*    G  23          1H2*        G  23  -0.934 -17.523  -6.717
  262   2H2*    G  23          2H2*        G  23   0.813 -17.638  -6.571
  263   1H5*    C  24          1H5*        C  24   4.102 -15.838  -7.435
  264   2H5*    C  24          2H5*        C  24   5.092 -16.524  -8.740
  265    H4*    C  24           H4*        C  24   6.371 -16.620  -6.760
  266    H3*    C  24           H3*        C  24   6.034 -18.897  -8.181
  267    H1*    C  24           H1*        C  24   5.574 -18.884  -4.310
  268   1H4     C  24          1H4         C  24  -0.916 -19.933  -3.431
  269   2H4     C  24          2H4         C  24  -0.173 -19.874  -1.851
  270    H5     C  24           H5         C  24   0.329 -19.597  -5.481
  271    H6     C  24           H6         C  24   2.528 -19.133  -6.424
  272    H3T    C  24           H3T        C  24   7.915 -19.303  -7.337
  273   1H2*    C  24          1H2*        C  24   4.315 -19.919  -6.885
  274   2H2*    C  24          2H2*        C  24   5.723 -20.526  -6.024
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1   0.818 -21.025   7.404
    2   2H5*    G   1          2H5*        G   1   1.849 -22.320   6.766
    3    H4*    G   1           H4*        G   1   3.731 -20.542   6.939
    4    H3*    G   1           H3*        G   1   1.841 -18.843   7.932
    5    H1*    G   1           H1*        G   1   3.032 -18.755   4.300
    6    H8     G   1           H8         G   1  -0.699 -19.681   4.508
    7    H1     G   1           H1         G   1   1.866 -19.761  -1.370
    8   1H2     G   1          1H2         G   1   4.858 -19.214   0.268
    9   2H2     G   1          2H2         G   1   4.040 -19.457  -1.262
   10    H5T    G   1           H5T        G   1   2.793 -20.867   8.959
   11   1H2*    G   1          1H2*        G   1   0.469 -18.703   5.974
   12   2H2*    G   1          2H2*        G   1   1.588 -17.382   5.670
   13   1H5*    C   2          1H5*        C   2   4.969 -13.890   7.276
   14   2H5*    C   2          2H5*        C   2   3.343 -14.150   6.609
   15    H4*    C   2           H4*        C   2   5.977 -14.175   5.140
   16    H3*    C   2           H3*        C   2   4.580 -11.938   5.627
   17    H1*    C   2           H1*        C   2   3.938 -13.901   2.363
   18   1H4     C   2          1H4         C   2  -1.851 -17.054   3.018
   19   2H4     C   2          2H4         C   2  -1.749 -16.491   1.363
   20    H5     C   2           H5         C   2  -0.145 -16.552   4.679
   21    H6     C   2           H6         C   2   1.965 -15.408   5.076
   22   1H2*    C   2          1H2*        C   2   2.465 -12.652   4.729
   23   2H2*    C   2          2H2*        C   2   3.168 -11.844   3.335
   24   1H5*    G   3          1H5*        G   3   6.579 -12.543   1.677
   25   2H5*    G   3          2H5*        G   3   7.564 -11.192   1.080
   26    H4*    G   3           H4*        G   3   6.675 -12.646  -0.703
   27    H3*    G   3           H3*        G   3   6.883  -9.936  -0.882
   28    H1*    G   3           H1*        G   3   3.861 -11.877  -2.070
   29    H8     G   3           H8         G   3   2.918 -11.067   1.558
   30    H1     G   3           H1         G   3  -1.929 -11.049  -2.633
   31   1H2     G   3          1H2         G   3   0.560 -11.481  -5.015
   32   2H2     G   3          2H2         G   3  -1.150 -11.329  -4.690
   33   1H2*    G   3          1H2*        G   3   4.583  -9.438  -0.358
   34   2H2*    G   3          2H2*        G   3   4.527  -9.526  -2.113
   35   1H5*    A   4          1H5*        A   4   4.308 -10.039  -4.095
   36   2H5*    A   4          2H5*        A   4   4.537 -11.690  -4.708
   37    H4*    A   4           H4*        A   4   4.350 -11.001  -6.947
   38    H3*    A   4           H3*        A   4   5.631  -8.729  -6.524
   39    H1*    A   4           H1*        A   4   1.737  -8.498  -6.917
   40    H8     A   4           H8         A   4   2.992  -8.147  -3.277
   41   1H6     A   4          1H6         A   4  -1.362  -7.670  -1.173
   42   2H6     A   4          2H6         A   4  -3.002  -7.726  -1.788
   43    H2     A   4           H2         A   4  -2.716  -8.439  -6.199
   44   1H2*    A   4          1H2*        A   4   4.024  -7.636  -5.104
   45   2H2*    A   4          2H2*        A   4   3.566  -6.993  -6.675
   46   1H5*    G   5          1H5*        G   5   3.200  -5.776  -8.575
   47   2H5*    G   5          2H5*        G   5   2.570  -7.431  -8.682
   48    H4*    G   5           H4*        G   5   2.058  -6.828 -11.141
   49    H3*    G   5           H3*        G   5   3.240  -4.491 -10.897
   50    H1*    G   5           H1*        G   5  -0.597  -4.542  -9.784
   51    H8     G   5           H8         G   5   2.147  -4.910  -7.079
   52    H1     G   5           H1         G   5  -3.894  -4.645  -4.957
   53   1H2     G   5          1H2         G   5  -4.746  -4.567  -8.309
   54   2H2     G   5          2H2         G   5  -5.299  -4.577  -6.648
   55   1H2*    G   5          1H2*        G   5   2.154  -3.634  -8.951
   56   2H2*    G   5          2H2*        G   5   1.098  -2.971 -10.188
   57   1H5*    A   6          1H5*        A   6  -0.413  -2.751 -11.364
   58   2H5*    A   6          2H5*        A   6  -0.971  -4.003 -12.491
   59    H4*    A   6           H4*        A   6  -2.345  -2.540 -13.643
   60    H3*    A   6           H3*        A   6  -0.507  -0.570 -13.476
   61    H1*    A   6           H1*        A   6  -3.709  -0.303 -11.007
   62    H8     A   6           H8         A   6  -0.138  -1.205  -9.804
   63   1H6     A   6          1H6         A   6  -1.162  -1.544  -5.076
   64   2H6     A   6          2H6         A   6  -2.639  -1.410  -4.158
   65    H2     A   6           H2         A   6  -5.914  -0.540  -7.081
   66   1H2*    A   6          1H2*        A   6  -0.843   0.358 -11.347
   67   2H2*    A   6          2H2*        A   6  -2.289   1.070 -12.061
   68   1H5*    T   7          1H5*        T   7  -4.785   0.175 -13.596
   69   2H5*    T   7          2H5*        T   7  -5.380   1.267 -14.864
   70    H4*    T   7           H4*        T   7  -6.918   1.427 -13.115
   71    H3*    T   7           H3*        T   7  -5.673   3.740 -13.881
   72   1H2*    T   7          1H2*        T   7  -4.178   3.970 -12.037
   73   2H2*    T   7          2H2*        T   7  -5.590   4.766 -11.358
   74    H1*    T   7           H1*        T   7  -6.320   2.802 -10.198
   75    H3     T   7           H3         T   7  -3.697   1.792  -6.726
   76   1H5M    T   7          1H5M        T   7  -0.084   1.628 -10.051
   77   2H5M    T   7          2H5M        T   7   0.079   3.116  -9.090
   78   3H5M    T   7          3H5M        T   7  -0.474   3.204 -10.779
   79    H6     T   7           H6         T   7  -2.781   2.948 -11.250
   80   1H5*    C   8          1H5*        C   8  -9.490   6.793 -11.156
   81   2H5*    C   8          2H5*        C   8  -8.021   7.515 -10.465
   82    H4*    C   8           H4*        C   8 -10.046   5.716  -9.238
   83    H3*    C   8           H3*        C   8  -9.634   8.301  -8.754
   84    H1*    C   8           H1*        C   8  -7.773   5.725  -6.486
   85   1H4     C   8          1H4         C   8  -1.539   5.604  -8.705
   86   2H4     C   8          2H4         C   8  -1.455   5.528  -6.962
   87    H5     C   8           H5         C   8  -3.628   5.818  -9.911
   88    H6     C   8           H6         C   8  -6.036   6.158  -9.683
   89   1H2*    C   8          1H2*        C   8  -7.312   8.210  -8.175
   90   2H2*    C   8          2H2*        C   8  -8.045   8.074  -6.586
   91   1H5*    T   9          1H5*        T   9  -8.675   6.289  -4.579
   92   2H5*    T   9          2H5*        T   9 -10.213   6.733  -3.810
   93    H4*    T   9           H4*        T   9  -8.728   7.015  -2.091
   94    H3*    T   9           H3*        T   9  -9.859   9.341  -2.888
   95   1H2*    T   9          1H2*        T   9  -8.048  10.090  -4.285
   96   2H2*    T   9          2H2*        T   9  -7.662  10.874  -2.764
   97    H1*    T   9           H1*        T   9  -6.145   9.078  -2.105
   98    H3     T   9           H3         T   9  -2.327   9.562  -4.348
   99   1H5M    T   9          1H5M        T   9  -6.287   9.840  -7.986
  100   2H5M    T   9          2H5M        T   9  -4.601  10.258  -8.371
  101   3H5M    T   9          3H5M        T   9  -5.094   8.551  -8.279
  102    H6     T   9           H6         T   9  -6.882   9.391  -5.722
  103   1H5*    G  10          1H5*        G  10  -6.337  10.452  -0.311
  104   2H5*    G  10          2H5*        G  10  -7.245   9.789   1.064
  105    H4*    G  10           H4*        G  10  -6.293  11.184   2.486
  106    H3*    G  10           H3*        G  10  -7.741  13.124   1.406
  107    H1*    G  10           H1*        G  10  -3.791  13.439   0.959
  108    H8     G  10           H8         G  10  -5.884  11.995  -1.968
  109    H1     G  10           H1         G  10   0.350  12.742  -3.148
  110   1H2     G  10          1H2         G  10   0.592  13.565   0.209
  111   2H2     G  10          2H2         G  10   1.430  13.293  -1.306
  112   1H2*    G  10          1H2*        G  10  -6.423  13.671  -0.501
  113   2H2*    G  10          2H2*        G  10  -5.693  14.766   0.663
  114   1H5*    C  11          1H5*        C  11  -3.721  14.429   3.400
  115   2H5*    C  11          2H5*        C  11  -4.332  15.369   4.778
  116    H4*    C  11           H4*        C  11  -2.262  16.287   4.462
  117    H3*    C  11           H3*        C  11  -4.295  18.017   3.887
  118    H1*    C  11           H1*        C  11  -1.151  17.669   1.607
  119   1H4     C  11          1H4         C  11  -3.579  15.342  -4.105
  120   2H4     C  11          2H4         C  11  -1.857  15.560  -4.314
  121    H5     C  11           H5         C  11  -4.715  15.789  -2.012
  122    H6     C  11           H6         C  11  -4.419  16.477   0.309
  123   1H2*    C  11          1H2*        C  11  -4.177  18.002   1.517
  124   2H2*    C  11          2H2*        C  11  -2.940  19.210   1.829
  125   1H5*    G  12          1H5*        G  12   0.082  20.060   3.654
  126   2H5*    G  12          2H5*        G  12  -0.139  21.135   5.051
  127    H4*    G  12           H4*        G  12   1.330  22.322   3.756
  128    H3*    G  12           H3*        G  12  -1.071  23.543   4.013
  129    H1*    G  12           H1*        G  12   0.683  23.297   0.564
  130    H8     G  12           H8         G  12  -2.448  21.048   0.859
  131    H1     G  12           H1         G  12   0.504  21.017  -4.835
  132   1H2     G  12          1H2         G  12   2.820  23.079  -3.299
  133   2H2     G  12          2H2         G  12   2.324  22.247  -4.757
  134    H3T    G  12           H3T        G  12   0.048  25.335   3.509
  135   1H2*    G  12          1H2*        G  12  -2.029  22.928   1.912
  136   2H2*    G  12          2H2*        G  12  -1.229  24.424   1.453
  137   1H5*    C  13          1H5*        C  13   1.769  19.798 -12.110
  138   2H5*    C  13          2H5*        C  13   1.930  21.495 -12.603
  139    H4*    C  13           H4*        C  13   4.348  21.347 -11.969
  140    H3*    C  13           H3*        C  13   4.170  18.670 -11.803
  141    H1*    C  13           H1*        C  13   3.831  20.800  -8.484
  142   1H4     C  13          1H4         C  13  -2.636  20.124  -7.168
  143   2H4     C  13          2H4         C  13  -1.863  20.735  -5.726
  144    H5     C  13           H5         C  13  -1.421  19.643  -9.207
  145    H6     C  13           H6         C  13   0.769  19.672 -10.277
  146    H5T    C  13           H5T        C  13   3.597  19.423 -13.597
  147   1H2*    C  13          1H2*        C  13   2.681  18.426  -9.970
  148   2H2*    C  13          2H2*        C  13   4.185  18.558  -9.067
  149   1H5*    G  14          1H5*        G  14   6.178  19.456  -7.942
  150   2H5*    G  14          2H5*        G  14   7.882  19.093  -8.286
  151    H4*    G  14           H4*        G  14   7.750  18.188  -6.229
  152    H3*    G  14           H3*        G  14   7.829  16.192  -8.068
  153    H1*    G  14           H1*        G  14   5.394  16.123  -5.091
  154    H8     G  14           H8         G  14   3.549  16.587  -8.457
  155    H1     G  14           H1         G  14  -0.147  16.376  -3.221
  156   1H2     G  14          1H2         G  14   2.836  16.286  -1.489
  157   2H2     G  14          2H2         G  14   1.088  16.308  -1.414
  158   1H2*    G  14          1H2*        G  14   5.492  15.671  -8.112
  159   2H2*    G  14          2H2*        G  14   6.028  14.591  -6.833
  160   1H5*    C  15          1H5*        C  15   7.906  15.138  -3.488
  161   2H5*    C  15          2H5*        C  15   9.436  14.245  -3.357
  162    H4*    C  15           H4*        C  15   8.238  13.488  -1.547
  163    H3*    C  15           H3*        C  15   8.805  11.558  -3.362
  164    H1*    C  15           H1*        C  15   5.337  11.844  -1.736
  165   1H4     C  15          1H4         C  15   1.065  13.707  -6.454
  166   2H4     C  15          2H4         C  15   0.131  13.208  -5.064
  167    H5     C  15           H5         C  15   3.474  13.750  -6.470
  168    H6     C  15           H6         C  15   5.496  13.121  -5.237
  169   1H2*    C  15          1H2*        C  15   6.675  11.497  -4.464
  170   2H2*    C  15          2H2*        C  15   6.427  10.285  -3.217
  171   1H5*    A  16          1H5*        A  16   6.007   8.361  -1.867
  172   2H5*    A  16          2H5*        A  16   5.918   9.936  -1.055
  173    H4*    A  16           H4*        A  16   5.806   8.507   1.114
  174    H3*    A  16           H3*        A  16   6.068   6.294  -0.320
  175    H1*    A  16           H1*        A  16   2.293   7.671   0.005
  176    H8     A  16           H8         A  16   4.560   9.004  -2.847
  177   1H6     A  16          1H6         A  16   1.026  10.304  -5.888
  178   2H6     A  16          2H6         A  16  -0.721  10.224  -5.808
  179    H2     A  16           H2         A  16  -1.744   8.365  -1.856
  180   1H2*    A  16          1H2*        A  16   4.302   6.485  -1.875
  181   2H2*    A  16          2H2*        A  16   3.395   5.716  -0.579
  182   1H5*    G  17          1H5*        G  17   2.266   6.870   1.993
  183   2H5*    G  17          2H5*        G  17   2.422   5.734   3.347
  184    H4*    G  17           H4*        G  17   0.121   6.238   3.046
  185    H3*    G  17           H3*        G  17   0.890   3.658   3.211
  186    H1*    G  17           H1*        G  17  -1.604   4.802   0.509
  187    H8     G  17           H8         G  17   1.878   4.011  -0.997
  188    H1     G  17           H1         G  17  -2.728   5.600  -5.176
  189   1H2     G  17          1H2         G  17  -4.660   6.121  -2.360
  190   2H2     G  17          2H2         G  17  -4.569   6.146  -4.106
  191   1H2*    G  17          1H2*        G  17   0.955   3.171   0.860
  192   2H2*    G  17          2H2*        G  17  -0.692   2.703   1.245
  193   1H5*  6MC  18          1H5*      6MC  18  -3.639   4.851   3.358
  194   2H5*  6MC  18          2H5*      6MC  18  -3.311   3.925   1.888
  195    H4*  6MC  18           H4*      6MC  18  -5.797   4.419   3.262
  196    H3*  6MC  18           H3*      6MC  18  -5.146   1.833   3.857
  197   1H2*  6MC  18          1H2*      6MC  18  -6.977   1.133   1.730
  198   2H2*  6MC  18          2H2*      6MC  18  -5.303   0.611   1.888
  199    H1*  6MC  18           H1*      6MC  18  -6.405   2.407  -0.032
  200    H8   6MC  18           H8       6MC  18  -3.078   1.901   1.663
  201   1H6   6MC  18          1H6       6MC  18  -0.383   1.635  -2.254
  202    H2   6MC  18           H2       6MC  18  -5.050   2.106  -4.196
  203   1H1   6MC  18          1H1       6MC  18   0.106   2.444  -4.498
  204   2H1   6MC  18          2H1       6MC  18  -1.091   1.595  -4.969
  205   3H1   6MC  18          3H1       6MC  18   0.176   0.905  -4.424
  206   1H5*    T  19          1H5*        T  19  -8.372   2.495   1.173
  207   2H5*    T  19          2H5*        T  19  -9.931   2.210   1.972
  208    H4*    T  19           H4*        T  19 -10.423   1.531  -0.135
  209    H3*    T  19           H3*        T  19 -10.291  -0.596   1.586
  210   1H2*    T  19          1H2*        T  19  -8.143  -1.402   0.869
  211   2H2*    T  19          2H2*        T  19  -9.211  -2.309  -0.189
  212    H1*    T  19           H1*        T  19  -9.018  -0.634  -1.972
  213    H3     T  19           H3         T  19  -5.114  -1.143  -4.105
  214   1H5M    T  19          1H5M        T  19  -3.565  -0.711   0.883
  215   2H5M    T  19          2H5M        T  19  -2.762  -1.821  -0.251
  216   3H5M    T  19          3H5M        T  19  -4.051  -2.422   0.817
  217    H6     T  19           H6         T  19  -6.271  -0.789   0.517
  218   1H5*    C  20          1H5*        C  20 -10.184  -3.906  -1.270
  219   2H5*    C  20          2H5*        C  20 -10.099  -2.272  -1.956
  220    H4*    C  20           H4*        C  20 -11.704  -3.247  -3.756
  221    H3*    C  20           H3*        C  20 -11.639  -5.591  -2.443
  222    H1*    C  20           H1*        C  20  -8.789  -4.973  -5.217
  223   1H4     C  20          1H4         C  20  -3.742  -4.124  -0.998
  224   2H4     C  20          2H4         C  20  -3.074  -4.397  -2.590
  225    H5     C  20           H5         C  20  -6.128  -4.074  -0.575
  226    H6     C  20           H6         C  20  -8.328  -4.254  -1.582
  227   1H2*    C  20          1H2*        C  20  -9.366  -6.186  -2.540
  228   2H2*    C  20          2H2*        C  20  -9.796  -6.744  -4.151
  229   1H5*    T  21          1H5*        T  21 -10.408  -6.409  -6.552
  230   2H5*    T  21          2H5*        T  21 -11.658  -7.362  -7.379
  231    H4*    T  21           H4*        T  21  -9.741  -8.263  -8.233
  232    H3*    T  21           H3*        T  21 -11.108 -10.019  -6.642
  233   1H2*    T  21          1H2*        T  21  -9.672  -9.845  -4.722
  234   2H2*    T  21          2H2*        T  21  -8.919 -11.179  -5.581
  235    H1*    T  21           H1*        T  21  -7.338  -9.687  -6.709
  236    H3     T  21           H3         T  21  -4.079  -8.619  -3.877
  237   1H5M    T  21          1H5M        T  21  -8.771  -7.811  -1.317
  238   2H5M    T  21          2H5M        T  21  -7.412  -6.714  -0.977
  239   3H5M    T  21          3H5M        T  21  -7.351  -8.402  -0.420
  240    H6     T  21           H6         T  21  -8.827  -8.365  -3.572
  241   1H5*    C  22          1H5*        C  22  -7.956 -13.874  -6.616
  242   2H5*    C  22          2H5*        C  22  -7.681 -12.123  -6.723
  243    H4*    C  22           H4*        C  22  -6.430 -13.082  -8.972
  244    H3*    C  22           H3*        C  22  -6.654 -15.448  -7.779
  245    H1*    C  22           H1*        C  22  -3.534 -13.227  -6.750
  246   1H4     C  22          1H4         C  22  -5.443 -10.805  -0.874
  247   2H4     C  22          2H4         C  22  -3.704 -10.998  -0.832
  248    H5     C  22           H5         C  22  -6.778 -11.427  -2.821
  249    H6     C  22           H6         C  22  -6.711 -12.450  -5.026
  250   1H2*    C  22          1H2*        C  22  -5.757 -14.944  -5.626
  251   2H2*    C  22          2H2*        C  22  -4.280 -15.430  -6.444
  252   1H5*    G  23          1H5*        G  23  -2.513 -14.125  -8.554
  253   2H5*    G  23          2H5*        G  23  -1.991 -15.033  -9.989
  254    H4*    G  23           H4*        G  23  -0.014 -14.376  -8.967
  255    H3*    G  23           H3*        G  23  -0.397 -17.070  -9.184
  256    H1*    G  23           H1*        G  23   1.030 -15.410  -6.016
  257    H8     G  23           H8         G  23  -2.554 -16.786  -5.454
  258    H1     G  23           H1         G  23   0.473 -14.545  -0.265
  259   1H2     G  23          1H2         G  23   3.009 -13.732  -2.473
  260   2H2     G  23          2H2         G  23   2.437 -13.735  -0.818
  261   1H2*    G  23          1H2*        G  23  -0.985 -17.525  -6.915
  262   2H2*    G  23          2H2*        G  23   0.763 -17.664  -6.803
  263   1H5*    C  24          1H5*        C  24   3.065 -17.057  -6.859
  264   2H5*    C  24          2H5*        C  24   3.932 -15.721  -7.639
  265    H4*    C  24           H4*        C  24   5.911 -16.461  -6.973
  266    H3*    C  24           H3*        C  24   5.622 -18.546  -8.588
  267    H1*    C  24           H1*        C  24   5.571 -19.378  -4.652
  268   1H4     C  24          1H4         C  24  -0.949 -20.361  -4.015
  269   2H4     C  24          2H4         C  24  -0.249 -20.452  -2.417
  270    H5     C  24           H5         C  24   0.354 -19.837  -5.990
  271    H6     C  24           H6         C  24   2.578 -19.286  -6.820
  272    H3T    C  24           H3T        C  24   7.433 -17.823  -6.659
  273   1H2*    C  24          1H2*        C  24   4.294 -20.018  -7.290
  274   2H2*    C  24          2H2*        C  24   5.865 -20.493  -6.662
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -0.158 -20.145   8.487
    2   2H5*    G   1          2H5*        G   1   1.056 -21.307   9.056
    3    H4*    G   1           H4*        G   1   2.834 -19.759   8.547
    4    H3*    G   1           H3*        G   1   1.153 -17.649   8.762
    5    H1*    G   1           H1*        G   1   2.410 -18.855   5.304
    6    H8     G   1           H8         G   1  -1.245 -19.960   6.018
    7    H1     G   1           H1         G   1   0.794 -20.621  -0.027
    8   1H2     G   1          1H2         G   1   3.794 -19.388   1.180
    9   2H2     G   1          2H2         G   1   2.895 -19.989  -0.200
   10    H5T    G   1           H5T        G   1  -0.047 -19.897  10.668
   11   1H2*    G   1          1H2*        G   1  -0.124 -17.990   6.770
   12   2H2*    G   1          2H2*        G   1   1.171 -16.986   6.134
   13   1H5*    C   2          1H5*        C   2   4.915 -13.557   7.243
   14   2H5*    C   2          2H5*        C   2   3.300 -13.527   6.503
   15    H4*    C   2           H4*        C   2   5.947 -14.179   5.227
   16    H3*    C   2           H3*        C   2   4.906 -11.732   5.345
   17    H1*    C   2           H1*        C   2   3.904 -13.980   2.296
   18   1H4     C   2          1H4         C   2  -2.204 -16.144   3.685
   19   2H4     C   2          2H4         C   2  -2.183 -15.704   1.989
   20    H5     C   2           H5         C   2  -0.256 -15.839   5.137
   21    H6     C   2           H6         C   2   1.990 -14.921   5.264
   22   1H2*    C   2          1H2*        C   2   2.729 -12.190   4.456
   23   2H2*    C   2          2H2*        C   2   3.580 -11.729   2.989
   24   1H5*    G   3          1H5*        G   3   6.006 -13.188   1.236
   25   2H5*    G   3          2H5*        G   3   7.579 -12.399   1.001
   26    H4*    G   3           H4*        G   3   6.953 -12.970  -1.140
   27    H3*    G   3           H3*        G   3   7.190 -10.303  -0.732
   28    H1*    G   3           H1*        G   3   4.171 -11.776  -2.659
   29    H8     G   3           H8         G   3   3.237 -11.230   1.063
   30    H1     G   3           H1         G   3  -1.639 -11.324  -3.095
   31   1H2     G   3          1H2         G   3   0.833 -11.755  -5.490
   32   2H2     G   3          2H2         G   3  -0.877 -11.630  -5.149
   33   1H2*    G   3          1H2*        G   3   4.875  -9.765  -0.473
   34   2H2*    G   3          2H2*        G   3   5.034  -9.588  -2.214
   35   1H5*    A   4          1H5*        A   4   5.031 -11.209  -4.961
   36   2H5*    A   4          2H5*        A   4   6.559 -10.956  -5.829
   37    H4*    A   4           H4*        A   4   5.158 -10.257  -7.439
   38    H3*    A   4           H3*        A   4   6.349  -8.088  -6.351
   39    H1*    A   4           H1*        A   4   2.522  -8.146  -6.977
   40    H8     A   4           H8         A   4   3.460  -8.143  -3.236
   41   1H6     A   4          1H6         A   4  -1.041  -8.153  -1.447
   42   2H6     A   4          2H6         A   4  -2.627  -8.253  -2.180
   43    H2     A   4           H2         A   4  -1.986  -8.573  -6.609
   44   1H2*    A   4          1H2*        A   4   4.600  -7.416  -4.864
   45   2H2*    A   4          2H2*        A   4   4.141  -6.516  -6.302
   46   1H5*    G   5          1H5*        G   5   3.484  -7.483 -10.041
   47   2H5*    G   5          2H5*        G   5   4.490  -6.587 -11.197
   48    H4*    G   5           H4*        G   5   2.330  -6.026 -11.790
   49    H3*    G   5           H3*        G   5   3.873  -3.936 -10.948
   50    H1*    G   5           H1*        G   5   0.175  -4.377  -9.845
   51    H8     G   5           H8         G   5   2.733  -5.190  -7.045
   52    H1     G   5           H1         G   5  -3.397  -4.672  -5.229
   53   1H2     G   5          1H2         G   5  -4.019  -4.096  -8.573
   54   2H2     G   5          2H2         G   5  -4.673  -4.267  -6.959
   55   1H2*    G   5          1H2*        G   5   2.929  -3.615  -8.784
   56   2H2*    G   5          2H2*        G   5   1.798  -2.646  -9.720
   57   1H5*    A   6          1H5*        A   6  -0.667  -3.054 -11.329
   58   2H5*    A   6          2H5*        A   6  -0.131  -3.377 -12.992
   59    H4*    A   6           H4*        A   6  -2.033  -2.495 -13.679
   60    H3*    A   6           H3*        A   6  -0.455  -0.363 -13.713
   61    H1*    A   6           H1*        A   6  -3.560  -0.105 -11.088
   62    H8     A   6           H8         A   6   0.085  -0.939 -10.069
   63   1H6     A   6          1H6         A   6  -0.733  -1.425  -5.312
   64   2H6     A   6          2H6         A   6  -2.171  -1.353  -4.325
   65    H2     A   6           H2         A   6  -5.588  -0.498  -7.100
   66   1H2*    A   6          1H2*        A   6  -0.746   0.618 -11.591
   67   2H2*    A   6          2H2*        A   6  -2.230   1.254 -12.292
   68   1H5*    T   7          1H5*        T   7  -4.769   0.095 -13.734
   69   2H5*    T   7          2H5*        T   7  -5.533   1.129 -14.957
   70    H4*    T   7           H4*        T   7  -6.921   1.212 -13.076
   71    H3*    T   7           H3*        T   7  -5.912   3.596 -13.988
   72   1H2*    T   7          1H2*        T   7  -4.310   3.984 -12.259
   73   2H2*    T   7          2H2*        T   7  -5.730   4.667 -11.483
   74    H1*    T   7           H1*        T   7  -6.210   2.670 -10.257
   75    H3     T   7           H3         T   7  -3.257   1.929  -6.973
   76   1H5M    T   7          1H5M        T   7   0.184   3.583  -9.605
   77   2H5M    T   7          2H5M        T   7  -0.492   3.596 -11.251
   78   3H5M    T   7          3H5M        T   7   0.105   2.074 -10.545
   79    H6     T   7           H6         T   7  -2.778   3.084 -11.565
   80   1H5*    C   8          1H5*        C   8  -9.796   7.071 -11.286
   81   2H5*    C   8          2H5*        C   8  -8.068   6.844 -10.940
   82    H4*    C   8           H4*        C   8 -10.317   5.523  -9.422
   83    H3*    C   8           H3*        C   8  -9.955   8.159  -9.145
   84    H1*    C   8           H1*        C   8  -7.904   5.760  -6.872
   85   1H4     C   8          1H4         C   8  -1.753   5.731  -9.328
   86   2H4     C   8          2H4         C   8  -1.611   5.705  -7.586
   87    H5     C   8           H5         C   8  -3.890   5.879 -10.461
   88    H6     C   8           H6         C   8  -6.298   6.141 -10.152
   89   1H2*    C   8          1H2*        C   8  -7.602   8.163  -8.716
   90   2H2*    C   8          2H2*        C   8  -8.229   8.106  -7.078
   91   1H5*    T   9          1H5*        T   9  -8.842   6.230  -4.875
   92   2H5*    T   9          2H5*        T   9 -10.349   6.754  -4.093
   93    H4*    T   9           H4*        T   9  -8.777   6.993  -2.421
   94    H3*    T   9           H3*        T   9  -9.964   9.302  -3.182
   95   1H2*    T   9          1H2*        T   9  -8.218  10.069  -4.647
   96   2H2*    T   9          2H2*        T   9  -7.784  10.862  -3.146
   97    H1*    T   9           H1*        T   9  -6.218   9.085  -2.541
   98    H3     T   9           H3         T   9  -2.503   9.631  -4.939
   99   1H5M    T   9          1H5M        T   9  -4.980  10.296  -8.860
  100   2H5M    T   9          2H5M        T   9  -5.374   8.563  -8.762
  101   3H5M    T   9          3H5M        T   9  -6.623   9.782  -8.409
  102    H6     T   9           H6         T   9  -7.106   9.369  -6.124
  103   1H5*    G  10          1H5*        G  10  -6.402  10.399  -0.620
  104   2H5*    G  10          2H5*        G  10  -7.303   9.753   0.766
  105    H4*    G  10           H4*        G  10  -6.296  11.124   2.165
  106    H3*    G  10           H3*        G  10  -7.800  13.060   1.127
  107    H1*    G  10           H1*        G  10  -3.842  13.408   0.589
  108    H8     G  10           H8         G  10  -6.075  11.982  -2.241
  109    H1     G  10           H1         G  10   0.048  12.951  -3.780
  110   1H2     G  10          1H2         G  10   0.463  13.724  -0.424
  111   2H2     G  10          2H2         G  10   1.219  13.514  -1.991
  112   1H2*    G  10          1H2*        G  10  -6.516  13.721  -0.753
  113   2H2*    G  10          2H2*        G  10  -5.735  14.740   0.446
  114   1H5*    C  11          1H5*        C  11  -3.612  14.043   2.807
  115   2H5*    C  11          2H5*        C  11  -4.287  14.533   4.375
  116    H4*    C  11           H4*        C  11  -2.226  15.459   4.531
  117    H3*    C  11           H3*        C  11  -4.068  17.376   4.338
  118    H1*    C  11           H1*        C  11  -1.025  17.517   1.821
  119   1H4     C  11          1H4         C  11  -3.870  15.630  -3.864
  120   2H4     C  11          2H4         C  11  -2.186  15.958  -4.197
  121    H5     C  11           H5         C  11  -4.827  15.828  -1.646
  122    H6     C  11           H6         C  11  -4.355  16.331   0.693
  123   1H2*    C  11          1H2*        C  11  -4.038  17.782   1.991
  124   2H2*    C  11          2H2*        C  11  -2.793  18.916   2.490
  125   1H5*    G  12          1H5*        G  12   0.165  18.552   4.704
  126   2H5*    G  12          2H5*        G  12   0.395  18.990   6.409
  127    H4*    G  12           H4*        G  12   2.220  19.996   5.557
  128    H3*    G  12           H3*        G  12   0.497  21.897   6.254
  129    H1*    G  12           H1*        G  12   1.793  21.970   2.482
  130    H8     G  12           H8         G  12  -1.824  20.908   3.183
  131    H1     G  12           H1         G  12   0.121  20.201  -2.886
  132   1H2     G  12          1H2         G  12   3.232  21.087  -1.674
  133   2H2     G  12          2H2         G  12   2.270  20.629  -3.059
  134    H3T    G  12           H3T        G  12   2.940  22.187   4.841
  135   1H2*    G  12          1H2*        G  12  -0.665  22.252   4.210
  136   2H2*    G  12          2H2*        G  12   0.661  23.379   3.964
  137   1H5*    C  13          1H5*        C  13   0.244  21.239 -10.440
  138   2H5*    C  13          2H5*        C  13   0.095  22.931  -9.928
  139    H4*    C  13           H4*        C  13   2.674  22.964 -10.158
  140    H3*    C  13           H3*        C  13   2.565  20.428 -11.034
  141    H1*    C  13           H1*        C  13   3.040  21.032  -7.123
  142   1H4     C  13          1H4         C  13  -2.978  19.250  -4.968
  143   2H4     C  13          2H4         C  13  -1.933  19.376  -3.576
  144    H5     C  13           H5         C  13  -2.218  19.683  -7.226
  145    H6     C  13           H6         C  13  -0.311  20.333  -8.597
  146    H5T    C  13           H5T        C  13   1.767  22.465 -12.091
  147   1H2*    C  13          1H2*        C  13   1.634  19.311  -9.164
  148   2H2*    C  13          2H2*        C  13   3.315  19.295  -8.645
  149   1H5*    G  14          1H5*        G  14   5.547  20.599  -7.883
  150   2H5*    G  14          2H5*        G  14   7.195  20.278  -8.464
  151    H4*    G  14           H4*        G  14   7.230  19.191  -6.469
  152    H3*    G  14           H3*        G  14   7.270  17.431  -8.559
  153    H1*    G  14           H1*        G  14   5.159  16.894  -5.392
  154    H8     G  14           H8         G  14   2.974  17.210  -8.539
  155    H1     G  14           H1         G  14  -0.200  16.861  -2.979
  156   1H2     G  14          1H2         G  14   2.930  17.100  -1.531
  157   2H2     G  14          2H2         G  14   1.201  16.965  -1.292
  158   1H2*    G  14          1H2*        G  14   4.995  16.710  -8.440
  159   2H2*    G  14          2H2*        G  14   5.726  15.570  -7.319
  160   1H5*    C  15          1H5*        C  15   7.357  15.889  -4.075
  161   2H5*    C  15          2H5*        C  15   8.950  15.106  -4.107
  162    H4*    C  15           H4*        C  15   7.843  14.070  -2.360
  163    H3*    C  15           H3*        C  15   8.585  12.418  -4.385
  164    H1*    C  15           H1*        C  15   5.161  12.164  -2.679
  165   1H4     C  15          1H4         C  15   0.548  13.886  -7.121
  166   2H4     C  15          2H4         C  15  -0.285  13.360  -5.678
  167    H5     C  15           H5         C  15   2.949  14.025  -7.274
  168    H6     C  15           H6         C  15   5.061  13.506  -6.148
  169   1H2*    C  15          1H2*        C  15   6.446  12.227  -5.455
  170   2H2*    C  15          2H2*        C  15   6.362  10.877  -4.331
  171   1H5*    A  16          1H5*        A  16   6.076   8.751  -3.049
  172   2H5*    A  16          2H5*        A  16   5.917  10.320  -2.236
  173    H4*    A  16           H4*        A  16   6.016   8.867  -0.066
  174    H3*    A  16           H3*        A  16   6.292   6.684  -1.531
  175    H1*    A  16           H1*        A  16   2.486   7.891  -1.004
  176    H8     A  16           H8         A  16   4.529   9.371  -3.955
  177   1H6     A  16          1H6         A  16   0.759  10.651  -6.718
  178   2H6     A  16          2H6         A  16  -0.974  10.495  -6.534
  179    H2     A  16           H2         A  16  -1.676   8.466  -2.596
  180   1H2*    A  16          1H2*        A  16   4.452   6.848  -3.016
  181   2H2*    A  16          2H2*        A  16   3.639   6.003  -1.705
  182   1H5*    G  17          1H5*        G  17   2.631   7.169   0.916
  183   2H5*    G  17          2H5*        G  17   2.918   6.106   2.309
  184    H4*    G  17           H4*        G  17   0.598   6.549   2.209
  185    H3*    G  17           H3*        G  17   1.409   3.989   2.366
  186    H1*    G  17           H1*        G  17  -1.308   5.010  -0.182
  187    H8     G  17           H8         G  17   2.096   4.283  -1.874
  188    H1     G  17           H1         G  17  -2.770   5.674  -5.819
  189   1H2     G  17          1H2         G  17  -4.569   6.194  -2.922
  190   2H2     G  17          2H2         G  17  -4.565   6.183  -4.670
  191   1H2*    G  17          1H2*        G  17   1.311   3.451   0.027
  192   2H2*    G  17          2H2*        G  17  -0.293   2.959   0.545
  193   1H5*  6MC  18          1H5*      6MC  18  -3.112   5.136   2.805
  194   2H5*  6MC  18          2H5*      6MC  18  -2.861   4.189   1.334
  195    H4*  6MC  18           H4*      6MC  18  -5.270   4.693   2.824
  196    H3*  6MC  18           H3*      6MC  18  -4.551   2.151   3.499
  197   1H2*  6MC  18          1H2*      6MC  18  -6.456   1.303   1.500
  198   2H2*  6MC  18          2H2*      6MC  18  -4.760   0.842   1.590
  199    H1*  6MC  18           H1*      6MC  18  -6.024   2.527  -0.340
  200    H8   6MC  18           H8       6MC  18  -2.612   2.086   1.181
  201   1H6   6MC  18          1H6       6MC  18  -0.114   1.747  -2.851
  202    H2   6MC  18           H2       6MC  18  -4.870   2.179  -4.578
  203   1H1   6MC  18          1H1       6MC  18  -0.511   2.472  -5.416
  204   2H1   6MC  18          2H1       6MC  18  -0.548   0.931  -5.342
  205   3H1   6MC  18          3H1       6MC  18   0.725   1.692  -4.927
  206   1H5*    T  19          1H5*        T  19  -7.933   2.612   0.974
  207   2H5*    T  19          2H5*        T  19  -9.447   2.286   1.839
  208    H4*    T  19           H4*        T  19  -9.968   1.511  -0.232
  209    H3*    T  19           H3*        T  19  -9.728  -0.528   1.577
  210   1H2*    T  19          1H2*        T  19  -7.571  -1.298   0.850
  211   2H2*    T  19          2H2*        T  19  -8.630  -2.288  -0.140
  212    H1*    T  19           H1*        T  19  -8.526  -0.698  -2.006
  213    H3     T  19           H3         T  19  -4.630  -1.069  -4.190
  214   1H5M    T  19          1H5M        T  19  -2.987  -0.581   0.737
  215   2H5M    T  19          2H5M        T  19  -2.239  -1.758  -0.369
  216   3H5M    T  19          3H5M        T  19  -3.517  -2.280   0.754
  217    H6     T  19           H6         T  19  -5.741  -0.735   0.442
  218   1H5*    C  20          1H5*        C  20  -9.622  -3.988  -1.256
  219   2H5*    C  20          2H5*        C  20  -9.593  -2.305  -1.815
  220    H4*    C  20           H4*        C  20 -11.245  -3.162  -3.626
  221    H3*    C  20           H3*        C  20 -11.130  -5.591  -2.497
  222    H1*    C  20           H1*        C  20  -8.389  -4.760  -5.318
  223   1H4     C  20          1H4         C  20  -3.171  -4.066  -1.285
  224   2H4     C  20          2H4         C  20  -2.564  -4.366  -2.897
  225    H5     C  20           H5         C  20  -5.531  -3.975  -0.775
  226    H6     C  20           H6         C  20  -7.772  -4.117  -1.696
  227   1H2*    C  20          1H2*        C  20  -8.847  -6.151  -2.701
  228   2H2*    C  20          2H2*        C  20  -9.328  -6.615  -4.326
  229   1H5*    T  21          1H5*        T  21 -11.412  -9.577  -5.374
  230   2H5*    T  21          2H5*        T  21 -10.312  -8.424  -4.593
  231    H4*    T  21           H4*        T  21 -10.380  -8.355  -7.539
  232    H3*    T  21           H3*        T  21 -10.302 -10.919  -6.686
  233   1H2*    T  21          1H2*        T  21  -8.401 -10.777  -5.247
  234   2H2*    T  21          2H2*        T  21  -7.602 -11.178  -6.761
  235    H1*    T  21           H1*        T  21  -7.018  -8.916  -7.227
  236    H3     T  21           H3         T  21  -3.615  -8.571  -4.328
  237   1H5M    T  21          1H5M        T  21  -6.762  -8.445  -0.764
  238   2H5M    T  21          2H5M        T  21  -8.227  -7.868  -1.594
  239   3H5M    T  21          3H5M        T  21  -6.880  -6.747  -1.283
  240    H6     T  21           H6         T  21  -8.355  -8.328  -3.868
  241   1H5*    C  22          1H5*        C  22  -8.095 -14.308  -8.514
  242   2H5*    C  22          2H5*        C  22  -7.837 -13.047  -7.290
  243    H4*    C  22           H4*        C  22  -5.852 -13.348  -9.489
  244    H3*    C  22           H3*        C  22  -6.394 -15.669  -8.161
  245    H1*    C  22           H1*        C  22  -3.549 -13.292  -7.147
  246   1H4     C  22          1H4         C  22  -5.142 -10.631  -1.285
  247   2H4     C  22          2H4         C  22  -3.398 -10.806  -1.337
  248    H5     C  22           H5         C  22  -6.581 -11.372  -3.110
  249    H6     C  22           H6         C  22  -6.628 -12.493  -5.270
  250   1H2*    C  22          1H2*        C  22  -5.832 -14.942  -5.953
  251   2H2*    C  22          2H2*        C  22  -4.258 -15.504  -6.499
  252   1H5*    G  23          1H5*        G  23  -2.527 -15.381  -7.813
  253   2H5*    G  23          2H5*        G  23  -1.574 -15.240  -9.304
  254    H4*    G  23           H4*        G  23   0.182 -16.199  -8.378
  255    H3*    G  23           H3*        G  23  -1.334 -18.488  -8.389
  256    H1*    G  23           H1*        G  23   0.506 -17.137  -5.311
  257    H8     G  23           H8         G  23  -3.285 -17.318  -4.711
  258    H1     G  23           H1         G  23   0.122 -14.538  -0.045
  259   1H2     G  23          1H2         G  23   2.771 -14.779  -2.256
  260   2H2     G  23          2H2         G  23   2.208 -14.268  -0.679
  261   1H2*    G  23          1H2*        G  23  -2.182 -18.334  -6.160
  262   2H2*    G  23          2H2*        G  23  -0.672 -19.178  -5.846
  263   1H5*    C  24          1H5*        C  24   2.994 -18.552  -7.351
  264   2H5*    C  24          2H5*        C  24   3.951 -19.652  -8.367
  265    H4*    C  24           H4*        C  24   5.087 -19.328  -6.297
  266    H3*    C  24           H3*        C  24   4.630 -21.851  -7.221
  267    H1*    C  24           H1*        C  24   4.105 -20.877  -3.518
  268   1H4     C  24          1H4         C  24  -2.408 -21.455  -2.408
  269   2H4     C  24          2H4         C  24  -1.627 -21.171  -0.869
  270    H5     C  24           H5         C  24  -1.189 -21.547  -4.502
  271    H6     C  24           H6         C  24   1.015 -21.386  -5.533
  272    H3T    C  24           H3T        C  24   6.562 -21.777  -6.442
  273   1H2*    C  24          1H2*        C  24   2.810 -22.439  -5.800
  274   2H2*    C  24          2H2*        C  24   4.149 -22.919  -4.768
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -0.703 -20.646   7.795
    2   2H5*    G   1          2H5*        G   1   0.374 -22.037   8.019
    3    H4*    G   1           H4*        G   1   2.293 -20.415   7.994
    4    H3*    G   1           H3*        G   1   0.514 -18.361   8.159
    5    H1*    G   1           H1*        G   1   2.208 -19.338   4.807
    6    H8     G   1           H8         G   1  -1.466 -20.574   5.040
    7    H1     G   1           H1         G   1   1.165 -20.591  -0.809
    8   1H2     G   1          1H2         G   1   3.988 -19.396   0.796
    9   2H2     G   1          2H2         G   1   3.248 -19.885  -0.715
   10    H5T    G   1           H5T        G   1   1.235 -20.773   9.863
   11   1H2*    G   1          1H2*        G   1  -0.485 -18.550   6.003
   12   2H2*    G   1          2H2*        G   1   0.882 -17.523   5.596
   13   1H5*    C   2          1H5*        C   2   4.194 -14.014   7.409
   14   2H5*    C   2          2H5*        C   2   2.630 -14.044   6.567
   15    H4*    C   2           H4*        C   2   5.386 -14.446   5.418
   16    H3*    C   2           H3*        C   2   4.239 -12.058   5.670
   17    H1*    C   2           H1*        C   2   3.472 -14.085   2.398
   18   1H4     C   2          1H4         C   2  -2.575 -16.630   3.332
   19   2H4     C   2          2H4         C   2  -2.492 -16.062   1.677
   20    H5     C   2           H5         C   2  -0.709 -16.336   4.904
   21    H6     C   2           H6         C   2   1.479 -15.325   5.203
   22   1H2*    C   2          1H2*        C   2   2.131 -12.519   4.629
   23   2H2*    C   2          2H2*        C   2   3.036 -11.917   3.249
   24   1H5*    G   3          1H5*        G   3   5.762 -13.171   1.671
   25   2H5*    G   3          2H5*        G   3   7.296 -12.297   1.477
   26    H4*    G   3           H4*        G   3   6.712 -12.923  -0.677
   27    H3*    G   3           H3*        G   3   6.917 -10.245  -0.250
   28    H1*    G   3           H1*        G   3   4.047 -11.786  -2.310
   29    H8     G   3           H8         G   3   2.823 -11.299   1.327
   30    H1     G   3           H1         G   3  -1.709 -11.220  -3.205
   31   1H2     G   3          1H2         G   3   0.939 -11.608  -5.406
   32   2H2     G   3          2H2         G   3  -0.795 -11.474  -5.193
   33   1H2*    G   3          1H2*        G   3   4.586  -9.731  -0.114
   34   2H2*    G   3          2H2*        G   3   4.832  -9.564  -1.846
   35   1H5*    A   4          1H5*        A   4   4.846 -11.074  -4.396
   36   2H5*    A   4          2H5*        A   4   6.429 -11.083  -5.202
   37    H4*    A   4           H4*        A   4   5.274 -10.372  -6.969
   38    H3*    A   4           H3*        A   4   6.460  -8.191  -5.983
   39    H1*    A   4           H1*        A   4   2.648  -8.062  -6.725
   40    H8     A   4           H8         A   4   3.451  -8.116  -2.949
   41   1H6     A   4          1H6         A   4  -1.125  -8.040  -1.338
   42   2H6     A   4          2H6         A   4  -2.683  -8.088  -2.130
   43    H2     A   4           H2         A   4  -1.869  -8.345  -6.537
   44   1H2*    A   4          1H2*        A   4   4.689  -7.430  -4.548
   45   2H2*    A   4          2H2*        A   4   4.339  -6.525  -6.014
   46   1H5*    G   5          1H5*        G   5   3.943  -4.966  -7.818
   47   2H5*    G   5          2H5*        G   5   3.445  -6.640  -8.133
   48    H4*    G   5           H4*        G   5   3.117  -5.764 -10.575
   49    H3*    G   5           H3*        G   5   3.946  -3.365  -9.855
   50    H1*    G   5           H1*        G   5   0.054  -4.074  -9.176
   51    H8     G   5           H8         G   5   2.635  -4.917  -6.402
   52    H1     G   5           H1         G   5  -3.492  -4.531  -4.565
   53   1H2     G   5          1H2         G   5  -4.134  -3.827  -7.878
   54   2H2     G   5          2H2         G   5  -4.780  -4.076  -6.272
   55   1H2*    G   5          1H2*        G   5   2.555  -2.919  -7.974
   56   2H2*    G   5          2H2*        G   5   1.519  -2.266  -9.234
   57   1H5*    A   6          1H5*        A   6  -0.471  -3.075 -10.918
   58   2H5*    A   6          2H5*        A   6   0.128  -3.342 -12.568
   59    H4*    A   6           H4*        A   6  -1.806  -2.544 -13.272
   60    H3*    A   6           H3*        A   6  -0.282  -0.367 -13.313
   61    H1*    A   6           H1*        A   6  -3.459  -0.156 -10.774
   62    H8     A   6           H8         A   6   0.180  -0.826  -9.661
   63   1H6     A   6          1H6         A   6  -0.706  -1.246  -4.891
   64   2H6     A   6          2H6         A   6  -2.173  -1.199  -3.947
   65    H2     A   6           H2         A   6  -5.548  -0.482  -6.793
   66   1H2*    A   6          1H2*        A   6  -0.656   0.652 -11.221
   67   2H2*    A   6          2H2*        A   6  -2.143   1.221 -11.972
   68   1H5*    T   7          1H5*        T   7  -4.660  -0.006 -13.420
   69   2H5*    T   7          2H5*        T   7  -5.364   1.003 -14.700
   70    H4*    T   7           H4*        T   7  -6.836   1.125 -12.882
   71    H3*    T   7           H3*        T   7  -5.800   3.480 -13.819
   72   1H2*    T   7          1H2*        T   7  -4.253   3.919 -12.056
   73   2H2*    T   7          2H2*        T   7  -5.694   4.632 -11.350
   74    H1*    T   7           H1*        T   7  -6.212   2.681 -10.065
   75    H3     T   7           H3         T   7  -3.355   1.912  -6.704
   76   1H5M    T   7          1H5M        T   7   0.138   3.653  -9.254
   77   2H5M    T   7          2H5M        T   7  -0.469   3.562 -10.924
   78   3H5M    T   7          3H5M        T   7   0.132   2.095 -10.113
   79    H6     T   7           H6         T   7  -2.752   3.137 -11.261
   80   1H5*    C   8          1H5*        C   8  -9.725   6.411 -11.114
   81   2H5*    C   8          2H5*        C   8  -8.283   7.231 -10.480
   82    H4*    C   8           H4*        C   8 -10.210   5.410  -9.141
   83    H3*    C   8           H3*        C   8  -9.883   8.021  -8.764
   84    H1*    C   8           H1*        C   8  -7.805   5.614  -6.457
   85   1H4     C   8          1H4         C   8  -1.719   5.695  -9.073
   86   2H4     C   8          2H4         C   8  -1.540   5.634  -7.336
   87    H5     C   8           H5         C   8  -3.890   5.850 -10.150
   88    H6     C   8           H6         C   8  -6.292   6.073  -9.774
   89   1H2*    C   8          1H2*        C   8  -7.551   8.058  -8.237
   90   2H2*    C   8          2H2*        C   8  -8.231   7.927  -6.625
   91   1H5*    T   9          1H5*        T   9  -8.841   6.092  -4.524
   92   2H5*    T   9          2H5*        T   9 -10.340   6.601  -3.719
   93    H4*    T   9           H4*        T   9  -8.748   6.867  -2.074
   94    H3*    T   9           H3*        T   9  -9.955   9.172  -2.831
   95   1H2*    T   9          1H2*        T   9  -8.219   9.943  -4.310
   96   2H2*    T   9          2H2*        T   9  -7.774  10.736  -2.809
   97    H1*    T   9           H1*        T   9  -6.213   8.955  -2.210
   98    H3     T   9           H3         T   9  -2.491   9.474  -4.599
   99   1H5M    T   9          1H5M        T   9  -6.607   9.738  -8.067
  100   2H5M    T   9          2H5M        T   9  -4.961  10.254  -8.504
  101   3H5M    T   9          3H5M        T   9  -5.363   8.520  -8.444
  102    H6     T   9           H6         T   9  -7.096   9.298  -5.792
  103   1H5*    G  10          1H5*        G  10  -6.670  10.590  -0.455
  104   2H5*    G  10          2H5*        G  10  -6.846   9.361   0.813
  105    H4*    G  10           H4*        G  10  -6.147  10.776   2.482
  106    H3*    G  10           H3*        G  10  -7.673  12.771   1.619
  107    H1*    G  10           H1*        G  10  -3.764  13.116   0.936
  108    H8     G  10           H8         G  10  -6.036  11.866  -1.947
  109    H1     G  10           H1         G  10   0.108  12.746  -3.471
  110   1H2     G  10          1H2         G  10   0.561  13.356  -0.093
  111   2H2     G  10          2H2         G  10   1.297  13.190  -1.673
  112   1H2*    G  10          1H2*        G  10  -6.485  13.444  -0.333
  113   2H2*    G  10          2H2*        G  10  -5.673  14.463   0.847
  114   1H5*    C  11          1H5*        C  11  -3.563  13.922   3.381
  115   2H5*    C  11          2H5*        C  11  -4.048  14.712   4.894
  116    H4*    C  11           H4*        C  11  -2.004  15.654   4.537
  117    H3*    C  11           H3*        C  11  -4.036  17.443   4.254
  118    H1*    C  11           H1*        C  11  -1.076  17.284   1.724
  119   1H4     C  11          1H4         C  11  -3.903  15.357  -3.955
  120   2H4     C  11          2H4         C  11  -2.205  15.626  -4.274
  121    H5     C  11           H5         C  11  -4.885  15.624  -1.753
  122    H6     C  11           H6         C  11  -4.426  16.161   0.580
  123   1H2*    C  11          1H2*        C  11  -4.101  17.609   1.885
  124   2H2*    C  11          2H2*        C  11  -2.844  18.796   2.203
  125   1H5*    G  12          1H5*        G  12   0.319  19.335   4.009
  126   2H5*    G  12          2H5*        G  12   0.277  20.210   5.554
  127    H4*    G  12           H4*        G  12   1.776  21.454   4.363
  128    H3*    G  12           H3*        G  12  -0.481  22.827   4.897
  129    H1*    G  12           H1*        G  12   1.021  22.870   1.310
  130    H8     G  12           H8         G  12  -2.187  20.727   1.638
  131    H1     G  12           H1         G  12   0.234  21.280  -4.274
  132   1H2     G  12          1H2         G  12   2.767  23.071  -2.736
  133   2H2     G  12          2H2         G  12   2.107  22.435  -4.227
  134    H3T    G  12           H3T        G  12   1.797  23.664   3.419
  135   1H2*    G  12          1H2*        G  12  -1.610  22.529   2.812
  136   2H2*    G  12          2H2*        G  12  -0.726  24.010   2.472
  137   1H5*    C  13          1H5*        C  13   0.603  20.711 -11.701
  138   2H5*    C  13          2H5*        C  13   0.830  22.415 -12.139
  139    H4*    C  13           H4*        C  13   3.264  22.127 -11.751
  140    H3*    C  13           H3*        C  13   3.010  19.454 -11.805
  141    H1*    C  13           H1*        C  13   3.095  21.269  -8.282
  142   1H4     C  13          1H4         C  13  -3.237  20.659  -6.389
  143   2H4     C  13          2H4         C  13  -2.303  21.122  -4.988
  144    H5     C  13           H5         C  13  -2.242  20.325  -8.575
  145    H6     C  13           H6         C  13  -0.166  20.384  -9.851
  146    H5T    C  13           H5T        C  13   2.226  20.282 -13.391
  147   1H2*    C  13          1H2*        C  13   1.719  19.076  -9.849
  148   2H2*    C  13          2H2*        C  13   3.313  19.089  -9.107
  149   1H5*    G  14          1H5*        G  14   5.461  19.895  -8.210
  150   2H5*    G  14          2H5*        G  14   7.122  19.558  -8.741
  151    H4*    G  14           H4*        G  14   7.164  18.566  -6.710
  152    H3*    G  14           H3*        G  14   7.185  16.689  -8.669
  153    H1*    G  14           H1*        G  14   4.961  16.336  -5.545
  154    H8     G  14           H8         G  14   2.887  16.881  -8.756
  155    H1     G  14           H1         G  14  -0.453  16.370  -3.304
  156   1H2     G  14          1H2         G  14   2.642  16.286  -1.776
  157   2H2     G  14          2H2         G  14   0.903  16.256  -1.585
  158   1H2*    G  14          1H2*        G  14   4.871  16.079  -8.589
  159   2H2*    G  14          2H2*        G  14   5.531  14.946  -7.419
  160   1H5*    C  15          1H5*        C  15   7.379  15.340  -4.213
  161   2H5*    C  15          2H5*        C  15   9.020  14.661  -4.167
  162    H4*    C  15           H4*        C  15   8.081  13.594  -2.398
  163    H3*    C  15           H3*        C  15   8.586  11.862  -4.404
  164    H1*    C  15           H1*        C  15   5.224  11.781  -2.528
  165   1H4     C  15          1H4         C  15   0.581  13.862  -6.781
  166   2H4     C  15          2H4         C  15  -0.238  13.327  -5.333
  167    H5     C  15           H5         C  15   2.982  13.892  -7.000
  168    H6     C  15           H6         C  15   5.096  13.258  -5.942
  169   1H2*    C  15          1H2*        C  15   6.385  11.786  -5.355
  170   2H2*    C  15          2H2*        C  15   6.296  10.447  -4.221
  171   1H5*    A  16          1H5*        A  16   6.086   8.359  -3.015
  172   2H5*    A  16          2H5*        A  16   6.017   9.884  -2.110
  173    H4*    A  16           H4*        A  16   6.143   8.323  -0.025
  174    H3*    A  16           H3*        A  16   6.326   6.195  -1.570
  175    H1*    A  16           H1*        A  16   2.576   7.455  -0.895
  176    H8     A  16           H8         A  16   4.522   9.059  -3.849
  177   1H6     A  16          1H6         A  16   0.661  10.563  -6.365
  178   2H6     A  16          2H6         A  16  -1.064  10.438  -6.106
  179    H2     A  16           H2         A  16  -1.634   8.219  -2.250
  180   1H2*    A  16          1H2*        A  16   4.473   6.519  -3.031
  181   2H2*    A  16          2H2*        A  16   3.666   5.593  -1.774
  182   1H5*    G  17          1H5*        G  17   2.854   6.692   1.126
  183   2H5*    G  17          2H5*        G  17   3.174   5.561   2.457
  184    H4*    G  17           H4*        G  17   0.889   6.178   2.559
  185    H3*    G  17           H3*        G  17   1.494   3.578   2.634
  186    H1*    G  17           H1*        G  17  -1.242   4.774   0.176
  187    H8     G  17           H8         G  17   2.114   4.027  -1.602
  188    H1     G  17           H1         G  17  -2.795   5.643  -5.402
  189   1H2     G  17          1H2         G  17  -4.528   6.088  -2.450
  190   2H2     G  17          2H2         G  17  -4.563   6.140  -4.198
  191   1H2*    G  17          1H2*        G  17   1.323   3.121   0.276
  192   2H2*    G  17          2H2*        G  17  -0.281   2.671   0.833
  193   1H5*  6MC  18          1H5*      6MC  18  -2.977   4.942   3.175
  194   2H5*  6MC  18          2H5*      6MC  18  -2.769   4.008   1.687
  195    H4*  6MC  18           H4*      6MC  18  -5.149   4.583   3.194
  196    H3*  6MC  18           H3*      6MC  18  -4.535   2.012   3.846
  197   1H2*  6MC  18          1H2*      6MC  18  -6.456   1.242   1.837
  198   2H2*  6MC  18          2H2*      6MC  18  -4.773   0.735   1.918
  199    H1*  6MC  18           H1*      6MC  18  -6.002   2.482   0.014
  200    H8   6MC  18           H8       6MC  18  -2.597   1.886   1.495
  201   1H6   6MC  18          1H6       6MC  18  -0.137   1.566  -2.557
  202    H2   6MC  18           H2       6MC  18  -4.889   2.167  -4.245
  203   1H1   6MC  18          1H1       6MC  18   0.622   1.940  -4.680
  204   2H1   6MC  18          2H1       6MC  18  -0.824   2.081  -5.196
  205   3H1   6MC  18          3H1       6MC  18  -0.235   0.682  -4.927
  206   1H5*    T  19          1H5*        T  19  -7.897   2.596   1.324
  207   2H5*    T  19          2H5*        T  19  -9.423   2.309   2.181
  208    H4*    T  19           H4*        T  19  -9.960   1.556   0.108
  209    H3*    T  19           H3*        T  19  -9.777  -0.495   1.906
  210   1H2*    T  19          1H2*        T  19  -7.630  -1.305   1.190
  211   2H2*    T  19          2H2*        T  19  -8.705  -2.275   0.199
  212    H1*    T  19           H1*        T  19  -8.565  -0.688  -1.669
  213    H3     T  19           H3         T  19  -4.661  -1.067  -3.856
  214   1H5M    T  19          1H5M        T  19  -3.600  -2.451   1.044
  215   2H5M    T  19          2H5M        T  19  -3.050  -0.759   1.108
  216   3H5M    T  19          3H5M        T  19  -2.302  -1.895  -0.038
  217    H6     T  19           H6         T  19  -5.790  -0.837   0.779
  218   1H5*    C  20          1H5*        C  20  -9.765  -3.974  -0.923
  219   2H5*    C  20          2H5*        C  20  -9.651  -2.287  -1.455
  220    H4*    C  20           H4*        C  20 -11.315  -3.065  -3.304
  221    H3*    C  20           H3*        C  20 -11.235  -5.523  -2.218
  222    H1*    C  20           H1*        C  20  -8.399  -4.653  -4.963
  223   1H4     C  20          1H4         C  20  -3.414  -4.175  -0.618
  224   2H4     C  20          2H4         C  20  -2.715  -4.411  -2.201
  225    H5     C  20           H5         C  20  -5.794  -4.054  -0.242
  226    H6     C  20           H6         C  20  -7.978  -4.132  -1.294
  227   1H2*    C  20          1H2*        C  20  -8.983  -6.154  -2.449
  228   2H2*    C  20          2H2*        C  20  -9.447  -6.498  -4.111
  229   1H5*    T  21          1H5*        T  21 -11.497  -9.399  -5.407
  230   2H5*    T  21          2H5*        T  21 -10.386  -8.319  -4.540
  231    H4*    T  21           H4*        T  21 -10.488  -8.012  -7.474
  232    H3*    T  21           H3*        T  21 -10.385 -10.632  -6.822
  233   1H2*    T  21          1H2*        T  21  -8.461 -10.599  -5.402
  234   2H2*    T  21          2H2*        T  21  -7.678 -10.858  -6.956
  235    H1*    T  21           H1*        T  21  -7.109  -8.570  -7.229
  236    H3     T  21           H3         T  21  -3.702  -8.500  -4.307
  237   1H5M    T  21          1H5M        T  21  -6.953  -6.805  -1.161
  238   2H5M    T  21          2H5M        T  21  -6.859  -8.533  -0.750
  239   3H5M    T  21          3H5M        T  21  -8.312  -7.886  -1.545
  240    H6     T  21           H6         T  21  -8.439  -8.197  -3.845
  241   1H5*    C  22          1H5*        C  22  -7.977 -13.791  -9.064
  242   2H5*    C  22          2H5*        C  22  -7.755 -12.660  -7.714
  243    H4*    C  22           H4*        C  22  -5.838 -12.563  -9.987
  244    H3*    C  22           H3*        C  22  -6.176 -15.062  -8.947
  245    H1*    C  22           H1*        C  22  -3.466 -12.618  -7.646
  246   1H4     C  22          1H4         C  22  -5.319 -10.840  -1.533
  247   2H4     C  22          2H4         C  22  -3.574 -10.982  -1.525
  248    H5     C  22           H5         C  22  -6.664 -11.346  -3.498
  249    H6     C  22           H6         C  22  -6.605 -12.199  -5.778
  250   1H2*    C  22          1H2*        C  22  -5.570 -14.610  -6.686
  251   2H2*    C  22          2H2*        C  22  -3.974 -14.934  -7.349
  252   1H5*    G  23          1H5*        G  23  -1.968 -14.107  -8.331
  253   2H5*    G  23          2H5*        G  23  -1.298 -14.670  -9.877
  254    H4*    G  23           H4*        G  23   0.515 -15.044  -8.614
  255    H3*    G  23           H3*        G  23  -0.735 -17.446  -9.046
  256    H1*    G  23           H1*        G  23   0.779 -16.387  -5.705
  257    H8     G  23           H8         G  23  -3.000 -17.003  -5.348
  258    H1     G  23           H1         G  23  -0.059 -14.650  -0.160
  259   1H2     G  23          1H2         G  23   2.687 -14.337  -2.244
  260   2H2     G  23          2H2         G  23   2.018 -14.109  -0.643
  261   1H2*    G  23          1H2*        G  23  -1.732 -17.683  -6.884
  262   2H2*    G  23          2H2*        G  23  -0.170 -18.433  -6.583
  263   1H5*    C  24          1H5*        C  24   3.479 -17.235  -7.564
  264   2H5*    C  24          2H5*        C  24   4.571 -18.001  -8.737
  265    H4*    C  24           H4*        C  24   5.701 -17.980  -6.677
  266    H3*    C  24           H3*        C  24   5.402 -20.366  -7.926
  267    H1*    C  24           H1*        C  24   4.732 -19.999  -4.118
  268   1H4     C  24          1H4         C  24  -1.811 -20.878  -3.440
  269   2H4     C  24          2H4         C  24  -1.101 -20.884  -1.842
  270    H5     C  24           H5         C  24  -0.498 -20.563  -5.456
  271    H6     C  24           H6         C  24   1.745 -20.184  -6.334
  272    H3T    C  24           H3T        C  24   7.309 -20.321  -7.083
  273   1H2*    C  24          1H2*        C  24   3.580 -21.235  -6.657
  274   2H2*    C  24          2H2*        C  24   4.920 -21.801  -5.670
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1   0.906 -20.147   7.877
    2   2H5*    G   1          2H5*        G   1   2.027 -21.523   7.888
    3    H4*    G   1           H4*        G   1   3.910 -19.967   8.118
    4    H3*    G   1           H3*        G   1   2.332 -18.012   9.019
    5    H1*    G   1           H1*        G   1   3.400 -17.940   5.266
    6    H8     G   1           H8         G   1  -0.251 -19.069   5.861
    7    H1     G   1           H1         G   1   1.612 -18.680  -0.263
    8   1H2     G   1          1H2         G   1   4.715 -17.904   1.058
    9   2H2     G   1          2H2         G   1   3.754 -18.167  -0.382
   10    H5T    G   1           H5T        G   1   2.710 -20.144   9.963
   11   1H2*    G   1          1H2*        G   1   0.962 -17.700   7.076
   12   2H2*    G   1          2H2*        G   1   2.224 -16.516   6.769
   13   1H5*    C   2          1H5*        C   2   5.068 -13.561   7.288
   14   2H5*    C   2          2H5*        C   2   3.470 -13.511   6.514
   15    H4*    C   2           H4*        C   2   6.161 -14.043   5.294
   16    H3*    C   2           H3*        C   2   4.955 -11.674   5.369
   17    H1*    C   2           H1*        C   2   4.196 -13.988   2.309
   18   1H4     C   2          1H4         C   2  -1.781 -16.587   3.494
   19   2H4     C   2          2H4         C   2  -1.736 -16.146   1.802
   20    H5     C   2           H5         C   2   0.070 -16.117   5.018
   21    H6     C   2           H6         C   2   2.272 -15.101   5.210
   22   1H2*    C   2          1H2*        C   2   2.833 -12.296   4.439
   23   2H2*    C   2          2H2*        C   2   3.679 -11.768   2.992
   24   1H5*    G   3          1H5*        G   3   6.083 -13.094   1.368
   25   2H5*    G   3          2H5*        G   3   7.642 -12.305   1.048
   26    H4*    G   3           H4*        G   3   6.959 -12.967  -1.046
   27    H3*    G   3           H3*        G   3   7.139 -10.271  -0.742
   28    H1*    G   3           H1*        G   3   4.184 -11.934  -2.574
   29    H8     G   3           H8         G   3   3.156 -11.352   1.109
   30    H1     G   3           H1         G   3  -1.616 -11.456  -3.171
   31   1H2     G   3          1H2         G   3   0.915 -11.849  -5.505
   32   2H2     G   3          2H2         G   3  -0.803 -11.738  -5.206
   33   1H2*    G   3          1H2*        G   3   4.812  -9.790  -0.489
   34   2H2*    G   3          2H2*        G   3   4.956  -9.683  -2.237
   35   1H5*    A   4          1H5*        A   4   5.038 -11.190  -5.117
   36   2H5*    A   4          2H5*        A   4   6.548 -10.773  -5.952
   37    H4*    A   4           H4*        A   4   5.085  -9.930  -7.443
   38    H3*    A   4           H3*        A   4   6.277  -7.901  -6.090
   39    H1*    A   4           H1*        A   4   2.469  -7.941  -6.772
   40    H8     A   4           H8         A   4   3.330  -8.243  -3.022
   41   1H6     A   4          1H6         A   4  -1.216  -8.419  -1.345
   42   2H6     A   4          2H6         A   4  -2.783  -8.504  -2.125
   43    H2     A   4           H2         A   4  -2.027  -8.576  -6.543
   44   1H2*    A   4          1H2*        A   4   4.508  -7.395  -4.564
   45   2H2*    A   4          2H2*        A   4   4.044  -6.359  -5.906
   46   1H5*    G   5          1H5*        G   5   3.921  -7.239  -9.896
   47   2H5*    G   5          2H5*        G   5   4.724  -6.113 -11.010
   48    H4*    G   5           H4*        G   5   2.422  -6.113 -11.532
   49    H3*    G   5           H3*        G   5   3.641  -3.726 -10.991
   50    H1*    G   5           H1*        G   5   0.144  -4.648  -9.773
   51    H8     G   5           H8         G   5   2.643  -4.975  -6.816
   52    H1     G   5           H1         G   5  -3.570  -4.590  -5.267
   53   1H2     G   5          1H2         G   5  -4.076  -4.342  -8.682
   54   2H2     G   5          2H2         G   5  -4.798  -4.392  -7.089
   55   1H2*    G   5          1H2*        G   5   2.766  -3.422  -8.776
   56   2H2*    G   5          2H2*        G   5   1.501  -2.649  -9.722
   57   1H5*    A   6          1H5*        A   6  -0.763  -3.448 -11.362
   58   2H5*    A   6          2H5*        A   6  -0.534  -4.079 -13.006
   59    H4*    A   6           H4*        A   6  -2.576  -3.454 -13.547
   60    H3*    A   6           H3*        A   6  -1.434  -1.097 -13.921
   61    H1*    A   6           H1*        A   6  -4.232  -1.203 -11.067
   62    H8     A   6           H8         A   6  -0.519  -1.675  -9.990
   63   1H6     A   6          1H6         A   6  -1.284  -1.386  -5.208
   64   2H6     A   6          2H6         A   6  -2.711  -1.132  -4.232
   65    H2     A   6           H2         A   6  -6.146  -0.665  -7.081
   66   1H2*    A   6          1H2*        A   6  -1.501  -0.168 -11.732
   67   2H2*    A   6          2H2*        A   6  -3.084   0.362 -12.290
   68   1H5*    T   7          1H5*        T   7  -5.564  -0.827 -12.608
   69   2H5*    T   7          2H5*        T   7  -6.563  -0.384 -14.009
   70    H4*    T   7           H4*        T   7  -7.859   0.451 -12.367
   71    H3*    T   7           H3*        T   7  -6.612   2.504 -13.683
   72   1H2*    T   7          1H2*        T   7  -5.019   3.151 -12.049
   73   2H2*    T   7          2H2*        T   7  -6.400   4.003 -11.378
   74    H1*    T   7           H1*        T   7  -6.864   2.362  -9.769
   75    H3     T   7           H3         T   7  -3.711   1.679  -6.650
   76   1H5M    T   7          1H5M        T   7  -0.695   1.041 -10.465
   77   2H5M    T   7          2H5M        T   7  -0.381   2.632  -9.733
   78   3H5M    T   7          3H5M        T   7  -1.199   2.525 -11.309
   79    H6     T   7           H6         T   7  -3.547   2.280 -11.369
   80   1H5*    C   8          1H5*        C   8 -10.149   6.157 -11.339
   81   2H5*    C   8          2H5*        C   8  -8.618   6.935 -10.882
   82    H4*    C   8           H4*        C   8 -10.605   5.471  -9.235
   83    H3*    C   8           H3*        C   8  -9.991   8.080  -9.233
   84    H1*    C   8           H1*        C   8  -8.217   5.738  -6.647
   85   1H4     C   8          1H4         C   8  -2.059   5.076  -9.001
   86   2H4     C   8          2H4         C   8  -1.941   5.115  -7.258
   87    H5     C   8           H5         C   8  -4.158   5.325 -10.180
   88    H6     C   8           H6         C   8  -6.546   5.770  -9.929
   89   1H2*    C   8          1H2*        C   8  -7.679   7.944  -8.666
   90   2H2*    C   8          2H2*        C   8  -8.375   8.060  -7.059
   91   1H5*    T   9          1H5*        T   9  -9.186   6.605  -4.847
   92   2H5*    T   9          2H5*        T   9 -10.672   7.272  -4.136
   93    H4*    T   9           H4*        T   9  -9.136   7.569  -2.451
   94    H3*    T   9           H3*        T   9 -10.105   9.887  -3.465
   95   1H2*    T   9          1H2*        T   9  -8.256  10.376  -4.919
   96   2H2*    T   9          2H2*        T   9  -7.797  11.258  -3.476
   97    H1*    T   9           H1*        T   9  -6.412   9.416  -2.666
   98    H3     T   9           H3         T   9  -2.604   9.496  -4.973
   99   1H5M    T   9          1H5M        T   9  -6.611   9.564  -8.582
  100   2H5M    T   9          2H5M        T   9  -4.933   9.958  -9.022
  101   3H5M    T   9          3H5M        T   9  -5.413   8.260  -8.784
  102    H6     T   9           H6         T   9  -7.179   9.419  -6.288
  103   1H5*    G  10          1H5*        G  10  -6.662  10.847  -0.773
  104   2H5*    G  10          2H5*        G  10  -7.651  10.317   0.602
  105    H4*    G  10           H4*        G  10  -6.558  11.623   2.003
  106    H3*    G  10           H3*        G  10  -7.815  13.677   0.861
  107    H1*    G  10           H1*        G  10  -3.826  13.582   0.451
  108    H8     G  10           H8         G  10  -6.106  12.267  -2.400
  109    H1     G  10           H1         G  10   0.113  12.669  -3.793
  110   1H2     G  10          1H2         G  10   0.510  13.500  -0.453
  111   2H2     G  10          2H2         G  10   1.280  13.179  -1.992
  112   1H2*    G  10          1H2*        G  10  -6.406  14.150  -0.986
  113   2H2*    G  10          2H2*        G  10  -5.556  15.107   0.219
  114   1H5*    C  11          1H5*        C  11  -3.591  14.267   2.548
  115   2H5*    C  11          2H5*        C  11  -4.273  14.742   4.116
  116    H4*    C  11           H4*        C  11  -2.160  15.476   4.410
  117    H3*    C  11           H3*        C  11  -3.771  17.581   4.173
  118    H1*    C  11           H1*        C  11  -0.629  17.442   1.751
  119   1H4     C  11          1H4         C  11  -3.532  15.781  -3.979
  120   2H4     C  11          2H4         C  11  -1.827  16.004  -4.292
  121    H5     C  11           H5         C  11  -4.498  16.023  -1.771
  122    H6     C  11           H6         C  11  -4.027  16.524   0.570
  123   1H2*    C  11          1H2*        C  11  -3.594  18.029   1.842
  124   2H2*    C  11          2H2*        C  11  -2.247  19.002   2.412
  125   1H5*    G  12          1H5*        G  12   0.519  18.226   4.725
  126   2H5*    G  12          2H5*        G  12   0.780  18.657   6.426
  127    H4*    G  12           H4*        G  12   2.740  19.378   5.575
  128    H3*    G  12           H3*        G  12   1.284  21.503   6.256
  129    H1*    G  12           H1*        G  12   2.673  21.387   2.532
  130    H8     G  12           H8         G  12  -1.090  20.905   3.086
  131    H1     G  12           H1         G  12   0.951  19.950  -2.918
  132   1H2     G  12          1H2         G  12   4.114  20.320  -1.578
  133   2H2     G  12          2H2         G  12   3.145  20.032  -3.005
  134    H3T    G  12           H3T        G  12   3.227  22.723   5.433
  135   1H2*    G  12          1H2*        G  12   0.227  22.018   4.191
  136   2H2*    G  12          2H2*        G  12   1.701  22.951   3.979
  137   1H5*    C  13          1H5*        C  13   1.395  20.989 -10.694
  138   2H5*    C  13          2H5*        C  13   1.202  22.397  -9.632
  139    H4*    C  13           H4*        C  13   3.892  22.397 -10.146
  140    H3*    C  13           H3*        C  13   3.424  19.922 -11.051
  141    H1*    C  13           H1*        C  13   4.009  20.341  -7.109
  142   1H4     C  13          1H4         C  13  -2.255  19.467  -5.101
  143   2H4     C  13          2H4         C  13  -1.232  19.421  -3.687
  144    H5     C  13           H5         C  13  -1.389  19.818  -7.337
  145    H6     C  13           H6         C  13   0.623  20.194  -8.659
  146    H5T    C  13           H5T        C  13   2.509  23.546 -11.235
  147   1H2*    C  13          1H2*        C  13   2.397  18.887  -9.189
  148   2H2*    C  13          2H2*        C  13   4.068  18.654  -8.692
  149   1H5*    G  14          1H5*        G  14   6.450  19.714  -7.931
  150   2H5*    G  14          2H5*        G  14   8.029  19.146  -8.513
  151    H4*    G  14           H4*        G  14   7.909  18.143  -6.467
  152    H3*    G  14           H3*        G  14   7.770  16.338  -8.517
  153    H1*    G  14           H1*        G  14   5.576  16.131  -5.366
  154    H8     G  14           H8         G  14   3.485  16.608  -8.555
  155    H1     G  14           H1         G  14   0.208  16.765  -3.047
  156   1H2     G  14          1H2         G  14   3.320  16.697  -1.546
  157   2H2     G  14          2H2         G  14   1.583  16.760  -1.337
  158   1H2*    G  14          1H2*        G  14   5.429  15.877  -8.409
  159   2H2*    G  14          2H2*        G  14   6.014  14.698  -7.245
  160   1H5*    C  15          1H5*        C  15   7.728  14.962  -4.038
  161   2H5*    C  15          2H5*        C  15   9.223  14.006  -3.996
  162    H4*    C  15           H4*        C  15   7.988  13.222  -2.201
  163    H3*    C  15           H3*        C  15   8.582  11.367  -4.093
  164    H1*    C  15           H1*        C  15   5.126  11.585  -2.451
  165   1H4     C  15          1H4         C  15   0.782  13.524  -7.071
  166   2H4     C  15          2H4         C  15  -0.128  13.083  -5.648
  167    H5     C  15           H5         C  15   3.189  13.480  -7.160
  168    H6     C  15           H6         C  15   5.226  12.815  -5.970
  169   1H2*    C  15          1H2*        C  15   6.452  11.326  -5.196
  170   2H2*    C  15          2H2*        C  15   6.212  10.073  -3.989
  171   1H5*    A  16          1H5*        A  16   5.685   8.075  -2.542
  172   2H5*    A  16          2H5*        A  16   5.675   9.706  -1.845
  173    H4*    A  16           H4*        A  16   5.607   8.411   0.423
  174    H3*    A  16           H3*        A  16   5.671   6.118  -0.908
  175    H1*    A  16           H1*        A  16   1.999   7.739  -0.496
  176    H8     A  16           H8         A  16   4.238   8.839  -3.459
  177   1H6     A  16          1H6         A  16   0.685  10.103  -6.493
  178   2H6     A  16          2H6         A  16  -1.062  10.067  -6.388
  179    H2     A  16           H2         A  16  -2.064   8.408  -2.339
  180   1H2*    A  16          1H2*        A  16   3.848   6.332  -2.383
  181   2H2*    A  16          2H2*        A  16   2.959   5.694  -1.008
  182   1H5*    G  17          1H5*        G  17   2.010   7.062   1.598
  183   2H5*    G  17          2H5*        G  17   2.112   5.917   2.951
  184    H4*    G  17           H4*        G  17  -0.158   6.601   2.670
  185    H3*    G  17           H3*        G  17   0.422   3.991   2.930
  186    H1*    G  17           H1*        G  17  -1.967   5.155   0.134
  187    H8     G  17           H8         G  17   1.536   4.241  -1.262
  188    H1     G  17           H1         G  17  -2.969   5.708  -5.586
  189   1H2     G  17          1H2         G  17  -4.948   6.357  -2.829
  190   2H2     G  17          2H2         G  17  -4.830   6.307  -4.571
  191   1H2*    G  17          1H2*        G  17   0.508   3.428   0.593
  192   2H2*    G  17          2H2*        G  17  -1.166   3.051   0.966
  193   1H5*  6MC  18          1H5*      6MC  18  -4.037   5.464   2.943
  194   2H5*  6MC  18          2H5*      6MC  18  -3.736   4.499   1.491
  195    H4*  6MC  18           H4*      6MC  18  -6.217   5.175   2.784
  196    H3*  6MC  18           H3*      6MC  18  -5.754   2.622   3.552
  197   1H2*  6MC  18          1H2*      6MC  18  -7.412   1.747   1.392
  198   2H2*  6MC  18          2H2*      6MC  18  -5.718   1.328   1.625
  199    H1*  6MC  18           H1*      6MC  18  -6.888   3.017  -0.397
  200    H8   6MC  18           H8       6MC  18  -3.565   2.489   1.271
  201   1H6   6MC  18          1H6       6MC  18  -0.912   1.965  -2.628
  202    H2   6MC  18           H2       6MC  18  -5.563   2.534  -4.585
  203   1H1   6MC  18          1H1       6MC  18  -0.003   2.128  -4.693
  204   2H1   6MC  18          2H1       6MC  18  -1.378   2.476  -5.294
  205   3H1   6MC  18          3H1       6MC  18  -1.011   1.007  -5.009
  206   1H5*    T  19          1H5*        T  19  -8.911   3.027   0.676
  207   2H5*    T  19          2H5*        T  19 -10.493   2.661   1.391
  208    H4*    T  19           H4*        T  19 -10.750   1.772  -0.683
  209    H3*    T  19           H3*        T  19 -10.594  -0.189   1.234
  210   1H2*    T  19          1H2*        T  19  -8.336  -0.862   0.722
  211   2H2*    T  19          2H2*        T  19  -9.262  -1.949  -0.301
  212    H1*    T  19           H1*        T  19  -9.127  -0.386  -2.208
  213    H3     T  19           H3         T  19  -5.148  -0.844  -4.173
  214   1H5M    T  19          1H5M        T  19  -3.982  -0.111   0.972
  215   2H5M    T  19          2H5M        T  19  -2.846  -0.824  -0.198
  216   3H5M    T  19          3H5M        T  19  -4.002  -1.864   0.666
  217    H6     T  19           H6         T  19  -6.461  -0.219   0.371
  218   1H5*    C  20          1H5*        C  20 -10.067  -3.713  -1.473
  219   2H5*    C  20          2H5*        C  20 -10.091  -2.072  -2.147
  220    H4*    C  20           H4*        C  20 -11.554  -3.133  -4.003
  221    H3*    C  20           H3*        C  20 -11.400  -5.476  -2.683
  222    H1*    C  20           H1*        C  20  -8.607  -4.698  -5.447
  223   1H4     C  20          1H4         C  20  -3.490  -3.652  -1.356
  224   2H4     C  20          2H4         C  20  -2.850  -4.002  -2.942
  225    H5     C  20           H5         C  20  -5.871  -3.631  -0.888
  226    H6     C  20           H6         C  20  -8.088  -3.876  -1.850
  227   1H2*    C  20          1H2*        C  20  -9.090  -5.946  -2.756
  228   2H2*    C  20          2H2*        C  20  -9.485  -6.538  -4.363
  229   1H5*    T  21          1H5*        T  21 -11.438  -9.628  -5.453
  230   2H5*    T  21          2H5*        T  21 -10.350  -8.415  -4.749
  231    H4*    T  21           H4*        T  21 -10.487  -8.438  -7.686
  232    H3*    T  21           H3*        T  21 -10.383 -10.982  -6.788
  233   1H2*    T  21          1H2*        T  21  -8.447 -10.836  -5.401
  234   2H2*    T  21          2H2*        T  21  -7.676 -11.228  -6.933
  235    H1*    T  21           H1*        T  21  -7.084  -8.982  -7.394
  236    H3     T  21           H3         T  21  -3.719  -8.704  -4.417
  237   1H5M    T  21          1H5M        T  21  -8.369  -7.639  -1.865
  238   2H5M    T  21          2H5M        T  21  -6.964  -6.594  -1.550
  239   3H5M    T  21          3H5M        T  21  -6.975  -8.270  -0.956
  240    H6     T  21           H6         T  21  -8.454  -8.230  -4.103
  241   1H5*    C  22          1H5*        C  22  -7.953 -14.334  -8.742
  242   2H5*    C  22          2H5*        C  22  -7.753 -13.043  -7.540
  243    H4*    C  22           H4*        C  22  -5.877 -13.059  -9.827
  244    H3*    C  22           H3*        C  22  -6.132 -15.531  -8.702
  245    H1*    C  22           H1*        C  22  -3.462 -12.979  -7.541
  246   1H4     C  22          1H4         C  22  -5.208 -10.940  -1.479
  247   2H4     C  22          2H4         C  22  -3.467 -11.116  -1.485
  248    H5     C  22           H5         C  22  -6.582 -11.505  -3.420
  249    H6     C  22           H6         C  22  -6.560 -12.486  -5.645
  250   1H2*    C  22          1H2*        C  22  -5.494 -14.988  -6.466
  251   2H2*    C  22          2H2*        C  22  -3.906 -15.298  -7.151
  252   1H5*    G  23          1H5*        G  23  -1.913 -14.453  -8.194
  253   2H5*    G  23          2H5*        G  23  -1.303 -15.025  -9.761
  254    H4*    G  23           H4*        G  23   0.577 -15.358  -8.600
  255    H3*    G  23           H3*        G  23  -0.644 -17.784  -8.885
  256    H1*    G  23           H1*        G  23   1.002 -16.619  -5.659
  257    H8     G  23           H8         G  23  -2.763 -17.177  -5.086
  258    H1     G  23           H1         G  23   0.493 -14.757  -0.120
  259   1H2     G  23          1H2         G  23   3.138 -14.578  -2.347
  260   2H2     G  23          2H2         G  23   2.563 -14.293  -0.722
  261   1H2*    G  23          1H2*        G  23  -1.576 -17.922  -6.679
  262   2H2*    G  23          2H2*        G  23  -0.017 -18.689  -6.420
  263   1H5*    C  24          1H5*        C  24   3.736 -17.400  -7.720
  264   2H5*    C  24          2H5*        C  24   4.726 -18.475  -8.731
  265    H4*    C  24           H4*        C  24   5.993 -18.098  -6.811
  266    H3*    C  24           H3*        C  24   5.383 -20.682  -7.362
  267    H1*    C  24           H1*        C  24   5.051 -19.261  -3.761
  268   1H4     C  24          1H4         C  24  -1.468 -19.271  -2.536
  269   2H4     C  24          2H4         C  24  -0.649 -18.865  -1.048
  270    H5     C  24           H5         C  24  -0.290 -19.693  -4.607
  271    H6     C  24           H6         C  24   1.902 -19.788  -5.672
  272    H3T    C  24           H3T        C  24   6.820 -20.655  -5.123
  273   1H2*    C  24          1H2*        C  24   3.604 -20.997  -5.809
  274   2H2*    C  24          2H2*        C  24   4.966 -21.417  -4.779
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1   1.141 -21.123   7.492
    2   2H5*    G   1          2H5*        G   1   2.250 -22.420   7.004
    3    H4*    G   1           H4*        G   1   4.065 -20.626   7.016
    4    H3*    G   1           H3*        G   1   2.223 -18.888   8.031
    5    H1*    G   1           H1*        G   1   3.287 -18.894   4.352
    6    H8     G   1           H8         G   1  -0.433 -19.824   4.734
    7    H1     G   1           H1         G   1   1.881 -19.976  -1.248
    8   1H2     G   1          1H2         G   1   4.937 -19.385   0.254
    9   2H2     G   1          2H2         G   1   4.059 -19.657  -1.236
   10    H5T    G   1           H5T        G   1   3.486 -22.009   8.833
   11   1H2*    G   1          1H2*        G   1   0.788 -18.776   6.117
   12   2H2*    G   1          2H2*        G   1   1.910 -17.477   5.742
   13   1H5*    C   2          1H5*        C   2   5.368 -13.978   7.199
   14   2H5*    C   2          2H5*        C   2   3.737 -14.251   6.547
   15    H4*    C   2           H4*        C   2   6.362 -14.333   5.065
   16    H3*    C   2           H3*        C   2   4.995 -12.070   5.505
   17    H1*    C   2           H1*        C   2   4.297 -14.109   2.295
   18   1H4     C   2          1H4         C   2  -1.520 -17.174   3.101
   19   2H4     C   2          2H4         C   2  -1.440 -16.639   1.437
   20    H5     C   2           H5         C   2   0.218 -16.661   4.726
   21    H6     C   2           H6         C   2   2.349 -15.534   5.068
   22   1H2*    C   2          1H2*        C   2   2.866 -12.773   4.639
   23   2H2*    C   2          2H2*        C   2   3.571 -12.016   3.219
   24   1H5*    G   3          1H5*        G   3   7.071 -12.737   1.554
   25   2H5*    G   3          2H5*        G   3   7.933 -11.352   0.852
   26    H4*    G   3           H4*        G   3   7.014 -13.014  -0.777
   27    H3*    G   3           H3*        G   3   7.261 -10.328  -1.172
   28    H1*    G   3           H1*        G   3   4.173 -12.312  -2.140
   29    H8     G   3           H8         G   3   3.358 -11.259   1.439
   30    H1     G   3           H1         G   3  -1.606 -11.262  -2.612
   31   1H2     G   3          1H2         G   3   0.795 -11.915  -5.036
   32   2H2     G   3          2H2         G   3  -0.899 -11.682  -4.672
   33   1H2*    G   3          1H2*        G   3   4.979  -9.747  -0.670
   34   2H2*    G   3          2H2*        G   3   4.890  -9.998  -2.408
   35   1H5*    A   4          1H5*        A   4   4.348 -11.804  -4.534
   36   2H5*    A   4          2H5*        A   4   5.692 -12.130  -5.650
   37    H4*    A   4           H4*        A   4   4.302 -11.467  -7.243
   38    H3*    A   4           H3*        A   4   5.757  -9.269  -6.696
   39    H1*    A   4           H1*        A   4   1.901  -9.047  -6.911
   40    H8     A   4           H8         A   4   3.208  -8.616  -3.296
   41   1H6     A   4          1H6         A   4  -1.101  -7.943  -1.162
   42   2H6     A   4          2H6         A   4  -2.749  -7.956  -1.753
   43    H2     A   4           H2         A   4  -2.538  -8.811  -6.149
   44   1H2*    A   4          1H2*        A   4   4.254  -8.217  -5.153
   45   2H2*    A   4          2H2*        A   4   3.716  -7.499  -6.663
   46   1H5*    G   5          1H5*        G   5   3.190  -6.192  -8.506
   47   2H5*    G   5          2H5*        G   5   2.546  -7.838  -8.684
   48    H4*    G   5           H4*        G   5   1.932  -7.143 -11.064
   49    H3*    G   5           H3*        G   5   3.238  -4.855 -10.818
   50    H1*    G   5           H1*        G   5  -0.584  -4.786  -9.687
   51    H8     G   5           H8         G   5   2.135  -5.231  -6.960
   52    H1     G   5           H1         G   5  -3.885  -4.500  -4.883
   53   1H2     G   5          1H2         G   5  -4.717  -4.473  -8.237
   54   2H2     G   5          2H2         G   5  -5.275  -4.398  -6.581
   55   1H2*    G   5          1H2*        G   5   2.198  -3.942  -8.878
   56   2H2*    G   5          2H2*        G   5   1.144  -3.261 -10.108
   57   1H5*    A   6          1H5*        A   6  -0.583  -3.251 -11.156
   58   2H5*    A   6          2H5*        A   6  -0.864  -4.483 -12.404
   59    H4*    A   6           H4*        A   6  -2.523  -3.331 -13.381
   60    H3*    A   6           H3*        A   6  -0.952  -1.210 -13.724
   61    H1*    A   6           H1*        A   6  -3.887  -0.830 -11.039
   62    H8     A   6           H8         A   6  -0.275  -1.462  -9.775
   63   1H6     A   6          1H6         A   6  -1.246  -1.208  -5.034
   64   2H6     A   6          2H6         A   6  -2.712  -0.962  -4.117
   65    H2     A   6           H2         A   6  -6.026  -0.493  -7.094
   66   1H2*    A   6          1H2*        A   6  -0.990  -0.229 -11.570
   67   2H2*    A   6          2H2*        A   6  -2.434   0.527 -12.226
   68   1H5*    T   7          1H5*        T   7  -3.602   1.879 -12.671
   69   2H5*    T   7          2H5*        T   7  -4.299   0.255 -12.551
   70    H4*    T   7           H4*        T   7  -6.485   1.340 -13.312
   71    H3*    T   7           H3*        T   7  -5.249   3.631 -13.774
   72   1H2*    T   7          1H2*        T   7  -4.251   4.146 -11.695
   73   2H2*    T   7          2H2*        T   7  -5.836   4.818 -11.347
   74    H1*    T   7           H1*        T   7  -6.419   3.100  -9.930
   75    H3     T   7           H3         T   7  -3.670   1.785  -6.653
   76   1H5M    T   7          1H5M        T   7  -0.391   1.139 -10.312
   77   2H5M    T   7          2H5M        T   7   0.023   2.558  -9.321
   78   3H5M    T   7          3H5M        T   7  -0.645   2.781 -10.954
   79    H6     T   7           H6         T   7  -3.000   2.700 -11.272
   80   1H5*    C   8          1H5*        C   8  -9.356   6.791 -11.675
   81   2H5*    C   8          2H5*        C   8  -7.900   7.562 -11.016
   82    H4*    C   8           H4*        C   8  -9.922   5.824  -9.709
   83    H3*    C   8           H3*        C   8  -9.465   8.438  -9.359
   84    H1*    C   8           H1*        C   8  -7.761   5.909  -6.932
   85   1H4     C   8          1H4         C   8  -1.418   5.614  -8.799
   86   2H4     C   8          2H4         C   8  -1.430   5.608  -7.052
   87    H5     C   8           H5         C   8  -3.434   5.817 -10.124
   88    H6     C   8           H6         C   8  -5.843   6.219 -10.038
   89   1H2*    C   8          1H2*        C   8  -7.176   8.331  -8.677
   90   2H2*    C   8          2H2*        C   8  -7.971   8.261  -7.114
   91   1H5*    T   9          1H5*        T   9  -8.868   6.565  -4.973
   92   2H5*    T   9          2H5*        T   9 -10.401   7.195  -4.331
   93    H4*    T   9           H4*        T   9  -8.933   7.454  -2.567
   94    H3*    T   9           H3*        T   9  -9.967   9.770  -3.523
   95   1H2*    T   9          1H2*        T   9  -8.083  10.395  -4.882
   96   2H2*    T   9          2H2*        T   9  -7.727  11.240  -3.387
   97    H1*    T   9           H1*        T   9  -6.305   9.421  -2.580
   98    H3     T   9           H3         T   9  -2.379   9.704  -4.650
   99   1H5M    T   9          1H5M        T   9  -4.438  10.333  -8.799
  100   2H5M    T   9          2H5M        T   9  -4.965   8.637  -8.681
  101   3H5M    T   9          3H5M        T   9  -6.148   9.954  -8.488
  102    H6     T   9           H6         T   9  -6.865   9.606  -6.240
  103   1H5*    G  10          1H5*        G  10  -6.649  10.752  -0.709
  104   2H5*    G  10          2H5*        G  10  -7.643  10.219   0.662
  105    H4*    G  10           H4*        G  10  -6.602  11.575   2.051
  106    H3*    G  10           H3*        G  10  -7.927  13.568   0.882
  107    H1*    G  10           H1*        G  10  -3.958  13.640   0.589
  108    H8     G  10           H8         G  10  -6.001  12.311  -2.427
  109    H1     G  10           H1         G  10   0.292  12.863  -3.374
  110   1H2     G  10          1H2         G  10   0.436  13.631   0.000
  111   2H2     G  10          2H2         G  10   1.320  13.360  -1.486
  112   1H2*    G  10          1H2*        G  10  -6.513  14.028  -0.975
  113   2H2*    G  10          2H2*        G  10  -5.754  15.084   0.206
  114   1H5*    C  11          1H5*        C  11  -3.714  14.439   2.654
  115   2H5*    C  11          2H5*        C  11  -4.514  14.851   4.185
  116    H4*    C  11           H4*        C  11  -2.527  15.798   4.614
  117    H3*    C  11           H3*        C  11  -4.268  17.765   4.111
  118    H1*    C  11           H1*        C  11  -0.901  17.719   1.943
  119   1H4     C  11          1H4         C  11  -3.470  15.727  -3.834
  120   2H4     C  11          2H4         C  11  -1.755  15.974  -4.072
  121    H5     C  11           H5         C  11  -4.555  16.060  -1.691
  122    H6     C  11           H6         C  11  -4.203  16.616   0.657
  123   1H2*    C  11          1H2*        C  11  -3.863  18.224   1.827
  124   2H2*    C  11          2H2*        C  11  -2.578  19.219   2.498
  125   1H5*    G  12          1H5*        G  12   0.027  19.271   4.448
  126   2H5*    G  12          2H5*        G  12   0.128  20.461   5.762
  127    H4*    G  12           H4*        G  12   1.679  21.217   4.234
  128    H3*    G  12           H3*        G  12  -0.424  22.913   4.653
  129    H1*    G  12           H1*        G  12   1.055  22.217   1.166
  130    H8     G  12           H8         G  12  -2.587  20.989   1.489
  131    H1     G  12           H1         G  12   0.275  19.810  -4.128
  132   1H2     G  12          1H2         G  12   3.108  21.070  -2.607
  133   2H2     G  12          2H2         G  12   2.389  20.390  -4.047
  134    H3T    G  12           H3T        G  12   1.915  23.254   3.079
  135   1H2*    G  12          1H2*        G  12  -1.614  22.507   2.627
  136   2H2*    G  12          2H2*        G  12  -0.529  23.776   2.079
  137   1H5*    C  13          1H5*        C  13   1.923  20.859 -11.769
  138   2H5*    C  13          2H5*        C  13   1.903  22.578 -11.329
  139    H4*    C  13           H4*        C  13   4.474  22.229 -11.045
  140    H3*    C  13           H3*        C  13   4.120  19.671 -11.777
  141    H1*    C  13           H1*        C  13   3.984  20.561  -7.924
  142   1H4     C  13          1H4         C  13  -2.495  19.941  -6.636
  143   2H4     C  13          2H4         C  13  -1.649  19.984  -5.108
  144    H5     C  13           H5         C  13  -1.355  20.074  -8.771
  145    H6     C  13           H6         C  13   0.812  20.303  -9.863
  146    H5T    C  13           H5T        C  13   3.583  22.862 -12.929
  147   1H2*    C  13          1H2*        C  13   2.631  18.920 -10.082
  148   2H2*    C  13          2H2*        C  13   4.153  18.632  -9.249
  149   1H5*    G  14          1H5*        G  14   6.368  19.774  -7.907
  150   2H5*    G  14          2H5*        G  14   8.033  19.285  -8.283
  151    H4*    G  14           H4*        G  14   7.856  18.358  -6.238
  152    H3*    G  14           H3*        G  14   7.730  16.396  -8.137
  153    H1*    G  14           H1*        G  14   5.479  16.480  -5.038
  154    H8     G  14           H8         G  14   3.425  16.945  -8.279
  155    H1     G  14           H1         G  14   0.098  17.065  -2.799
  156   1H2     G  14          1H2         G  14   3.190  16.918  -1.270
  157   2H2     G  14          2H2         G  14   1.453  17.006  -1.078
  158   1H2*    G  14          1H2*        G  14   5.370  16.013  -8.061
  159   2H2*    G  14          2H2*        G  14   5.901  14.897  -6.811
  160   1H5*    C  15          1H5*        C  15   8.007  15.237  -3.549
  161   2H5*    C  15          2H5*        C  15   9.445  14.194  -3.546
  162    H4*    C  15           H4*        C  15   8.212  13.568  -1.667
  163    H3*    C  15           H3*        C  15   8.748  11.612  -3.460
  164    H1*    C  15           H1*        C  15   5.276  11.980  -1.864
  165   1H4     C  15          1H4         C  15   1.079  13.959  -6.601
  166   2H4     C  15          2H4         C  15   0.122  13.478  -5.221
  167    H5     C  15           H5         C  15   3.486  13.924  -6.612
  168    H6     C  15           H6         C  15   5.484  13.241  -5.368
  169   1H2*    C  15          1H2*        C  15   6.625  11.596  -4.582
  170   2H2*    C  15          2H2*        C  15   6.342  10.393  -3.333
  171   1H5*    A  16          1H5*        A  16   5.828   8.472  -1.923
  172   2H5*    A  16          2H5*        A  16   5.749  10.075  -1.166
  173    H4*    A  16           H4*        A  16   5.594   8.714   1.047
  174    H3*    A  16           H3*        A  16   5.819   6.460  -0.344
  175    H1*    A  16           H1*        A  16   2.068   7.931  -0.065
  176    H8     A  16           H8         A  16   4.404   9.110  -2.924
  177   1H6     A  16          1H6         A  16   0.943  10.343  -6.080
  178   2H6     A  16          2H6         A  16  -0.804  10.274  -6.038
  179    H2     A  16           H2         A  16  -1.925   8.564  -2.045
  180   1H2*    A  16          1H2*        A  16   4.044   6.612  -1.878
  181   2H2*    A  16          2H2*        A  16   3.124   5.932  -0.542
  182   1H5*    G  17          1H5*        G  17   2.024   7.235   1.924
  183   2H5*    G  17          2H5*        G  17   2.122   6.124   3.306
  184    H4*    G  17           H4*        G  17  -0.157   6.692   2.948
  185    H3*    G  17           H3*        G  17   0.526   4.101   3.203
  186    H1*    G  17           H1*        G  17  -1.850   5.216   0.367
  187    H8     G  17           H8         G  17   1.710   4.406  -0.933
  188    H1     G  17           H1         G  17  -2.707   5.729  -5.395
  189   1H2     G  17          1H2         G  17  -4.794   6.310  -2.704
  190   2H2     G  17          2H2         G  17  -4.611   6.273  -4.442
  191   1H2*    G  17          1H2*        G  17   0.652   3.542   0.872
  192   2H2*    G  17          2H2*        G  17  -1.022   3.132   1.215
  193   1H5*  6MC  18          1H5*      6MC  18  -3.961   5.404   3.143
  194   2H5*  6MC  18          2H5*      6MC  18  -3.623   4.436   1.703
  195    H4*  6MC  18           H4*      6MC  18  -6.129   5.044   2.983
  196    H3*  6MC  18           H3*      6MC  18  -5.578   2.487   3.725
  197   1H2*  6MC  18          1H2*      6MC  18  -7.299   1.666   1.569
  198   2H2*  6MC  18          2H2*      6MC  18  -5.622   1.185   1.803
  199    H1*  6MC  18           H1*      6MC  18  -6.706   2.892  -0.226
  200    H8   6MC  18           H8       6MC  18  -3.409   2.394   1.525
  201   1H6   6MC  18          1H6       6MC  18  -0.663   2.001  -2.342
  202    H2   6MC  18           H2       6MC  18  -5.293   2.496  -4.367
  203   1H1   6MC  18          1H1       6MC  18   0.039   2.625  -4.515
  204   2H1   6MC  18          2H1       6MC  18  -1.311   2.127  -5.069
  205   3H1   6MC  18          3H1       6MC  18  -0.266   1.114  -4.559
  206   1H5*    T  19          1H5*        T  19  -8.717   2.994   0.875
  207   2H5*    T  19          2H5*        T  19 -10.304   2.712   1.618
  208    H4*    T  19           H4*        T  19 -10.679   1.877  -0.455
  209    H3*    T  19           H3*        T  19 -10.547  -0.131   1.407
  210   1H2*    T  19          1H2*        T  19  -8.342  -0.893   0.824
  211   2H2*    T  19          2H2*        T  19  -9.338  -1.912  -0.202
  212    H1*    T  19           H1*        T  19  -9.159  -0.334  -2.084
  213    H3     T  19           H3         T  19  -5.203  -0.847  -4.103
  214   1H5M    T  19          1H5M        T  19  -4.122  -1.930   0.807
  215   2H5M    T  19          2H5M        T  19  -3.883  -0.175   0.970
  216   3H5M    T  19          3H5M        T  19  -2.882  -1.107  -0.168
  217    H6     T  19           H6         T  19  -6.466  -0.301   0.471
  218   1H5*    C  20          1H5*        C  20 -10.212  -3.594  -1.201
  219   2H5*    C  20          2H5*        C  20 -10.205  -2.006  -1.992
  220    H4*    C  20           H4*        C  20 -11.705  -3.173  -3.755
  221    H3*    C  20           H3*        C  20 -11.560  -5.419  -2.263
  222    H1*    C  20           H1*        C  20  -8.757  -4.863  -5.095
  223   1H4     C  20          1H4         C  20  -3.693  -3.751  -0.959
  224   2H4     C  20          2H4         C  20  -3.036  -4.059  -2.551
  225    H5     C  20           H5         C  20  -6.077  -3.755  -0.510
  226    H6     C  20           H6         C  20  -8.285  -4.011  -1.493
  227   1H2*    C  20          1H2*        C  20  -9.282  -5.983  -2.369
  228   2H2*    C  20          2H2*        C  20  -9.710  -6.609  -3.955
  229   1H5*    T  21          1H5*        T  21 -10.335  -6.387  -6.346
  230   2H5*    T  21          2H5*        T  21 -11.621  -7.344  -7.110
  231    H4*    T  21           H4*        T  21  -9.752  -8.260  -8.044
  232    H3*    T  21           H3*        T  21 -11.034  -9.997  -6.367
  233   1H2*    T  21          1H2*        T  21  -9.517  -9.794  -4.516
  234   2H2*    T  21          2H2*        T  21  -8.793 -11.134  -5.391
  235    H1*    T  21           H1*        T  21  -7.262  -9.656  -6.591
  236    H3     T  21           H3         T  21  -3.924  -8.589  -3.864
  237   1H5M    T  21          1H5M        T  21  -8.541  -7.486  -1.267
  238   2H5M    T  21          2H5M        T  21  -7.113  -6.466  -0.971
  239   3H5M    T  21          3H5M        T  21  -7.155  -8.136  -0.361
  240    H6     T  21           H6         T  21  -8.656  -8.188  -3.473
  241   1H5*    C  22          1H5*        C  22  -7.913 -13.765  -6.321
  242   2H5*    C  22          2H5*        C  22  -7.560 -12.045  -6.582
  243    H4*    C  22           H4*        C  22  -6.424 -13.199  -8.777
  244    H3*    C  22           H3*        C  22  -6.782 -15.494  -7.480
  245    H1*    C  22           H1*        C  22  -3.484 -13.454  -6.619
  246   1H4     C  22          1H4         C  22  -5.093 -10.743  -0.775
  247   2H4     C  22          2H4         C  22  -3.361 -10.998  -0.799
  248    H5     C  22           H5         C  22  -6.521 -11.368  -2.662
  249    H6     C  22           H6         C  22  -6.572 -12.472  -4.828
  250   1H2*    C  22          1H2*        C  22  -5.777 -14.986  -5.379
  251   2H2*    C  22          2H2*        C  22  -4.359 -15.590  -6.226
  252   1H5*    G  23          1H5*        G  23  -2.693 -14.456  -8.460
  253   2H5*    G  23          2H5*        G  23  -2.197 -15.398  -9.881
  254    H4*    G  23           H4*        G  23  -0.204 -14.720  -8.895
  255    H3*    G  23           H3*        G  23  -0.602 -17.419  -9.072
  256    H1*    G  23           H1*        G  23   0.902 -15.708  -5.976
  257    H8     G  23           H8         G  23  -2.673 -17.048  -5.272
  258    H1     G  23           H1         G  23   0.579 -14.830  -0.212
  259   1H2     G  23          1H2         G  23   3.048 -14.080  -2.522
  260   2H2     G  23          2H2         G  23   2.542 -14.060  -0.847
  261   1H2*    G  23          1H2*        G  23  -1.136 -17.840  -6.783
  262   2H2*    G  23          2H2*        G  23   0.615 -17.981  -6.710
  263   1H5*    C  24          1H5*        C  24   2.938 -17.398  -6.863
  264   2H5*    C  24          2H5*        C  24   3.807 -16.063  -7.646
  265    H4*    C  24           H4*        C  24   5.800 -16.861  -7.081
  266    H3*    C  24           H3*        C  24   5.376 -18.964  -8.646
  267    H1*    C  24           H1*        C  24   5.474 -19.723  -4.697
  268   1H4     C  24          1H4         C  24  -1.034 -20.526  -3.764
  269   2H4     C  24          2H4         C  24  -0.267 -20.612  -2.195
  270    H5     C  24           H5         C  24   0.194 -20.065  -5.799
  271    H6     C  24           H6         C  24   2.392 -19.585  -6.735
  272    H3T    C  24           H3T        C  24   7.287 -18.313  -6.765
  273   1H2*    C  24          1H2*        C  24   4.064 -20.373  -7.266
  274   2H2*    C  24          2H2*        C  24   5.646 -20.883  -6.697
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1   0.534 -19.792   8.122
    2   2H5*    G   1          2H5*        G   1   1.661 -21.159   8.216
    3    H4*    G   1           H4*        G   1   3.547 -19.609   8.132
    4    H3*    G   1           H3*        G   1   2.014 -17.559   8.950
    5    H1*    G   1           H1*        G   1   3.016 -17.849   5.235
    6    H8     G   1           H8         G   1  -0.646 -18.977   5.836
    7    H1     G   1           H1         G   1   1.183 -18.435  -0.286
    8   1H2     G   1          1H2         G   1   4.265 -17.585   1.036
    9   2H2     G   1          2H2         G   1   3.306 -17.856  -0.404
   10    H5T    G   1           H5T        G   1   2.373 -19.382  10.056
   11   1H2*    G   1          1H2*        G   1   0.582 -17.409   7.028
   12   2H2*    G   1          2H2*        G   1   1.838 -16.257   6.598
   13   1H5*    C   2          1H5*        C   2   5.248 -13.401   7.123
   14   2H5*    C   2          2H5*        C   2   3.647 -13.089   6.422
   15    H4*    C   2           H4*        C   2   6.213 -13.845   5.101
   16    H3*    C   2           H3*        C   2   5.078 -11.445   5.142
   17    H1*    C   2           H1*        C   2   4.180 -13.801   2.175
   18   1H4     C   2          1H4         C   2  -1.816 -16.282   3.509
   19   2H4     C   2          2H4         C   2  -1.807 -15.852   1.814
   20    H5     C   2           H5         C   2   0.075 -15.838   4.984
   21    H6     C   2           H6         C   2   2.307 -14.876   5.115
   22   1H2*    C   2          1H2*        C   2   2.901 -12.066   4.329
   23   2H2*    C   2          2H2*        C   2   3.686 -11.555   2.843
   24   1H5*    G   3          1H5*        G   3   6.383 -12.974   1.094
   25   2H5*    G   3          2H5*        G   3   7.758 -11.959   0.611
   26    H4*    G   3           H4*        G   3   6.865 -12.937  -1.346
   27    H3*    G   3           H3*        G   3   7.164 -10.233  -1.254
   28    H1*    G   3           H1*        G   3   4.059 -11.920  -2.729
   29    H8     G   3           H8         G   3   3.222 -11.154   0.958
   30    H1     G   3           H1         G   3  -1.733 -11.132  -3.104
   31   1H2     G   3          1H2         G   3   0.682 -11.651  -5.544
   32   2H2     G   3          2H2         G   3  -1.017 -11.463  -5.174
   33   1H2*    G   3          1H2*        G   3   4.874  -9.662  -0.831
   34   2H2*    G   3          2H2*        G   3   4.886  -9.654  -2.589
   35   1H5*    A   4          1H5*        A   4   4.498 -11.257  -5.023
   36   2H5*    A   4          2H5*        A   4   5.928 -11.341  -6.072
   37    H4*    A   4           H4*        A   4   4.582 -10.546  -7.646
   38    H3*    A   4           H3*        A   4   5.893  -8.375  -6.741
   39    H1*    A   4           H1*        A   4   2.043  -8.299  -7.143
   40    H8     A   4           H8         A   4   3.165  -8.224  -3.450
   41   1H6     A   4          1H6         A   4  -1.259  -8.032  -1.459
   42   2H6     A   4          2H6         A   4  -2.877  -8.105  -2.121
   43    H2     A   4           H2         A   4  -2.441  -8.550  -6.561
   44   1H2*    A   4          1H2*        A   4   4.262  -7.602  -5.165
   45   2H2*    A   4          2H2*        A   4   3.762  -6.719  -6.599
   46   1H5*    G   5          1H5*        G   5   2.924  -8.021 -10.174
   47   2H5*    G   5          2H5*        G   5   3.862  -7.431 -11.563
   48    H4*    G   5           H4*        G   5   1.725  -6.876 -12.158
   49    H3*    G   5           H3*        G   5   3.300  -4.700 -11.700
   50    H1*    G   5           H1*        G   5  -0.354  -4.918 -10.336
   51    H8     G   5           H8         G   5   2.398  -5.367  -7.641
   52    H1     G   5           H1         G   5  -3.595  -4.635  -5.475
   53   1H2     G   5          1H2         G   5  -4.467  -4.517  -8.817
   54   2H2     G   5          2H2         G   5  -4.998  -4.478  -7.151
   55   1H2*    G   5          1H2*        G   5   2.459  -4.033  -9.579
   56   2H2*    G   5          2H2*        G   5   1.278  -3.220 -10.599
   57   1H5*    A   6          1H5*        A   6  -0.584  -2.954 -11.612
   58   2H5*    A   6          2H5*        A   6  -0.839  -4.105 -12.940
   59    H4*    A   6           H4*        A   6  -2.539  -2.940 -13.821
   60    H3*    A   6           H3*        A   6  -1.007  -0.787 -14.081
   61    H1*    A   6           H1*        A   6  -3.863  -0.563 -11.280
   62    H8     A   6           H8         A   6  -0.207  -1.301 -10.202
   63   1H6     A   6          1H6         A   6  -1.005  -1.370  -5.423
   64   2H6     A   6          2H6         A   6  -2.432  -1.179  -4.436
   65    H2     A   6           H2         A   6  -5.851  -0.490  -7.252
   66   1H2*    A   6          1H2*        A   6  -0.991   0.073 -11.878
   67   2H2*    A   6          2H2*        A   6  -2.455   0.855 -12.448
   68   1H5*    T   7          1H5*        T   7  -3.640   2.183 -12.776
   69   2H5*    T   7          2H5*        T   7  -4.353   0.563 -12.753
   70    H4*    T   7           H4*        T   7  -6.544   1.699 -13.374
   71    H3*    T   7           H3*        T   7  -5.317   4.001 -13.784
   72   1H2*    T   7          1H2*        T   7  -4.230   4.410 -11.723
   73   2H2*    T   7          2H2*        T   7  -5.789   5.094 -11.294
   74    H1*    T   7           H1*        T   7  -6.359   3.324  -9.932
   75    H3     T   7           H3         T   7  -3.550   1.823  -6.791
   76   1H5M    T   7          1H5M        T   7  -0.362   1.362 -10.575
   77   2H5M    T   7          2H5M        T   7   0.092   2.690  -9.479
   78   3H5M    T   7          3H5M        T   7  -0.606   3.054 -11.074
   79    H6     T   7           H6         T   7  -2.977   2.946 -11.376
   80   1H5*    C   8          1H5*        C   8  -9.407   6.965 -11.316
   81   2H5*    C   8          2H5*        C   8  -7.955   7.705 -10.611
   82    H4*    C   8           H4*        C   8  -9.918   5.810  -9.434
   83    H3*    C   8           H3*        C   8  -9.537   8.394  -8.867
   84    H1*    C   8           H1*        C   8  -7.697   5.735  -6.689
   85   1H4     C   8          1H4         C   8  -1.405   5.735  -8.737
   86   2H4     C   8          2H4         C   8  -1.363   5.659  -6.992
   87    H5     C   8           H5         C   8  -3.468   5.931  -9.988
   88    H6     C   8           H6         C   8  -5.882   6.278  -9.811
   89   1H2*    C   8          1H2*        C   8  -7.228   8.305  -8.245
   90   2H2*    C   8          2H2*        C   8  -7.985   8.082  -6.678
   91   1H5*    T   9          1H5*        T   9  -8.710   6.295  -4.705
   92   2H5*    T   9          2H5*        T   9 -10.251   6.758  -3.951
   93    H4*    T   9           H4*        T   9  -8.766   7.017  -2.222
   94    H3*    T   9           H3*        T   9  -9.898   9.344  -3.017
   95   1H2*    T   9          1H2*        T   9  -8.076  10.103  -4.395
   96   2H2*    T   9          2H2*        T   9  -7.706  10.882  -2.868
   97    H1*    T   9           H1*        T   9  -6.201   9.075  -2.197
   98    H3     T   9           H3         T   9  -2.345   9.580  -4.353
   99   1H5M    T   9          1H5M        T   9  -6.219   9.927  -8.073
  100   2H5M    T   9          2H5M        T   9  -4.523  10.347  -8.411
  101   3H5M    T   9          3H5M        T   9  -5.023   8.639  -8.360
  102    H6     T   9           H6         T   9  -6.869   9.431  -5.828
  103   1H5*    G  10          1H5*        G  10  -6.458  10.324  -0.313
  104   2H5*    G  10          2H5*        G  10  -7.394   9.778   1.092
  105    H4*    G  10           H4*        G  10  -6.345  11.177   2.430
  106    H3*    G  10           H3*        G  10  -7.799  13.103   1.301
  107    H1*    G  10           H1*        G  10  -3.858  13.350   0.898
  108    H8     G  10           H8         G  10  -5.899  11.985  -2.103
  109    H1     G  10           H1         G  10   0.363  12.711  -3.123
  110   1H2     G  10          1H2         G  10   0.535  13.437   0.260
  111   2H2     G  10          2H2         G  10   1.405  13.208  -1.241
  112   1H2*    G  10          1H2*        G  10  -6.468  13.605  -0.608
  113   2H2*    G  10          2H2*        G  10  -5.728  14.711   0.539
  114   1H5*    C  11          1H5*        C  11  -3.602  14.142   3.035
  115   2H5*    C  11          2H5*        C  11  -4.361  14.628   4.566
  116    H4*    C  11           H4*        C  11  -2.360  15.617   4.852
  117    H3*    C  11           H3*        C  11  -4.194  17.511   4.378
  118    H1*    C  11           H1*        C  11  -0.916  17.509   2.102
  119   1H4     C  11          1H4         C  11  -3.556  15.403  -3.600
  120   2H4     C  11          2H4         C  11  -1.849  15.676  -3.874
  121    H5     C  11           H5         C  11  -4.605  15.741  -1.442
  122    H6     C  11           H6         C  11  -4.217  16.319   0.895
  123   1H2*    C  11          1H2*        C  11  -3.903  17.907   2.063
  124   2H2*    C  11          2H2*        C  11  -2.636  18.973   2.650
  125   1H5*    G  12          1H5*        G  12   0.064  19.188   4.581
  126   2H5*    G  12          2H5*        G  12   0.143  20.411   5.866
  127    H4*    G  12           H4*        G  12   1.634  21.183   4.281
  128    H3*    G  12           H3*        G  12  -0.506  22.818   4.742
  129    H1*    G  12           H1*        G  12   0.883  22.119   1.219
  130    H8     G  12           H8         G  12  -2.700  20.769   1.678
  131    H1     G  12           H1         G  12   0.012  19.626  -4.021
  132   1H2     G  12          1H2         G  12   2.847  21.005  -2.609
  133   2H2     G  12          2H2         G  12   2.105  20.281  -4.018
  134    H3T    G  12           H3T        G  12   1.834  23.141   3.181
  135   1H2*    G  12          1H2*        G  12  -1.747  22.342   2.762
  136   2H2*    G  12          2H2*        G  12  -0.723  23.640   2.162
  137   1H5*    C  13          1H5*        C  13   1.408  20.697 -11.672
  138   2H5*    C  13          2H5*        C  13   1.383  22.444 -11.366
  139    H4*    C  13           H4*        C  13   3.921  22.201 -11.033
  140    H3*    C  13           H3*        C  13   3.725  19.618 -11.750
  141    H1*    C  13           H1*        C  13   3.578  20.537  -7.910
  142   1H4     C  13          1H4         C  13  -2.814  19.455  -6.496
  143   2H4     C  13          2H4         C  13  -1.948  19.574  -4.985
  144    H5     C  13           H5         C  13  -1.726  19.655  -8.652
  145    H6     C  13           H6         C  13   0.399  20.032  -9.787
  146    H5T    C  13           H5T        C  13   2.980  22.655 -13.018
  147   1H2*    C  13          1H2*        C  13   2.310  18.785 -10.032
  148   2H2*    C  13          2H2*        C  13   3.856  18.606  -9.214
  149   1H5*    G  14          1H5*        G  14   5.998  19.813  -7.885
  150   2H5*    G  14          2H5*        G  14   7.679  19.404  -8.287
  151    H4*    G  14           H4*        G  14   7.570  18.399  -6.281
  152    H3*    G  14           H3*        G  14   7.452  16.489  -8.234
  153    H1*    G  14           H1*        G  14   5.276  16.430  -5.085
  154    H8     G  14           H8         G  14   3.125  16.912  -8.259
  155    H1     G  14           H1         G  14  -0.058  16.818  -2.695
  156   1H2     G  14          1H2         G  14   3.076  16.723  -1.250
  157   2H2     G  14          2H2         G  14   1.344  16.761  -1.010
  158   1H2*    G  14          1H2*        G  14   5.103  16.043  -8.115
  159   2H2*    G  14          2H2*        G  14   5.691  14.906  -6.911
  160   1H5*    C  15          1H5*        C  15   7.990  15.272  -3.658
  161   2H5*    C  15          2H5*        C  15   9.424  14.230  -3.770
  162    H4*    C  15           H4*        C  15   8.313  13.607  -1.804
  163    H3*    C  15           H3*        C  15   8.790  11.657  -3.611
  164    H1*    C  15           H1*        C  15   5.374  11.960  -1.870
  165   1H4     C  15          1H4         C  15   0.992  13.929  -6.440
  166   2H4     C  15          2H4         C  15   0.090  13.400  -5.039
  167    H5     C  15           H5         C  15   3.399  13.937  -6.528
  168    H6     C  15           H6         C  15   5.448  13.283  -5.356
  169   1H2*    C  15          1H2*        C  15   6.621  11.609  -4.640
  170   2H2*    C  15          2H2*        C  15   6.413  10.399  -3.383
  171   1H5*    A  16          1H5*        A  16   6.014   8.476  -2.041
  172   2H5*    A  16          2H5*        A  16   5.905  10.052  -1.233
  173    H4*    A  16           H4*        A  16   5.810   8.651   0.941
  174    H3*    A  16           H3*        A  16   6.146   6.427  -0.485
  175    H1*    A  16           H1*        A  16   2.328   7.693  -0.123
  176    H8     A  16           H8         A  16   4.528   8.911  -3.084
  177   1H6     A  16          1H6         A  16   0.898  10.020  -6.101
  178   2H6     A  16          2H6         A  16  -0.844   9.930  -5.971
  179    H2     A  16           H2         A  16  -1.744   8.298  -1.893
  180   1H2*    A  16          1H2*        A  16   4.330   6.474  -1.978
  181   2H2*    A  16          2H2*        A  16   3.473   5.755  -0.622
  182   1H5*    G  17          1H5*        G  17   2.355   6.994   1.844
  183   2H5*    G  17          2H5*        G  17   2.551   5.891   3.222
  184    H4*    G  17           H4*        G  17   0.243   6.296   2.966
  185    H3*    G  17           H3*        G  17   1.074   3.734   3.053
  186    H1*    G  17           H1*        G  17  -1.475   4.874   0.377
  187    H8     G  17           H8         G  17   2.060   4.284  -1.096
  188    H1     G  17           H1         G  17  -2.573   5.672  -5.314
  189   1H2     G  17          1H2         G  17  -4.575   6.024  -2.523
  190   2H2     G  17          2H2         G  17  -4.457   6.088  -4.266
  191   1H2*    G  17          1H2*        G  17   1.116   3.294   0.695
  192   2H2*    G  17          2H2*        G  17  -0.522   2.796   1.084
  193   1H5*  6MC  18          1H5*      6MC  18  -3.457   4.840   3.276
  194   2H5*  6MC  18          2H5*      6MC  18  -3.155   4.016   1.740
  195    H4*  6MC  18           H4*      6MC  18  -5.619   4.429   3.160
  196    H3*  6MC  18           H3*      6MC  18  -4.945   1.842   3.693
  197   1H2*  6MC  18          1H2*      6MC  18  -6.767   1.136   1.574
  198   2H2*  6MC  18          2H2*      6MC  18  -5.075   0.667   1.698
  199    H1*  6MC  18           H1*      6MC  18  -6.265   2.479  -0.165
  200    H8   6MC  18           H8       6MC  18  -2.891   2.025   1.446
  201   1H6   6MC  18          1H6       6MC  18  -0.283   1.856  -2.528
  202    H2   6MC  18           H2       6MC  18  -4.999   2.260  -4.363
  203   1H1   6MC  18          1H1       6MC  18   0.416   2.479  -4.660
  204   2H1   6MC  18          2H1       6MC  18  -0.998   2.206  -5.211
  205   3H1   6MC  18          3H1       6MC  18  -0.074   1.028  -4.843
  206   1H5*    T  19          1H5*        T  19  -8.218   2.466   1.066
  207   2H5*    T  19          2H5*        T  19  -9.762   2.111   1.864
  208    H4*    T  19           H4*        T  19 -10.229   1.448  -0.256
  209    H3*    T  19           H3*        T  19 -10.029  -0.696   1.443
  210   1H2*    T  19          1H2*        T  19  -7.863  -1.430   0.698
  211   2H2*    T  19          2H2*        T  19  -8.914  -2.353  -0.361
  212    H1*    T  19           H1*        T  19  -8.795  -0.633  -2.119
  213    H3     T  19           H3         T  19  -4.931  -1.082  -4.323
  214   1H5M    T  19          1H5M        T  19  -3.324  -0.597   0.661
  215   2H5M    T  19          2H5M        T  19  -2.460  -1.611  -0.518
  216   3H5M    T  19          3H5M        T  19  -3.696  -2.333   0.540
  217    H6     T  19           H6         T  19  -5.992  -0.727   0.320
  218   1H5*    C  20          1H5*        C  20  -9.841  -3.942  -1.512
  219   2H5*    C  20          2H5*        C  20  -9.840  -2.272  -2.112
  220    H4*    C  20           H4*        C  20 -11.421  -3.195  -3.940
  221    H3*    C  20           H3*        C  20 -11.328  -5.592  -2.735
  222    H1*    C  20           H1*        C  20  -8.559  -4.838  -5.532
  223   1H4     C  20          1H4         C  20  -3.332  -4.085  -1.517
  224   2H4     C  20          2H4         C  20  -2.729  -4.376  -3.132
  225    H5     C  20           H5         C  20  -5.696  -4.006  -0.998
  226    H6     C  20           H6         C  20  -7.940  -4.164  -1.915
  227   1H2*    C  20          1H2*        C  20  -9.039  -6.139  -2.866
  228   2H2*    C  20          2H2*        C  20  -9.490  -6.674  -4.479
  229   1H5*    T  21          1H5*        T  21 -10.178  -6.332  -6.783
  230   2H5*    T  21          2H5*        T  21 -11.463  -7.160  -7.688
  231    H4*    T  21           H4*        T  21  -9.636  -8.175  -8.566
  232    H3*    T  21           H3*        T  21 -11.028  -9.896  -6.970
  233   1H2*    T  21          1H2*        T  21  -9.568  -9.759  -5.062
  234   2H2*    T  21          2H2*        T  21  -8.878 -11.127  -5.919
  235    H1*    T  21           H1*        T  21  -7.252  -9.703  -7.074
  236    H3     T  21           H3         T  21  -3.915  -8.677  -4.329
  237   1H5M    T  21          1H5M        T  21  -7.218  -6.742  -1.364
  238   2H5M    T  21          2H5M        T  21  -7.025  -8.407  -0.769
  239   3H5M    T  21          3H5M        T  21  -8.521  -7.929  -1.606
  240    H6     T  21           H6         T  21  -8.651  -8.382  -3.892
  241   1H5*    C  22          1H5*        C  22  -7.986 -13.745  -6.873
  242   2H5*    C  22          2H5*        C  22  -7.625 -12.019  -7.088
  243    H4*    C  22           H4*        C  22  -6.424 -13.142  -9.271
  244    H3*    C  22           H3*        C  22  -6.810 -15.451  -8.003
  245    H1*    C  22           H1*        C  22  -3.544 -13.414  -7.063
  246   1H4     C  22          1H4         C  22  -5.200 -10.753  -1.212
  247   2H4     C  22          2H4         C  22  -3.459 -10.939  -1.256
  248    H5     C  22           H5         C  22  -6.627 -11.444  -3.076
  249    H6     C  22           H6         C  22  -6.659 -12.544  -5.248
  250   1H2*    C  22          1H2*        C  22  -5.868 -14.945  -5.872
  251   2H2*    C  22          2H2*        C  22  -4.431 -15.554  -6.680
  252   1H5*    G  23          1H5*        G  23  -2.324 -14.583  -8.293
  253   2H5*    G  23          2H5*        G  23  -1.966 -15.599  -9.705
  254    H4*    G  23           H4*        G  23   0.034 -15.521  -8.542
  255    H3*    G  23           H3*        G  23  -1.073 -18.005  -8.803
  256    H1*    G  23           H1*        G  23   0.614 -16.767  -5.625
  257    H8     G  23           H8         G  23  -3.125 -17.442  -4.957
  258    H1     G  23           H1         G  23   0.220 -15.067  -0.025
  259   1H2     G  23          1H2         G  23   2.806 -14.812  -2.311
  260   2H2     G  23          2H2         G  23   2.265 -14.558  -0.667
  261   1H2*    G  23          1H2*        G  23  -1.927 -18.197  -6.569
  262   2H2*    G  23          2H2*        G  23  -0.324 -18.885  -6.362
  263   1H5*    C  24          1H5*        C  24   3.250 -17.337  -7.876
  264   2H5*    C  24          2H5*        C  24   4.386 -18.383  -8.754
  265    H4*    C  24           H4*        C  24   5.471 -17.680  -6.785
  266    H3*    C  24           H3*        C  24   5.284 -20.352  -7.268
  267    H1*    C  24           H1*        C  24   4.622 -18.844  -3.758
  268   1H4     C  24          1H4         C  24  -1.836 -19.854  -2.620
  269   2H4     C  24          2H4         C  24  -1.115 -19.300  -1.129
  270    H5     C  24           H5         C  24  -0.572 -20.131  -4.665
  271    H6     C  24           H6         C  24   1.628 -19.918  -5.694
  272    H3T    C  24           H3T        C  24   7.169 -20.139  -6.415
  273   1H2*    C  24          1H2*        C  24   3.527 -20.884  -5.748
  274   2H2*    C  24          2H2*        C  24   4.901 -21.039  -4.663
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -0.034 -19.899   8.443
    2   2H5*    G   1          2H5*        G   1   1.214 -20.986   9.084
    3    H4*    G   1           H4*        G   1   2.958 -19.549   8.357
    4    H3*    G   1           H3*        G   1   1.377 -17.364   8.642
    5    H1*    G   1           H1*        G   1   2.412 -18.662   5.154
    6    H8     G   1           H8         G   1  -1.280 -19.511   5.994
    7    H1     G   1           H1         G   1   0.557 -20.534  -0.065
    8   1H2     G   1          1H2         G   1   3.666 -19.481   1.029
    9   2H2     G   1          2H2         G   1   2.692 -20.062  -0.306
   10    H5T    G   1           H5T        G   1   0.222 -18.586  10.096
   11   1H2*    G   1          1H2*        G   1  -0.017 -17.679   6.722
   12   2H2*    G   1          2H2*        G   1   1.280 -16.731   6.008
   13   1H5*    C   2          1H5*        C   2   5.282 -13.518   6.821
   14   2H5*    C   2          2H5*        C   2   3.637 -13.372   6.167
   15    H4*    C   2           H4*        C   2   6.171 -14.187   4.771
   16    H3*    C   2           H3*        C   2   5.207 -11.705   4.869
   17    H1*    C   2           H1*        C   2   4.039 -14.000   1.934
   18   1H4     C   2          1H4         C   2  -2.084 -15.979   3.507
   19   2H4     C   2          2H4         C   2  -2.098 -15.581   1.803
   20    H5     C   2           H5         C   2  -0.107 -15.678   4.907
   21    H6     C   2           H6         C   2   2.172 -14.832   4.964
   22   1H2*    C   2          1H2*        C   2   2.976 -12.134   4.095
   23   2H2*    C   2          2H2*        C   2   3.772 -11.722   2.582
   24   1H5*    G   3          1H5*        G   3   6.195 -13.314   0.741
   25   2H5*    G   3          2H5*        G   3   7.703 -12.461   0.353
   26    H4*    G   3           H4*        G   3   6.854 -13.191  -1.696
   27    H3*    G   3           H3*        G   3   7.273 -10.533  -1.450
   28    H1*    G   3           H1*        G   3   4.074 -11.900  -3.050
   29    H8     G   3           H8         G   3   3.327 -11.208   0.690
   30    H1     G   3           H1         G   3  -1.719 -11.201  -3.263
   31   1H2     G   3          1H2         G   3   0.642 -11.736  -5.749
   32   2H2     G   3          2H2         G   3  -1.050 -11.547  -5.346
   33   1H2*    G   3          1H2*        G   3   5.011  -9.896  -0.935
   34   2H2*    G   3          2H2*        G   3   5.026  -9.707  -2.683
   35   1H5*    A   4          1H5*        A   4   4.764  -9.851  -4.706
   36   2H5*    A   4          2H5*        A   4   4.876 -11.463  -5.443
   37    H4*    A   4           H4*        A   4   4.900 -10.524  -7.644
   38    H3*    A   4           H3*        A   4   6.048  -8.269  -6.851
   39    H1*    A   4           H1*        A   4   2.135  -8.162  -7.410
   40    H8     A   4           H8         A   4   3.350  -8.149  -3.751
   41   1H6     A   4          1H6         A   4  -1.025  -8.132  -1.637
   42   2H6     A   4          2H6         A   4  -2.657  -8.242  -2.263
   43    H2     A   4           H2         A   4  -2.327  -8.596  -6.716
   44   1H2*    A   4          1H2*        A   4   4.318  -7.376  -5.460
   45   2H2*    A   4          2H2*        A   4   3.880  -6.634  -6.992
   46   1H5*    G   5          1H5*        G   5   3.244  -8.055 -10.488
   47   2H5*    G   5          2H5*        G   5   4.109  -7.293 -11.839
   48    H4*    G   5           H4*        G   5   1.847  -6.895 -12.241
   49    H3*    G   5           H3*        G   5   3.456  -4.704 -12.002
   50    H1*    G   5           H1*        G   5  -0.061  -4.898 -10.395
   51    H8     G   5           H8         G   5   2.812  -4.963  -7.800
   52    H1     G   5           H1         G   5  -3.137  -4.759  -5.403
   53   1H2     G   5          1H2         G   5  -4.142  -4.965  -8.701
   54   2H2     G   5          2H2         G   5  -4.610  -4.866  -7.016
   55   1H2*    G   5          1H2*        G   5   2.801  -4.003  -9.819
   56   2H2*    G   5          2H2*        G   5   1.566  -3.182 -10.764
   57   1H5*    A   6          1H5*        A   6  -0.303  -2.704 -11.823
   58   2H5*    A   6          2H5*        A   6  -0.869  -3.989 -12.909
   59    H4*    A   6           H4*        A   6  -2.397  -2.602 -13.968
   60    H3*    A   6           H3*        A   6  -0.682  -0.540 -13.948
   61    H1*    A   6           H1*        A   6  -3.632  -0.433 -11.183
   62    H8     A   6           H8         A   6   0.031  -1.363 -10.274
   63   1H6     A   6          1H6         A   6  -0.666  -1.831  -5.498
   64   2H6     A   6          2H6         A   6  -2.069  -1.685  -4.470
   65    H2     A   6           H2         A   6  -5.524  -0.661  -7.137
   66   1H2*    A   6          1H2*        A   6  -0.813   0.288 -11.747
   67   2H2*    A   6          2H2*        A   6  -2.323   1.006 -12.303
   68   1H5*    T   7          1H5*        T   7  -4.914  -0.035 -13.534
   69   2H5*    T   7          2H5*        T   7  -5.787   1.039 -14.647
   70    H4*    T   7           H4*        T   7  -7.016   0.996 -12.650
   71    H3*    T   7           H3*        T   7  -6.178   3.431 -13.578
   72   1H2*    T   7          1H2*        T   7  -4.407   3.783 -12.002
   73   2H2*    T   7          2H2*        T   7  -5.754   4.477 -11.113
   74    H1*    T   7           H1*        T   7  -6.163   2.425  -9.892
   75    H3     T   7           H3         T   7  -3.075   1.933  -6.709
   76   1H5M    T   7          1H5M        T   7   0.347   3.061  -9.604
   77   2H5M    T   7          2H5M        T   7  -0.424   3.124 -11.205
   78   3H5M    T   7          3H5M        T   7   0.048   1.556 -10.505
   79    H6     T   7           H6         T   7  -2.783   2.762 -11.386
   80   1H5*    C   8          1H5*        C   8  -8.542   7.068 -10.739
   81   2H5*    C   8          2H5*        C   8  -7.261   5.851 -10.568
   82    H4*    C   8           H4*        C   8  -9.622   5.244  -8.980
   83    H3*    C   8           H3*        C   8  -9.373   7.906  -8.892
   84    H1*    C   8           H1*        C   8  -7.318   5.772  -6.360
   85   1H4     C   8          1H4         C   8  -1.104   5.874  -8.644
   86   2H4     C   8          2H4         C   8  -1.001   5.877  -6.899
   87    H5     C   8           H5         C   8  -3.201   5.936  -9.840
   88    H6     C   8           H6         C   8  -5.620   6.096  -9.614
   89   1H2*    C   8          1H2*        C   8  -7.049   8.048  -8.363
   90   2H2*    C   8          2H2*        C   8  -7.745   8.080  -6.752
   91   1H5*    T   9          1H5*        T   9  -8.463   6.097  -4.505
   92   2H5*    T   9          2H5*        T   9 -10.017   6.625  -3.826
   93    H4*    T   9           H4*        T   9  -8.535   6.797  -2.052
   94    H3*    T   9           H3*        T   9  -9.730   9.105  -2.759
   95   1H2*    T   9          1H2*        T   9  -7.951   9.938  -4.162
   96   2H2*    T   9          2H2*        T   9  -7.599  10.718  -2.631
   97    H1*    T   9           H1*        T   9  -6.008   8.979  -1.993
   98    H3     T   9           H3         T   9  -2.209   9.623  -4.223
   99   1H5M    T   9          1H5M        T   9  -4.845   8.563  -8.186
  100   2H5M    T   9          2H5M        T   9  -6.189   9.689  -7.867
  101   3H5M    T   9          3H5M        T   9  -4.566  10.320  -8.233
  102    H6     T   9           H6         T   9  -6.754   9.310  -5.605
  103   1H5*    G  10          1H5*        G  10  -6.223  10.358  -0.199
  104   2H5*    G  10          2H5*        G  10  -7.081   9.597   1.157
  105    H4*    G  10           H4*        G  10  -6.243  11.025   2.620
  106    H3*    G  10           H3*        G  10  -7.789  12.898   1.558
  107    H1*    G  10           H1*        G  10  -3.852  13.439   1.110
  108    H8     G  10           H8         G  10  -5.912  11.926  -1.798
  109    H1     G  10           H1         G  10   0.268  12.968  -3.046
  110   1H2     G  10          1H2         G  10   0.505  13.796   0.310
  111   2H2     G  10          2H2         G  10   1.339  13.575  -1.214
  112   1H2*    G  10          1H2*        G  10  -6.497  13.566  -0.326
  113   2H2*    G  10          2H2*        G  10  -5.819  14.665   0.866
  114   1H5*    C  11          1H5*        C  11  -3.865  14.374   3.568
  115   2H5*    C  11          2H5*        C  11  -4.516  15.239   4.975
  116    H4*    C  11           H4*        C  11  -2.500  16.271   4.694
  117    H3*    C  11           H3*        C  11  -4.609  17.914   4.143
  118    H1*    C  11           H1*        C  11  -1.443  17.768   1.869
  119   1H4     C  11          1H4         C  11  -3.741  15.451  -3.898
  120   2H4     C  11          2H4         C  11  -2.028  15.736  -4.092
  121    H5     C  11           H5         C  11  -4.909  15.828  -1.808
  122    H6     C  11           H6         C  11  -4.650  16.461   0.532
  123   1H2*    C  11          1H2*        C  11  -4.480  17.961   1.776
  124   2H2*    C  11          2H2*        C  11  -3.300  19.217   2.123
  125   1H5*    G  12          1H5*        G  12  -0.417  20.154   3.794
  126   2H5*    G  12          2H5*        G  12  -0.570  21.085   5.298
  127    H4*    G  12           H4*        G  12   0.810  22.397   4.002
  128    H3*    G  12           H3*        G  12  -1.548  23.568   4.633
  129    H1*    G  12           H1*        G  12  -0.124  23.743   1.039
  130    H8     G  12           H8         G  12  -3.426  21.799   1.244
  131    H1     G  12           H1         G  12  -0.462  21.586  -4.440
  132   1H2     G  12          1H2         G  12   2.115  23.222  -2.815
  133   2H2     G  12          2H2         G  12   1.516  22.535  -4.308
  134    H3T    G  12           H3T        G  12   0.613  24.595   3.103
  135   1H2*    G  12          1H2*        G  12  -2.705  23.189   2.578
  136   2H2*    G  12          2H2*        G  12  -1.956  24.740   2.228
  137   1H5*    C  13          1H5*        C  13   1.187  20.660 -11.793
  138   2H5*    C  13          2H5*        C  13   1.002  22.422 -11.706
  139    H4*    C  13           H4*        C  13   3.627  22.312 -11.418
  140    H3*    C  13           H3*        C  13   3.397  19.647 -11.460
  141    H1*    C  13           H1*        C  13   3.063  21.458  -7.918
  142   1H4     C  13          1H4         C  13  -3.484  20.873  -7.009
  143   2H4     C  13          2H4         C  13  -2.776  21.334  -5.480
  144    H5     C  13           H5         C  13  -2.172  20.530  -9.014
  145    H6     C  13           H6         C  13   0.074  20.583  -9.960
  146    H5T    C  13           H5T        C  13   1.437  22.096 -13.797
  147   1H2*    C  13          1H2*        C  13   1.927  19.258  -9.641
  148   2H2*    C  13          2H2*        C  13   3.434  19.309  -8.736
  149   1H5*    G  14          1H5*        G  14   5.501  20.148  -7.641
  150   2H5*    G  14          2H5*        G  14   7.208  19.972  -8.098
  151    H4*    G  14           H4*        G  14   7.296  18.995  -6.071
  152    H3*    G  14           H3*        G  14   7.508  17.085  -7.960
  153    H1*    G  14           H1*        G  14   5.116  16.615  -4.964
  154    H8     G  14           H8         G  14   3.235  17.056  -8.297
  155    H1     G  14           H1         G  14  -0.429  16.594  -3.053
  156   1H2     G  14          1H2         G  14   2.557  16.653  -1.329
  157   2H2     G  14          2H2         G  14   0.812  16.574  -1.252
  158   1H2*    G  14          1H2*        G  14   5.213  16.380  -8.008
  159   2H2*    G  14          2H2*        G  14   5.864  15.275  -6.806
  160   1H5*    C  15          1H5*        C  15   7.554  15.876  -3.456
  161   2H5*    C  15          2H5*        C  15   9.182  15.179  -3.308
  162    H4*    C  15           H4*        C  15   8.106  14.224  -1.536
  163    H3*    C  15           H3*        C  15   8.795  12.403  -3.417
  164    H1*    C  15           H1*        C  15   5.341  12.346  -1.732
  165   1H4     C  15          1H4         C  15   0.866  13.993  -6.340
  166   2H4     C  15          2H4         C  15  -0.012  13.465  -4.926
  167    H5     C  15           H5         C  15   3.269  14.153  -6.416
  168    H6     C  15           H6         C  15   5.347  13.623  -5.230
  169   1H2*    C  15          1H2*        C  15   6.657  12.199  -4.489
  170   2H2*    C  15          2H2*        C  15   6.533  10.931  -3.277
  171   1H5*    A  16          1H5*        A  16   6.270   8.928  -1.962
  172   2H5*    A  16          2H5*        A  16   6.058  10.483  -1.134
  173    H4*    A  16           H4*        A  16   6.091   9.025   1.020
  174    H3*    A  16           H3*        A  16   6.498   6.856  -0.448
  175    H1*    A  16           H1*        A  16   2.636   7.944  -0.054
  176    H8     A  16           H8         A  16   4.757   9.400  -2.964
  177   1H6     A  16          1H6         A  16   1.059  10.606  -5.861
  178   2H6     A  16          2H6         A  16  -0.677  10.443  -5.721
  179    H2     A  16           H2         A  16  -1.479   8.485  -1.767
  180   1H2*    A  16          1H2*        A  16   4.694   6.925  -1.974
  181   2H2*    A  16          2H2*        A  16   3.867   6.087  -0.668
  182   1H5*    G  17          1H5*        G  17   2.765   7.125   1.918
  183   2H5*    G  17          2H5*        G  17   3.023   6.042   3.301
  184    H4*    G  17           H4*        G  17   0.702   6.349   3.104
  185    H3*    G  17           H3*        G  17   1.616   3.821   3.147
  186    H1*    G  17           H1*        G  17  -1.005   4.878   0.509
  187    H8     G  17           H8         G  17   2.529   4.448  -1.025
  188    H1     G  17           H1         G  17  -2.215   5.788  -5.132
  189   1H2     G  17          1H2         G  17  -4.168   6.025  -2.292
  190   2H2     G  17          2H2         G  17  -4.095   6.127  -4.037
  191   1H2*    G  17          1H2*        G  17   1.664   3.426   0.778
  192   2H2*    G  17          2H2*        G  17   0.058   2.839   1.175
  193   1H5*  6MC  18          1H5*      6MC  18  -2.942   4.738   3.427
  194   2H5*  6MC  18          2H5*      6MC  18  -2.635   3.958   1.868
  195    H4*  6MC  18           H4*      6MC  18  -5.086   4.254   3.328
  196    H3*  6MC  18           H3*      6MC  18  -4.301   1.681   3.813
  197   1H2*  6MC  18          1H2*      6MC  18  -6.183   0.977   1.727
  198   2H2*  6MC  18          2H2*      6MC  18  -4.486   0.517   1.811
  199    H1*  6MC  18           H1*      6MC  18  -5.725   2.329  -0.008
  200    H8   6MC  18           H8       6MC  18  -2.311   1.965   1.545
  201   1H6   6MC  18          1H6       6MC  18   0.243   1.925  -2.470
  202    H2   6MC  18           H2       6MC  18  -4.512   2.184  -4.235
  203   1H1   6MC  18          1H1       6MC  18  -0.558   1.984  -5.161
  204   2H1   6MC  18          2H1       6MC  18   0.719   1.254  -4.698
  205   3H1   6MC  18          3H1       6MC  18   0.664   2.795  -4.682
  206   1H5*    T  19          1H5*        T  19  -7.638   2.301   1.294
  207   2H5*    T  19          2H5*        T  19  -9.157   1.925   2.130
  208    H4*    T  19           H4*        T  19  -9.683   1.324   0.001
  209    H3*    T  19           H3*        T  19  -9.453  -0.854   1.650
  210   1H2*    T  19          1H2*        T  19  -7.312  -1.587   0.840
  211   2H2*    T  19          2H2*        T  19  -8.394  -2.483  -0.212
  212    H1*    T  19           H1*        T  19  -8.306  -0.733  -1.939
  213    H3     T  19           H3         T  19  -4.507  -1.212  -4.246
  214   1H5M    T  19          1H5M        T  19  -3.122  -2.446   0.584
  215   2H5M    T  19          2H5M        T  19  -2.762  -0.706   0.684
  216   3H5M    T  19          3H5M        T  19  -1.926  -1.720  -0.516
  217    H6     T  19           H6         T  19  -5.439  -0.860   0.427
  218   1H5*    C  20          1H5*        C  20  -9.352  -4.064  -1.425
  219   2H5*    C  20          2H5*        C  20  -9.312  -2.353  -1.893
  220    H4*    C  20           H4*        C  20 -10.917  -3.087  -3.784
  221    H3*    C  20           H3*        C  20 -10.899  -5.568  -2.768
  222    H1*    C  20           H1*        C  20  -8.093  -4.688  -5.489
  223   1H4     C  20          1H4         C  20  -2.841  -4.312  -1.441
  224   2H4     C  20          2H4         C  20  -2.271  -4.661  -3.056
  225    H5     C  20           H5         C  20  -5.213  -4.086  -0.928
  226    H6     C  20           H6         C  20  -7.460  -4.113  -1.860
  227   1H2*    C  20          1H2*        C  20  -8.622  -6.165  -2.927
  228   2H2*    C  20          2H2*        C  20  -9.076  -6.569  -4.578
  229   1H5*    T  21          1H5*        T  21  -9.884  -6.164  -6.868
  230   2H5*    T  21          2H5*        T  21 -11.203  -6.905  -7.801
  231    H4*    T  21           H4*        T  21  -9.438  -8.005  -8.691
  232    H3*    T  21           H3*        T  21 -10.900  -9.676  -7.105
  233   1H2*    T  21          1H2*        T  21  -9.433  -9.631  -5.203
  234   2H2*    T  21          2H2*        T  21  -8.804 -11.016  -6.079
  235    H1*    T  21           H1*        T  21  -7.115  -9.653  -7.212
  236    H3     T  21           H3         T  21  -3.740  -8.706  -4.469
  237   1H5M    T  21          1H5M        T  21  -7.020  -6.860  -1.420
  238   2H5M    T  21          2H5M        T  21  -6.807  -8.542  -0.879
  239   3H5M    T  21          3H5M        T  21  -8.318  -8.051  -1.681
  240    H6     T  21           H6         T  21  -8.474  -8.425  -3.984
  241   1H5*    C  22          1H5*        C  22  -8.010 -13.606  -7.012
  242   2H5*    C  22          2H5*        C  22  -7.597 -11.896  -7.245
  243    H4*    C  22           H4*        C  22  -6.422 -13.061  -9.412
  244    H3*    C  22           H3*        C  22  -6.894 -15.356  -8.149
  245    H1*    C  22           H1*        C  22  -3.568 -13.431  -7.193
  246   1H4     C  22          1H4         C  22  -5.133 -10.712  -1.347
  247   2H4     C  22          2H4         C  22  -3.403 -10.988  -1.374
  248    H5     C  22           H5         C  22  -6.581 -11.339  -3.215
  249    H6     C  22           H6         C  22  -6.649 -12.401  -5.404
  250   1H2*    C  22          1H2*        C  22  -5.948 -14.886  -6.011
  251   2H2*    C  22          2H2*        C  22  -4.528 -15.545  -6.813
  252   1H5*    G  23          1H5*        G  23  -2.380 -14.995  -8.380
  253   2H5*    G  23          2H5*        G  23  -2.047 -16.052  -9.767
  254    H4*    G  23           H4*        G  23  -0.163 -16.374  -8.536
  255    H3*    G  23           H3*        G  23  -1.777 -18.601  -8.504
  256    H1*    G  23           H1*        G  23   0.155 -17.271  -5.487
  257    H8     G  23           H8         G  23  -3.619 -17.335  -4.775
  258    H1     G  23           H1         G  23   0.004 -14.573  -0.261
  259   1H2     G  23          1H2         G  23   2.576 -14.936  -2.550
  260   2H2     G  23          2H2         G  23   2.081 -14.376  -0.967
  261   1H2*    G  23          1H2*        G  23  -2.596 -18.370  -6.270
  262   2H2*    G  23          2H2*        G  23  -1.122 -19.275  -5.956
  263   1H5*    C  24          1H5*        C  24   2.567 -18.793  -7.521
  264   2H5*    C  24          2H5*        C  24   3.436 -19.960  -8.540
  265    H4*    C  24           H4*        C  24   4.689 -19.605  -6.548
  266    H3*    C  24           H3*        C  24   4.102 -22.138  -7.348
  267    H1*    C  24           H1*        C  24   3.764 -21.023  -3.656
  268   1H4     C  24          1H4         C  24  -2.729 -21.259  -2.315
  269   2H4     C  24          2H4         C  24  -1.880 -21.008  -0.806
  270    H5     C  24           H5         C  24  -1.590 -21.440  -4.447
  271    H6     C  24           H6         C  24   0.582 -21.407  -5.555
  272    H3T    C  24           H3T        C  24   5.931 -22.529  -6.363
  273   1H2*    C  24          1H2*        C  24   2.318 -22.601  -5.834
  274   2H2*    C  24          2H2*        C  24   3.680 -23.101  -4.841
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1   1.098 -20.598   8.514
    2   2H5*    G   1          2H5*        G   1   2.000 -22.029   7.980
    3    H4*    G   1           H4*        G   1   3.964 -20.275   7.794
    4    H3*    G   1           H3*        G   1   2.082 -18.418   8.473
    5    H1*    G   1           H1*        G   1   3.152 -19.076   4.836
    6    H8     G   1           H8         G   1  -0.427 -20.399   5.549
    7    H1     G   1           H1         G   1   1.461 -20.486  -0.580
    8   1H2     G   1          1H2         G   1   4.467 -19.300   0.660
    9   2H2     G   1          2H2         G   1   3.550 -19.796  -0.748
   10    H5T    G   1           H5T        G   1   3.556 -21.557   9.586
   11   1H2*    G   1          1H2*        G   1   0.666 -18.642   6.560
   12   2H2*    G   1          2H2*        G   1   1.797 -17.441   5.955
   13   1H5*    C   2          1H5*        C   2   5.474 -13.779   7.248
   14   2H5*    C   2          2H5*        C   2   3.794 -13.869   6.678
   15    H4*    C   2           H4*        C   2   6.341 -14.141   5.103
   16    H3*    C   2           H3*        C   2   4.988 -11.854   5.492
   17    H1*    C   2           H1*        C   2   4.272 -13.997   2.369
   18   1H4     C   2          1H4         C   2  -1.558 -17.025   3.219
   19   2H4     C   2          2H4         C   2  -1.505 -16.463   1.562
   20    H5     C   2           H5         C   2   0.209 -16.536   4.821
   21    H6     C   2           H6         C   2   2.349 -15.417   5.141
   22   1H2*    C   2          1H2*        C   2   2.847 -12.585   4.676
   23   2H2*    C   2          2H2*        C   2   3.535 -11.868   3.228
   24   1H5*    G   3          1H5*        G   3   6.517 -12.835   1.461
   25   2H5*    G   3          2H5*        G   3   7.729 -11.666   0.896
   26    H4*    G   3           H4*        G   3   6.758 -12.843  -0.970
   27    H3*    G   3           H3*        G   3   7.076 -10.157  -1.020
   28    H1*    G   3           H1*        G   3   3.925 -11.829  -2.246
   29    H8     G   3           H8         G   3   3.135 -11.126   1.465
   30    H1     G   3           H1         G   3  -1.848 -10.962  -2.558
   31   1H2     G   3          1H2         G   3   0.553 -11.378  -5.031
   32   2H2     G   3          2H2         G   3  -1.143 -11.202  -4.647
   33   1H2*    G   3          1H2*        G   3   4.822  -9.600  -0.341
   34   2H2*    G   3          2H2*        G   3   4.708  -9.517  -2.094
   35   1H5*    A   4          1H5*        A   4   4.241 -10.063  -4.041
   36   2H5*    A   4          2H5*        A   4   4.424 -11.673  -4.767
   37    H4*    A   4           H4*        A   4   4.048 -10.861  -6.936
   38    H3*    A   4           H3*        A   4   5.373  -8.609  -6.445
   39    H1*    A   4           H1*        A   4   1.516  -8.440  -6.766
   40    H8     A   4           H8         A   4   2.702  -8.052  -3.105
   41   1H6     A   4          1H6         A   4  -1.692  -7.507  -1.095
   42   2H6     A   4          2H6         A   4  -3.318  -7.540  -1.755
   43    H2     A   4           H2         A   4  -2.949  -8.312  -6.138
   44   1H2*    A   4          1H2*        A   4   3.801  -7.596  -4.923
   45   2H2*    A   4          2H2*        A   4   3.311  -6.873  -6.449
   46   1H5*    G   5          1H5*        G   5   2.586  -8.594 -10.093
   47   2H5*    G   5          2H5*        G   5   3.471  -8.086 -11.546
   48    H4*    G   5           H4*        G   5   1.310  -7.429 -11.986
   49    H3*    G   5           H3*        G   5   3.092  -5.368 -11.787
   50    H1*    G   5           H1*        G   5  -0.451  -5.238 -10.250
   51    H8     G   5           H8         G   5   2.341  -5.399  -7.568
   52    H1     G   5           H1         G   5  -3.656  -4.768  -5.381
   53   1H2     G   5          1H2         G   5  -4.559  -4.994  -8.710
   54   2H2     G   5          2H2         G   5  -5.087  -4.826  -7.052
   55   1H2*    G   5          1H2*        G   5   2.459  -4.545  -9.638
   56   2H2*    G   5          2H2*        G   5   1.306  -3.661 -10.631
   57   1H5*    A   6          1H5*        A   6  -0.505  -3.010 -11.803
   58   2H5*    A   6          2H5*        A   6  -1.093  -4.329 -12.835
   59    H4*    A   6           H4*        A   6  -2.475  -2.920 -14.065
   60    H3*    A   6           H3*        A   6  -0.671  -0.945 -14.058
   61    H1*    A   6           H1*        A   6  -3.696  -0.564 -11.379
   62    H8     A   6           H8         A   6  -0.099  -1.670 -10.387
   63   1H6     A   6          1H6         A   6  -0.896  -1.991  -5.621
   64   2H6     A   6          2H6         A   6  -2.310  -1.764  -4.616
   65    H2     A   6           H2         A   6  -5.685  -0.697  -7.370
   66   1H2*    A   6          1H2*        A   6  -0.839  -0.016 -11.902
   67   2H2*    A   6          2H2*        A   6  -2.295   0.747 -12.534
   68   1H5*    T   7          1H5*        T   7  -4.888  -0.355 -13.651
   69   2H5*    T   7          2H5*        T   7  -5.717   0.722 -14.796
   70    H4*    T   7           H4*        T   7  -6.982   0.713 -12.811
   71    H3*    T   7           H3*        T   7  -6.117   3.123 -13.779
   72   1H2*    T   7          1H2*        T   7  -4.374   3.519 -12.189
   73   2H2*    T   7          2H2*        T   7  -5.734   4.213 -11.321
   74    H1*    T   7           H1*        T   7  -6.126   2.199 -10.055
   75    H3     T   7           H3         T   7  -2.996   1.739  -6.901
   76   1H5M    T   7          1H5M        T   7   0.061   1.313 -10.763
   77   2H5M    T   7          2H5M        T   7   0.395   2.804  -9.850
   78   3H5M    T   7          3H5M        T   7  -0.402   2.894 -11.438
   79    H6     T   7           H6         T   7  -2.768   2.511 -11.592
   80   1H5*    C   8          1H5*        C   8  -8.360   6.782 -10.925
   81   2H5*    C   8          2H5*        C   8  -7.163   5.485 -10.746
   82    H4*    C   8           H4*        C   8  -9.560   4.949  -9.219
   83    H3*    C   8           H3*        C   8  -9.291   7.615  -9.126
   84    H1*    C   8           H1*        C   8  -7.291   5.451  -6.526
   85   1H4     C   8          1H4         C   8  -1.077   5.647  -8.823
   86   2H4     C   8          2H4         C   8  -0.976   5.645  -7.079
   87    H5     C   8           H5         C   8  -3.186   5.660 -10.010
   88    H6     C   8           H6         C   8  -5.603   5.822  -9.774
   89   1H2*    C   8          1H2*        C   8  -7.014   7.774  -8.460
   90   2H2*    C   8          2H2*        C   8  -7.776   7.733  -6.879
   91   1H5*    T   9          1H5*        T   9  -8.554   5.929  -4.689
   92   2H5*    T   9          2H5*        T   9 -10.142   6.441  -4.078
   93    H4*    T   9           H4*        T   9  -8.748   6.758  -2.266
   94    H3*    T   9           H3*        T   9  -9.906   9.018  -3.192
   95   1H2*    T   9          1H2*        T   9  -8.052   9.790  -4.518
   96   2H2*    T   9          2H2*        T   9  -7.773  10.633  -3.005
   97    H1*    T   9           H1*        T   9  -6.225   8.924  -2.215
   98    H3     T   9           H3         T   9  -2.308   9.351  -4.290
   99   1H5M    T   9          1H5M        T   9  -4.788   8.287  -8.344
  100   2H5M    T   9          2H5M        T   9  -6.124   9.440  -8.107
  101   3H5M    T   9          3H5M        T   9  -4.477  10.039  -8.412
  102    H6     T   9           H6         T   9  -6.798   9.145  -5.870
  103   1H5*    G  10          1H5*        G  10  -6.912  10.713  -0.777
  104   2H5*    G  10          2H5*        G  10  -7.148   9.542   0.537
  105    H4*    G  10           H4*        G  10  -6.642  11.084   2.184
  106    H3*    G  10           H3*        G  10  -8.063  12.998   1.003
  107    H1*    G  10           H1*        G  10  -4.099  13.300   0.742
  108    H8     G  10           H8         G  10  -6.061  11.886  -2.289
  109    H1     G  10           H1         G  10   0.211  12.686  -3.198
  110   1H2     G  10          1H2         G  10   0.313  13.475   0.173
  111   2H2     G  10          2H2         G  10   1.212  13.229  -1.310
  112   1H2*    G  10          1H2*        G  10  -6.660  13.550  -0.836
  113   2H2*    G  10          2H2*        G  10  -5.971  14.639   0.359
  114   1H5*    C  11          1H5*        C  11  -4.218  14.126   3.185
  115   2H5*    C  11          2H5*        C  11  -4.867  14.948   4.619
  116    H4*    C  11           H4*        C  11  -2.743  15.766   4.573
  117    H3*    C  11           H3*        C  11  -4.589  17.674   4.006
  118    H1*    C  11           H1*        C  11  -1.346  17.309   1.824
  119   1H4     C  11          1H4         C  11  -3.750  15.316  -4.025
  120   2H4     C  11          2H4         C  11  -2.029  15.567  -4.211
  121    H5     C  11           H5         C  11  -4.901  15.651  -1.917
  122    H6     C  11           H6         C  11  -4.624  16.231   0.436
  123   1H2*    C  11          1H2*        C  11  -4.332  17.838   1.655
  124   2H2*    C  11          2H2*        C  11  -3.033  18.923   2.130
  125   1H5*    G  12          1H5*        G  12  -0.182  19.314   4.268
  126   2H5*    G  12          2H5*        G  12  -0.305  20.188   5.810
  127    H4*    G  12           H4*        G  12   1.411  21.255   4.669
  128    H3*    G  12           H3*        G  12  -0.701  22.816   5.320
  129    H1*    G  12           H1*        G  12   0.875  22.977   1.774
  130    H8     G  12           H8         G  12  -2.681  21.489   1.834
  131    H1     G  12           H1         G  12   0.170  21.649  -3.911
  132   1H2     G  12          1H2         G  12   2.941  22.761  -2.168
  133   2H2     G  12          2H2         G  12   2.242  22.334  -3.716
  134    H3T    G  12           H3T        G  12   0.914  24.109   5.506
  135   1H2*    G  12          1H2*        G  12  -1.813  22.853   3.209
  136   2H2*    G  12          2H2*        G  12  -0.741  24.231   3.004
  137   1H5*    C  13          1H5*        C  13   1.403  21.261 -11.369
  138   2H5*    C  13          2H5*        C  13   1.425  23.018 -11.125
  139    H4*    C  13           H4*        C  13   4.021  22.606 -10.937
  140    H3*    C  13           H3*        C  13   3.530  20.000 -11.246
  141    H1*    C  13           H1*        C  13   3.425  21.433  -7.516
  142   1H4     C  13          1H4         C  13  -3.139  21.448  -6.566
  143   2H4     C  13          2H4         C  13  -2.377  21.665  -5.007
  144    H5     C  13           H5         C  13  -1.883  21.186  -8.618
  145    H6     C  13           H6         C  13   0.350  21.099  -9.589
  146    H5T    C  13           H5T        C  13   3.289  21.896 -12.890
  147   1H2*    C  13          1H2*        C  13   2.054  19.564  -9.442
  148   2H2*    C  13          2H2*        C  13   3.571  19.364  -8.575
  149   1H5*    G  14          1H5*        G  14   5.776  20.018  -7.507
  150   2H5*    G  14          2H5*        G  14   7.460  19.726  -7.989
  151    H4*    G  14           H4*        G  14   7.444  18.679  -5.983
  152    H3*    G  14           H3*        G  14   7.588  16.862  -7.993
  153    H1*    G  14           H1*        G  14   5.215  16.367  -4.988
  154    H8     G  14           H8         G  14   3.317  16.868  -8.301
  155    H1     G  14           H1         G  14  -0.314  16.432  -3.032
  156   1H2     G  14          1H2         G  14   2.687  16.411  -1.334
  157   2H2     G  14          2H2         G  14   0.942  16.367  -1.237
  158   1H2*    G  14          1H2*        G  14   5.291  16.193  -8.035
  159   2H2*    G  14          2H2*        G  14   5.918  15.049  -6.857
  160   1H5*    C  15          1H5*        C  15   7.359  15.494  -3.582
  161   2H5*    C  15          2H5*        C  15   9.024  14.904  -3.406
  162    H4*    C  15           H4*        C  15   8.046  13.825  -1.675
  163    H3*    C  15           H3*        C  15   8.712  12.067  -3.605
  164    H1*    C  15           H1*        C  15   5.240  11.914  -1.928
  165   1H4     C  15          1H4         C  15   0.824  13.820  -6.491
  166   2H4     C  15          2H4         C  15  -0.068  13.310  -5.076
  167    H5     C  15           H5         C  15   3.231  13.884  -6.571
  168    H6     C  15           H6         C  15   5.289  13.276  -5.390
  169   1H2*    C  15          1H2*        C  15   6.571  11.898  -4.678
  170   2H2*    C  15          2H2*        C  15   6.456  10.584  -3.517
  171   1H5*    A  16          1H5*        A  16   6.231   8.521  -2.271
  172   2H5*    A  16          2H5*        A  16   6.086  10.072  -1.421
  173    H4*    A  16           H4*        A  16   6.115   8.618   0.719
  174    H3*    A  16           H3*        A  16   6.506   6.437  -0.733
  175    H1*    A  16           H1*        A  16   2.652   7.528  -0.289
  176    H8     A  16           H8         A  16   4.698   8.903  -3.294
  177   1H6     A  16          1H6         A  16   0.920  10.182  -6.050
  178   2H6     A  16          2H6         A  16  -0.813  10.077  -5.837
  179    H2     A  16           H2         A  16  -1.509   8.191  -1.828
  180   1H2*    A  16          1H2*        A  16   4.679   6.497  -2.240
  181   2H2*    A  16          2H2*        A  16   3.872   5.666  -0.919
  182   1H5*    G  17          1H5*        G  17   2.885   6.708   1.723
  183   2H5*    G  17          2H5*        G  17   3.135   5.642   3.121
  184    H4*    G  17           H4*        G  17   0.830   5.964   2.982
  185    H3*    G  17           H3*        G  17   1.670   3.412   2.922
  186    H1*    G  17           H1*        G  17  -0.974   4.627   0.380
  187    H8     G  17           H8         G  17   2.526   4.239  -1.242
  188    H1     G  17           H1         G  17  -2.319   5.595  -5.214
  189   1H2     G  17          1H2         G  17  -4.224   5.734  -2.326
  190   2H2     G  17          2H2         G  17  -4.192   5.875  -4.068
  191   1H2*    G  17          1H2*        G  17   1.662   3.101   0.539
  192   2H2*    G  17          2H2*        G  17   0.048   2.541   0.946
  193   1H5*  6MC  18          1H5*      6MC  18  -2.821   4.601   3.348
  194   2H5*  6MC  18          2H5*      6MC  18  -2.542   3.950   1.726
  195    H4*  6MC  18           H4*      6MC  18  -4.993   4.354   3.132
  196    H3*  6MC  18           H3*      6MC  18  -4.472   1.698   3.507
  197   1H2*  6MC  18          1H2*      6MC  18  -6.335   1.264   1.340
  198   2H2*  6MC  18          2H2*      6MC  18  -4.684   0.661   1.437
  199    H1*  6MC  18           H1*      6MC  18  -5.730   2.669  -0.302
  200    H8   6MC  18           H8       6MC  18  -2.378   2.017   1.279
  201   1H6   6MC  18          1H6       6MC  18   0.190   1.778  -2.705
  202    H2   6MC  18           H2       6MC  18  -4.529   2.264  -4.513
  203   1H1   6MC  18          1H1       6MC  18  -0.565   2.022  -5.393
  204   2H1   6MC  18          2H1       6MC  18   0.482   0.970  -4.979
  205   3H1   6MC  18          3H1       6MC  18   0.812   2.472  -4.867
  206   1H5*    T  19          1H5*        T  19  -7.624   2.812   0.984
  207   2H5*    T  19          2H5*        T  19  -9.226   2.531   1.693
  208    H4*    T  19           H4*        T  19  -9.590   2.218  -0.555
  209    H3*    T  19           H3*        T  19  -9.983  -0.011   0.965
  210   1H2*    T  19          1H2*        T  19  -7.881  -1.064   0.397
  211   2H2*    T  19          2H2*        T  19  -8.981  -1.781  -0.767
  212    H1*    T  19           H1*        T  19  -8.454  -0.025  -2.439
  213    H3     T  19           H3         T  19  -4.678  -1.145  -4.489
  214   1H5M    T  19          1H5M        T  19  -2.538  -2.275  -0.611
  215   2H5M    T  19          2H5M        T  19  -3.855  -2.334   0.583
  216   3H5M    T  19          3H5M        T  19  -2.932  -0.829   0.349
  217    H6     T  19           H6         T  19  -5.819  -0.663   0.122
  218   1H5*    C  20          1H5*        C  20 -10.119  -3.092  -1.862
  219   2H5*    C  20          2H5*        C  20  -9.835  -1.457  -2.489
  220    H4*    C  20           H4*        C  20 -11.404  -2.214  -4.412
  221    H3*    C  20           H3*        C  20 -11.601  -4.604  -3.121
  222    H1*    C  20           H1*        C  20  -8.723  -4.145  -5.886
  223   1H4     C  20          1H4         C  20  -3.623  -4.303  -1.645
  224   2H4     C  20          2H4         C  20  -3.024  -4.780  -3.218
  225    H5     C  20           H5         C  20  -5.949  -3.768  -1.239
  226    H6     C  20           H6         C  20  -8.142  -3.521  -2.261
  227   1H2*    C  20          1H2*        C  20  -9.456  -5.483  -3.309
  228   2H2*    C  20          2H2*        C  20  -9.946  -5.860  -4.954
  229   1H5*    T  21          1H5*        T  21 -12.472  -8.669  -5.368
  230   2H5*    T  21          2H5*        T  21 -11.179  -7.762  -4.555
  231    H4*    T  21           H4*        T  21 -10.938  -8.430  -7.459
  232    H3*    T  21           H3*        T  21 -11.398 -10.577  -5.904
  233   1H2*    T  21          1H2*        T  21  -9.696 -10.132  -4.255
  234   2H2*    T  21          2H2*        T  21  -8.861 -11.227  -5.344
  235    H1*    T  21           H1*        T  21  -7.830  -9.389  -6.571
  236    H3     T  21           H3         T  21  -4.447  -8.228  -3.907
  237   1H5M    T  21          1H5M        T  21  -8.900  -6.445  -1.527
  238   2H5M    T  21          2H5M        T  21  -7.266  -6.156  -0.885
  239   3H5M    T  21          3H5M        T  21  -8.098  -7.691  -0.542
  240    H6     T  21           H6         T  21  -9.182  -7.879  -3.466
  241   1H5*    C  22          1H5*        C  22  -7.954 -13.262  -6.233
  242   2H5*    C  22          2H5*        C  22  -7.751 -11.595  -6.807
  243    H4*    C  22           H4*        C  22  -6.519 -12.811  -8.799
  244    H3*    C  22           H3*        C  22  -6.914 -15.123  -7.545
  245    H1*    C  22           H1*        C  22  -3.626 -13.120  -6.602
  246   1H4     C  22          1H4         C  22  -5.258 -10.483  -0.737
  247   2H4     C  22          2H4         C  22  -3.528 -10.750  -0.748
  248    H5     C  22           H5         C  22  -6.679 -11.084  -2.628
  249    H6     C  22           H6         C  22  -6.721 -12.131  -4.826
  250   1H2*    C  22          1H2*        C  22  -5.958 -14.640  -5.413
  251   2H2*    C  22          2H2*        C  22  -4.529 -15.254  -6.233
  252   1H5*    G  23          1H5*        G  23  -2.748 -14.065  -8.427
  253   2H5*    G  23          2H5*        G  23  -2.242 -15.050  -9.814
  254    H4*    G  23           H4*        G  23  -0.267 -14.361  -8.779
  255    H3*    G  23           H3*        G  23  -0.670 -17.062  -8.978
  256    H1*    G  23           H1*        G  23   0.814 -15.346  -5.904
  257    H8     G  23           H8         G  23  -2.757 -16.663  -5.136
  258    H1     G  23           H1         G  23   0.617 -14.513  -0.128
  259   1H2     G  23          1H2         G  23   3.064 -13.800  -2.466
  260   2H2     G  23          2H2         G  23   2.576 -13.782  -0.784
  261   1H2*    G  23          1H2*        G  23  -1.246 -17.470  -6.690
  262   2H2*    G  23          2H2*        G  23   0.501 -17.643  -6.605
  263   1H5*    C  24          1H5*        C  24   3.699 -16.513  -6.641
  264   2H5*    C  24          2H5*        C  24   4.565 -17.046  -8.096
  265    H4*    C  24           H4*        C  24   5.775 -17.907  -6.297
  266    H3*    C  24           H3*        C  24   4.817 -19.713  -8.096
  267    H1*    C  24           H1*        C  24   4.614 -20.307  -4.274
  268   1H4     C  24          1H4         C  24  -1.853 -20.336  -2.821
  269   2H4     C  24          2H4         C  24  -0.977 -20.527  -1.320
  270    H5     C  24           H5         C  24  -0.746 -20.016  -4.953
  271    H6     C  24           H6         C  24   1.412 -19.795  -6.064
  272    H3T    C  24           H3T        C  24   6.453 -20.101  -5.806
  273   1H2*    C  24          1H2*        C  24   2.978 -20.553  -6.840
  274   2H2*    C  24          2H2*        C  24   4.242 -21.617  -6.242
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -0.204 -20.619   8.295
    2   2H5*    G   1          2H5*        G   1   1.061 -21.780   8.742
    3    H4*    G   1           H4*        G   1   2.777 -20.151   8.243
    4    H3*    G   1           H3*        G   1   1.009 -18.113   8.597
    5    H1*    G   1           H1*        G   1   2.286 -19.136   5.097
    6    H8     G   1           H8         G   1  -1.368 -20.289   5.720
    7    H1     G   1           H1         G   1   0.754 -20.732  -0.315
    8   1H2     G   1          1H2         G   1   3.739 -19.550   0.976
    9   2H2     G   1          2H2         G   1   2.858 -20.100  -0.437
   10    H5T    G   1           H5T        G   1   0.068 -20.570  10.514
   11   1H2*    G   1          1H2*        G   1  -0.268 -18.393   6.598
   12   2H2*    G   1          2H2*        G   1   0.998 -17.329   5.997
   13   1H5*    C   2          1H5*        C   2   4.623 -13.831   7.200
   14   2H5*    C   2          2H5*        C   2   3.011 -13.848   6.455
   15    H4*    C   2           H4*        C   2   5.682 -14.376   5.171
   16    H3*    C   2           H3*        C   2   4.565 -11.965   5.347
   17    H1*    C   2           H1*        C   2   3.646 -14.164   2.242
   18   1H4     C   2          1H4         C   2  -2.389 -16.576   3.522
   19   2H4     C   2          2H4         C   2  -2.382 -16.063   1.847
   20    H5     C   2           H5         C   2  -0.462 -16.251   4.993
   21    H6     C   2           H6         C   2   1.758 -15.277   5.161
   22   1H2*    C   2          1H2*        C   2   2.404 -12.473   4.446
   23   2H2*    C   2          2H2*        C   2   3.241 -11.944   2.993
   24   1H5*    G   3          1H5*        G   3   5.609 -13.295   1.239
   25   2H5*    G   3          2H5*        G   3   7.208 -12.551   1.023
   26    H4*    G   3           H4*        G   3   6.616 -13.052  -1.132
   27    H3*    G   3           H3*        G   3   6.807 -10.389  -0.683
   28    H1*    G   3           H1*        G   3   3.827 -11.877  -2.658
   29    H8     G   3           H8         G   3   2.856 -11.415   1.065
   30    H1     G   3           H1         G   3  -1.991 -11.517  -3.131
   31   1H2     G   3          1H2         G   3   0.503 -11.903  -5.508
   32   2H2     G   3          2H2         G   3  -1.212 -11.803  -5.179
   33   1H2*    G   3          1H2*        G   3   4.482  -9.893  -0.432
   34   2H2*    G   3          2H2*        G   3   4.653  -9.682  -2.168
   35   1H5*    A   4          1H5*        A   4   4.831 -10.104  -4.319
   36   2H5*    A   4          2H5*        A   4   5.479 -11.497  -5.208
   37    H4*    A   4           H4*        A   4   5.412 -10.414  -7.238
   38    H3*    A   4           H3*        A   4   6.454  -8.186  -6.237
   39    H1*    A   4           H1*        A   4   2.617  -8.102  -7.155
   40    H8     A   4           H8         A   4   3.469  -8.213  -3.401
   41   1H6     A   4          1H6         A   4  -1.076  -8.305  -1.713
   42   2H6     A   4          2H6         A   4  -2.647  -8.394  -2.478
   43    H2     A   4           H2         A   4  -1.901  -8.590  -6.903
   44   1H2*    A   4          1H2*        A   4   4.593  -7.385  -4.969
   45   2H2*    A   4          2H2*        A   4   4.289  -6.570  -6.495
   46   1H5*    G   5          1H5*        G   5   3.964  -5.001  -8.243
   47   2H5*    G   5          2H5*        G   5   3.464  -6.683  -8.500
   48    H4*    G   5           H4*        G   5   3.210  -5.853 -10.994
   49    H3*    G   5           H3*        G   5   3.906  -3.421 -10.244
   50    H1*    G   5           H1*        G   5   0.025  -4.314  -9.628
   51    H8     G   5           H8         G   5   2.642  -5.138  -6.881
   52    H1     G   5           H1         G   5  -3.468  -4.840  -4.983
   53   1H2     G   5          1H2         G   5  -4.145  -4.064  -8.278
   54   2H2     G   5          2H2         G   5  -4.775  -4.347  -6.669
   55   1H2*    G   5          1H2*        G   5   2.444  -3.029  -8.409
   56   2H2*    G   5          2H2*        G   5   1.398  -2.449  -9.697
   57   1H5*    A   6          1H5*        A   6  -0.110  -2.440 -11.207
   58   2H5*    A   6          2H5*        A   6  -0.272  -3.614 -12.529
   59    H4*    A   6           H4*        A   6  -1.829  -2.396 -13.621
   60    H3*    A   6           H3*        A   6  -0.231  -0.265 -13.606
   61    H1*    A   6           H1*        A   6  -3.342  -0.089 -10.995
   62    H8     A   6           H8         A   6   0.308  -0.806  -9.944
   63   1H6     A   6          1H6         A   6  -0.527  -1.399  -5.206
   64   2H6     A   6          2H6         A   6  -1.972  -1.395  -4.226
   65    H2     A   6           H2         A   6  -5.395  -0.609  -7.013
   66   1H2*    A   6          1H2*        A   6  -0.523   0.668 -11.464
   67   2H2*    A   6          2H2*        A   6  -2.012   1.311 -12.151
   68   1H5*    T   7          1H5*        T   7  -4.537   0.224 -13.585
   69   2H5*    T   7          2H5*        T   7  -5.273   1.206 -14.868
   70    H4*    T   7           H4*        T   7  -6.725   1.409 -13.074
   71    H3*    T   7           H3*        T   7  -5.578   3.743 -13.931
   72   1H2*    T   7          1H2*        T   7  -4.030   4.070 -12.150
   73   2H2*    T   7          2H2*        T   7  -5.445   4.812 -11.422
   74    H1*    T   7           H1*        T   7  -6.033   2.848 -10.196
   75    H3     T   7           H3         T   7  -3.198   1.799  -6.894
   76   1H5M    T   7          1H5M        T   7   0.338   3.576  -9.369
   77   2H5M    T   7          2H5M        T   7  -0.269   3.564 -11.041
   78   3H5M    T   7          3H5M        T   7   0.292   2.052 -10.286
   79    H6     T   7           H6         T   7  -2.563   3.206 -11.396
   80   1H5*    C   8          1H5*        C   8  -9.507   6.549 -11.060
   81   2H5*    C   8          2H5*        C   8  -8.105   7.403 -10.381
   82    H4*    C   8           H4*        C   8  -9.954   5.447  -9.146
   83    H3*    C   8           H3*        C   8  -9.639   8.028  -8.591
   84    H1*    C   8           H1*        C   8  -7.543   5.478  -6.478
   85   1H4     C   8          1H4         C   8  -1.458   5.726  -9.073
   86   2H4     C   8          2H4         C   8  -1.269   5.620  -7.339
   87    H5     C   8           H5         C   8  -3.630   5.876 -10.142
   88    H6     C   8           H6         C   8  -6.032   6.089  -9.756
   89   1H2*    C   8          1H2*        C   8  -7.299   8.038  -8.092
   90   2H2*    C   8          2H2*        C   8  -7.963   7.801  -6.485
   91   1H5*    T   9          1H5*        T   9  -8.460   5.982  -4.482
   92   2H5*    T   9          2H5*        T   9  -9.971   6.381  -3.635
   93    H4*    T   9           H4*        T   9  -8.395   6.716  -2.003
   94    H3*    T   9           H3*        T   9  -9.677   8.988  -2.731
   95   1H2*    T   9          1H2*        T   9  -7.979   9.808  -4.230
   96   2H2*    T   9          2H2*        T   9  -7.554  10.622  -2.737
   97    H1*    T   9           H1*        T   9  -5.932   8.886  -2.140
   98    H3     T   9           H3         T   9  -2.231   9.528  -4.524
   99   1H5M    T   9          1H5M        T   9  -4.691  10.231  -8.433
  100   2H5M    T   9          2H5M        T   9  -5.112   8.503  -8.370
  101   3H5M    T   9          3H5M        T   9  -6.343   9.734  -7.994
  102    H6     T   9           H6         T   9  -6.829   9.220  -5.721
  103   1H5*    G  10          1H5*        G  10  -6.453  10.494  -0.308
  104   2H5*    G  10          2H5*        G  10  -6.557   9.269   0.972
  105    H4*    G  10           H4*        G  10  -5.972  10.750   2.634
  106    H3*    G  10           H3*        G  10  -7.588  12.644   1.712
  107    H1*    G  10           H1*        G  10  -3.691  13.183   1.057
  108    H8     G  10           H8         G  10  -5.892  11.791  -1.812
  109    H1     G  10           H1         G  10   0.221  12.877  -3.316
  110   1H2     G  10          1H2         G  10   0.630  13.546   0.059
  111   2H2     G  10          2H2         G  10   1.386  13.390  -1.513
  112   1H2*    G  10          1H2*        G  10  -6.413  13.351  -0.234
  113   2H2*    G  10          2H2*        G  10  -5.666  14.425   0.939
  114   1H5*    C  11          1H5*        C  11  -3.583  14.064   3.516
  115   2H5*    C  11          2H5*        C  11  -4.132  14.868   5.002
  116    H4*    C  11           H4*        C  11  -2.148  15.925   4.643
  117    H3*    C  11           H3*        C  11  -4.283  17.580   4.242
  118    H1*    C  11           H1*        C  11  -1.235  17.490   1.796
  119   1H4     C  11          1H4         C  11  -3.874  15.292  -3.872
  120   2H4     C  11          2H4         C  11  -2.178  15.595  -4.165
  121    H5     C  11           H5         C  11  -4.912  15.609  -1.707
  122    H6     C  11           H6         C  11  -4.518  16.212   0.623
  123   1H2*    C  11          1H2*        C  11  -4.269  17.708   1.875
  124   2H2*    C  11          2H2*        C  11  -3.058  18.939   2.200
  125   1H5*    G  12          1H5*        G  12  -0.111  19.758   3.965
  126   2H5*    G  12          2H5*        G  12  -0.187  20.726   5.452
  127    H4*    G  12           H4*        G  12   1.221  21.917   4.037
  128    H3*    G  12           H3*        G  12  -1.020  23.218   4.853
  129    H1*    G  12           H1*        G  12   0.206  23.361   1.193
  130    H8     G  12           H8         G  12  -3.180  21.566   1.568
  131    H1     G  12           H1         G  12  -0.699  21.598  -4.346
  132   1H2     G  12          1H2         G  12   2.062  23.044  -2.852
  133   2H2     G  12          2H2         G  12   1.319  22.457  -4.324
  134    H3T    G  12           H3T        G  12   0.514  24.623   4.871
  135   1H2*    G  12          1H2*        G  12  -2.321  22.983   2.867
  136   2H2*    G  12          2H2*        G  12  -1.472  24.476   2.493
  137   1H5*    C  13          1H5*        C  13   0.716  21.006 -11.730
  138   2H5*    C  13          2H5*        C  13   0.395  22.670 -11.205
  139    H4*    C  13           H4*        C  13   3.118  22.631 -11.323
  140    H3*    C  13           H3*        C  13   2.816  19.986 -11.534
  141    H1*    C  13           H1*        C  13   2.747  21.508  -7.810
  142   1H4     C  13          1H4         C  13  -3.783  20.951  -6.795
  143   2H4     C  13          2H4         C  13  -3.036  21.324  -5.261
  144    H5     C  13           H5         C  13  -2.518  20.717  -8.847
  145    H6     C  13           H6         C  13  -0.294  20.812  -9.839
  146    H5T    C  13           H5T        C  13   1.720  23.394 -12.918
  147   1H2*    C  13          1H2*        C  13   1.531  19.452  -9.623
  148   2H2*    C  13          2H2*        C  13   3.105  19.470  -8.837
  149   1H5*    G  14          1H5*        G  14   5.200  20.258  -7.893
  150   2H5*    G  14          2H5*        G  14   6.873  20.087  -8.462
  151    H4*    G  14           H4*        G  14   7.057  19.066  -6.454
  152    H3*    G  14           H3*        G  14   7.227  17.229  -8.418
  153    H1*    G  14           H1*        G  14   4.981  16.603  -5.342
  154    H8     G  14           H8         G  14   2.941  17.087  -8.573
  155    H1     G  14           H1         G  14  -0.470  16.422  -3.181
  156   1H2     G  14          1H2         G  14   2.592  16.513  -1.595
  157   2H2     G  14          2H2         G  14   0.854  16.390  -1.438
  158   1H2*    G  14          1H2*        G  14   4.949  16.477  -8.393
  159   2H2*    G  14          2H2*        G  14   5.673  15.343  -7.261
  160   1H5*    C  15          1H5*        C  15   7.357  15.831  -3.962
  161   2H5*    C  15          2H5*        C  15   9.021  15.213  -3.890
  162    H4*    C  15           H4*        C  15   8.075  14.108  -2.143
  163    H3*    C  15           H3*        C  15   8.722  12.410  -4.146
  164    H1*    C  15           H1*        C  15   5.344  12.160  -2.323
  165   1H4     C  15          1H4         C  15   0.639  13.929  -6.647
  166   2H4     C  15          2H4         C  15  -0.163  13.354  -5.205
  167    H5     C  15           H5         C  15   3.037  14.102  -6.838
  168    H6     C  15           H6         C  15   5.171  13.580  -5.760
  169   1H2*    C  15          1H2*        C  15   6.545  12.204  -5.135
  170   2H2*    C  15          2H2*        C  15   6.508  10.870  -3.992
  171   1H5*    A  16          1H5*        A  16   6.336   8.770  -2.738
  172   2H5*    A  16          2H5*        A  16   6.165  10.311  -1.875
  173    H4*    A  16           H4*        A  16   6.338   8.812   0.250
  174    H3*    A  16           H3*        A  16   6.655   6.667  -1.258
  175    H1*    A  16           H1*        A  16   2.825   7.749  -0.654
  176    H8     A  16           H8         A  16   4.771   9.330  -3.618
  177   1H6     A  16          1H6         A  16   0.912  10.625  -6.253
  178   2H6     A  16          2H6         A  16  -0.812  10.440  -6.026
  179    H2     A  16           H2         A  16  -1.382   8.315  -2.116
  180   1H2*    A  16          1H2*        A  16   4.790   6.814  -2.719
  181   2H2*    A  16          2H2*        A  16   4.023   5.912  -1.420
  182   1H5*    G  17          1H5*        G  17   3.041   6.952   1.267
  183   2H5*    G  17          2H5*        G  17   3.340   5.847   2.623
  184    H4*    G  17           H4*        G  17   1.012   6.251   2.513
  185    H3*    G  17           H3*        G  17   1.878   3.696   2.587
  186    H1*    G  17           H1*        G  17  -0.870   4.778   0.110
  187    H8     G  17           H8         G  17   2.498   4.103  -1.675
  188    H1     G  17           H1         G  17  -2.464   5.586  -5.463
  189   1H2     G  17          1H2         G  17  -4.192   6.017  -2.509
  190   2H2     G  17          2H2         G  17  -4.234   6.056  -4.256
  191   1H2*    G  17          1H2*        G  17   1.756   3.224   0.236
  192   2H2*    G  17          2H2*        G  17   0.159   2.707   0.753
  193   1H5*  6MC  18          1H5*      6MC  18  -2.626   4.782   3.113
  194   2H5*  6MC  18          2H5*      6MC  18  -2.410   3.909   1.589
  195    H4*  6MC  18           H4*      6MC  18  -4.786   4.363   3.136
  196    H3*  6MC  18           H3*      6MC  18  -4.084   1.784   3.707
  197   1H2*  6MC  18          1H2*      6MC  18  -6.056   1.059   1.719
  198   2H2*  6MC  18          2H2*      6MC  18  -4.374   0.544   1.764
  199    H1*  6MC  18           H1*      6MC  18  -5.608   2.322  -0.091
  200    H8   6MC  18           H8       6MC  18  -2.177   1.800   1.375
  201   1H6   6MC  18          1H6       6MC  18   0.255   1.592  -2.707
  202    H2   6MC  18           H2       6MC  18  -4.529   2.059  -4.340
  203   1H1   6MC  18          1H1       6MC  18  -0.568   1.300  -5.346
  204   2H1   6MC  18          2H1       6MC  18   0.874   1.071  -4.850
  205   3H1   6MC  18          3H1       6MC  18   0.349   2.506  -5.056
  206   1H5*    T  19          1H5*        T  19  -7.467   2.443   1.274
  207   2H5*    T  19          2H5*        T  19  -8.980   2.169   2.160
  208    H4*    T  19           H4*        T  19  -9.588   1.513   0.072
  209    H3*    T  19           H3*        T  19  -9.433  -0.602   1.795
  210   1H2*    T  19          1H2*        T  19  -7.331  -1.456   1.006
  211   2H2*    T  19          2H2*        T  19  -8.458  -2.357   0.006
  212    H1*    T  19           H1*        T  19  -8.302  -0.716  -1.812
  213    H3     T  19           H3         T  19  -4.464  -1.193  -4.087
  214   1H5M    T  19          1H5M        T  19  -2.700  -0.953   0.806
  215   2H5M    T  19          2H5M        T  19  -2.051  -2.150  -0.340
  216   3H5M    T  19          3H5M        T  19  -3.332  -2.617   0.803
  217    H6     T  19           H6         T  19  -5.481  -0.989   0.576
  218   1H5*    C  20          1H5*        C  20  -9.586  -3.970  -1.121
  219   2H5*    C  20          2H5*        C  20  -9.443  -2.279  -1.638
  220    H4*    C  20           H4*        C  20 -11.172  -2.999  -3.454
  221    H3*    C  20           H3*        C  20 -11.119  -5.467  -2.390
  222    H1*    C  20           H1*        C  20  -8.344  -4.636  -5.205
  223   1H4     C  20          1H4         C  20  -3.204  -4.327  -1.029
  224   2H4     C  20          2H4         C  20  -2.580  -4.600  -2.639
  225    H5     C  20           H5         C  20  -5.573  -4.126  -0.570
  226    H6     C  20           H6         C  20  -7.792  -4.140  -1.549
  227   1H2*    C  20          1H2*        C  20  -8.892  -6.150  -2.691
  228   2H2*    C  20          2H2*        C  20  -9.413  -6.469  -4.341
  229   1H5*    T  21          1H5*        T  21 -11.596  -9.330  -5.360
  230   2H5*    T  21          2H5*        T  21 -10.438  -8.223  -4.595
  231    H4*    T  21           H4*        T  21 -10.599  -8.092  -7.536
  232    H3*    T  21           H3*        T  21 -10.581 -10.674  -6.733
  233   1H2*    T  21          1H2*        T  21  -8.626 -10.631  -5.362
  234   2H2*    T  21          2H2*        T  21  -7.895 -11.023  -6.913
  235    H1*    T  21           H1*        T  21  -7.252  -8.773  -7.352
  236    H3     T  21           H3         T  21  -3.736  -8.583  -4.569
  237   1H5M    T  21          1H5M        T  21  -6.806  -8.577  -0.905
  238   2H5M    T  21          2H5M        T  21  -8.231  -7.823  -1.659
  239   3H5M    T  21          3H5M        T  21  -6.790  -6.843  -1.301
  240    H6     T  21           H6         T  21  -8.451  -8.281  -3.918
  241   1H5*    C  22          1H5*        C  22  -8.470 -14.093  -8.762
  242   2H5*    C  22          2H5*        C  22  -8.209 -12.859  -7.511
  243    H4*    C  22           H4*        C  22  -6.266 -13.003  -9.749
  244    H3*    C  22           H3*        C  22  -6.737 -15.437  -8.596
  245    H1*    C  22           H1*        C  22  -3.914 -13.070  -7.446
  246   1H4     C  22          1H4         C  22  -5.520 -10.885  -1.400
  247   2H4     C  22          2H4         C  22  -3.781 -11.090  -1.424
  248    H5     C  22           H5         C  22  -6.940 -11.472  -3.281
  249    H6     C  22           H6         C  22  -6.981 -12.431  -5.517
  250   1H2*    C  22          1H2*        C  22  -6.107 -14.897  -6.356
  251   2H2*    C  22          2H2*        C  22  -4.534 -15.345  -7.002
  252   1H5*    G  23          1H5*        G  23  -2.421 -14.688  -8.208
  253   2H5*    G  23          2H5*        G  23  -1.844 -15.393  -9.734
  254    H4*    G  23           H4*        G  23  -0.007 -15.805  -8.522
  255    H3*    G  23           H3*        G  23  -1.436 -18.143  -8.689
  256    H1*    G  23           H1*        G  23   0.313 -16.910  -5.532
  257    H8     G  23           H8         G  23  -3.469 -17.249  -4.939
  258    H1     G  23           H1         G  23  -0.118 -14.669  -0.118
  259   1H2     G  23          1H2         G  23   2.521 -14.690  -2.357
  260   2H2     G  23          2H2         G  23   1.956 -14.296  -0.749
  261   1H2*    G  23          1H2*        G  23  -2.337 -18.123  -6.473
  262   2H2*    G  23          2H2*        G  23  -0.818 -18.955  -6.177
  263   1H5*    C  24          1H5*        C  24   2.932 -18.158  -7.501
  264   2H5*    C  24          2H5*        C  24   3.851 -19.199  -8.609
  265    H4*    C  24           H4*        C  24   5.067 -19.021  -6.580
  266    H3*    C  24           H3*        C  24   4.532 -21.482  -7.592
  267    H1*    C  24           H1*        C  24   4.081 -20.700  -3.825
  268   1H4     C  24          1H4         C  24  -2.451 -21.026  -2.720
  269   2H4     C  24          2H4         C  24  -1.649 -20.934  -1.168
  270    H5     C  24           H5         C  24  -1.246 -21.001  -4.823
  271    H6     C  24           H6         C  24   0.960 -20.874  -5.854
  272    H3T    C  24           H3T        C  24   6.050 -22.157  -5.874
  273   1H2*    C  24          1H2*        C  24   2.706 -22.076  -6.178
  274   2H2*    C  24          2H2*        C  24   4.043 -22.661  -5.198
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1   0.443 -18.987   8.408
    2   2H5*    G   1          2H5*        G   1   1.313 -20.523   8.571
    3    H4*    G   1           H4*        G   1   3.442 -19.328   8.397
    4    H3*    G   1           H3*        G   1   2.311 -17.000   9.086
    5    H1*    G   1           H1*        G   1   3.127 -17.678   5.372
    6    H8     G   1           H8         G   1  -0.656 -18.059   6.128
    7    H1     G   1           H1         G   1   1.075 -18.541  -0.028
    8   1H2     G   1          1H2         G   1   4.295 -18.186   1.180
    9   2H2     G   1          2H2         G   1   3.265 -18.412  -0.219
   10    H5T    G   1           H5T        G   1   1.074 -19.957  10.619
   11   1H2*    G   1          1H2*        G   1   0.855 -16.746   7.188
   12   2H2*    G   1          2H2*        G   1   2.264 -15.840   6.657
   13   1H5*    C   2          1H5*        C   2   5.373 -13.193   6.760
   14   2H5*    C   2          2H5*        C   2   3.709 -13.175   6.141
   15    H4*    C   2           H4*        C   2   6.246 -13.916   4.700
   16    H3*    C   2           H3*        C   2   5.255 -11.446   4.800
   17    H1*    C   2           H1*        C   2   4.085 -13.765   1.920
   18   1H4     C   2          1H4         C   2  -2.006 -15.860   3.458
   19   2H4     C   2          2H4         C   2  -2.012 -15.479   1.751
   20    H5     C   2           H5         C   2  -0.060 -15.497   4.877
   21    H6     C   2           H6         C   2   2.222 -14.654   4.940
   22   1H2*    C   2          1H2*        C   2   3.002 -11.945   4.117
   23   2H2*    C   2          2H2*        C   2   3.731 -11.486   2.587
   24   1H5*    G   3          1H5*        G   3   6.645 -12.950   0.719
   25   2H5*    G   3          2H5*        G   3   7.942 -11.879   0.149
   26    H4*    G   3           H4*        G   3   6.931 -12.949  -1.729
   27    H3*    G   3           H3*        G   3   7.275 -10.256  -1.732
   28    H1*    G   3           H1*        G   3   4.090 -11.916  -2.980
   29    H8     G   3           H8         G   3   3.397 -11.108   0.728
   30    H1     G   3           H1         G   3  -1.698 -11.093  -3.156
   31   1H2     G   3          1H2         G   3   0.626 -11.616  -5.676
   32   2H2     G   3          2H2         G   3  -1.056 -11.419  -5.249
   33   1H2*    G   3          1H2*        G   3   5.021  -9.665  -1.122
   34   2H2*    G   3          2H2*        G   3   4.920  -9.633  -2.876
   35   1H5*    A   4          1H5*        A   4   4.510 -10.155  -4.886
   36   2H5*    A   4          2H5*        A   4   4.730 -11.789  -5.545
   37    H4*    A   4           H4*        A   4   4.461 -11.050  -7.758
   38    H3*    A   4           H3*        A   4   5.734  -8.773  -7.317
   39    H1*    A   4           H1*        A   4   1.830  -8.588  -7.614
   40    H8     A   4           H8         A   4   3.177  -8.264  -4.007
   41   1H6     A   4          1H6         A   4  -1.115  -7.853  -1.775
   42   2H6     A   4          2H6         A   4  -2.774  -7.908  -2.336
   43    H2     A   4           H2         A   4  -2.612  -8.591  -6.764
   44   1H2*    A   4          1H2*        A   4   4.150  -7.719  -5.848
   45   2H2*    A   4          2H2*        A   4   3.642  -7.063  -7.395
   46   1H5*    G   5          1H5*        G   5   3.295  -5.810  -9.201
   47   2H5*    G   5          2H5*        G   5   2.637  -7.451  -9.362
   48    H4*    G   5           H4*        G   5   2.077  -6.714 -11.784
   49    H3*    G   5           H3*        G   5   3.261  -4.391 -11.420
   50    H1*    G   5           H1*        G   5  -0.555  -4.531 -10.238
   51    H8     G   5           H8         G   5   2.234  -5.145  -7.616
   52    H1     G   5           H1         G   5  -3.752  -4.725  -5.366
   53   1H2     G   5          1H2         G   5  -4.651  -4.413  -8.684
   54   2H2     G   5          2H2         G   5  -5.176  -4.497  -7.017
   55   1H2*    G   5          1H2*        G   5   2.209  -3.655  -9.408
   56   2H2*    G   5          2H2*        G   5   1.124  -2.928 -10.582
   57   1H5*    A   6          1H5*        A   6  -0.398  -2.569 -11.747
   58   2H5*    A   6          2H5*        A   6  -1.002  -3.795 -12.880
   59    H4*    A   6           H4*        A   6  -2.367  -2.278 -13.992
   60    H3*    A   6           H3*        A   6  -0.510  -0.331 -13.765
   61    H1*    A   6           H1*        A   6  -3.678  -0.136 -11.239
   62    H8     A   6           H8         A   6  -0.094  -1.114 -10.144
   63   1H6     A   6          1H6         A   6  -1.040  -1.677  -5.415
   64   2H6     A   6          2H6         A   6  -2.499  -1.571  -4.467
   65    H2     A   6           H2         A   6  -5.814  -0.532  -7.291
   66   1H2*    A   6          1H2*        A   6  -0.818   0.521 -11.602
   67   2H2*    A   6          2H2*        A   6  -2.270   1.264 -12.270
   68   1H5*    T   7          1H5*        T   7  -4.766   0.423 -13.833
   69   2H5*    T   7          2H5*        T   7  -5.396   1.561 -15.042
   70    H4*    T   7           H4*        T   7  -6.901   1.622 -13.255
   71    H3*    T   7           H3*        T   7  -5.713   3.983 -13.959
   72   1H2*    T   7          1H2*        T   7  -4.176   4.157 -12.139
   73   2H2*    T   7          2H2*        T   7  -5.580   4.919 -11.408
   74    H1*    T   7           H1*        T   7  -6.279   2.899 -10.312
   75    H3     T   7           H3         T   7  -3.607   1.867  -6.890
   76   1H5M    T   7          1H5M        T   7   0.138   3.218  -9.274
   77   2H5M    T   7          2H5M        T   7  -0.437   3.358 -10.952
   78   3H5M    T   7          3H5M        T   7  -0.040   1.759 -10.277
   79    H6     T   7           H6         T   7  -2.750   3.078 -11.411
   80   1H5*    C   8          1H5*        C   8  -9.507   6.891 -11.052
   81   2H5*    C   8          2H5*        C   8  -8.029   7.596 -10.365
   82    H4*    C   8           H4*        C   8 -10.015   5.734  -9.163
   83    H3*    C   8           H3*        C   8  -9.636   8.313  -8.610
   84    H1*    C   8           H1*        C   8  -7.715   5.697  -6.443
   85   1H4     C   8          1H4         C   8  -1.499   5.718  -8.715
   86   2H4     C   8          2H4         C   8  -1.398   5.629  -6.973
   87    H5     C   8           H5         C   8  -3.606   5.911  -9.897
   88    H6     C   8           H6         C   8  -6.017   6.216  -9.641
   89   1H2*    C   8          1H2*        C   8  -7.307   8.239  -8.059
   90   2H2*    C   8          2H2*        C   8  -8.020   8.044  -6.468
   91   1H5*    T   9          1H5*        T   9  -8.595   6.201  -4.502
   92   2H5*    T   9          2H5*        T   9 -10.128   6.605  -3.702
   93    H4*    T   9           H4*        T   9  -8.622   6.867  -1.998
   94    H3*    T   9           H3*        T   9  -9.800   9.193  -2.719
   95   1H2*    T   9          1H2*        T   9  -8.024   9.997  -4.132
   96   2H2*    T   9          2H2*        T   9  -7.629  10.760  -2.603
   97    H1*    T   9           H1*        T   9  -6.075   8.972  -1.998
   98    H3     T   9           H3         T   9  -2.292   9.572  -4.269
   99   1H5M    T   9          1H5M        T   9  -5.086   8.597  -8.192
  100   2H5M    T   9          2H5M        T   9  -6.294   9.864  -7.860
  101   3H5M    T   9          3H5M        T   9  -4.619  10.313  -8.253
  102    H6     T   9           H6         T   9  -6.859   9.360  -5.599
  103   1H5*    G  10          1H5*        G  10  -6.274  10.313  -0.137
  104   2H5*    G  10          2H5*        G  10  -7.156   9.601   1.230
  105    H4*    G  10           H4*        G  10  -6.226  10.988   2.675
  106    H3*    G  10           H3*        G  10  -7.726  12.915   1.646
  107    H1*    G  10           H1*        G  10  -3.787  13.328   1.164
  108    H8     G  10           H8         G  10  -5.887  11.896  -1.762
  109    H1     G  10           H1         G  10   0.317  12.787  -3.003
  110   1H2     G  10          1H2         G  10   0.579  13.564   0.365
  111   2H2     G  10          2H2         G  10   1.406  13.338  -1.163
  112   1H2*    G  10          1H2*        G  10  -6.439  13.529  -0.262
  113   2H2*    G  10          2H2*        G  10  -5.721  14.618   0.916
  114   1H5*    C  11          1H5*        C  11  -3.720  14.250   3.636
  115   2H5*    C  11          2H5*        C  11  -4.335  15.148   5.040
  116    H4*    C  11           H4*        C  11  -2.278  16.098   4.734
  117    H3*    C  11           H3*        C  11  -4.338  17.814   4.221
  118    H1*    C  11           H1*        C  11  -1.211  17.573   1.903
  119   1H4     C  11          1H4         C  11  -3.660  15.332  -3.835
  120   2H4     C  11          2H4         C  11  -1.943  15.581  -4.056
  121    H5     C  11           H5         C  11  -4.783  15.722  -1.724
  122    H6     C  11           H6         C  11  -4.477  16.370   0.607
  123   1H2*    C  11          1H2*        C  11  -4.242  17.865   1.852
  124   2H2*    C  11          2H2*        C  11  -3.017  19.081   2.186
  125   1H5*    G  12          1H5*        G  12   0.002  19.853   4.074
  126   2H5*    G  12          2H5*        G  12  -0.192  20.889   5.505
  127    H4*    G  12           H4*        G  12   1.326  22.052   4.225
  128    H3*    G  12           H3*        G  12  -1.018  23.357   4.604
  129    H1*    G  12           H1*        G  12   0.658  23.218   1.113
  130    H8     G  12           H8         G  12  -2.567  21.094   1.348
  131    H1     G  12           H1         G  12   0.276  21.253  -4.398
  132   1H2     G  12          1H2         G  12   2.712  23.119  -2.801
  133   2H2     G  12          2H2         G  12   2.152  22.392  -4.291
  134    H3T    G  12           H3T        G  12   0.165  25.132   4.148
  135   1H2*    G  12          1H2*        G  12  -2.044  22.895   2.498
  136   2H2*    G  12          2H2*        G  12  -1.189  24.379   2.098
  137   1H5*    C  13          1H5*        C  13   1.519  20.140 -11.758
  138   2H5*    C  13          2H5*        C  13   1.483  21.905 -11.934
  139    H4*    C  13           H4*        C  13   4.042  21.740 -11.582
  140    H3*    C  13           H3*        C  13   3.804  19.071 -11.494
  141    H1*    C  13           H1*        C  13   3.599  21.071  -8.064
  142   1H4     C  13          1H4         C  13  -2.883  20.526  -6.763
  143   2H4     C  13          2H4         C  13  -2.091  21.056  -5.298
  144    H5     C  13           H5         C  13  -1.685  20.093  -8.822
  145    H6     C  13           H6         C  13   0.503  20.103  -9.893
  146    H5T    C  13           H5T        C  13   3.407  21.323 -13.451
  147   1H2*    C  13          1H2*        C  13   2.377  18.788  -9.619
  148   2H2*    C  13          2H2*        C  13   3.910  18.866  -8.762
  149   1H5*    G  14          1H5*        G  14   5.959  19.712  -7.709
  150   2H5*    G  14          2H5*        G  14   7.650  19.356  -8.116
  151    H4*    G  14           H4*        G  14   7.571  18.441  -6.055
  152    H3*    G  14           H3*        G  14   7.670  16.478  -7.924
  153    H1*    G  14           H1*        G  14   5.274  16.296  -4.917
  154    H8     G  14           H8         G  14   3.381  16.766  -8.253
  155    H1     G  14           H1         G  14  -0.249  16.419  -2.979
  156   1H2     G  14          1H2         G  14   2.754  16.362  -1.282
  157   2H2     G  14          2H2         G  14   1.007  16.349  -1.186
  158   1H2*    G  14          1H2*        G  14   5.344  15.906  -7.948
  159   2H2*    G  14          2H2*        G  14   5.921  14.814  -6.698
  160   1H5*    C  15          1H5*        C  15   7.802  15.344  -3.373
  161   2H5*    C  15          2H5*        C  15   9.360  14.499  -3.262
  162    H4*    C  15           H4*        C  15   8.203  13.669  -1.460
  163    H3*    C  15           H3*        C  15   8.800  11.790  -3.317
  164    H1*    C  15           H1*        C  15   5.339  11.954  -1.659
  165   1H4     C  15          1H4         C  15   0.984  13.805  -6.304
  166   2H4     C  15          2H4         C  15   0.073  13.290  -4.904
  167    H5     C  15           H5         C  15   3.393  13.869  -6.355
  168    H6     C  15           H6         C  15   5.437  13.266  -5.147
  169   1H2*    C  15          1H2*        C  15   6.663  11.700  -4.404
  170   2H2*    C  15          2H2*        C  15   6.457  10.455  -3.182
  171   1H5*    A  16          1H5*        A  16   6.092   8.490  -1.872
  172   2H5*    A  16          2H5*        A  16   5.962  10.048  -1.033
  173    H4*    A  16           H4*        A  16   5.896   8.573   1.111
  174    H3*    A  16           H3*        A  16   6.206   6.394  -0.360
  175    H1*    A  16           H1*        A  16   2.404   7.674  -0.009
  176    H8     A  16           H8         A  16   4.621   9.116  -2.852
  177   1H6     A  16          1H6         A  16   1.023  10.447  -5.810
  178   2H6     A  16          2H6         A  16  -0.721  10.332  -5.710
  179    H2     A  16           H2         A  16  -1.661   8.346  -1.800
  180   1H2*    A  16          1H2*        A  16   4.442   6.591  -1.922
  181   2H2*    A  16          2H2*        A  16   3.553   5.763  -0.653
  182   1H5*    G  17          1H5*        G  17   2.384   6.827   1.966
  183   2H5*    G  17          2H5*        G  17   2.584   5.672   3.300
  184    H4*    G  17           H4*        G  17   0.269   6.104   3.036
  185    H3*    G  17           H3*        G  17   1.112   3.545   3.117
  186    H1*    G  17           H1*        G  17  -1.434   4.690   0.461
  187    H8     G  17           H8         G  17   2.067   4.072  -1.084
  188    H1     G  17           H1         G  17  -2.620   5.608  -5.189
  189   1H2     G  17          1H2         G  17  -4.551   5.979  -2.348
  190   2H2     G  17          2H2         G  17  -4.473   6.058  -4.093
  191   1H2*    G  17          1H2*        G  17   1.180   3.135   0.749
  192   2H2*    G  17          2H2*        G  17  -0.449   2.601   1.129
  193   1H5*  6MC  18          1H5*      6MC  18  -3.436   4.615   3.336
  194   2H5*  6MC  18          2H5*      6MC  18  -3.107   3.777   1.815
  195    H4*  6MC  18           H4*      6MC  18  -5.589   4.161   3.220
  196    H3*  6MC  18           H3*      6MC  18  -4.887   1.567   3.722
  197   1H2*  6MC  18          1H2*      6MC  18  -6.731   0.915   1.591
  198   2H2*  6MC  18          2H2*      6MC  18  -5.050   0.406   1.717
  199    H1*  6MC  18           H1*      6MC  18  -6.183   2.249  -0.136
  200    H8   6MC  18           H8       6MC  18  -2.832   1.784   1.529
  201   1H6   6MC  18          1H6       6MC  18  -0.165   1.652  -2.416
  202    H2   6MC  18           H2       6MC  18  -4.859   2.046  -4.308
  203   1H1   6MC  18          1H1       6MC  18  -0.614   2.392  -5.006
  204   2H1   6MC  18          2H1       6MC  18  -0.351   0.878  -4.904
  205   3H1   6MC  18          3H1       6MC  18   0.734   1.881  -4.466
  206   1H5*    T  19          1H5*        T  19  -8.133   2.294   1.108
  207   2H5*    T  19          2H5*        T  19  -9.685   1.975   1.906
  208    H4*    T  19           H4*        T  19 -10.188   1.394  -0.231
  209    H3*    T  19           H3*        T  19 -10.074  -0.794   1.412
  210   1H2*    T  19          1H2*        T  19  -7.933  -1.589   0.660
  211   2H2*    T  19          2H2*        T  19  -9.014  -2.456  -0.415
  212    H1*    T  19           H1*        T  19  -8.829  -0.716  -2.145
  213    H3     T  19           H3         T  19  -4.973  -1.252  -4.352
  214   1H5M    T  19          1H5M        T  19  -3.326  -0.870   0.610
  215   2H5M    T  19          2H5M        T  19  -2.548  -1.971  -0.551
  216   3H5M    T  19          3H5M        T  19  -3.818  -2.579   0.536
  217    H6     T  19           H6         T  19  -6.038  -0.941   0.297
  218   1H5*    C  20          1H5*        C  20 -10.021  -4.014  -1.614
  219   2H5*    C  20          2H5*        C  20  -9.903  -2.327  -2.148
  220    H4*    C  20           H4*        C  20 -11.519  -3.097  -4.031
  221    H3*    C  20           H3*        C  20 -11.539  -5.544  -2.939
  222    H1*    C  20           H1*        C  20  -8.663  -4.785  -5.630
  223   1H4     C  20          1H4         C  20  -3.556  -4.324  -1.424
  224   2H4     C  20          2H4         C  20  -2.911  -4.638  -3.018
  225    H5     C  20           H5         C  20  -5.930  -4.133  -0.987
  226    H6     C  20           H6         C  20  -8.145  -4.185  -1.984
  227   1H2*    C  20          1H2*        C  20  -9.268  -6.162  -3.033
  228   2H2*    C  20          2H2*        C  20  -9.693  -6.621  -4.675
  229   1H5*    T  21          1H5*        T  21 -11.989  -9.528  -5.598
  230   2H5*    T  21          2H5*        T  21 -10.798  -8.491  -4.785
  231    H4*    T  21           H4*        T  21 -10.638  -8.753  -7.741
  232    H3*    T  21           H3*        T  21 -10.841 -11.163  -6.576
  233   1H2*    T  21          1H2*        T  21  -9.143 -10.815  -4.891
  234   2H2*    T  21          2H2*        T  21  -8.252 -11.658  -6.146
  235    H1*    T  21           H1*        T  21  -7.423  -9.566  -7.102
  236    H3     T  21           H3         T  21  -4.039  -8.786  -4.305
  237   1H5M    T  21          1H5M        T  21  -8.621  -7.527  -1.725
  238   2H5M    T  21          2H5M        T  21  -7.094  -6.697  -1.340
  239   3H5M    T  21          3H5M        T  21  -7.358  -8.371  -0.797
  240    H6     T  21           H6         T  21  -8.774  -8.445  -3.853
  241   1H5*    C  22          1H5*        C  22  -7.385 -13.226  -7.119
  242   2H5*    C  22          2H5*        C  22  -7.062 -11.585  -7.719
  243    H4*    C  22           H4*        C  22  -5.723 -12.812  -9.572
  244    H3*    C  22           H3*        C  22  -6.457 -15.153  -8.542
  245    H1*    C  22           H1*        C  22  -3.103 -13.567  -7.171
  246   1H4     C  22          1H4         C  22  -4.935 -11.196  -1.253
  247   2H4     C  22          2H4         C  22  -3.222 -11.545  -1.201
  248    H5     C  22           H5         C  22  -6.287 -11.614  -3.250
  249    H6     C  22           H6         C  22  -6.255 -12.498  -5.519
  250   1H2*    C  22          1H2*        C  22  -5.677 -14.905  -6.299
  251   2H2*    C  22          2H2*        C  22  -4.244 -15.619  -7.027
  252   1H5*    G  23          1H5*        G  23  -1.935 -14.856  -8.537
  253   2H5*    G  23          2H5*        G  23  -1.501 -15.880  -9.921
  254    H4*    G  23           H4*        G  23   0.330 -16.127  -8.581
  255    H3*    G  23           H3*        G  23  -1.139 -18.431  -8.776
  256    H1*    G  23           H1*        G  23   0.496 -17.196  -5.577
  257    H8     G  23           H8         G  23  -3.312 -17.398  -5.100
  258    H1     G  23           H1         G  23  -0.027 -14.874  -0.203
  259   1H2     G  23          1H2         G  23   2.693 -15.082  -2.336
  260   2H2     G  23          2H2         G  23   2.090 -14.623  -0.760
  261   1H2*    G  23          1H2*        G  23  -2.163 -18.321  -6.609
  262   2H2*    G  23          2H2*        G  23  -0.698 -19.216  -6.227
  263   1H5*    C  24          1H5*        C  24   3.150 -18.309  -7.596
  264   2H5*    C  24          2H5*        C  24   4.137 -19.487  -8.487
  265    H4*    C  24           H4*        C  24   5.389 -19.032  -6.598
  266    H3*    C  24           H3*        C  24   4.587 -21.617  -6.839
  267    H1*    C  24           H1*        C  24   4.368 -19.724  -3.457
  268   1H4     C  24          1H4         C  24  -2.124 -19.160  -2.229
  269   2H4     C  24          2H4         C  24  -1.266 -18.627  -0.803
  270    H5     C  24           H5         C  24  -0.997 -19.901  -4.240
  271    H6     C  24           H6         C  24   1.173 -20.274  -5.286
  272    H3T    C  24           H3T        C  24   6.549 -21.623  -6.139
  273   1H2*    C  24          1H2*        C  24   2.794 -21.606  -5.270
  274   2H2*    C  24          2H2*        C  24   4.124 -21.984  -4.184
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1   1.281 -20.761   8.243
    2   2H5*    G   1          2H5*        G   1   2.490 -22.044   8.048
    3    H4*    G   1           H4*        G   1   4.195 -20.157   7.840
    4    H3*    G   1           H3*        G   1   2.195 -18.401   8.441
    5    H1*    G   1           H1*        G   1   3.444 -18.981   4.839
    6    H8     G   1           H8         G   1  -0.060 -20.532   5.440
    7    H1     G   1           H1         G   1   1.974 -20.400  -0.643
    8   1H2     G   1          1H2         G   1   4.867 -19.040   0.684
    9   2H2     G   1          2H2         G   1   4.012 -19.578  -0.748
   10    H5T    G   1           H5T        G   1   3.653 -20.738   9.772
   11   1H2*    G   1          1H2*        G   1   0.876 -18.675   6.467
   12   2H2*    G   1          2H2*        G   1   1.978 -17.420   5.916
   13   1H5*    C   2          1H5*        C   2   5.374 -13.576   7.411
   14   2H5*    C   2          2H5*        C   2   3.726 -13.766   6.775
   15    H4*    C   2           H4*        C   2   6.343 -13.884   5.294
   16    H3*    C   2           H3*        C   2   4.882 -11.662   5.664
   17    H1*    C   2           H1*        C   2   4.339 -13.798   2.492
   18   1H4     C   2          1H4         C   2  -1.388 -17.045   3.208
   19   2H4     C   2          2H4         C   2  -1.326 -16.474   1.553
   20    H5     C   2           H5         C   2   0.322 -16.503   4.844
   21    H6     C   2           H6         C   2   2.418 -15.317   5.214
   22   1H2*    C   2          1H2*        C   2   2.802 -12.464   4.769
   23   2H2*    C   2          2H2*        C   2   3.508 -11.711   3.348
   24   1H5*    G   3          1H5*        G   3   6.515 -12.559   1.649
   25   2H5*    G   3          2H5*        G   3   7.683 -11.331   1.117
   26    H4*    G   3           H4*        G   3   6.789 -12.534  -0.774
   27    H3*    G   3           H3*        G   3   7.007  -9.837  -0.795
   28    H1*    G   3           H1*        G   3   3.950 -11.622  -2.095
   29    H8     G   3           H8         G   3   3.052 -10.986   1.602
   30    H1     G   3           H1         G   3  -1.839 -10.969  -2.540
   31   1H2     G   3          1H2         G   3   0.633 -11.277  -4.953
   32   2H2     G   3          2H2         G   3  -1.078 -11.170  -4.607
   33   1H2*    G   3          1H2*        G   3   4.721  -9.371  -0.159
   34   2H2*    G   3          2H2*        G   3   4.639  -9.279  -1.913
   35   1H5*    A   4          1H5*        A   4   4.253  -9.860  -3.878
   36   2H5*    A   4          2H5*        A   4   4.532 -11.436  -4.649
   37    H4*    A   4           H4*        A   4   4.149 -10.585  -6.795
   38    H3*    A   4           H3*        A   4   5.407  -8.320  -6.225
   39    H1*    A   4           H1*        A   4   1.559  -8.230  -6.629
   40    H8     A   4           H8         A   4   2.636  -7.897  -2.928
   41   1H6     A   4          1H6         A   4  -1.829  -7.502  -1.033
   42   2H6     A   4          2H6         A   4  -3.433  -7.575  -1.737
   43    H2     A   4           H2         A   4  -2.919  -8.256  -6.124
   44   1H2*    A   4          1H2*        A   4   3.780  -7.381  -4.709
   45   2H2*    A   4          2H2*        A   4   3.305  -6.626  -6.224
   46   1H5*    G   5          1H5*        G   5   2.637  -8.301  -9.960
   47   2H5*    G   5          2H5*        G   5   3.590  -7.676 -11.322
   48    H4*    G   5           H4*        G   5   1.392  -7.181 -11.870
   49    H3*    G   5           H3*        G   5   3.059  -5.033 -11.608
   50    H1*    G   5           H1*        G   5  -0.555  -5.064 -10.191
   51    H8     G   5           H8         G   5   2.184  -5.161  -7.452
   52    H1     G   5           H1         G   5  -3.865  -4.610  -5.390
   53   1H2     G   5          1H2         G   5  -4.706  -4.873  -8.730
   54   2H2     G   5          2H2         G   5  -5.259  -4.704  -7.079
   55   1H2*    G   5          1H2*        G   5   2.294  -4.215  -9.504
   56   2H2*    G   5          2H2*        G   5   1.126  -3.415 -10.550
   57   1H5*    A   6          1H5*        A   6  -0.767  -3.105 -11.616
   58   2H5*    A   6          2H5*        A   6  -1.097  -4.375 -12.812
   59    H4*    A   6           H4*        A   6  -2.723  -3.192 -13.846
   60    H3*    A   6           H3*        A   6  -1.158  -1.078 -14.154
   61    H1*    A   6           H1*        A   6  -4.028  -0.710 -11.385
   62    H8     A   6           H8         A   6  -0.399  -1.499 -10.241
   63   1H6     A   6          1H6         A   6  -1.259  -1.466  -5.477
   64   2H6     A   6          2H6         A   6  -2.695  -1.248  -4.511
   65    H2     A   6           H2         A   6  -6.075  -0.571  -7.382
   66   1H2*    A   6          1H2*        A   6  -1.131  -0.173 -11.966
   67   2H2*    A   6          2H2*        A   6  -2.562   0.642 -12.571
   68   1H5*    T   7          1H5*        T   7  -3.713   2.102 -13.015
   69   2H5*    T   7          2H5*        T   7  -4.372   0.464 -12.864
   70    H4*    T   7           H4*        T   7  -6.604   1.546 -13.578
   71    H3*    T   7           H3*        T   7  -5.406   3.864 -13.954
   72   1H2*    T   7          1H2*        T   7  -4.320   4.241 -11.883
   73   2H2*    T   7          2H2*        T   7  -5.878   4.933 -11.459
   74    H1*    T   7           H1*        T   7  -6.476   3.145 -10.123
   75    H3     T   7           H3         T   7  -3.691   1.689  -6.940
   76   1H5M    T   7          1H5M        T   7  -0.712   2.827 -11.230
   77   2H5M    T   7          2H5M        T   7  -0.480   1.146 -10.689
   78   3H5M    T   7          3H5M        T   7  -0.026   2.497  -9.623
   79    H6     T   7           H6         T   7  -3.081   2.746 -11.536
   80   1H5*    C   8          1H5*        C   8  -9.451   6.882 -11.499
   81   2H5*    C   8          2H5*        C   8  -7.967   7.574 -10.811
   82    H4*    C   8           H4*        C   8  -9.992   5.760  -9.602
   83    H3*    C   8           H3*        C   8  -9.540   8.344  -9.084
   84    H1*    C   8           H1*        C   8  -7.760   5.676  -6.856
   85   1H4     C   8          1H4         C   8  -1.478   5.534  -8.934
   86   2H4     C   8          2H4         C   8  -1.430   5.462  -7.189
   87    H5     C   8           H5         C   8  -3.540   5.761 -10.179
   88    H6     C   8           H6         C   8  -5.949   6.148  -9.996
   89   1H2*    C   8          1H2*        C   8  -7.239   8.211  -8.450
   90   2H2*    C   8          2H2*        C   8  -8.003   8.025  -6.881
   91   1H5*    T   9          1H5*        T   9  -8.750   6.330  -4.889
   92   2H5*    T   9          2H5*        T   9 -10.272   6.845  -4.133
   93    H4*    T   9           H4*        T   9  -8.761   7.112  -2.425
   94    H3*    T   9           H3*        T   9  -9.858   9.443  -3.269
   95   1H2*    T   9          1H2*        T   9  -8.028  10.137  -4.670
   96   2H2*    T   9          2H2*        T   9  -7.636  10.940  -3.161
   97    H1*    T   9           H1*        T   9  -6.166   9.110  -2.457
   98    H3     T   9           H3         T   9  -2.314   9.565  -4.639
   99   1H5M    T   9          1H5M        T   9  -4.498  10.219  -8.707
  100   2H5M    T   9          2H5M        T   9  -5.026   8.521  -8.608
  101   3H5M    T   9          3H5M        T   9  -6.200   9.836  -8.350
  102    H6     T   9           H6         T   9  -6.844   9.385  -6.091
  103   1H5*    G  10          1H5*        G  10  -6.420  10.375  -0.526
  104   2H5*    G  10          2H5*        G  10  -7.393   9.823   0.853
  105    H4*    G  10           H4*        G  10  -6.317  11.154   2.236
  106    H3*    G  10           H3*        G  10  -7.727  13.139   1.157
  107    H1*    G  10           H1*        G  10  -3.770  13.321   0.738
  108    H8     G  10           H8         G  10  -5.885  11.994  -2.229
  109    H1     G  10           H1         G  10   0.350  12.746  -3.396
  110   1H2     G  10          1H2         G  10   0.597  13.462  -0.013
  111   2H2     G  10          2H2         G  10   1.433  13.244  -1.536
  112   1H2*    G  10          1H2*        G  10  -6.383  13.691  -0.725
  113   2H2*    G  10          2H2*        G  10  -5.609  14.728   0.464
  114   1H5*    C  11          1H5*        C  11  -3.472  14.077   2.792
  115   2H5*    C  11          2H5*        C  11  -4.240  14.395   4.360
  116    H4*    C  11           H4*        C  11  -2.278  15.394   4.781
  117    H3*    C  11           H3*        C  11  -4.085  17.323   4.392
  118    H1*    C  11           H1*        C  11  -0.780  17.456   2.130
  119   1H4     C  11          1H4         C  11  -3.459  15.549  -3.627
  120   2H4     C  11          2H4         C  11  -1.761  15.858  -3.907
  121    H5     C  11           H5         C  11  -4.488  15.781  -1.444
  122    H6     C  11           H6         C  11  -4.083  16.285   0.908
  123   1H2*    C  11          1H2*        C  11  -3.759  17.870   2.114
  124   2H2*    C  11          2H2*        C  11  -2.486  18.881   2.782
  125   1H5*    G  12          1H5*        G  12   0.189  18.902   4.768
  126   2H5*    G  12          2H5*        G  12   0.283  20.085   6.090
  127    H4*    G  12           H4*        G  12   1.826  20.845   4.542
  128    H3*    G  12           H3*        G  12  -0.259  22.541   5.047
  129    H1*    G  12           H1*        G  12   1.155  21.922   1.523
  130    H8     G  12           H8         G  12  -2.486  20.690   1.871
  131    H1     G  12           H1         G  12   0.270  19.712  -3.837
  132   1H2     G  12          1H2         G  12   3.128  20.927  -2.324
  133   2H2     G  12          2H2         G  12   2.384  20.294  -3.774
  134    H3T    G  12           H3T        G  12   1.195  24.038   4.516
  135   1H2*    G  12          1H2*        G  12  -1.489  22.192   3.034
  136   2H2*    G  12          2H2*        G  12  -0.407  23.469   2.497
  137   1H5*    C  13          1H5*        C  13   1.604  20.994 -11.546
  138   2H5*    C  13          2H5*        C  13   1.632  22.731 -11.187
  139    H4*    C  13           H4*        C  13   4.169  22.391 -10.880
  140    H3*    C  13           H3*        C  13   3.867  19.832 -11.646
  141    H1*    C  13           H1*        C  13   3.800  20.684  -7.799
  142   1H4     C  13          1H4         C  13  -2.603  19.845  -6.268
  143   2H4     C  13          2H4         C  13  -1.695  19.879  -4.776
  144    H5     C  13           H5         C  13  -1.552  20.056  -8.444
  145    H6     C  13           H6         C  13   0.564  20.365  -9.615
  146    H5T    C  13           H5T        C  13   1.913  22.344 -13.414
  147   1H2*    C  13          1H2*        C  13   2.420  19.032  -9.936
  148   2H2*    C  13          2H2*        C  13   3.963  18.756  -9.140
  149   1H5*    G  14          1H5*        G  14   6.178  19.892  -7.827
  150   2H5*    G  14          2H5*        G  14   7.851  19.470  -8.248
  151    H4*    G  14           H4*        G  14   7.753  18.456  -6.245
  152    H3*    G  14           H3*        G  14   7.606  16.559  -8.208
  153    H1*    G  14           H1*        G  14   5.440  16.494  -5.045
  154    H8     G  14           H8         G  14   3.297  17.005  -8.218
  155    H1     G  14           H1         G  14   0.108  16.949  -2.656
  156   1H2     G  14          1H2         G  14   3.242  16.821  -1.208
  157   2H2     G  14          2H2         G  14   1.508  16.873  -0.969
  158   1H2*    G  14          1H2*        G  14   5.259  16.124  -8.077
  159   2H2*    G  14          2H2*        G  14   5.847  14.980  -6.879
  160   1H5*    C  15          1H5*        C  15   7.984  15.268  -3.700
  161   2H5*    C  15          2H5*        C  15   9.455  14.274  -3.723
  162    H4*    C  15           H4*        C  15   8.261  13.561  -1.854
  163    H3*    C  15           H3*        C  15   8.822  11.665  -3.704
  164    H1*    C  15           H1*        C  15   5.370  11.908  -2.045
  165   1H4     C  15          1H4         C  15   1.040  13.861  -6.672
  166   2H4     C  15          2H4         C  15   0.121  13.337  -5.281
  167    H5     C  15           H5         C  15   3.449  13.876  -6.730
  168    H6     C  15           H6         C  15   5.484  13.235  -5.528
  169   1H2*    C  15          1H2*        C  15   6.682  11.620  -4.793
  170   2H2*    C  15          2H2*        C  15   6.451  10.380  -3.568
  171   1H5*    A  16          1H5*        A  16   6.025   8.422  -2.214
  172   2H5*    A  16          2H5*        A  16   5.933   9.998  -1.403
  173    H4*    A  16           H4*        A  16   5.840   8.573   0.768
  174    H3*    A  16           H3*        A  16   6.104   6.357  -0.666
  175    H1*    A  16           H1*        A  16   2.326   7.718  -0.309
  176    H8     A  16           H8         A  16   4.562   9.049  -3.185
  177   1H6     A  16          1H6         A  16   0.990  10.299  -6.208
  178   2H6     A  16          2H6         A  16  -0.755  10.193  -6.120
  179    H2     A  16           H2         A  16  -1.729   8.344  -2.152
  180   1H2*    A  16          1H2*        A  16   4.321   6.531  -2.202
  181   2H2*    A  16          2H2*        A  16   3.430   5.766  -0.892
  182   1H5*    G  17          1H5*        G  17   2.309   6.937   1.683
  183   2H5*    G  17          2H5*        G  17   2.494   5.802   3.036
  184    H4*    G  17           H4*        G  17   0.186   6.280   2.777
  185    H3*    G  17           H3*        G  17   0.975   3.705   2.908
  186    H1*    G  17           H1*        G  17  -1.551   4.844   0.209
  187    H8     G  17           H8         G  17   1.976   4.171  -1.248
  188    H1     G  17           H1         G  17  -2.632   5.534  -5.498
  189   1H2     G  17          1H2         G  17  -4.626   5.993  -2.716
  190   2H2     G  17          2H2         G  17  -4.511   6.010  -4.460
  191   1H2*    G  17          1H2*        G  17   1.014   3.227   0.557
  192   2H2*    G  17          2H2*        G  17  -0.633   2.762   0.950
  193   1H5*  6MC  18          1H5*      6MC  18  -3.526   4.914   3.109
  194   2H5*  6MC  18          2H5*      6MC  18  -3.235   4.052   1.594
  195    H4*  6MC  18           H4*      6MC  18  -5.695   4.561   2.986
  196    H3*  6MC  18           H3*      6MC  18  -5.111   1.957   3.554
  197   1H2*  6MC  18          1H2*      6MC  18  -6.957   1.306   1.432
  198   2H2*  6MC  18          2H2*      6MC  18  -5.289   0.761   1.572
  199    H1*  6MC  18           H1*      6MC  18  -6.379   2.601  -0.320
  200    H8   6MC  18           H8       6MC  18  -3.031   2.048   1.321
  201   1H6   6MC  18          1H6       6MC  18  -0.408   1.748  -2.637
  202    H2   6MC  18           H2       6MC  18  -5.106   2.229  -4.502
  203   1H1   6MC  18          1H1       6MC  18  -1.160   1.737  -5.340
  204   2H1   6MC  18          2H1       6MC  18   0.081   0.984  -4.824
  205   3H1   6MC  18          3H1       6MC  18   0.080   2.525  -4.877
  206   1H5*    T  19          1H5*        T  19  -8.324   2.722   0.901
  207   2H5*    T  19          2H5*        T  19  -9.895   2.460   1.680
  208    H4*    T  19           H4*        T  19 -10.372   1.822  -0.447
  209    H3*    T  19           H3*        T  19 -10.337  -0.317   1.261
  210   1H2*    T  19          1H2*        T  19  -8.195  -1.172   0.575
  211   2H2*    T  19          2H2*        T  19  -9.276  -2.059  -0.486
  212    H1*    T  19           H1*        T  19  -9.038  -0.372  -2.269
  213    H3     T  19           H3         T  19  -5.180  -1.042  -4.422
  214   1H5M    T  19          1H5M        T  19  -4.094  -2.295   0.497
  215   2H5M    T  19          2H5M        T  19  -3.574  -0.593   0.551
  216   3H5M    T  19          3H5M        T  19  -2.800  -1.723  -0.584
  217    H6     T  19           H6         T  19  -6.281  -0.615   0.208
  218   1H5*    C  20          1H5*        C  20 -10.299  -3.647  -1.763
  219   2H5*    C  20          2H5*        C  20 -10.094  -1.959  -2.264
  220    H4*    C  20           H4*        C  20 -11.707  -2.644  -4.195
  221    H3*    C  20           H3*        C  20 -11.780  -5.116  -3.139
  222    H1*    C  20           H1*        C  20  -8.873  -4.344  -5.800
  223   1H4     C  20          1H4         C  20  -3.822  -4.139  -1.506
  224   2H4     C  20          2H4         C  20  -3.165  -4.528  -3.079
  225    H5     C  20           H5         C  20  -6.185  -3.807  -1.121
  226    H6     C  20           H6         C  20  -8.383  -3.755  -2.155
  227   1H2*    C  20          1H2*        C  20  -9.536  -5.793  -3.256
  228   2H2*    C  20          2H2*        C  20  -9.963  -6.183  -4.916
  229   1H5*    T  21          1H5*        T  21 -12.412  -9.062  -5.535
  230   2H5*    T  21          2H5*        T  21 -11.170  -8.123  -4.679
  231    H4*    T  21           H4*        T  21 -10.848  -8.711  -7.591
  232    H3*    T  21           H3*        T  21 -11.272 -10.915  -6.111
  233   1H2*    T  21          1H2*        T  21  -9.626 -10.454  -4.407
  234   2H2*    T  21          2H2*        T  21  -8.734 -11.502  -5.499
  235    H1*    T  21           H1*        T  21  -7.733  -9.604  -6.664
  236    H3     T  21           H3         T  21  -4.437  -8.430  -3.900
  237   1H5M    T  21          1H5M        T  21  -7.942  -7.940  -0.518
  238   2H5M    T  21          2H5M        T  21  -9.070  -7.013  -1.535
  239   3H5M    T  21          3H5M        T  21  -7.508  -6.303  -1.065
  240    H6     T  21           H6         T  21  -9.186  -8.183  -3.564
  241   1H5*    C  22          1H5*        C  22  -7.724 -13.484  -6.417
  242   2H5*    C  22          2H5*        C  22  -7.530 -11.791  -6.915
  243    H4*    C  22           H4*        C  22  -6.210 -12.935  -8.912
  244    H3*    C  22           H3*        C  22  -6.580 -15.274  -7.699
  245    H1*    C  22           H1*        C  22  -3.383 -13.187  -6.616
  246   1H4     C  22          1H4         C  22  -5.314 -10.705  -0.772
  247   2H4     C  22          2H4         C  22  -3.577 -10.899  -0.729
  248    H5     C  22           H5         C  22  -6.649 -11.336  -2.717
  249    H6     C  22           H6         C  22  -6.577 -12.345  -4.933
  250   1H2*    C  22          1H2*        C  22  -5.703 -14.797  -5.533
  251   2H2*    C  22          2H2*        C  22  -4.231 -15.352  -6.316
  252   1H5*    G  23          1H5*        G  23  -2.431 -14.055  -8.460
  253   2H5*    G  23          2H5*        G  23  -1.852 -15.013  -9.838
  254    H4*    G  23           H4*        G  23   0.065 -14.242  -8.745
  255    H3*    G  23           H3*        G  23  -0.218 -16.954  -8.994
  256    H1*    G  23           H1*        G  23   1.119 -15.226  -5.859
  257    H8     G  23           H8         G  23  -2.417 -16.695  -5.192
  258    H1     G  23           H1         G  23   0.758 -14.475  -0.084
  259   1H2     G  23          1H2         G  23   3.218 -13.629  -2.364
  260   2H2     G  23          2H2         G  23   2.701 -13.651  -0.692
  261   1H2*    G  23          1H2*        G  23  -0.829 -17.423  -6.728
  262   2H2*    G  23          2H2*        G  23   0.922 -17.523  -6.603
  263   1H5*    C  24          1H5*        C  24   4.159 -16.242  -6.719
  264   2H5*    C  24          2H5*        C  24   5.050 -16.795  -8.152
  265    H4*    C  24           H4*        C  24   6.246 -17.571  -6.291
  266    H3*    C  24           H3*        C  24   5.393 -19.425  -8.105
  267    H1*    C  24           H1*        C  24   5.162 -19.982  -4.283
  268   1H4     C  24          1H4         C  24  -1.315 -20.348  -2.920
  269   2H4     C  24          2H4         C  24  -0.449 -20.511  -1.409
  270    H5     C  24           H5         C  24  -0.199 -19.958  -5.035
  271    H6     C  24           H6         C  24   1.958 -19.632  -6.118
  272    H3T    C  24           H3T        C  24   7.011 -19.710  -5.791
  273   1H2*    C  24          1H2*        C  24   3.581 -20.349  -6.868
  274   2H2*    C  24          2H2*        C  24   4.888 -21.338  -6.234
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -0.061 -19.660   8.284
    2   2H5*    G   1          2H5*        G   1   1.054 -20.887   8.915
    3    H4*    G   1           H4*        G   1   2.951 -19.639   8.111
    4    H3*    G   1           H3*        G   1   1.479 -17.333   8.159
    5    H1*    G   1           H1*        G   1   2.548 -19.081   4.877
    6    H8     G   1           H8         G   1  -1.231 -19.544   5.645
    7    H1     G   1           H1         G   1   0.675 -21.117  -0.273
    8   1H2     G   1          1H2         G   1   3.831 -20.254   0.852
    9   2H2     G   1          2H2         G   1   2.850 -20.837  -0.477
   10    H5T    G   1           H5T        G   1   1.744 -18.418   9.778
   11   1H2*    G   1          1H2*        G   1   0.177 -17.685   6.197
   12   2H2*    G   1          2H2*        G   1   1.604 -16.969   5.458
   13   1H5*    C   2          1H5*        C   2   5.807 -13.807   6.765
   14   2H5*    C   2          2H5*        C   2   4.151 -13.511   6.200
   15    H4*    C   2           H4*        C   2   6.580 -14.333   4.647
   16    H3*    C   2           H3*        C   2   5.635 -11.843   4.916
   17    H1*    C   2           H1*        C   2   4.439 -13.988   1.894
   18   1H4     C   2          1H4         C   2  -1.762 -15.845   3.321
   19   2H4     C   2          2H4         C   2  -1.713 -15.473   1.611
   20    H5     C   2           H5         C   2   0.183 -15.588   4.775
   21    H6     C   2           H6         C   2   2.477 -14.792   4.891
   22   1H2*    C   2          1H2*        C   2   3.397 -12.205   4.136
   23   2H2*    C   2          2H2*        C   2   4.185 -11.731   2.640
   24   1H5*    G   3          1H5*        G   3   6.922 -13.166   0.838
   25   2H5*    G   3          2H5*        G   3   8.351 -12.231   0.356
   26    H4*    G   3           H4*        G   3   7.406 -13.038  -1.627
   27    H3*    G   3           H3*        G   3   7.718 -10.348  -1.414
   28    H1*    G   3           H1*        G   3   4.580 -11.942  -2.890
   29    H8     G   3           H8         G   3   3.817 -11.271   0.838
   30    H1     G   3           H1         G   3  -1.231 -11.357  -3.107
   31   1H2     G   3          1H2         G   3   1.140 -11.785  -5.601
   32   2H2     G   3          2H2         G   3  -0.556 -11.649  -5.195
   33   1H2*    G   3          1H2*        G   3   5.441  -9.806  -0.872
   34   2H2*    G   3          2H2*        G   3   5.403  -9.677  -2.625
   35   1H5*    A   4          1H5*        A   4   4.850 -11.309  -5.098
   36   2H5*    A   4          2H5*        A   4   6.206 -11.238  -6.243
   37    H4*    A   4           H4*        A   4   4.690 -10.424  -7.651
   38    H3*    A   4           H3*        A   4   6.013  -8.273  -6.655
   39    H1*    A   4           H1*        A   4   2.189  -8.348  -7.017
   40    H8     A   4           H8         A   4   3.259  -8.269  -3.299
   41   1H6     A   4          1H6         A   4  -1.200  -8.145  -1.380
   42   2H6     A   4          2H6         A   4  -2.806  -8.221  -2.073
   43    H2     A   4           H2         A   4  -2.291  -8.637  -6.506
   44   1H2*    A   4          1H2*        A   4   4.390  -7.593  -5.030
   45   2H2*    A   4          2H2*        A   4   3.829  -6.681  -6.425
   46   1H5*    G   5          1H5*        G   5   3.224  -7.940 -10.155
   47   2H5*    G   5          2H5*        G   5   4.087  -7.260 -11.550
   48    H4*    G   5           H4*        G   5   1.875  -6.844 -12.039
   49    H3*    G   5           H3*        G   5   3.398  -4.608 -11.701
   50    H1*    G   5           H1*        G   5  -0.169  -4.930 -10.211
   51    H8     G   5           H8         G   5   2.622  -5.242  -7.534
   52    H1     G   5           H1         G   5  -3.369  -4.588  -5.334
   53   1H2     G   5          1H2         G   5  -4.266  -4.562  -8.669
   54   2H2     G   5          2H2         G   5  -4.787  -4.497  -6.999
   55   1H2*    G   5          1H2*        G   5   2.646  -3.966  -9.531
   56   2H2*    G   5          2H2*        G   5   1.415  -3.169 -10.503
   57   1H5*    A   6          1H5*        A   6  -0.337  -2.608 -11.645
   58   2H5*    A   6          2H5*        A   6  -0.914  -3.912 -12.702
   59    H4*    A   6           H4*        A   6  -2.382  -2.499 -13.844
   60    H3*    A   6           H3*        A   6  -0.640  -0.451 -13.705
   61    H1*    A   6           H1*        A   6  -3.742  -0.371 -11.102
   62    H8     A   6           H8         A   6  -0.118  -1.297 -10.056
   63   1H6     A   6          1H6         A   6  -0.972  -1.697  -5.295
   64   2H6     A   6          2H6         A   6  -2.408  -1.526  -4.315
   65    H2     A   6           H2         A   6  -5.766  -0.525  -7.108
   66   1H2*    A   6          1H2*        A   6  -0.908   0.387 -11.527
   67   2H2*    A   6          2H2*        A   6  -2.396   1.084 -12.163
   68   1H5*    T   7          1H5*        T   7  -4.838   0.135 -13.490
   69   2H5*    T   7          2H5*        T   7  -5.611   1.081 -14.779
   70    H4*    T   7           H4*        T   7  -7.056   1.309 -12.996
   71    H3*    T   7           H3*        T   7  -5.897   3.642 -13.829
   72   1H2*    T   7          1H2*        T   7  -4.343   3.929 -12.039
   73   2H2*    T   7          2H2*        T   7  -5.749   4.698 -11.320
   74    H1*    T   7           H1*        T   7  -6.394   2.728 -10.118
   75    H3     T   7           H3         T   7  -3.641   1.889  -6.706
   76   1H5M    T   7          1H5M        T   7  -0.561   3.188 -10.893
   77   2H5M    T   7          2H5M        T   7  -0.152   1.609 -10.178
   78   3H5M    T   7          3H5M        T   7   0.050   3.098  -9.225
   79    H6     T   7           H6         T   7  -2.887   2.878 -11.298
   80   1H5*    C   8          1H5*        C   8  -9.640   6.691 -11.024
   81   2H5*    C   8          2H5*        C   8  -8.140   7.421 -10.415
   82    H4*    C   8           H4*        C   8 -10.101   5.634  -9.063
   83    H3*    C   8           H3*        C   8  -9.709   8.244  -8.672
   84    H1*    C   8           H1*        C   8  -7.787   5.746  -6.390
   85   1H4     C   8          1H4         C   8  -1.565   5.648  -8.646
   86   2H4     C   8          2H4         C   8  -1.470   5.628  -6.900
   87    H5     C   8           H5         C   8  -3.665   5.807  -9.843
   88    H6     C   8           H6         C   8  -6.077   6.107  -9.607
   89   1H2*    C   8          1H2*        C   8  -7.371   8.188  -8.158
   90   2H2*    C   8          2H2*        C   8  -8.061   8.102  -6.548
   91   1H5*    T   9          1H5*        T   9  -8.689   6.288  -4.442
   92   2H5*    T   9          2H5*        T   9 -10.211   6.777  -3.668
   93    H4*    T   9           H4*        T   9  -8.674   7.045  -1.978
   94    H3*    T   9           H3*        T   9  -9.855   9.350  -2.743
   95   1H2*    T   9          1H2*        T   9  -8.095  10.100  -4.214
   96   2H2*    T   9          2H2*        T   9  -7.688  10.920  -2.718
   97    H1*    T   9           H1*        T   9  -6.131   9.150  -2.058
   98    H3     T   9           H3         T   9  -2.352   9.666  -4.350
   99   1H5M    T   9          1H5M        T   9  -5.129   8.558  -8.235
  100   2H5M    T   9          2H5M        T   9  -6.361   9.813  -7.948
  101   3H5M    T   9          3H5M        T   9  -4.693  10.279  -8.358
  102    H6     T   9           H6         T   9  -6.921   9.432  -5.669
  103   1H5*    G  10          1H5*        G  10  -6.694  10.946  -0.368
  104   2H5*    G  10          2H5*        G  10  -6.714   9.704   0.902
  105    H4*    G  10           H4*        G  10  -6.248  11.254   2.588
  106    H3*    G  10           H3*        G  10  -7.778  13.135   1.500
  107    H1*    G  10           H1*        G  10  -3.843  13.551   0.999
  108    H8     G  10           H8         G  10  -5.957  12.099  -1.906
  109    H1     G  10           H1         G  10   0.250  12.920  -3.168
  110   1H2     G  10          1H2         G  10   0.531  13.704   0.196
  111   2H2     G  10          2H2         G  10   1.351  13.465  -1.331
  112   1H2*    G  10          1H2*        G  10  -6.501  13.723  -0.419
  113   2H2*    G  10          2H2*        G  10  -5.775  14.833   0.736
  114   1H5*    C  11          1H5*        C  11  -3.840  14.530   3.419
  115   2H5*    C  11          2H5*        C  11  -4.429  15.398   4.853
  116    H4*    C  11           H4*        C  11  -2.401  16.384   4.563
  117    H3*    C  11           H3*        C  11  -4.450  18.091   3.980
  118    H1*    C  11           H1*        C  11  -1.284  17.797   1.704
  119   1H4     C  11          1H4         C  11  -3.717  15.447  -3.995
  120   2H4     C  11          2H4         C  11  -1.999  15.687  -4.212
  121    H5     C  11           H5         C  11  -4.849  15.889  -1.898
  122    H6     C  11           H6         C  11  -4.551  16.584   0.420
  123   1H2*    C  11          1H2*        C  11  -4.306  18.125   1.615
  124   2H2*    C  11          2H2*        C  11  -3.067  19.324   1.958
  125   1H5*    G  12          1H5*        G  12  -0.178  20.035   3.845
  126   2H5*    G  12          2H5*        G  12  -0.277  21.010   5.326
  127    H4*    G  12           H4*        G  12   1.299  22.106   4.036
  128    H3*    G  12           H3*        G  12  -0.914  23.563   4.627
  129    H1*    G  12           H1*        G  12   0.632  23.555   1.088
  130    H8     G  12           H8         G  12  -2.835  21.854   1.204
  131    H1     G  12           H1         G  12   0.057  21.931  -4.521
  132   1H2     G  12          1H2         G  12   2.728  23.303  -2.811
  133   2H2     G  12          2H2         G  12   2.084  22.756  -4.344
  134    H3T    G  12           H3T        G  12   1.594  24.053   3.532
  135   1H2*    G  12          1H2*        G  12  -2.051  23.356   2.536
  136   2H2*    G  12          2H2*        G  12  -1.088  24.792   2.217
  137   1H5*    C  13          1H5*        C  13   1.633  21.292 -11.856
  138   2H5*    C  13          2H5*        C  13   2.044  23.007 -12.046
  139    H4*    C  13           H4*        C  13   4.405  22.363 -11.397
  140    H3*    C  13           H3*        C  13   3.733  19.761 -11.567
  141    H1*    C  13           H1*        C  13   3.618  21.532  -8.025
  142   1H4     C  13          1H4         C  13  -2.930  21.855  -7.002
  143   2H4     C  13          2H4         C  13  -2.139  22.152  -5.472
  144    H5     C  13           H5         C  13  -1.712  21.409  -9.044
  145    H6     C  13           H6         C  13   0.503  21.175 -10.035
  146    H5T    C  13           H5T        C  13   3.753  21.187 -13.269
  147   1H2*    C  13          1H2*        C  13   2.149  19.580  -9.812
  148   2H2*    C  13          2H2*        C  13   3.609  19.346  -8.861
  149   1H5*    G  14          1H5*        G  14   5.847  19.841  -7.733
  150   2H5*    G  14          2H5*        G  14   7.526  19.489  -8.192
  151    H4*    G  14           H4*        G  14   7.469  18.524  -6.144
  152    H3*    G  14           H3*        G  14   7.611  16.627  -8.068
  153    H1*    G  14           H1*        G  14   5.192  16.285  -5.096
  154    H8     G  14           H8         G  14   3.311  16.761  -8.427
  155    H1     G  14           H1         G  14  -0.338  16.490  -3.162
  156   1H2     G  14          1H2         G  14   2.658  16.456  -1.451
  157   2H2     G  14          2H2         G  14   0.910  16.444  -1.363
  158   1H2*    G  14          1H2*        G  14   5.283  16.043  -8.142
  159   2H2*    G  14          2H2*        G  14   5.864  14.898  -6.941
  160   1H5*    C  15          1H5*        C  15   7.871  15.424  -3.528
  161   2H5*    C  15          2H5*        C  15   9.369  14.473  -3.450
  162    H4*    C  15           H4*        C  15   8.137  13.771  -1.617
  163    H3*    C  15           H3*        C  15   8.737  11.837  -3.431
  164    H1*    C  15           H1*        C  15   5.289  12.112  -1.775
  165   1H4     C  15          1H4         C  15   0.916  13.783  -6.471
  166   2H4     C  15          2H4         C  15   0.012  13.301  -5.057
  167    H5     C  15           H5         C  15   3.326  13.861  -6.528
  168    H6     C  15           H6         C  15   5.374  13.293  -5.312
  169   1H2*    C  15          1H2*        C  15   6.599  11.718  -4.512
  170   2H2*    C  15          2H2*        C  15   6.376  10.528  -3.237
  171   1H5*    A  16          1H5*        A  16   5.976   8.632  -1.855
  172   2H5*    A  16          2H5*        A  16   5.898  10.224  -1.073
  173    H4*    A  16           H4*        A  16   5.814   8.847   1.127
  174    H3*    A  16           H3*        A  16   6.077   6.599  -0.250
  175    H1*    A  16           H1*        A  16   2.300   7.955   0.079
  176    H8     A  16           H8         A  16   4.509   9.241  -2.843
  177   1H6     A  16          1H6         A  16   0.906  10.475  -5.831
  178   2H6     A  16          2H6         A  16  -0.839  10.387  -5.719
  179    H2     A  16           H2         A  16  -1.771   8.576  -1.720
  180   1H2*    A  16          1H2*        A  16   4.302   6.753  -1.802
  181   2H2*    A  16          2H2*        A  16   3.411   5.998  -0.487
  182   1H5*    G  17          1H5*        G  17   2.217   7.185   2.056
  183   2H5*    G  17          2H5*        G  17   2.419   6.066   3.421
  184    H4*    G  17           H4*        G  17   0.100   6.466   3.125
  185    H3*    G  17           H3*        G  17   0.976   3.920   3.279
  186    H1*    G  17           H1*        G  17  -1.555   4.962   0.557
  187    H8     G  17           H8         G  17   1.985   4.356  -0.901
  188    H1     G  17           H1         G  17  -2.640   5.701  -5.138
  189   1H2     G  17          1H2         G  17  -4.632   6.121  -2.344
  190   2H2     G  17          2H2         G  17  -4.523   6.152  -4.089
  191   1H2*    G  17          1H2*        G  17   1.066   3.443   0.929
  192   2H2*    G  17          2H2*        G  17  -0.563   2.909   1.303
  193   1H5*  6MC  18          1H5*      6MC  18  -3.589   4.959   3.424
  194   2H5*  6MC  18          2H5*      6MC  18  -3.232   4.079   1.932
  195    H4*  6MC  18           H4*      6MC  18  -5.735   4.483   3.293
  196    H3*  6MC  18           H3*      6MC  18  -5.015   1.917   3.883
  197   1H2*  6MC  18          1H2*      6MC  18  -6.798   1.151   1.747
  198   2H2*  6MC  18          2H2*      6MC  18  -5.102   0.704   1.909
  199    H1*  6MC  18           H1*      6MC  18  -6.277   2.466  -0.007
  200    H8   6MC  18           H8       6MC  18  -2.928   2.077   1.676
  201   1H6   6MC  18          1H6       6MC  18  -0.251   1.891  -2.264
  202    H2   6MC  18           H2       6MC  18  -4.943   2.237  -4.168
  203   1H1   6MC  18          1H1       6MC  18  -0.980   2.017  -4.972
  204   2H1   6MC  18          2H1       6MC  18   0.162   1.096  -4.498
  205   3H1   6MC  18          3H1       6MC  18   0.336   2.627  -4.452
  206   1H5*    T  19          1H5*        T  19  -8.262   2.481   1.180
  207   2H5*    T  19          2H5*        T  19  -9.809   2.091   1.957
  208    H4*    T  19           H4*        T  19 -10.222   1.419  -0.175
  209    H3*    T  19           H3*        T  19 -10.027  -0.710   1.542
  210   1H2*    T  19          1H2*        T  19  -7.830  -1.407   0.846
  211   2H2*    T  19          2H2*        T  19  -8.845  -2.365  -0.218
  212    H1*    T  19           H1*        T  19  -8.739  -0.653  -1.989
  213    H3     T  19           H3         T  19  -4.866  -1.092  -4.169
  214   1H5M    T  19          1H5M        T  19  -2.369  -1.336  -0.337
  215   2H5M    T  19          2H5M        T  19  -3.526  -2.293   0.619
  216   3H5M    T  19          3H5M        T  19  -3.382  -0.540   0.892
  217    H6     T  19           H6         T  19  -5.945  -0.675   0.466
  218   1H5*    C  20          1H5*        C  20  -9.760  -4.030  -1.559
  219   2H5*    C  20          2H5*        C  20  -9.657  -2.314  -1.999
  220    H4*    C  20           H4*        C  20 -11.222  -3.018  -3.960
  221    H3*    C  20           H3*        C  20 -11.211  -5.514  -3.004
  222    H1*    C  20           H1*        C  20  -8.319  -4.560  -5.581
  223   1H4     C  20          1H4         C  20  -3.210  -4.044  -1.389
  224   2H4     C  20          2H4         C  20  -2.559  -4.382  -2.976
  225    H5     C  20           H5         C  20  -5.582  -3.882  -0.947
  226    H6     C  20           H6         C  20  -7.800  -3.974  -1.937
  227   1H2*    C  20          1H2*        C  20  -8.906  -6.023  -3.010
  228   2H2*    C  20          2H2*        C  20  -9.267  -6.484  -4.666
  229   1H5*    T  21          1H5*        T  21 -11.775  -9.351  -5.500
  230   2H5*    T  21          2H5*        T  21 -10.617  -8.215  -4.773
  231    H4*    T  21           H4*        T  21 -10.460  -8.571  -7.703
  232    H3*    T  21           H3*        T  21 -10.692 -10.971  -6.510
  233   1H2*    T  21          1H2*        T  21  -8.967 -10.652  -4.858
  234   2H2*    T  21          2H2*        T  21  -8.095 -11.491  -6.125
  235    H1*    T  21           H1*        T  21  -7.258  -9.407  -7.076
  236    H3     T  21           H3         T  21  -3.854  -8.629  -4.305
  237   1H5M    T  21          1H5M        T  21  -7.074  -8.336  -0.737
  238   2H5M    T  21          2H5M        T  21  -8.428  -7.582  -1.615
  239   3H5M    T  21          3H5M        T  21  -6.953  -6.644  -1.275
  240    H6     T  21           H6         T  21  -8.585  -8.327  -3.805
  241   1H5*    C  22          1H5*        C  22  -7.214 -12.998  -7.048
  242   2H5*    C  22          2H5*        C  22  -6.800 -11.396  -7.695
  243    H4*    C  22           H4*        C  22  -5.535 -12.757  -9.510
  244    H3*    C  22           H3*        C  22  -6.403 -15.012  -8.382
  245    H1*    C  22           H1*        C  22  -2.938 -13.570  -7.118
  246   1H4     C  22          1H4         C  22  -4.600 -11.006  -1.216
  247   2H4     C  22          2H4         C  22  -2.888 -11.359  -1.201
  248    H5     C  22           H5         C  22  -5.998 -11.437  -3.191
  249    H6     C  22           H6         C  22  -6.025 -12.383  -5.428
  250   1H2*    C  22          1H2*        C  22  -5.557 -14.753  -6.168
  251   2H2*    C  22          2H2*        C  22  -4.176 -15.555  -6.905
  252   1H5*    G  23          1H5*        G  23  -1.931 -14.999  -8.504
  253   2H5*    G  23          2H5*        G  23  -1.571 -16.030  -9.904
  254    H4*    G  23           H4*        G  23   0.281 -16.431  -8.679
  255    H3*    G  23           H3*        G  23  -1.401 -18.605  -8.571
  256    H1*    G  23           H1*        G  23   0.573 -17.238  -5.581
  257    H8     G  23           H8         G  23  -3.208 -17.173  -4.923
  258    H1     G  23           H1         G  23   0.424 -14.375  -0.439
  259   1H2     G  23          1H2         G  23   3.017 -14.865  -2.673
  260   2H2     G  23          2H2         G  23   2.509 -14.252  -1.114
  261   1H2*    G  23          1H2*        G  23  -2.196 -18.300  -6.341
  262   2H2*    G  23          2H2*        G  23  -0.736 -19.222  -6.007
  263   1H5*    C  24          1H5*        C  24   2.915 -18.992  -7.517
  264   2H5*    C  24          2H5*        C  24   3.759 -20.095  -8.623
  265    H4*    C  24           H4*        C  24   4.988 -20.005  -6.600
  266    H3*    C  24           H3*        C  24   4.265 -22.424  -7.599
  267    H1*    C  24           H1*        C  24   3.904 -21.591  -3.842
  268   1H4     C  24          1H4         C  24  -2.614 -21.456  -2.617
  269   2H4     C  24          2H4         C  24  -1.776 -21.359  -1.086
  270    H5     C  24           H5         C  24  -1.448 -21.573  -4.743
  271    H6     C  24           H6         C  24   0.743 -21.613  -5.814
  272    H3T    C  24           H3T        C  24   5.597 -22.657  -5.229
  273   1H2*    C  24          1H2*        C  24   2.399 -22.861  -6.176
  274   2H2*    C  24          2H2*        C  24   3.688 -23.553  -5.203
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1   0.419 -19.184   9.027
    2   2H5*    G   1          2H5*        G   1   1.627 -20.448   9.331
    3    H4*    G   1           H4*        G   1   3.387 -18.869   8.589
    4    H3*    G   1           H3*        G   1   1.603 -16.808   8.805
    5    H1*    G   1           H1*        G   1   2.730 -18.274   5.431
    6    H8     G   1           H8         G   1  -0.881 -19.397   6.315
    7    H1     G   1           H1         G   1   0.981 -20.336   0.250
    8   1H2     G   1          1H2         G   1   3.987 -18.976   1.291
    9   2H2     G   1          2H2         G   1   3.060 -19.670  -0.024
   10    H5T    G   1           H5T        G   1   2.465 -18.195  10.478
   11   1H2*    G   1          1H2*        G   1   0.232 -17.336   6.922
   12   2H2*    G   1          2H2*        G   1   1.458 -16.358   6.129
   13   1H5*    C   2          1H5*        C   2   5.330 -12.776   6.860
   14   2H5*    C   2          2H5*        C   2   3.679 -12.781   6.207
   15    H4*    C   2           H4*        C   2   6.249 -13.553   4.843
   16    H3*    C   2           H3*        C   2   5.207 -11.092   4.844
   17    H1*    C   2           H1*        C   2   4.173 -13.543   2.004
   18   1H4     C   2          1H4         C   2  -1.962 -15.586   3.453
   19   2H4     C   2          2H4         C   2  -1.927 -15.256   1.735
   20    H5     C   2           H5         C   2  -0.042 -15.187   4.905
   21    H6     C   2           H6         C   2   2.224 -14.307   4.999
   22   1H2*    C   2          1H2*        C   2   3.001 -11.626   4.063
   23   2H2*    C   2          2H2*        C   2   3.801 -11.245   2.546
   24   1H5*    G   3          1H5*        G   3   6.295 -12.832   0.802
   25   2H5*    G   3          2H5*        G   3   7.772 -11.943   0.374
   26    H4*    G   3           H4*        G   3   6.941 -12.798  -1.637
   27    H3*    G   3           H3*        G   3   7.291 -10.123  -1.516
   28    H1*    G   3           H1*        G   3   4.139 -11.645  -3.049
   29    H8     G   3           H8         G   3   3.335 -10.872   0.661
   30    H1     G   3           H1         G   3  -1.660 -11.033  -3.346
   31   1H2     G   3          1H2         G   3   0.747 -11.548  -5.800
   32   2H2     G   3          2H2         G   3  -0.952 -11.385  -5.424
   33   1H2*    G   3          1H2*        G   3   5.011  -9.530  -1.015
   34   2H2*    G   3          2H2*        G   3   5.021  -9.405  -2.767
   35   1H5*    A   4          1H5*        A   4   4.769  -9.747  -4.795
   36   2H5*    A   4          2H5*        A   4   4.958 -11.346  -5.545
   37    H4*    A   4           H4*        A   4   4.925 -10.410  -7.733
   38    H3*    A   4           H3*        A   4   6.053  -8.142  -6.938
   39    H1*    A   4           H1*        A   4   2.155  -8.087  -7.554
   40    H8     A   4           H8         A   4   3.303  -7.979  -3.878
   41   1H6     A   4          1H6         A   4  -1.096  -7.931  -1.835
   42   2H6     A   4          2H6         A   4  -2.719  -8.076  -2.478
   43    H2     A   4           H2         A   4  -2.323  -8.567  -6.915
   44   1H2*    A   4          1H2*        A   4   4.300  -7.246  -5.580
   45   2H2*    A   4          2H2*        A   4   3.871  -6.528  -7.126
   46   1H5*    G   5          1H5*        G   5   3.324  -7.959 -10.613
   47   2H5*    G   5          2H5*        G   5   4.178  -7.196 -11.969
   48    H4*    G   5           H4*        G   5   1.906  -6.811 -12.351
   49    H3*    G   5           H3*        G   5   3.520  -4.614 -12.140
   50    H1*    G   5           H1*        G   5   0.013  -4.816 -10.535
   51    H8     G   5           H8         G   5   2.860  -4.783  -7.910
   52    H1     G   5           H1         G   5  -3.125  -4.660  -5.602
   53   1H2     G   5          1H2         G   5  -4.077  -4.970  -8.903
   54   2H2     G   5          2H2         G   5  -4.573  -4.843  -7.232
   55   1H2*    G   5          1H2*        G   5   2.871  -3.901  -9.958
   56   2H2*    G   5          2H2*        G   5   1.631  -3.087 -10.905
   57   1H5*    A   6          1H5*        A   6  -0.240  -2.620 -11.940
   58   2H5*    A   6          2H5*        A   6  -0.803  -3.907 -13.026
   59    H4*    A   6           H4*        A   6  -2.337  -2.524 -14.081
   60    H3*    A   6           H3*        A   6  -0.638  -0.443 -14.036
   61    H1*    A   6           H1*        A   6  -3.610  -0.395 -11.288
   62    H8     A   6           H8         A   6   0.062  -1.293 -10.381
   63   1H6     A   6          1H6         A   6  -0.654  -1.773  -5.593
   64   2H6     A   6          2H6         A   6  -2.060  -1.614  -4.571
   65    H2     A   6           H2         A   6  -5.489  -0.535  -7.267
   66   1H2*    A   6          1H2*        A   6  -0.811   0.392 -11.843
   67   2H2*    A   6          2H2*        A   6  -2.339   1.067 -12.406
   68   1H5*    T   7          1H5*        T   7  -4.710  -0.118 -13.232
   69   2H5*    T   7          2H5*        T   7  -5.684   0.647 -14.504
   70    H4*    T   7           H4*        T   7  -7.018   0.845 -12.645
   71    H3*    T   7           H3*        T   7  -6.157   3.235 -13.652
   72   1H2*    T   7          1H2*        T   7  -4.517   3.764 -12.009
   73   2H2*    T   7          2H2*        T   7  -5.935   4.413 -11.201
   74    H1*    T   7           H1*        T   7  -6.244   2.469  -9.850
   75    H3     T   7           H3         T   7  -3.035   2.169  -6.737
   76   1H5M    T   7          1H5M        T   7  -0.039   1.790 -10.684
   77   2H5M    T   7          2H5M        T   7   0.244   3.280  -9.754
   78   3H5M    T   7          3H5M        T   7  -0.590   3.358 -11.323
   79    H6     T   7           H6         T   7  -2.922   2.755 -11.458
   80   1H5*    C   8          1H5*        C   8  -9.907   6.187 -10.782
   81   2H5*    C   8          2H5*        C   8  -8.401   6.969 -10.260
   82    H4*    C   8           H4*        C   8 -10.277   5.207  -8.763
   83    H3*    C   8           H3*        C   8  -9.930   7.847  -8.514
   84    H1*    C   8           H1*        C   8  -7.884   5.485  -6.168
   85   1H4     C   8          1H4         C   8  -1.743   5.479  -8.642
   86   2H4     C   8          2H4         C   8  -1.586   5.528  -6.903
   87    H5     C   8           H5         C   8  -3.886   5.533  -9.766
   88    H6     C   8           H6         C   8  -6.297   5.788  -9.455
   89   1H2*    C   8          1H2*        C   8  -7.595   7.883  -8.013
   90   2H2*    C   8          2H2*        C   8  -8.258   7.809  -6.391
   91   1H5*    T   9          1H5*        T   9  -8.837   6.079  -4.228
   92   2H5*    T   9          2H5*        T   9 -10.353   6.580  -3.449
   93    H4*    T   9           H4*        T   9  -8.802   6.946  -1.795
   94    H3*    T   9           H3*        T   9  -9.990   9.214  -2.690
   95   1H2*    T   9          1H2*        T   9  -8.224   9.930  -4.151
   96   2H2*    T   9          2H2*        T   9  -7.802  10.772  -2.673
   97    H1*    T   9           H1*        T   9  -6.250   9.016  -1.991
   98    H3     T   9           H3         T   9  -2.513   9.457  -4.373
   99   1H5M    T   9          1H5M        T   9  -5.371   8.275  -8.189
  100   2H5M    T   9          2H5M        T   9  -6.603   9.524  -7.882
  101   3H5M    T   9          3H5M        T   9  -4.949   9.999  -8.334
  102    H6     T   9           H6         T   9  -7.108   9.177  -5.590
  103   1H5*    G  10          1H5*        G  10  -6.465  10.333  -0.109
  104   2H5*    G  10          2H5*        G  10  -7.400   9.823   1.312
  105    H4*    G  10           H4*        G  10  -6.311  11.225   2.613
  106    H3*    G  10           H3*        G  10  -7.799  13.135   1.507
  107    H1*    G  10           H1*        G  10  -3.864  13.397   0.953
  108    H8     G  10           H8         G  10  -6.033  11.907  -1.896
  109    H1     G  10           H1         G  10   0.152  12.716  -3.264
  110   1H2     G  10          1H2         G  10   0.471  13.588   0.080
  111   2H2     G  10          2H2         G  10   1.273  13.324  -1.454
  112   1H2*    G  10          1H2*        G  10  -6.530  13.634  -0.442
  113   2H2*    G  10          2H2*        G  10  -5.750  14.743   0.675
  114   1H5*    C  11          1H5*        C  11  -3.524  14.228   2.973
  115   2H5*    C  11          2H5*        C  11  -4.251  14.586   4.552
  116    H4*    C  11           H4*        C  11  -2.297  15.635   4.879
  117    H3*    C  11           H3*        C  11  -4.154  17.514   4.486
  118    H1*    C  11           H1*        C  11  -0.926  17.639   2.123
  119   1H4     C  11          1H4         C  11  -3.691  15.477  -3.501
  120   2H4     C  11          2H4         C  11  -2.005  15.811  -3.830
  121    H5     C  11           H5         C  11  -4.678  15.774  -1.307
  122    H6     C  11           H6         C  11  -4.231  16.360   1.018
  123   1H2*    C  11          1H2*        C  11  -3.916  17.975   2.177
  124   2H2*    C  11          2H2*        C  11  -2.655  19.048   2.766
  125   1H5*    G  12          1H5*        G  12   0.093  19.181   4.695
  126   2H5*    G  12          2H5*        G  12   0.208  20.395   5.987
  127    H4*    G  12           H4*        G  12   1.696  21.148   4.389
  128    H3*    G  12           H3*        G  12  -0.410  22.819   4.884
  129    H1*    G  12           H1*        G  12   0.939  22.118   1.347
  130    H8     G  12           H8         G  12  -2.667  20.830   1.822
  131    H1     G  12           H1         G  12  -0.023  19.703  -3.912
  132   1H2     G  12          1H2         G  12   2.844  21.025  -2.512
  133   2H2     G  12          2H2         G  12   2.080  20.329  -3.922
  134    H3T    G  12           H3T        G  12   1.439  23.830   4.813
  135   1H2*    G  12          1H2*        G  12  -1.677  22.384   2.910
  136   2H2*    G  12          2H2*        G  12  -0.631  23.665   2.311
  137   1H5*    C  13          1H5*        C  13   1.145  20.624 -11.616
  138   2H5*    C  13          2H5*        C  13   1.123  22.371 -11.316
  139    H4*    C  13           H4*        C  13   3.691  22.122 -11.136
  140    H3*    C  13           H3*        C  13   3.430  19.527 -11.761
  141    H1*    C  13           H1*        C  13   3.459  20.541  -7.937
  142   1H4     C  13          1H4         C  13  -2.907  19.668  -6.280
  143   2H4     C  13          2H4         C  13  -1.985  19.805  -4.803
  144    H5     C  13           H5         C  13  -1.887  19.778  -8.476
  145    H6     C  13           H6         C  13   0.206  20.067  -9.691
  146    H5T    C  13           H5T        C  13   3.013  21.459 -13.137
  147   1H2*    C  13          1H2*        C  13   2.077  18.764  -9.962
  148   2H2*    C  13          2H2*        C  13   3.654  18.580  -9.208
  149   1H5*    G  14          1H5*        G  14   5.832  19.785  -8.056
  150   2H5*    G  14          2H5*        G  14   7.510  19.370  -8.465
  151    H4*    G  14           H4*        G  14   7.431  18.422  -6.431
  152    H3*    G  14           H3*        G  14   7.275  16.453  -8.324
  153    H1*    G  14           H1*        G  14   5.155  16.501  -5.134
  154    H8     G  14           H8         G  14   2.954  16.836  -8.289
  155    H1     G  14           H1         G  14  -0.144  17.019  -2.678
  156   1H2     G  14          1H2         G  14   3.014  17.028  -1.278
  157   2H2     G  14          2H2         G  14   1.285  17.063  -1.016
  158   1H2*    G  14          1H2*        G  14   4.931  16.012  -8.148
  159   2H2*    G  14          2H2*        G  14   5.539  14.916  -6.915
  160   1H5*    C  15          1H5*        C  15   7.840  15.407  -3.779
  161   2H5*    C  15          2H5*        C  15   9.265  14.348  -3.781
  162    H4*    C  15           H4*        C  15   8.068  13.874  -1.815
  163    H3*    C  15           H3*        C  15   8.627  11.807  -3.480
  164    H1*    C  15           H1*        C  15   5.181  12.213  -1.832
  165   1H4     C  15          1H4         C  15   0.831  13.731  -6.602
  166   2H4     C  15          2H4         C  15  -0.081  13.255  -5.189
  167    H5     C  15           H5         C  15   3.242  13.803  -6.650
  168    H6     C  15           H6         C  15   5.284  13.287  -5.403
  169   1H2*    C  15          1H2*        C  15   6.480  11.641  -4.541
  170   2H2*    C  15          2H2*        C  15   6.256  10.538  -3.191
  171   1H5*    A  16          1H5*        A  16   5.784   8.732  -1.670
  172   2H5*    A  16          2H5*        A  16   5.658  10.385  -1.036
  173    H4*    A  16           H4*        A  16   5.537   9.215   1.273
  174    H3*    A  16           H3*        A  16   5.887   6.862   0.079
  175    H1*    A  16           H1*        A  16   2.063   8.154   0.264
  176    H8     A  16           H8         A  16   4.322   9.132  -2.732
  177   1H6     A  16          1H6         A  16   0.779   9.923  -5.943
  178   2H6     A  16          2H6         A  16  -0.964   9.801  -5.866
  179    H2     A  16           H2         A  16  -1.974   8.451  -1.708
  180   1H2*    A  16          1H2*        A  16   4.090   6.759  -1.432
  181   2H2*    A  16          2H2*        A  16   3.219   6.175  -0.022
  182   1H5*    G  17          1H5*        G  17   1.667   6.905   2.585
  183   2H5*    G  17          2H5*        G  17   1.993   5.520   3.647
  184    H4*    G  17           H4*        G  17  -0.313   5.514   2.950
  185    H3*    G  17           H3*        G  17   1.230   3.254   2.819
  186    H1*    G  17           H1*        G  17  -1.253   4.289   0.193
  187    H8     G  17           H8         G  17   2.260   4.393  -1.411
  188    H1     G  17           H1         G  17  -2.641   6.092  -5.182
  189   1H2     G  17          1H2         G  17  -4.529   5.813  -2.302
  190   2H2     G  17          2H2         G  17  -4.512   6.163  -4.012
  191   1H2*    G  17          1H2*        G  17   1.660   3.371   0.453
  192   2H2*    G  17          2H2*        G  17   0.233   2.352   0.494
  193   1H5*  6MC  18          1H5*      6MC  18  -3.197   5.388   2.751
  194   2H5*  6MC  18          2H5*      6MC  18  -2.678   3.927   1.897
  195    H4*  6MC  18           H4*      6MC  18  -5.354   4.669   2.997
  196    H3*  6MC  18           H3*      6MC  18  -4.522   2.108   3.593
  197   1H2*  6MC  18          1H2*      6MC  18  -6.327   1.359   1.459
  198   2H2*  6MC  18          2H2*      6MC  18  -4.630   0.908   1.599
  199    H1*  6MC  18           H1*      6MC  18  -5.877   2.713  -0.249
  200    H8   6MC  18           H8       6MC  18  -2.461   2.260   1.255
  201   1H6   6MC  18          1H6       6MC  18  -0.009   1.807  -2.787
  202    H2   6MC  18           H2       6MC  18  -4.784   2.189  -4.476
  203   1H1   6MC  18          1H1       6MC  18  -0.755   2.118  -5.454
  204   2H1   6MC  18          2H1       6MC  18   0.006   0.829  -5.088
  205   3H1   6MC  18          3H1       6MC  18   0.697   2.199  -4.943
  206   1H5*    T  19          1H5*        T  19  -7.812   2.722   0.982
  207   2H5*    T  19          2H5*        T  19  -9.360   2.279   1.730
  208    H4*    T  19           H4*        T  19  -9.705   1.788  -0.487
  209    H3*    T  19           H3*        T  19  -9.735  -0.409   1.154
  210   1H2*    T  19          1H2*        T  19  -7.553  -1.223   0.519
  211   2H2*    T  19          2H2*        T  19  -8.592  -2.082  -0.606
  212    H1*    T  19           H1*        T  19  -8.325  -0.312  -2.313
  213    H3     T  19           H3         T  19  -4.479  -1.105  -4.410
  214   1H5M    T  19          1H5M        T  19  -2.051  -1.456  -0.546
  215   2H5M    T  19          2H5M        T  19  -3.302  -2.234   0.453
  216   3H5M    T  19          3H5M        T  19  -2.979  -0.492   0.628
  217    H6     T  19           H6         T  19  -5.578  -0.498   0.197
  218   1H5*    C  20          1H5*        C  20  -9.535  -3.596  -1.861
  219   2H5*    C  20          2H5*        C  20  -9.392  -1.917  -2.413
  220    H4*    C  20           H4*        C  20 -10.894  -2.691  -4.368
  221    H3*    C  20           H3*        C  20 -11.007  -5.127  -3.211
  222    H1*    C  20           H1*        C  20  -8.121  -4.443  -5.889
  223   1H4     C  20          1H4         C  20  -2.943  -4.242  -1.753
  224   2H4     C  20          2H4         C  20  -2.345  -4.720  -3.322
  225    H5     C  20           H5         C  20  -5.282  -3.815  -1.313
  226    H6     C  20           H6         C  20  -7.511  -3.751  -2.286
  227   1H2*    C  20          1H2*        C  20  -8.763  -5.827  -3.297
  228   2H2*    C  20          2H2*        C  20  -9.190  -6.263  -4.944
  229   1H5*    T  21          1H5*        T  21 -11.800  -9.079  -5.638
  230   2H5*    T  21          2H5*        T  21 -10.553  -8.014  -4.955
  231    H4*    T  21           H4*        T  21 -10.528  -8.418  -7.890
  232    H3*    T  21           H3*        T  21 -10.812 -10.778  -6.647
  233   1H2*    T  21          1H2*        T  21  -9.048 -10.470  -5.026
  234   2H2*    T  21          2H2*        T  21  -8.242 -11.396  -6.277
  235    H1*    T  21           H1*        T  21  -7.327  -9.381  -7.318
  236    H3     T  21           H3         T  21  -3.837  -8.564  -4.673
  237   1H5M    T  21          1H5M        T  21  -6.825  -6.445  -1.619
  238   2H5M    T  21          2H5M        T  21  -6.934  -8.116  -1.016
  239   3H5M    T  21          3H5M        T  21  -8.313  -7.387  -1.874
  240    H6     T  21           H6         T  21  -8.547  -8.190  -4.035
  241   1H5*    C  22          1H5*        C  22  -7.538 -13.069  -7.184
  242   2H5*    C  22          2H5*        C  22  -7.095 -11.469  -7.815
  243    H4*    C  22           H4*        C  22  -5.892 -12.909  -9.661
  244    H3*    C  22           H3*        C  22  -6.688 -15.105  -8.385
  245    H1*    C  22           H1*        C  22  -3.242 -13.507  -7.194
  246   1H4     C  22          1H4         C  22  -5.123 -10.581  -1.538
  247   2H4     C  22          2H4         C  22  -3.394 -10.862  -1.479
  248    H5     C  22           H5         C  22  -6.468 -11.238  -3.476
  249    H6     C  22           H6         C  22  -6.417 -12.327  -5.653
  250   1H2*    C  22          1H2*        C  22  -5.826 -14.712  -6.203
  251   2H2*    C  22          2H2*        C  22  -4.424 -15.503  -6.908
  252   1H5*    G  23          1H5*        G  23  -2.175 -14.983  -8.489
  253   2H5*    G  23          2H5*        G  23  -1.813 -16.137  -9.789
  254    H4*    G  23           H4*        G  23   0.045 -16.346  -8.487
  255    H3*    G  23           H3*        G  23  -1.540 -18.590  -8.390
  256    H1*    G  23           H1*        G  23   0.286 -17.090  -5.401
  257    H8     G  23           H8         G  23  -3.505 -17.128  -4.776
  258    H1     G  23           H1         G  23   0.016 -14.188  -0.294
  259   1H2     G  23          1H2         G  23   2.639 -14.638  -2.507
  260   2H2     G  23          2H2         G  23   2.110 -14.019  -0.961
  261   1H2*    G  23          1H2*        G  23  -2.439 -18.244  -6.199
  262   2H2*    G  23          2H2*        G  23  -0.974 -19.127  -5.793
  263   1H5*    C  24          1H5*        C  24   2.791 -18.630  -7.310
  264   2H5*    C  24          2H5*        C  24   3.654 -19.799  -8.333
  265    H4*    C  24           H4*        C  24   4.991 -19.383  -6.427
  266    H3*    C  24           H3*        C  24   4.383 -21.949  -7.064
  267    H1*    C  24           H1*        C  24   4.152 -20.667  -3.406
  268   1H4     C  24          1H4         C  24  -2.322 -20.743  -1.955
  269   2H4     C  24          2H4         C  24  -1.441 -20.506  -0.463
  270    H5     C  24           H5         C  24  -1.223 -20.973  -4.104
  271    H6     C  24           H6         C  24   0.931 -21.011  -5.248
  272    H3T    C  24           H3T        C  24   6.388 -21.767  -6.468
  273   1H2*    C  24          1H2*        C  24   2.650 -22.335  -5.473
  274   2H2*    C  24          2H2*        C  24   4.043 -22.787  -4.501
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -0.407 -19.210   8.287
    2   2H5*    G   1          2H5*        G   1   0.497 -20.703   8.599
    3    H4*    G   1           H4*        G   1   2.594 -19.269   8.438
    4    H3*    G   1           H3*        G   1   1.063 -17.061   8.346
    5    H1*    G   1           H1*        G   1   2.367 -18.626   5.009
    6    H8     G   1           H8         G   1  -1.277 -19.642   5.878
    7    H1     G   1           H1         G   1   0.575 -20.626  -0.181
    8   1H2     G   1          1H2         G   1   3.601 -19.302   0.855
    9   2H2     G   1          2H2         G   1   2.660 -19.983  -0.459
   10    H5T    G   1           H5T        G   1   1.298 -19.843  10.453
   11   1H2*    G   1          1H2*        G   1  -0.129 -17.484   6.321
   12   2H2*    G   1          2H2*        G   1   1.267 -16.635   5.672
   13   1H5*    C   2          1H5*        C   2   5.124 -13.260   6.844
   14   2H5*    C   2          2H5*        C   2   3.486 -13.193   6.159
   15    H4*    C   2           H4*        C   2   6.061 -13.983   4.821
   16    H3*    C   2           H3*        C   2   5.078 -11.503   4.870
   17    H1*    C   2           H1*        C   2   3.983 -13.851   1.948
   18   1H4     C   2          1H4         C   2  -2.181 -15.791   3.428
   19   2H4     C   2          2H4         C   2  -2.144 -15.430   1.714
   20    H5     C   2           H5         C   2  -0.221 -15.475   4.868
   21    H6     C   2           H6         C   2   2.047 -14.608   4.957
   22   1H2*    C   2          1H2*        C   2   2.872 -11.949   4.049
   23   2H2*    C   2          2H2*        C   2   3.700 -11.564   2.548
   24   1H5*    G   3          1H5*        G   3   5.752 -13.157   0.639
   25   2H5*    G   3          2H5*        G   3   7.351 -12.421   0.406
   26    H4*    G   3           H4*        G   3   6.702 -12.841  -1.748
   27    H3*    G   3           H3*        G   3   6.940 -10.206  -1.227
   28    H1*    G   3           H1*        G   3   3.811 -11.554  -3.104
   29    H8     G   3           H8         G   3   3.131 -11.102   0.690
   30    H1     G   3           H1         G   3  -2.028 -11.420  -3.099
   31   1H2     G   3          1H2         G   3   0.274 -11.764  -5.669
   32   2H2     G   3          2H2         G   3  -1.409 -11.703  -5.200
   33   1H2*    G   3          1H2*        G   3   4.639  -9.685  -0.842
   34   2H2*    G   3          2H2*        G   3   4.723  -9.416  -2.577
   35   1H5*    A   4          1H5*        A   4   4.738 -11.120  -5.433
   36   2H5*    A   4          2H5*        A   4   6.313 -10.929  -6.230
   37    H4*    A   4           H4*        A   4   5.007 -10.385  -7.976
   38    H3*    A   4           H3*        A   4   6.148  -8.144  -7.075
   39    H1*    A   4           H1*        A   4   2.262  -8.165  -7.601
   40    H8     A   4           H8         A   4   3.410  -8.133  -3.922
   41   1H6     A   4          1H6         A   4  -0.986  -8.208  -1.884
   42   2H6     A   4          2H6         A   4  -2.612  -8.353  -2.517
   43    H2     A   4           H2         A   4  -2.207  -8.718  -6.976
   44   1H2*    A   4          1H2*        A   4   4.422  -7.377  -5.608
   45   2H2*    A   4          2H2*        A   4   3.943  -6.567  -7.092
   46   1H5*    G   5          1H5*        G   5   3.652  -7.978 -10.765
   47   2H5*    G   5          2H5*        G   5   4.393  -7.208 -12.183
   48    H4*    G   5           H4*        G   5   2.102  -6.897 -12.451
   49    H3*    G   5           H3*        G   5   3.626  -4.630 -12.292
   50    H1*    G   5           H1*        G   5   0.206  -5.012 -10.591
   51    H8     G   5           H8         G   5   3.080  -4.941  -7.987
   52    H1     G   5           H1         G   5  -2.889  -4.842  -5.637
   53   1H2     G   5          1H2         G   5  -3.864  -5.124  -8.933
   54   2H2     G   5          2H2         G   5  -4.350  -5.013  -7.258
   55   1H2*    G   5          1H2*        G   5   3.039  -3.983 -10.066
   56   2H2*    G   5          2H2*        G   5   1.746  -3.194 -10.959
   57   1H5*    A   6          1H5*        A   6  -0.153  -2.691 -12.009
   58   2H5*    A   6          2H5*        A   6  -0.800  -4.017 -12.996
   59    H4*    A   6           H4*        A   6  -2.340  -2.618 -14.071
   60    H3*    A   6           H3*        A   6  -0.640  -0.546 -14.067
   61    H1*    A   6           H1*        A   6  -3.509  -0.497 -11.222
   62    H8     A   6           H8         A   6   0.172  -1.471 -10.398
   63   1H6     A   6          1H6         A   6  -0.461  -1.987  -5.607
   64   2H6     A   6          2H6         A   6  -1.849  -1.826  -4.558
   65    H2     A   6           H2         A   6  -5.322  -0.710  -7.176
   66   1H2*    A   6          1H2*        A   6  -0.700   0.227 -11.841
   67   2H2*    A   6          2H2*        A   6  -2.224   0.965 -12.336
   68   1H5*    T   7          1H5*        T   7  -4.795  -0.197 -13.262
   69   2H5*    T   7          2H5*        T   7  -5.773   0.818 -14.341
   70    H4*    T   7           H4*        T   7  -6.912   0.733 -12.294
   71    H3*    T   7           H3*        T   7  -6.227   3.202 -13.258
   72   1H2*    T   7          1H2*        T   7  -4.414   3.650 -11.760
   73   2H2*    T   7          2H2*        T   7  -5.756   4.267 -10.807
   74    H1*    T   7           H1*        T   7  -5.988   2.208  -9.565
   75    H3     T   7           H3         T   7  -2.691   1.993  -6.561
   76   1H5M    T   7          1H5M        T   7  -0.346   3.082 -11.237
   77   2H5M    T   7          2H5M        T   7   0.148   1.497 -10.594
   78   3H5M    T   7          3H5M        T   7   0.536   2.983  -9.695
   79    H6     T   7           H6         T   7  -2.719   2.595 -11.282
   80   1H5*    C   8          1H5*        C   8  -8.618   6.695 -10.232
   81   2H5*    C   8          2H5*        C   8  -7.310   5.501 -10.104
   82    H4*    C   8           H4*        C   8  -9.651   4.808  -8.517
   83    H3*    C   8           H3*        C   8  -9.439   7.469  -8.348
   84    H1*    C   8           H1*        C   8  -7.331   5.288  -5.898
   85   1H4     C   8          1H4         C   8  -1.141   5.504  -8.242
   86   2H4     C   8          2H4         C   8  -1.022   5.514  -6.498
   87    H5     C   8           H5         C   8  -3.258   5.506  -9.414
   88    H6     C   8           H6         C   8  -5.676   5.674  -9.158
   89   1H2*    C   8          1H2*        C   8  -7.111   7.628  -7.829
   90   2H2*    C   8          2H2*        C   8  -7.794   7.597  -6.213
   91   1H5*    T   9          1H5*        T   9  -8.342   5.828  -3.985
   92   2H5*    T   9          2H5*        T   9  -9.892   6.292  -3.251
   93    H4*    T   9           H4*        T   9  -8.371   6.714  -1.573
   94    H3*    T   9           H3*        T   9  -9.675   8.912  -2.457
   95   1H2*    T   9          1H2*        T   9  -7.955   9.701  -3.946
   96   2H2*    T   9          2H2*        T   9  -7.590  10.597  -2.483
   97    H1*    T   9           H1*        T   9  -5.938   8.948  -1.763
   98    H3     T   9           H3         T   9  -2.193   9.482  -4.104
   99   1H5M    T   9          1H5M        T   9  -4.634   9.965  -8.092
  100   2H5M    T   9          2H5M        T   9  -4.912   8.212  -7.953
  101   3H5M    T   9          3H5M        T   9  -6.249   9.351  -7.660
  102    H6     T   9           H6         T   9  -6.764   9.080  -5.376
  103   1H5*    G  10          1H5*        G  10  -6.238  10.402   0.023
  104   2H5*    G  10          2H5*        G  10  -7.057   9.690   1.429
  105    H4*    G  10           H4*        G  10  -6.212  11.193   2.812
  106    H3*    G  10           H3*        G  10  -7.786  13.005   1.686
  107    H1*    G  10           H1*        G  10  -3.857  13.545   1.157
  108    H8     G  10           H8         G  10  -5.954  11.890  -1.649
  109    H1     G  10           H1         G  10   0.201  12.918  -3.041
  110   1H2     G  10          1H2         G  10   0.486  13.894   0.268
  111   2H2     G  10          2H2         G  10   1.295  13.609  -1.259
  112   1H2*    G  10          1H2*        G  10  -6.524  13.596  -0.242
  113   2H2*    G  10          2H2*        G  10  -5.835  14.750   0.891
  114   1H5*    C  11          1H5*        C  11  -3.859  14.570   3.580
  115   2H5*    C  11          2H5*        C  11  -4.491  15.473   4.973
  116    H4*    C  11           H4*        C  11  -2.485  16.503   4.646
  117    H3*    C  11           H3*        C  11  -4.597  18.125   4.041
  118    H1*    C  11           H1*        C  11  -1.441  17.887   1.743
  119   1H4     C  11          1H4         C  11  -3.834  15.311  -3.875
  120   2H4     C  11          2H4         C  11  -2.124  15.588  -4.110
  121    H5     C  11           H5         C  11  -4.969  15.788  -1.787
  122    H6     C  11           H6         C  11  -4.672  16.533   0.516
  123   1H2*    C  11          1H2*        C  11  -4.475  18.100   1.675
  124   2H2*    C  11          2H2*        C  11  -3.280  19.354   1.974
  125   1H5*    G  12          1H5*        G  12  -0.391  20.322   3.779
  126   2H5*    G  12          2H5*        G  12  -0.570  21.375   5.197
  127    H4*    G  12           H4*        G  12   0.892  22.510   3.790
  128    H3*    G  12           H3*        G  12  -1.417  23.805   4.409
  129    H1*    G  12           H1*        G  12   0.010  23.766   0.821
  130    H8     G  12           H8         G  12  -3.356  21.916   1.109
  131    H1     G  12           H1         G  12  -0.554  21.703  -4.658
  132   1H2     G  12          1H2         G  12   2.089  23.287  -3.094
  133   2H2     G  12          2H2         G  12   1.442  22.611  -4.573
  134    H3T    G  12           H3T        G  12   0.030  25.296   4.390
  135   1H2*    G  12          1H2*        G  12  -2.601  23.430   2.370
  136   2H2*    G  12          2H2*        G  12  -1.761  24.918   1.958
  137   1H5*    C  13          1H5*        C  13   1.988  21.507 -13.130
  138   2H5*    C  13          2H5*        C  13   1.058  20.604 -11.919
  139    H4*    C  13           H4*        C  13   3.563  22.185 -11.637
  140    H3*    C  13           H3*        C  13   3.262  19.529 -11.585
  141    H1*    C  13           H1*        C  13   2.994  21.465  -8.108
  142   1H4     C  13          1H4         C  13  -3.559  21.123  -7.141
  143   2H4     C  13          2H4         C  13  -2.823  21.589  -5.625
  144    H5     C  13           H5         C  13  -2.276  20.695  -9.148
  145    H6     C  13           H6         C  13  -0.037  20.647 -10.110
  146    H5T    C  13           H5T        C  13   0.969  23.060 -11.107
  147   1H2*    C  13          1H2*        C  13   1.777  19.251  -9.756
  148   2H2*    C  13          2H2*        C  13   3.286  19.276  -8.854
  149   1H5*    G  14          1H5*        G  14   5.396  20.047  -7.789
  150   2H5*    G  14          2H5*        G  14   7.095  19.848  -8.266
  151    H4*    G  14           H4*        G  14   7.180  18.908  -6.214
  152    H3*    G  14           H3*        G  14   7.412  16.981  -8.088
  153    H1*    G  14           H1*        G  14   5.045  16.523  -5.078
  154    H8     G  14           H8         G  14   3.127  16.838  -8.400
  155    H1     G  14           H1         G  14  -0.480  16.503  -3.109
  156   1H2     G  14          1H2         G  14   2.522  16.662  -1.417
  157   2H2     G  14          2H2         G  14   0.779  16.563  -1.319
  158   1H2*    G  14          1H2*        G  14   5.127  16.251  -8.119
  159   2H2*    G  14          2H2*        G  14   5.796  15.164  -6.909
  160   1H5*    C  15          1H5*        C  15   7.528  15.869  -3.550
  161   2H5*    C  15          2H5*        C  15   9.146  15.152  -3.412
  162    H4*    C  15           H4*        C  15   8.065  14.271  -1.596
  163    H3*    C  15           H3*        C  15   8.763  12.393  -3.422
  164    H1*    C  15           H1*        C  15   5.320  12.377  -1.716
  165   1H4     C  15          1H4         C  15   0.800  13.791  -6.358
  166   2H4     C  15          2H4         C  15  -0.063  13.313  -4.915
  167    H5     C  15           H5         C  15   3.201  13.979  -6.454
  168    H6     C  15           H6         C  15   5.292  13.514  -5.265
  169   1H2*    C  15          1H2*        C  15   6.623  12.128  -4.472
  170   2H2*    C  15          2H2*        C  15   6.514  10.910  -3.209
  171   1H5*    A  16          1H5*        A  16   6.257   8.949  -1.794
  172   2H5*    A  16          2H5*        A  16   6.060  10.548  -1.052
  173    H4*    A  16           H4*        A  16   6.125   9.206   1.180
  174    H3*    A  16           H3*        A  16   6.499   6.961  -0.176
  175    H1*    A  16           H1*        A  16   2.646   8.090   0.208
  176    H8     A  16           H8         A  16   4.743   9.402  -2.786
  177   1H6     A  16          1H6         A  16   1.026  10.447  -5.708
  178   2H6     A  16          2H6         A  16  -0.710  10.287  -5.557
  179    H2     A  16           H2         A  16  -1.483   8.525  -1.503
  180   1H2*    A  16          1H2*        A  16   4.678   6.966  -1.683
  181   2H2*    A  16          2H2*        A  16   3.864   6.196  -0.329
  182   1H5*    G  17          1H5*        G  17   2.764   7.288   2.324
  183   2H5*    G  17          2H5*        G  17   3.041   6.176   3.680
  184    H4*    G  17           H4*        G  17   0.708   6.474   3.468
  185    H3*    G  17           H3*        G  17   1.643   3.964   3.558
  186    H1*    G  17           H1*        G  17  -0.928   4.931   0.854
  187    H8     G  17           H8         G  17   2.633   4.598  -0.640
  188    H1     G  17           H1         G  17  -2.116   5.813  -4.777
  189   1H2     G  17          1H2         G  17  -4.094   6.008  -1.948
  190   2H2     G  17          2H2         G  17  -4.014   6.106  -3.691
  191   1H2*    G  17          1H2*        G  17   1.786   3.577   1.185
  192   2H2*    G  17          2H2*        G  17   0.196   2.924   1.543
  193   1H5*  6MC  18          1H5*      6MC  18  -2.967   4.785   3.694
  194   2H5*  6MC  18          2H5*      6MC  18  -2.546   4.059   2.138
  195    H4*  6MC  18           H4*      6MC  18  -5.084   4.223   3.481
  196    H3*  6MC  18           H3*      6MC  18  -4.262   1.632   3.838
  197   1H2*  6MC  18          1H2*      6MC  18  -6.043   1.050   1.633
  198   2H2*  6MC  18          2H2*      6MC  18  -4.346   0.599   1.758
  199    H1*  6MC  18           H1*      6MC  18  -5.532   2.517   0.017
  200    H8   6MC  18           H8       6MC  18  -2.172   2.206   1.691
  201   1H6   6MC  18          1H6       6MC  18   0.498   2.173  -2.241
  202    H2   6MC  18           H2       6MC  18  -4.205   2.269  -4.147
  203   1H1   6MC  18          1H1       6MC  18  -0.003   2.842  -4.843
  204   2H1   6MC  18          2H1       6MC  18   0.404   1.361  -4.713
  205   3H1   6MC  18          3H1       6MC  18   1.384   2.471  -4.286
  206   1H5*    T  19          1H5*        T  19  -7.493   2.454   1.261
  207   2H5*    T  19          2H5*        T  19  -9.060   1.979   1.945
  208    H4*    T  19           H4*        T  19  -9.357   1.681  -0.319
  209    H3*    T  19           H3*        T  19  -9.523  -0.616   1.160
  210   1H2*    T  19          1H2*        T  19  -7.331  -1.441   0.549
  211   2H2*    T  19          2H2*        T  19  -8.363  -2.223  -0.635
  212    H1*    T  19           H1*        T  19  -8.033  -0.350  -2.238
  213    H3     T  19           H3         T  19  -4.239  -1.262  -4.361
  214   1H5M    T  19          1H5M        T  19  -1.796  -1.757  -0.528
  215   2H5M    T  19          2H5M        T  19  -3.067  -2.393   0.543
  216   3H5M    T  19          3H5M        T  19  -2.623  -0.670   0.613
  217    H6     T  19           H6         T  19  -5.289  -0.700   0.261
  218   1H5*    C  20          1H5*        C  20  -9.366  -3.574  -1.714
  219   2H5*    C  20          2H5*        C  20  -9.291  -1.938  -2.401
  220    H4*    C  20           H4*        C  20 -10.776  -2.910  -4.271
  221    H3*    C  20           H3*        C  20 -10.787  -5.255  -2.894
  222    H1*    C  20           H1*        C  20  -8.038  -4.678  -5.742
  223   1H4     C  20          1H4         C  20  -2.700  -4.294  -1.827
  224   2H4     C  20          2H4         C  20  -2.148  -4.726  -3.425
  225    H5     C  20           H5         C  20  -5.031  -3.965  -1.284
  226    H6     C  20           H6         C  20  -7.299  -3.951  -2.163
  227   1H2*    C  20          1H2*        C  20  -8.557  -5.960  -3.074
  228   2H2*    C  20          2H2*        C  20  -9.050  -6.459  -4.685
  229   1H5*    T  21          1H5*        T  21  -9.867  -6.085  -6.946
  230   2H5*    T  21          2H5*        T  21 -11.210  -6.840  -7.829
  231    H4*    T  21           H4*        T  21  -9.443  -7.888  -8.793
  232    H3*    T  21           H3*        T  21 -10.865  -9.600  -7.198
  233   1H2*    T  21          1H2*        T  21  -9.331  -9.661  -5.358
  234   2H2*    T  21          2H2*        T  21  -8.700 -10.976  -6.337
  235    H1*    T  21           H1*        T  21  -7.062  -9.545  -7.413
  236    H3     T  21           H3         T  21  -3.678  -8.747  -4.641
  237   1H5M    T  21          1H5M        T  21  -8.243  -7.970  -1.864
  238   2H5M    T  21          2H5M        T  21  -6.931  -6.792  -1.613
  239   3H5M    T  21          3H5M        T  21  -6.738  -8.471  -1.056
  240    H6     T  21           H6         T  21  -8.404  -8.358  -4.160
  241   1H5*    C  22          1H5*        C  22  -8.520 -14.266  -7.759
  242   2H5*    C  22          2H5*        C  22  -8.104 -12.692  -7.051
  243    H4*    C  22           H4*        C  22  -6.513 -13.288  -9.398
  244    H3*    C  22           H3*        C  22  -6.902 -15.661  -8.198
  245    H1*    C  22           H1*        C  22  -3.917 -13.432  -7.126
  246   1H4     C  22          1H4         C  22  -5.455 -10.876  -1.207
  247   2H4     C  22          2H4         C  22  -3.725 -11.161  -1.232
  248    H5     C  22           H5         C  22  -6.902 -11.473  -3.084
  249    H6     C  22           H6         C  22  -6.974 -12.540  -5.267
  250   1H2*    C  22          1H2*        C  22  -6.232 -15.056  -5.975
  251   2H2*    C  22          2H2*        C  22  -4.707 -15.639  -6.624
  252   1H5*    G  23          1H5*        G  23  -3.293 -16.854  -7.129
  253   2H5*    G  23          2H5*        G  23  -2.648 -15.398  -7.916
  254    H4*    G  23           H4*        G  23  -0.714 -16.776  -8.689
  255    H3*    G  23           H3*        G  23  -1.983 -19.047  -8.118
  256    H1*    G  23           H1*        G  23   0.399 -17.571  -5.289
  257    H8     G  23           H8         G  23  -3.402 -17.401  -4.752
  258    H1     G  23           H1         G  23   0.166 -14.410  -0.346
  259   1H2     G  23          1H2         G  23   2.809 -15.102  -2.469
  260   2H2     G  23          2H2         G  23   2.276 -14.374  -0.967
  261   1H2*    G  23          1H2*        G  23  -2.305 -18.824  -5.773
  262   2H2*    G  23          2H2*        G  23  -0.715 -19.572  -5.753
  263   1H5*    C  24          1H5*        C  24   2.385 -19.070  -7.753
  264   2H5*    C  24          2H5*        C  24   3.334 -20.235  -8.700
  265    H4*    C  24           H4*        C  24   4.496 -19.737  -6.675
  266    H3*    C  24           H3*        C  24   4.063 -22.328  -7.422
  267    H1*    C  24           H1*        C  24   3.625 -21.096  -3.789
  268   1H4     C  24          1H4         C  24  -2.825 -21.764  -2.397
  269   2H4     C  24          2H4         C  24  -2.002 -21.316  -0.919
  270    H5     C  24           H5         C  24  -1.673 -22.017  -4.516
  271    H6     C  24           H6         C  24   0.488 -21.877  -5.638
  272    H3T    C  24           H3T        C  24   5.544 -21.152  -5.319
  273   1H2*    C  24          1H2*        C  24   2.299 -22.852  -5.908
  274   2H2*    C  24          2H2*        C  24   3.678 -23.228  -4.884
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -0.070 -19.324   8.552
    2   2H5*    G   1          2H5*        G   1   1.082 -20.569   9.072
    3    H4*    G   1           H4*        G   1   2.939 -19.162   8.385
    4    H3*    G   1           H3*        G   1   1.351 -16.950   8.524
    5    H1*    G   1           H1*        G   1   2.484 -18.476   5.160
    6    H8     G   1           H8         G   1  -1.234 -19.276   5.945
    7    H1     G   1           H1         G   1   0.703 -20.403  -0.064
    8   1H2     G   1          1H2         G   1   3.789 -19.309   1.056
    9   2H2     G   1          2H2         G   1   2.840 -19.923  -0.283
   10    H5T    G   1           H5T        G   1   1.786 -18.227  10.154
   11   1H2*    G   1          1H2*        G   1   0.032 -17.328   6.571
   12   2H2*    G   1          2H2*        G   1   1.384 -16.467   5.849
   13   1H5*    C   2          1H5*        C   2   5.434 -13.228   6.745
   14   2H5*    C   2          2H5*        C   2   3.778 -13.057   6.127
   15    H4*    C   2           H4*        C   2   6.264 -13.931   4.689
   16    H3*    C   2           H3*        C   2   5.291 -11.445   4.751
   17    H1*    C   2           H1*        C   2   4.146 -13.811   1.887
   18   1H4     C   2          1H4         C   2  -2.009 -15.745   3.393
   19   2H4     C   2          2H4         C   2  -1.993 -15.392   1.679
   20    H5     C   2           H5         C   2  -0.063 -15.415   4.819
   21    H6     C   2           H6         C   2   2.222 -14.584   4.897
   22   1H2*    C   2          1H2*        C   2   3.057 -11.909   4.008
   23   2H2*    C   2          2H2*        C   2   3.836 -11.514   2.482
   24   1H5*    G   3          1H5*        G   3   6.198 -13.134   0.645
   25   2H5*    G   3          2H5*        G   3   7.715 -12.307   0.230
   26    H4*    G   3           H4*        G   3   6.853 -13.045  -1.803
   27    H3*    G   3           H3*        G   3   7.263 -10.387  -1.599
   28    H1*    G   3           H1*        G   3   4.043 -11.774  -3.136
   29    H8     G   3           H8         G   3   3.351 -11.073   0.613
   30    H1     G   3           H1         G   3  -1.754 -11.103  -3.259
   31   1H2     G   3          1H2         G   3   0.572 -11.605  -5.786
   32   2H2     G   3          2H2         G   3  -1.111 -11.423  -5.357
   33   1H2*    G   3          1H2*        G   3   5.005  -9.757  -1.045
   34   2H2*    G   3          2H2*        G   3   4.991  -9.575  -2.793
   35   1H5*    A   4          1H5*        A   4   4.670  -9.891  -4.832
   36   2H5*    A   4          2H5*        A   4   4.844 -11.479  -5.608
   37    H4*    A   4           H4*        A   4   4.763 -10.518  -7.780
   38    H3*    A   4           H3*        A   4   5.920  -8.257  -6.996
   39    H1*    A   4           H1*        A   4   2.016  -8.185  -7.529
   40    H8     A   4           H8         A   4   3.223  -8.102  -3.872
   41   1H6     A   4          1H6         A   4  -1.140  -8.041  -1.762
   42   2H6     A   4          2H6         A   4  -2.776  -8.165  -2.371
   43    H2     A   4           H2         A   4  -2.456  -8.616  -6.825
   44   1H2*    A   4          1H2*        A   4   4.201  -7.381  -5.582
   45   2H2*    A   4          2H2*        A   4   3.750  -6.633  -7.106
   46   1H5*    G   5          1H5*        G   5   3.108  -8.041 -10.549
   47   2H5*    G   5          2H5*        G   5   3.959  -7.390 -11.965
   48    H4*    G   5           H4*        G   5   1.752  -6.868 -12.377
   49    H3*    G   5           H3*        G   5   3.392  -4.706 -12.072
   50    H1*    G   5           H1*        G   5  -0.147  -4.883 -10.496
   51    H8     G   5           H8         G   5   2.714  -5.088  -7.892
   52    H1     G   5           H1         G   5  -3.241  -4.738  -5.535
   53   1H2     G   5          1H2         G   5  -4.225  -4.821  -8.844
   54   2H2     G   5          2H2         G   5  -4.707  -4.754  -7.164
   55   1H2*    G   5          1H2*        G   5   2.720  -4.032  -9.888
   56   2H2*    G   5          2H2*        G   5   1.498  -3.185 -10.829
   57   1H5*    A   6          1H5*        A   6  -0.227  -2.524 -11.900
   58   2H5*    A   6          2H5*        A   6  -0.942  -3.782 -12.929
   59    H4*    A   6           H4*        A   6  -2.312  -2.224 -14.049
   60    H3*    A   6           H3*        A   6  -0.447  -0.288 -13.782
   61    H1*    A   6           H1*        A   6  -3.558  -0.198 -11.173
   62    H8     A   6           H8         A   6   0.046  -1.295 -10.237
   63   1H6     A   6          1H6         A   6  -0.772  -2.005  -5.504
   64   2H6     A   6          2H6         A   6  -2.189  -1.859  -4.496
   65    H2     A   6           H2         A   6  -5.549  -0.573  -7.176
   66   1H2*    A   6          1H2*        A   6  -0.716   0.491 -11.586
   67   2H2*    A   6          2H2*        A   6  -2.189   1.243 -12.193
   68   1H5*    T   7          1H5*        T   7  -4.622   0.417 -13.676
   69   2H5*    T   7          2H5*        T   7  -5.362   1.506 -14.866
   70    H4*    T   7           H4*        T   7  -6.800   1.542 -13.041
   71    H3*    T   7           H3*        T   7  -5.687   3.942 -13.746
   72   1H2*    T   7          1H2*        T   7  -4.105   4.122 -11.964
   73   2H2*    T   7          2H2*        T   7  -5.505   4.847 -11.187
   74    H1*    T   7           H1*        T   7  -6.140   2.793 -10.107
   75    H3     T   7           H3         T   7  -3.385   1.899  -6.722
   76   1H5M    T   7          1H5M        T   7   0.084   1.673 -10.229
   77   2H5M    T   7          2H5M        T   7   0.317   3.112  -9.208
   78   3H5M    T   7          3H5M        T   7  -0.299   3.291 -10.867
   79    H6     T   7           H6         T   7  -2.630   2.969 -11.295
   80   1H5*    C   8          1H5*        C   8  -9.477   6.708 -10.700
   81   2H5*    C   8          2H5*        C   8  -8.003   7.435 -10.028
   82    H4*    C   8           H4*        C   8  -9.922   5.508  -8.825
   83    H3*    C   8           H3*        C   8  -9.573   8.083  -8.229
   84    H1*    C   8           H1*        C   8  -7.587   5.448  -6.149
   85   1H4     C   8          1H4         C   8  -1.401   5.581  -8.492
   86   2H4     C   8          2H4         C   8  -1.270   5.526  -6.749
   87    H5     C   8           H5         C   8  -3.526   5.714  -9.643
   88    H6     C   8           H6         C   8  -5.938   5.988  -9.355
   89   1H2*    C   8          1H2*        C   8  -7.236   8.032  -7.711
   90   2H2*    C   8          2H2*        C   8  -7.922   7.791  -6.114
   91   1H5*    T   9          1H5*        T   9  -8.394   6.037  -4.181
   92   2H5*    T   9          2H5*        T   9  -9.927   6.362  -3.344
   93    H4*    T   9           H4*        T   9  -8.426   6.741  -1.672
   94    H3*    T   9           H3*        T   9  -9.681   9.010  -2.437
   95   1H2*    T   9          1H2*        T   9  -7.950   9.822  -3.902
   96   2H2*    T   9          2H2*        T   9  -7.563  10.646  -2.403
   97    H1*    T   9           H1*        T   9  -5.946   8.924  -1.760
   98    H3     T   9           H3         T   9  -2.194   9.529  -4.079
   99   1H5M    T   9          1H5M        T   9  -5.005   8.407  -7.951
  100   2H5M    T   9          2H5M        T   9  -6.225   9.668  -7.644
  101   3H5M    T   9          3H5M        T   9  -4.556  10.126  -8.061
  102    H6     T   9           H6         T   9  -6.767   9.212  -5.366
  103   1H5*    G  10          1H5*        G  10  -6.150  10.186   0.126
  104   2H5*    G  10          2H5*        G  10  -7.032   9.640   1.567
  105    H4*    G  10           H4*        G  10  -5.999  11.113   2.835
  106    H3*    G  10           H3*        G  10  -7.618  12.920   1.738
  107    H1*    G  10           H1*        G  10  -3.716  13.412   1.141
  108    H8     G  10           H8         G  10  -5.823  11.864  -1.720
  109    H1     G  10           H1         G  10   0.343  12.874  -3.059
  110   1H2     G  10          1H2         G  10   0.629  13.719   0.289
  111   2H2     G  10          2H2         G  10   1.442  13.486  -1.244
  112   1H2*    G  10          1H2*        G  10  -6.407  13.480  -0.233
  113   2H2*    G  10          2H2*        G  10  -5.687  14.645   0.869
  114   1H5*    C  11          1H5*        C  11  -4.158  15.166   2.289
  115   2H5*    C  11          2H5*        C  11  -3.922  14.505   3.920
  116    H4*    C  11           H4*        C  11  -2.720  16.274   4.627
  117    H3*    C  11           H3*        C  11  -4.671  17.955   3.914
  118    H1*    C  11           H1*        C  11  -1.313  18.052   1.726
  119   1H4     C  11          1H4         C  11  -3.630  15.211  -3.787
  120   2H4     C  11          2H4         C  11  -1.911  15.446  -4.007
  121    H5     C  11           H5         C  11  -4.783  15.786  -1.734
  122    H6     C  11           H6         C  11  -4.505  16.608   0.544
  123   1H2*    C  11          1H2*        C  11  -4.313  18.185   1.586
  124   2H2*    C  11          2H2*        C  11  -3.157  19.397   2.120
  125   1H5*    G  12          1H5*        G  12  -0.601  20.216   3.501
  126   2H5*    G  12          2H5*        G  12  -0.702  21.155   5.006
  127    H4*    G  12           H4*        G  12   0.566  22.500   3.635
  128    H3*    G  12           H3*        G  12  -1.839  23.576   4.341
  129    H1*    G  12           H1*        G  12  -0.404  23.825   0.781
  130    H8     G  12           H8         G  12  -3.792  22.075   0.805
  131    H1     G  12           H1         G  12  -0.526  21.566  -4.691
  132   1H2     G  12          1H2         G  12   2.069  23.015  -2.922
  133   2H2     G  12          2H2         G  12   1.510  22.356  -4.444
  134    H3T    G  12           H3T        G  12  -0.845  25.495   3.852
  135   1H2*    G  12          1H2*        G  12  -2.998  23.217   2.283
  136   2H2*    G  12          2H2*        G  12  -2.275  24.786   1.951
  137   1H5*    C  13          1H5*        C  13   1.378  20.171 -12.055
  138   2H5*    C  13          2H5*        C  13   1.176  21.934 -12.019
  139    H4*    C  13           H4*        C  13   3.819  21.814 -11.719
  140    H3*    C  13           H3*        C  13   3.542  19.160 -11.594
  141    H1*    C  13           H1*        C  13   3.165  21.190  -8.176
  142   1H4     C  13          1H4         C  13  -3.416  20.836  -7.419
  143   2H4     C  13          2H4         C  13  -2.731  21.343  -5.893
  144    H5     C  13           H5         C  13  -2.064  20.361  -9.370
  145    H6     C  13           H6         C  13   0.207  20.299 -10.254
  146    H5T    C  13           H5T        C  13   1.612  20.991 -14.135
  147   1H2*    C  13          1H2*        C  13   2.019  18.917  -9.792
  148   2H2*    C  13          2H2*        C  13   3.504  18.988  -8.855
  149   1H5*    G  14          1H5*        G  14   5.593  19.803  -7.755
  150   2H5*    G  14          2H5*        G  14   7.299  19.638  -8.221
  151    H4*    G  14           H4*        G  14   7.431  18.732  -6.166
  152    H3*    G  14           H3*        G  14   7.632  16.750  -7.972
  153    H1*    G  14           H1*        G  14   5.251  16.375  -4.951
  154    H8     G  14           H8         G  14   3.360  16.745  -8.291
  155    H1     G  14           H1         G  14  -0.282  16.406  -3.023
  156   1H2     G  14          1H2         G  14   2.712  16.508  -1.312
  157   2H2     G  14          2H2         G  14   0.967  16.434  -1.225
  158   1H2*    G  14          1H2*        G  14   5.337  16.048  -7.986
  159   2H2*    G  14          2H2*        G  14   5.995  14.980  -6.754
  160   1H5*    C  15          1H5*        C  15   7.725  15.656  -3.380
  161   2H5*    C  15          2H5*        C  15   9.313  14.870  -3.260
  162    H4*    C  15           H4*        C  15   8.168  14.008  -1.463
  163    H3*    C  15           H3*        C  15   8.875  12.147  -3.305
  164    H1*    C  15           H1*        C  15   5.402  12.163  -1.664
  165   1H4     C  15          1H4         C  15   0.993  13.707  -6.372
  166   2H4     C  15          2H4         C  15   0.095  13.214  -4.957
  167    H5     C  15           H5         C  15   3.397  13.861  -6.417
  168    H6     C  15           H6         C  15   5.457  13.363  -5.192
  169   1H2*    C  15          1H2*        C  15   6.751  11.932  -4.400
  170   2H2*    C  15          2H2*        C  15   6.598  10.697  -3.159
  171   1H5*    A  16          1H5*        A  16   6.286   8.737  -1.809
  172   2H5*    A  16          2H5*        A  16   6.126  10.324  -1.032
  173    H4*    A  16           H4*        A  16   6.109   8.936   1.171
  174    H3*    A  16           H3*        A  16   6.455   6.708  -0.212
  175    H1*    A  16           H1*        A  16   2.631   7.918   0.122
  176    H8     A  16           H8         A  16   4.777   9.286  -2.812
  177   1H6     A  16          1H6         A  16   1.106  10.472  -5.743
  178   2H6     A  16          2H6         A  16  -0.634  10.336  -5.607
  179    H2     A  16           H2         A  16  -1.473   8.468  -1.617
  180   1H2*    A  16          1H2*        A  16   4.677   6.814  -1.775
  181   2H2*    A  16          2H2*        A  16   3.814   6.010  -0.472
  182   1H5*    G  17          1H5*        G  17   2.601   7.170   2.074
  183   2H5*    G  17          2H5*        G  17   2.850   6.089   3.460
  184    H4*    G  17           H4*        G  17   0.524   6.403   3.218
  185    H3*    G  17           H3*        G  17   1.454   3.882   3.341
  186    H1*    G  17           H1*        G  17  -1.138   4.862   0.662
  187    H8     G  17           H8         G  17   2.392   4.400  -0.872
  188    H1     G  17           H1         G  17  -2.370   5.636  -4.993
  189   1H2     G  17          1H2         G  17  -4.311   5.952  -2.151
  190   2H2     G  17          2H2         G  17  -4.244   6.009  -3.896
  191   1H2*    G  17          1H2*        G  17   1.546   3.439   0.979
  192   2H2*    G  17          2H2*        G  17  -0.056   2.836   1.369
  193   1H5*  6MC  18          1H5*      6MC  18  -3.141   4.759   3.534
  194   2H5*  6MC  18          2H5*      6MC  18  -2.752   3.900   2.038
  195    H4*  6MC  18           H4*      6MC  18  -5.264   4.168   3.442
  196    H3*  6MC  18           H3*      6MC  18  -4.418   1.594   3.881
  197   1H2*  6MC  18          1H2*      6MC  18  -6.276   0.932   1.759
  198   2H2*  6MC  18          2H2*      6MC  18  -4.581   0.466   1.857
  199    H1*  6MC  18           H1*      6MC  18  -5.778   2.312   0.054
  200    H8   6MC  18           H8       6MC  18  -2.406   1.970   1.704
  201   1H6   6MC  18          1H6       6MC  18   0.239   1.883  -2.252
  202    H2   6MC  18           H2       6MC  18  -4.476   2.106  -4.122
  203   1H1   6MC  18          1H1       6MC  18   0.860   1.256  -4.417
  204   2H1   6MC  18          2H1       6MC  18   0.590   2.770  -4.511
  205   3H1   6MC  18          3H1       6MC  18  -0.493   1.765  -4.953
  206   1H5*    T  19          1H5*        T  19  -7.687   2.261   1.371
  207   2H5*    T  19          2H5*        T  19  -9.234   1.886   2.154
  208    H4*    T  19           H4*        T  19  -9.717   1.403  -0.015
  209    H3*    T  19           H3*        T  19  -9.620  -0.850   1.541
  210   1H2*    T  19          1H2*        T  19  -7.473  -1.614   0.761
  211   2H2*    T  19          2H2*        T  19  -8.558  -2.442  -0.343
  212    H1*    T  19           H1*        T  19  -8.385  -0.622  -2.000
  213    H3     T  19           H3         T  19  -4.591  -1.230  -4.271
  214   1H5M    T  19          1H5M        T  19  -3.251  -2.538   0.523
  215   2H5M    T  19          2H5M        T  19  -2.915  -0.801   0.723
  216   3H5M    T  19          3H5M        T  19  -2.039  -1.742  -0.507
  217    H6     T  19           H6         T  19  -5.548  -0.852   0.395
  218   1H5*    C  20          1H5*        C  20  -9.530  -3.948  -1.639
  219   2H5*    C  20          2H5*        C  20  -9.393  -2.237  -2.087
  220    H4*    C  20           H4*        C  20 -10.970  -2.886  -4.036
  221    H3*    C  20           H3*        C  20 -11.067  -5.382  -3.050
  222    H1*    C  20           H1*        C  20  -8.199  -4.561  -5.706
  223   1H4     C  20          1H4         C  20  -2.982  -4.460  -1.612
  224   2H4     C  20          2H4         C  20  -2.392  -4.856  -3.208
  225    H5     C  20           H5         C  20  -5.322  -4.085  -1.134
  226    H6     C  20           H6         C  20  -7.561  -4.012  -2.081
  227   1H2*    C  20          1H2*        C  20  -8.806  -6.040  -3.156
  228   2H2*    C  20          2H2*        C  20  -9.240  -6.432  -4.813
  229   1H5*    T  21          1H5*        T  21 -11.857  -9.190  -5.498
  230   2H5*    T  21          2H5*        T  21 -10.613  -8.114  -4.828
  231    H4*    T  21           H4*        T  21 -10.584  -8.513  -7.757
  232    H3*    T  21           H3*        T  21 -10.902 -10.885  -6.550
  233   1H2*    T  21          1H2*        T  21  -9.146 -10.616  -4.912
  234   2H2*    T  21          2H2*        T  21  -8.344 -11.540  -6.169
  235    H1*    T  21           H1*        T  21  -7.398  -9.525  -7.184
  236    H3     T  21           H3         T  21  -3.911  -8.742  -4.526
  237   1H5M    T  21          1H5M        T  21  -8.387  -7.617  -1.706
  238   2H5M    T  21          2H5M        T  21  -6.891  -6.696  -1.423
  239   3H5M    T  21          3H5M        T  21  -7.019  -8.379  -0.861
  240    H6     T  21           H6         T  21  -8.623  -8.399  -3.877
  241   1H5*    C  22          1H5*        C  22  -7.564 -13.159  -7.112
  242   2H5*    C  22          2H5*        C  22  -7.154 -11.538  -7.712
  243    H4*    C  22           H4*        C  22  -5.922 -12.892  -9.588
  244    H3*    C  22           H3*        C  22  -6.704 -15.146  -8.409
  245    H1*    C  22           H1*        C  22  -3.271 -13.576  -7.158
  246   1H4     C  22          1H4         C  22  -5.117 -10.853  -1.396
  247   2H4     C  22          2H4         C  22  -3.400 -11.190  -1.325
  248    H5     C  22           H5         C  22  -6.466 -11.407  -3.357
  249    H6     C  22           H6         C  22  -6.426 -12.402  -5.579
  250   1H2*    C  22          1H2*        C  22  -5.849 -14.833  -6.209
  251   2H2*    C  22          2H2*        C  22  -4.442 -15.591  -6.944
  252   1H5*    G  23          1H5*        G  23  -2.232 -15.055  -8.517
  253   2H5*    G  23          2H5*        G  23  -1.847 -16.126  -9.880
  254    H4*    G  23           H4*        G  23  -0.003 -16.427  -8.591
  255    H3*    G  23           H3*        G  23  -1.608 -18.660  -8.554
  256    H1*    G  23           H1*        G  23   0.246 -17.258  -5.530
  257    H8     G  23           H8         G  23  -3.539 -17.312  -4.886
  258    H1     G  23           H1         G  23   0.000 -14.472  -0.354
  259   1H2     G  23          1H2         G  23   2.613 -14.865  -2.589
  260   2H2     G  23          2H2         G  23   2.088 -14.280  -1.027
  261   1H2*    G  23          1H2*        G  23  -2.486 -18.379  -6.346
  262   2H2*    G  23          2H2*        G  23  -1.021 -19.278  -5.977
  263   1H5*    C  24          1H5*        C  24   2.715 -18.796  -7.492
  264   2H5*    C  24          2H5*        C  24   3.600 -19.935  -8.528
  265    H4*    C  24           H4*        C  24   4.875 -19.610  -6.562
  266    H3*    C  24           H3*        C  24   4.260 -22.143  -7.313
  267    H1*    C  24           H1*        C  24   3.926 -20.989  -3.626
  268   1H4     C  24          1H4         C  24  -2.581 -21.087  -2.345
  269   2H4     C  24          2H4         C  24  -1.743 -20.786  -0.840
  270    H5     C  24           H5         C  24  -1.424 -21.354  -4.459
  271    H6     C  24           H6         C  24   0.759 -21.379  -5.546
  272    H3T    C  24           H3T        C  24   5.812 -22.682  -5.572
  273   1H2*    C  24          1H2*        C  24   2.465 -22.559  -5.797
  274   2H2*    C  24          2H2*        C  24   3.817 -23.069  -4.798