*HEADER    DNA                                     11-MAR-04   1SNJ              
*TITLE     SOLUTION STRUCTURE OF THE DNA THREE-WAY JUNCTION WITH THE             
*TITLE    2 A/C-STACKED CONFORMATION                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 36-MER;                                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    DNA, THREE-WAY JUNCTION, RESIDUAL DIPOLAR COUPLING,                   
*KEYWDS   2 HOLLIDAY JUNCTION, HAMMERHEAD                                        
*EXPDTA    NMR, 12 STRUCTURES                                                    
*AUTHOR    B.WU, F.GIRARD, B.VAN BUUREN, J.SCHLEUCHER, M.TESSARI,                
*AUTHOR   2 S.WIJMENGA                                                           
*REVDAT   1   05-APR-05 1SNJ    0                                                

{Distance constraints for twj11}
assign (resid 1 and name N4  ) (resid 36 and name  O6  ) 2.91 0.15 0.15
assign (resid 1 and name N3  ) (resid 36 and name  N1  ) 2.95 0.15 0.15
assign (resid 1 and name O2  ) (resid 36 and name  N2  ) 2.86 0.15 0.13
assign (resid 35 and name N4  ) (resid 2 and name  O6  ) 2.91 0.15 0.15
assign (resid 35 and name N3  ) (resid 2 and name  N1  ) 2.95 0.15 0.15
assign (resid 35 and name O2  ) (resid 2 and name  N2  ) 2.86 0.15 0.13
assign (resid 34 and name N6  ) (resid 3 and name  O4  ) 2.95 0.15 0.15
assign (resid 34 and name N1  ) (resid 3 and name  N3  ) 2.82 0.15 0.15
assign (resid 33 and name N4  ) (resid 4 and name  O6  ) 2.91 0.15 0.15
assign (resid 33 and name N3  ) (resid 4 and name  N1  ) 2.95 0.15 0.15
assign (resid 33 and name O2  ) (resid 4 and name  N2  ) 2.86 0.15 0.13
assign (resid 5 and name N4  ) (resid 32 and name  O6  ) 2.91 0.15 0.15
assign (resid 5 and name N3  ) (resid 32 and name  N1  ) 2.95 0.15 0.15
assign (resid 5 and name O2  ) (resid 32 and name  N2  ) 2.86 0.15 0.13
assign (resid 6 and name N6  ) (resid 31 and name  O4  ) 2.95 0.15 0.15
assign (resid 6 and name N1  ) (resid 31 and name  N3  ) 2.82 0.15 0.15
assign (resid 30 and name N4  ) (resid 7 and name  O6  ) 2.91 0.15 0.15
assign (resid 30 and name N3  ) (resid 7 and name  N1  ) 2.95 0.15 0.15
assign (resid 30 and name O2  ) (resid 7 and name  N2  ) 2.86 0.15 0.13
assign (resid 8 and name N4  ) (resid 17 and name  O6  ) 2.91 0.15 0.15
assign (resid 8 and name N3  ) (resid 17 and name  N1  ) 2.95 0.15 0.15
assign (resid 8 and name O2  ) (resid 17 and name  N2  ) 2.86 0.15 0.13
assign (resid 16 and name N4  ) (resid 9 and name  O6  ) 2.91 0.15 0.15
assign (resid 16 and name N3  ) (resid 9 and name  N1  ) 2.95 0.15 0.15
assign (resid 16 and name O2  ) (resid 9 and name  N2  ) 2.86 0.15 0.13
assign (resid 15 and name N4  ) (resid 10 and name  O6  ) 2.91 0.15 0.15
assign (resid 15 and name N3  ) (resid 10 and name  N1  ) 2.95 0.15 0.15
assign (resid 15 and name O2  ) (resid 10 and name  N2  ) 2.86 0.15 0.13
assign (resid 11 and name N4  ) (resid 14 and name  O6  ) 2.91 0.15 0.15
assign (resid 11 and name N3  ) (resid 14 and name  N1  ) 2.95 0.15 0.15
assign (resid 11 and name O2  ) (resid 14 and name  N2  ) 2.86 0.15 0.13
assign (resid 27 and name N4  ) (resid 18 and name  O6  ) 2.91 0.15 0.15
assign (resid 27 and name N3  ) (resid 18 and name  N1  ) 2.95 0.15 0.15
assign (resid 27 and name O2  ) (resid 18 and name  N2  ) 2.86 0.15 0.13
assign (resid 19 and name N4  ) (resid 26 and name  O6  ) 2.91 0.15 0.15
assign (resid 19 and name N3  ) (resid 26 and name  N1  ) 2.95 0.15 0.15
assign (resid 19 and name O2  ) (resid 26 and name  N2  ) 2.86 0.15 0.13
assign (resid 20 and name N6  ) (resid 25 and name  O4  ) 2.95 0.15 0.15
assign (resid 20 and name N1  ) (resid 25 and name  N3  ) 2.82 0.15 0.15
assign (resid 21 and name N4  ) (resid 24 and name  O6  ) 2.91 0.15 0.15
assign (resid 21 and name N3  ) (resid 24 and name  N1  ) 2.95 0.15 0.15
assign (resid 21 and name O2  ) (resid 24 and name  N2  ) 2.86 0.15 0.13

assign  (segid TW11 and resid  1 and name H1'  ) (segid TW11 and resid  1 and name H2'' )  2.81 0.42 0.62
assign  (segid TW11 and resid  1 and name H1'  ) (segid TW11 and resid  1 and name H2'  )  3.39 0.92 0.75
assign  (segid TW11 and resid  1 and name H1'  ) (segid TW11 and resid  1 and name H3'  )  4.47 0.55 0.75
assign  (segid TW11 and resid  1 and name H1'  ) (segid TW11 and resid  1 and name H6   )  3.40 0.46 0.66
assign  (segid TW11 and resid  1 and name H1'  ) (segid TW11 and resid  2 and name H8   )  4.93 0.59 0.79
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  2 and name H2'' )  2.80 0.42 0.74
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  2 and name H2'  )  3.18 0.45 0.65
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  2 and name H3'  )  3.97 0.51 0.78
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  3 and name H6   )  3.95 0.51 1.21
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  2 and name H8   )  3.99 0.51 0.72
assign  (segid TW11 and resid  2 and name H1'  ) (segid TW11 and resid  3 and name H5#  )  4.72 0.57 0.77
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  3 and name H2'' )  2.50 0.50 0.81
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  3 and name H2'  )  3.65 0.48 0.75
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  3 and name H3'  )  4.37 0.95 0.76
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  3 and name H6   )  3.91 0.51 0.71
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  4 and name H8   )  4.04 0.52 1.14
assign  (segid TW11 and resid  3 and name H1'  ) (segid TW11 and resid  3 and name H5#  )  5.07 0.61 0.81
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  4 and name H2'' )  2.42 0.57 0.70
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  4 and name H2'  )  2.90 0.42 0.62
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  4 and name H3'  )  3.44 0.47 0.75
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  5 and name H5   )  4.19 0.93 0.73
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  5 and name H6   )  3.22 0.52 0.72
assign  (segid TW11 and resid  4 and name H1'  ) (segid TW11 and resid  4 and name H8   )  4.14 0.52 1.12
assign  (segid TW11 and resid  5 and name H1'  ) (segid TW11 and resid  5 and name H2'' )  3.10 0.44 0.64
assign  (segid TW11 and resid  5 and name H1'  ) (segid TW11 and resid  5 and name H2'  )  3.53 0.47 0.67
assign  (segid TW11 and resid  5 and name H1'  ) (segid TW11 and resid  5 and name H5   )  4.93 0.65 0.85
assign  (segid TW11 and resid  5 and name H1'  ) (segid TW11 and resid  5 and name H6   )  4.03 0.51 0.71
assign  (segid TW11 and resid  5 and name H1'  ) (segid TW11 and resid  6 and name H8   )  4.86 0.58 0.78
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  6 and name H2   )  5.01 0.63 0.76
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  6 and name H2'' )  2.95 0.43 0.78
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  6 and name H2'  )  3.18 0.45 0.65
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  6 and name H3'  )  4.09 0.52 0.63
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  6 and name H8   )  4.05 0.52 0.72
assign  (segid TW11 and resid  6 and name H1'  ) (segid TW11 and resid  7 and name H8   )  4.07 0.52 1.02
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  7 and name H2'' )  2.94 0.43 0.72
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  7 and name H2'  )  3.47 0.47 0.67
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  7 and name H3'  )  4.27 0.53 0.52
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  8 and name H5   )  4.39 0.54 0.74
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  8 and name H6   )  4.06 0.52 0.72
assign  (segid TW11 and resid  7 and name H1'  ) (segid TW11 and resid  7 and name H8   )  4.13 0.52 1.11
assign  (segid TW11 and resid  8 and name H1'  ) (segid TW11 and resid  8 and name H2'' )  2.86 0.42 0.62
assign  (segid TW11 and resid  8 and name H1'  ) (segid TW11 and resid  8 and name H2'  )  3.41 0.46 1.09
assign  (segid TW11 and resid  8 and name H1'  ) (segid TW11 and resid  8 and name H5   )  4.51 0.55 0.75
assign  (segid TW11 and resid  8 and name H1'  ) (segid TW11 and resid  8 and name H6   )  4.05 0.52 0.72
assign  (segid TW11 and resid  9 and name H1'  ) (segid TW11 and resid  9 and name H2'' )  3.02 0.43 0.63
assign  (segid TW11 and resid  9 and name H1'  ) (segid TW11 and resid  9 and name H2'  )  3.03 0.43 0.63
assign  (segid TW11 and resid  9 and name H1'  ) (segid TW11 and resid  9 and name H3'  )  4.01 0.51 0.77
assign  (segid TW11 and resid  9 and name H1'  ) (segid TW11 and resid  9 and name H8   )  3.70 0.49 0.74
assign  (segid TW11 and resid  9 and name H1'  ) (segid TW11 and resid 10 and name H8   )  3.86 0.50 0.70
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 10 and name H2'' )  2.79 0.42 0.62
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 10 and name H3'  )  4.51 0.77 0.79
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 11 and name H5   )  4.78 0.79 0.73
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 11 and name H6   )  4.45 0.74 0.71
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 10 and name H8   )  3.59 0.48 0.68
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 12 and name H1'  )  4.49 0.54 0.74
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 11 and name H2'' )  2.21 0.58 0.86
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 11 and name H2'  )  3.31 0.46 0.66
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 11 and name H3'  )  4.63 0.78 0.76
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 11 and name H5   )  4.88 0.62 0.82
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 11 and name H6   )  4.21 0.95 0.71
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 12 and name H6   )  3.47 0.47 0.79
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 12 and name H5#  )  3.53 0.47 0.67
assign  (segid TW11 and resid 11 and name H1'  ) (segid TW11 and resid 13 and name H5#  )  4.44 0.61 1.02
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 12 and name H2'' )  2.37 0.53 0.76
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 12 and name H2'  )  3.66 0.48 0.68
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 12 and name H6   )  3.98 0.51 0.71
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 13 and name H6   )  5.05 0.49 0.69
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 12 and name H5#  )  5.02 0.50 0.70
assign  (segid TW11 and resid 10 and name H1'  ) (segid TW11 and resid 12 and name H5#  )  4.98 0.47 0.67 
assign  (segid TW11 and resid 13 and name H1'  ) (segid TW11 and resid 13 and name H2'' )  2.83 0.42 0.62
assign  (segid TW11 and resid 13 and name H1'  ) (segid TW11 and resid 13 and name H2'  )  2.97 0.43 0.63
assign  (segid TW11 and resid 13 and name H1'  ) (segid TW11 and resid 13 and name H3'  )  3.88 0.96 1.09
assign  (segid TW11 and resid 13 and name H1'  ) (segid TW11 and resid 13 and name H6   )  3.83 0.50 0.70
assign  (segid TW11 and resid 14 and name H1'  ) (segid TW11 and resid 14 and name H2'' )  2.92 0.43 1.30
assign  (segid TW11 and resid 14 and name H1'  ) (segid TW11 and resid 14 and name H2'  )  3.17 0.45 0.65
assign  (segid TW11 and resid 14 and name H1'  ) (segid TW11 and resid 15 and name H5   )  4.36 0.54 1.08
assign  (segid TW11 and resid 14 and name H1'  ) (segid TW11 and resid 15 and name H6   )  3.66 0.48 0.68
assign  (segid TW11 and resid 14 and name H1'  ) (segid TW11 and resid 14 and name H8   )  3.94 0.51 1.01
assign  (segid TW11 and resid 15 and name H1'  ) (segid TW11 and resid 15 and name H2'  )  3.48 0.47 1.15
assign  (segid TW11 and resid 15 and name H1'  ) (segid TW11 and resid 15 and name H3'  )  3.98 0.51 0.71
assign  (segid TW11 and resid 15 and name H1'  ) (segid TW11 and resid 16 and name H5   )  4.87 1.25 1.49
assign  (segid TW11 and resid 15 and name H1'  ) (segid TW11 and resid 15 and name H6   )  3.69 0.49 0.69
assign  (segid TW11 and resid 15 and name H1'  ) (segid TW11 and resid 16 and name H6   )  3.76 0.49 0.69
assign  (segid TW11 and resid 16 and name H1'  ) (segid TW11 and resid 16 and name H3'  )  4.13 0.52 0.72
assign  (segid TW11 and resid 16 and name H1'  ) (segid TW11 and resid 16 and name H5   )  4.93 0.53 1.03
assign  (segid TW11 and resid 16 and name H1'  ) (segid TW11 and resid 16 and name H6   )  4.10 0.92 0.88
assign  (segid TW11 and resid 16 and name H1'  ) (segid TW11 and resid 17 and name H8   )  2.99 0.43 0.63
assign  (segid TW11 and resid 17 and name H1'  ) (segid TW11 and resid 17 and name H2'' )  3.20 0.45 0.65
assign  (segid TW11 and resid 17 and name H1'  ) (segid TW11 and resid 17 and name H3'  )  4.05 0.52 1.60
assign  (segid TW11 and resid 17 and name H1'  ) (segid TW11 and resid 30 and name H5   )  4.53 0.55 0.75
assign  (segid TW11 and resid 17 and name H1'  ) (segid TW11 and resid 30 and name H6   )  3.68 0.49 0.69
assign  (segid TW11 and resid 17 and name H1'  ) (segid TW11 and resid 17 and name H8   )  4.02 0.51 1.39
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 18 and name H2'' )  2.80 0.42 1.03
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 18 and name H2'  )  3.21 0.45 0.65
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 18 and name H3'  )  4.08 0.52 0.72
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 19 and name H5   )  4.03 1.15 1.27
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 19 and name H6   )  4.05 0.95 1.02
assign  (segid TW11 and resid 18 and name H1'  ) (segid TW11 and resid 18 and name H8   )  4.25 0.53 1.43
assign  (segid TW11 and resid 19 and name H1'  ) (segid TW11 and resid 19 and name H2'  )  3.65 0.99 0.68
assign  (segid TW11 and resid 19 and name H1'  ) (segid TW11 and resid 19 and name H5   )  4.43 0.55 0.75
assign  (segid TW11 and resid 19 and name H1'  ) (segid TW11 and resid 19 and name H6   )  4.23 0.53 1.46
assign  (segid TW11 and resid 19 and name H1'  ) (segid TW11 and resid 20 and name H8   )  4.26 0.53 0.73
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 20 and name H2   )  5.21 0.61 0.81
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 20 and name H2'' )  2.81 0.42 0.62
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 20 and name H2'  )  3.70 0.49 1.49
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 20 and name H3'  )  4.23 0.99 1.21
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 21 and name H5   )  4.95 0.59 0.79
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 21 and name H6   )  4.94 0.59 0.79
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 20 and name H8   )  3.73 0.49 0.69
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 22 and name H1'  )  4.36 0.54 0.74
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 21 and name H2'  )  3.51 0.47 0.67
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 21 and name H3'  )  4.51 0.55 0.75
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 21 and name H5   )  4.82 0.58 0.78
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 21 and name H6   )  4.31 0.54 1.19
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 22 and name H6   )  3.44 0.47 0.67
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 22 and name H5#  )  3.60 0.48 0.68
assign  (segid TW11 and resid 21 and name H1'  ) (segid TW11 and resid 23 and name H5#  )  4.43 1.34 1.42
assign  (segid TW11 and resid 22 and name H1'  ) (segid TW11 and resid 22 and name H2'' )  2.40 0.51 0.75
assign  (segid TW11 and resid 22 and name H1'  ) (segid TW11 and resid 22 and name H2'  )  3.61 0.48 1.16
assign  (segid TW11 and resid 22 and name H1'  ) (segid TW11 and resid 22 and name H6   )  3.88 0.50 1.17
assign  (segid TW11 and resid 22 and name H1'  ) (segid TW11 and resid 23 and name H6   )  5.04 0.44 0.64
assign  (segid TW11 and resid 22 and name H1'  ) (segid TW11 and resid 22 and name H5#  )  5.00 0.53 0.73
assign  (segid TW11 and resid 20 and name H1'  ) (segid TW11 and resid 22 and name H5#  )  4.01 0.47 0.67 
assign  (segid TW11 and resid 23 and name H1'  ) (segid TW11 and resid 23 and name H2'' )  2.65 0.40 0.60
assign  (segid TW11 and resid 23 and name H1'  ) (segid TW11 and resid 23 and name H2'  )  3.13 0.44 0.64
assign  (segid TW11 and resid 23 and name H1'  ) (segid TW11 and resid 23 and name H3'  )  4.08 1.09 0.83
assign  (segid TW11 and resid 23 and name H1'  ) (segid TW11 and resid 23 and name H6   )  3.81 0.50 1.29
assign  (segid TW11 and resid 20 and name H2   ) (segid TW11 and resid 22 and name H5#  )  3.09 0.50 0.70 
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 24 and name H2'' )  2.94 0.43 1.30
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 24 and name H2'  )  3.74 0.49 1.36
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 24 and name H3'  )  4.21 0.53 0.73
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 25 and name H6   )  3.49 0.47 1.23
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 24 and name H8   )  4.09 0.52 0.72
assign  (segid TW11 and resid 24 and name H1'  ) (segid TW11 and resid 25 and name H5#  )  4.29 0.54 0.74
assign  (segid TW11 and resid 25 and name H1'  ) (segid TW11 and resid 25 and name H2'  )  3.35 0.46 0.66
assign  (segid TW11 and resid 25 and name H1'  ) (segid TW11 and resid 25 and name H3'  )  4.26 0.53 0.73
assign  (segid TW11 and resid 25 and name H1'  ) (segid TW11 and resid 25 and name H6   )  3.99 0.51 1.03
assign  (segid TW11 and resid 25 and name H1'  ) (segid TW11 and resid 26 and name H8   )  4.64 1.05 1.22
assign  (segid TW11 and resid 25 and name H1'  ) (segid TW11 and resid 25 and name H5#  )  5.04 0.61 0.81
assign  (segid TW11 and resid 26 and name H1'  ) (segid TW11 and resid 26 and name H2'' )  2.62 0.40 0.60
assign  (segid TW11 and resid 26 and name H1'  ) (segid TW11 and resid 26 and name H2'  )  2.99 0.43 0.63
assign  (segid TW11 and resid 26 and name H1'  ) (segid TW11 and resid 26 and name H3'  )  4.09 1.29 2.20
assign  (segid TW11 and resid 26 and name H1'  ) (segid TW11 and resid 27 and name H5   )  4.26 0.53 0.73
assign  (segid TW11 and resid 26 and name H1'  ) (segid TW11 and resid 27 and name H6   )  4.24 0.53 1.30
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 27 and name H2'' )  2.48 0.73 0.94
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 27 and name H2'  )  3.54 0.47 0.67
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 27 and name H3'  )  4.92 0.59 1.24
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 27 and name H5   )  5.16 0.61 0.81
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 27 and name H6   )  4.06 0.52 0.72
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 28 and name H6   )  3.96 0.51 0.71
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 28 and name H5#  )  3.53 0.47 0.67
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 29 and name H5#  )  4.99 1.29 1.52
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 28 and name H2'' )  2.95 0.43 0.63
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 28 and name H2'  )  3.15 0.54 0.74
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 28 and name H3'  )  4.10 0.62 0.82
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 28 and name H6   )  4.13 0.52 0.72
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 29 and name H6   )  4.98 0.49 0.59
assign  (segid TW11 and resid 28 and name H1'  ) (segid TW11 and resid 28 and name H5#  )  4.97 0.93 0.71
assign  (segid TW11 and resid 29 and name H1'  ) (segid TW11 and resid 29 and name H2'' )  2.84 0.42 0.62
assign  (segid TW11 and resid 29 and name H1'  ) (segid TW11 and resid 29 and name H2'  )  2.97 0.43 0.63
assign  (segid TW11 and resid 29 and name H1'  ) (segid TW11 and resid 29 and name H3'  )  4.38 0.54 0.74
assign  (segid TW11 and resid 29 and name H1'  ) (segid TW11 and resid 29 and name H6   )  4.10 0.52 1.38
assign  (segid TW11 and resid 30 and name H1'  ) (segid TW11 and resid 30 and name H2'' )  2.75 0.41 1.06
assign  (segid TW11 and resid 30 and name H1'  ) (segid TW11 and resid 30 and name H2'  )  3.65 0.48 0.68
assign  (segid TW11 and resid 30 and name H1'  ) (segid TW11 and resid 30 and name H3'  )  4.38 0.54 0.74
assign  (segid TW11 and resid 30 and name H1'  ) (segid TW11 and resid 30 and name H6   )  3.60 0.48 0.68
assign  (segid TW11 and resid 30 and name H1'  ) (segid TW11 and resid 31 and name H5#  )  5.05 0.60 0.80
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 31 and name H2'' )  2.73 0.41 0.61
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 31 and name H2'  )  3.63 0.48 1.60
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 31 and name H3'  )  4.15 0.52 0.72
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 31 and name H6   )  3.53 0.47 1.16
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 32 and name H8   )  4.07 0.52 1.32
assign  (segid TW11 and resid 31 and name H1'  ) (segid TW11 and resid 31 and name H5#  )  5.06 0.60 0.80
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 32 and name H2'' )  2.77 0.41 0.61
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 32 and name H2'  )  3.46 0.47 0.63
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 32 and name H3'  )  4.06 0.99 1.82
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 33 and name H5   )  4.80 1.27 1.64
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 33 and name H6   )  3.69 0.49 1.10
assign  (segid TW11 and resid 32 and name H1'  ) (segid TW11 and resid 32 and name H8   )  4.08 0.52 1.27
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 33 and name H2'' )  2.87 0.42 1.04
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 33 and name H2'  )  3.88 0.50 0.70
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 33 and name H3'  )  4.72 1.32 1.80
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 33 and name H5   )  4.94 1.48 1.69
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 33 and name H6   )  3.52 0.47 0.67
assign  (segid TW11 and resid 33 and name H1'  ) (segid TW11 and resid 34 and name H8   )  4.52 0.55 0.75
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 34 and name H2   )  5.01 0.60 1.25
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 34 and name H2'' )  2.69 0.41 1.10
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 34 and name H2'  )  3.24 0.45 0.65
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 34 and name H3'  )  3.89 0.50 1.57
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 35 and name H5   )  4.72 1.18 1.18
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 35 and name H6   )  4.40 0.54 0.74
assign  (segid TW11 and resid 34 and name H1'  ) (segid TW11 and resid 34 and name H8   )  3.70 0.49 0.69
assign  (segid TW11 and resid 35 and name H1'  ) (segid TW11 and resid 35 and name H2'' )  2.86 0.42 0.62
assign  (segid TW11 and resid 35 and name H1'  ) (segid TW11 and resid 35 and name H2'  )  3.82 0.50 0.70
assign  (segid TW11 and resid 35 and name H1'  ) (segid TW11 and resid 35 and name H6   )  4.14 0.52 0.72
assign  (segid TW11 and resid 35 and name H1'  ) (segid TW11 and resid 36 and name H8   )  4.94 0.61 0.81
assign  (segid TW11 and resid 36 and name H1'  ) (segid TW11 and resid 36 and name H2'' )  2.41 0.46 1.60
assign  (segid TW11 and resid 36 and name H1'  ) (segid TW11 and resid 36 and name H2'  )  2.42 0.53 0.76
assign  (segid TW11 and resid 36 and name H1'  ) (segid TW11 and resid 36 and name H8   )  3.65 0.48 0.68
assign  (segid TW11 and resid  1 and name H2'' ) (segid TW11 and resid  1 and name H3'  )  3.28 0.45 0.65
assign  (segid TW11 and resid  1 and name H2'' ) (segid TW11 and resid  1 and name H6   )  3.14 0.44 1.26
assign  (segid TW11 and resid  2 and name H2'' ) (segid TW11 and resid  3 and name H6   )  3.40 0.46 1.33
assign  (segid TW11 and resid  2 and name H2'' ) (segid TW11 and resid  2 and name H8   )  3.80 0.44 0.64
assign  (segid TW11 and resid  2 and name H2'' ) (segid TW11 and resid  3 and name H5#  )  3.99 0.51 0.71
assign  (segid TW11 and resid  3 and name H2'' ) (segid TW11 and resid  3 and name H6   )  3.45 0.47 0.67
assign  (segid TW11 and resid  3 and name H2'' ) (segid TW11 and resid  4 and name H8   )  3.37 0.46 0.66
assign  (segid TW11 and resid  3 and name H2'' ) (segid TW11 and resid  3 and name H5#  )  4.66 0.98 1.18
assign  (segid TW11 and resid  4 and name H2'' ) (segid TW11 and resid  5 and name H5   )  3.69 0.49 1.10
assign  (segid TW11 and resid  4 and name H2'' ) (segid TW11 and resid  5 and name H6   )  3.29 0.45 0.65
assign  (segid TW11 and resid  4 and name H2'' ) (segid TW11 and resid  4 and name H8   )  2.92 0.43 0.63
assign  (segid TW11 and resid  5 and name H2'' ) (segid TW11 and resid  5 and name H5   )  5.00 0.53 0.73
assign  (segid TW11 and resid  5 and name H2'' ) (segid TW11 and resid  5 and name H6   )  3.53 0.47 1.22
assign  (segid TW11 and resid  5 and name H2'' ) (segid TW11 and resid  6 and name H8   )  4.07 0.52 0.72
assign  (segid TW11 and resid  6 and name H2'' ) (segid TW11 and resid  6 and name H3'  )  2.98 0.43 0.63
assign  (segid TW11 and resid  6 and name H2'' ) (segid TW11 and resid  6 and name H8   )  3.41 0.46 1.11
assign  (segid TW11 and resid  6 and name H2'' ) (segid TW11 and resid  7 and name H8   )  3.20 0.45 1.16
assign  (segid TW11 and resid  7 and name H2'' ) (segid TW11 and resid  8 and name H5   )  3.95 0.51 1.19
assign  (segid TW11 and resid  7 and name H2'' ) (segid TW11 and resid  8 and name H6   )  3.63 0.48 1.33
assign  (segid TW11 and resid  7 and name H2'' ) (segid TW11 and resid  7 and name H8   )  3.67 0.49 0.69
assign  (segid TW11 and resid  8 and name H2'' ) (segid TW11 and resid  8 and name H5   )  5.04 0.60 0.80
assign  (segid TW11 and resid  8 and name H2'' ) (segid TW11 and resid  8 and name H6   )  3.97 0.51 1.32
assign  (segid TW11 and resid  8 and name H2'' ) (segid TW11 and resid  9 and name H8   )  4.45 0.55 0.75
assign  (segid TW11 and resid  9 and name H2'' ) (segid TW11 and resid  9 and name H8   )  3.82 0.42 0.62
assign  (segid TW11 and resid 10 and name H2'' ) (segid TW11 and resid 11 and name H5   )  3.69 0.49 0.69
assign  (segid TW11 and resid 10 and name H2'' ) (segid TW11 and resid 11 and name H6   )  3.30 0.46 0.66
assign  (segid TW11 and resid 10 and name H2'' ) (segid TW11 and resid 10 and name H8   )  3.83 0.42 0.62
assign  (segid TW11 and resid 11 and name H2'' ) (segid TW11 and resid 11 and name H5   )  4.74 1.22 1.81
assign  (segid TW11 and resid 11 and name H2'' ) (segid TW11 and resid 11 and name H6   )  2.55 0.86 1.49
assign  (segid TW11 and resid 11 and name H2'' ) (segid TW11 and resid 12 and name H6   )  3.43 0.41 1.28
assign  (segid TW11 and resid 12 and name H2'' ) (segid TW11 and resid 12 and name H6   )  3.09 1.03 1.28
assign  (segid TW11 and resid 13 and name H2'' ) (segid TW11 and resid 13 and name H3'  )  2.89 0.42 0.62
assign  (segid TW11 and resid 13 and name H2'' ) (segid TW11 and resid 13 and name H6   )  3.37 0.46 0.66
assign  (segid TW11 and resid 14 and name H2'' ) (segid TW11 and resid 15 and name H5   )  2.92 1.28 2.36
assign  (segid TW11 and resid 14 and name H2'' ) (segid TW11 and resid 14 and name H8   )  3.21 0.45 0.65
assign  (segid TW11 and resid 15 and name H2'' ) (segid TW11 and resid 15 and name H5   )  4.98 0.52 0.72
assign  (segid TW11 and resid 15 and name H2'' ) (segid TW11 and resid 16 and name H5   )  4.30 0.54 0.74
assign  (segid TW11 and resid 16 and name H2'' ) (segid TW11 and resid 16 and name H5   )  5.01 1.06 1.06
assign  (segid TW11 and resid 17 and name H2'' ) (segid TW11 and resid 30 and name H5   )  3.76 0.49 0.69
assign  (segid TW11 and resid 17 and name H2'' ) (segid TW11 and resid 17 and name H8   )  4.20 0.62 1.07
assign  (segid TW11 and resid 18 and name H2'' ) (segid TW11 and resid 19 and name H5   )  4.09 0.52 1.37
assign  (segid TW11 and resid 18 and name H2'' ) (segid TW11 and resid 19 and name H6   )  3.39 0.46 1.12
assign  (segid TW11 and resid 18 and name H2'' ) (segid TW11 and resid 18 and name H8   )  3.59 0.48 1.30
assign  (segid TW11 and resid 19 and name H2'' ) (segid TW11 and resid 19 and name H5   )  5.05 0.53 0.73
assign  (segid TW11 and resid 19 and name H2'' ) (segid TW11 and resid 19 and name H6   )  3.60 0.44 0.64
assign  (segid TW11 and resid 19 and name H2'' ) (segid TW11 and resid 20 and name H8   )  3.40 0.46 0.66
assign  (segid TW11 and resid 20 and name H2'' ) (segid TW11 and resid 21 and name H5   )  4.12 0.52 1.34
assign  (segid TW11 and resid 20 and name H2'' ) (segid TW11 and resid 21 and name H6   )  3.57 0.48 0.68
assign  (segid TW11 and resid 20 and name H2'' ) (segid TW11 and resid 20 and name H8   )  3.08 0.44 0.64
assign  (segid TW11 and resid 21 and name H2'' ) (segid TW11 and resid 21 and name H5   )  4.99 0.46 0.66
assign  (segid TW11 and resid 21 and name H2'' ) (segid TW11 and resid 21 and name H6   )  2.68 0.41 1.21
assign  (segid TW11 and resid 22 and name H2'' ) (segid TW11 and resid 22 and name H6   )  2.78 0.95 1.57
assign  (segid TW11 and resid 23 and name H2'' ) (segid TW11 and resid 23 and name H3'  )  2.89 0.42 0.62
assign  (segid TW11 and resid 23 and name H2'' ) (segid TW11 and resid 23 and name H6   )  4.30 0.44 0.64
assign  (segid TW11 and resid 24 and name H2'' ) (segid TW11 and resid 24 and name H3'  )  3.03 0.43 1.18
assign  (segid TW11 and resid 24 and name H2'' ) (segid TW11 and resid 25 and name H6   )  3.87 0.50 1.38
assign  (segid TW11 and resid 24 and name H2'' ) (segid TW11 and resid 24 and name H8   )  3.24 0.45 0.65
assign  (segid TW11 and resid 24 and name H2'' ) (segid TW11 and resid 25 and name H5#  )  3.91 2.37 1.14
assign  (segid TW11 and resid 25 and name H2'' ) (segid TW11 and resid 25 and name H6   )  3.36 0.46 1.15
assign  (segid TW11 and resid 25 and name H2'' ) (segid TW11 and resid 25 and name H5#  )  5.04 0.57 0.77
assign  (segid TW11 and resid 26 and name H2'' ) (segid TW11 and resid 27 and name H5   )  4.00 0.51 0.71
assign  (segid TW11 and resid 26 and name H2'' ) (segid TW11 and resid 27 and name H6   )  3.40 0.46 1.07
assign  (segid TW11 and resid 26 and name H2'' ) (segid TW11 and resid 26 and name H8   )  3.14 0.44 0.64
assign  (segid TW11 and resid 27 and name H2'' ) (segid TW11 and resid 27 and name H5   )  4.99 0.45 0.65
assign  (segid TW11 and resid 27 and name H2'' ) (segid TW11 and resid 27 and name H6   )  3.80 0.55 1.09
assign  (segid TW11 and resid 28 and name H2'' ) (segid TW11 and resid 28 and name H6   )  4.00 0.42 0.62
assign  (segid TW11 and resid 28 and name H2'' ) (segid TW11 and resid 29 and name H5#  )  4.07 0.45 0.56
assign  (segid TW11 and resid 29 and name H2'' ) (segid TW11 and resid 29 and name H6   )  3.22 0.45 0.65
assign  (segid TW11 and resid 30 and name H2'' ) (segid TW11 and resid 30 and name H5   )  5.16 0.60 0.80
assign  (segid TW11 and resid 30 and name H2'' ) (segid TW11 and resid 30 and name H6   )  3.50 0.42 0.62
assign  (segid TW11 and resid 30 and name H2'' ) (segid TW11 and resid 31 and name H5#  )  4.65 1.17 1.40
assign  (segid TW11 and resid 31 and name H2'' ) (segid TW11 and resid 31 and name H6   )  2.92 0.43 0.63
assign  (segid TW11 and resid 31 and name H2'' ) (segid TW11 and resid 32 and name H8   )  3.01 0.43 0.63
assign  (segid TW11 and resid 32 and name H2'' ) (segid TW11 and resid 33 and name H5   )  3.73 0.49 1.10
assign  (segid TW11 and resid 32 and name H2'' ) (segid TW11 and resid 32 and name H8   )  3.80 0.42 0.62
assign  (segid TW11 and resid 33 and name H2'' ) (segid TW11 and resid 33 and name H5   )  4.31 0.95 1.15
assign  (segid TW11 and resid 33 and name H2'' ) (segid TW11 and resid 33 and name H6   )  3.15 0.44 1.33
assign  (segid TW11 and resid 33 and name H2'' ) (segid TW11 and resid 34 and name H8   )  3.47 1.35 1.31
assign  (segid TW11 and resid 34 and name H2'' ) (segid TW11 and resid 35 and name H5   )  4.09 0.52 0.72
assign  (segid TW11 and resid 34 and name H2'' ) (segid TW11 and resid 35 and name H6   )  3.08 0.44 1.09
assign  (segid TW11 and resid 34 and name H2'' ) (segid TW11 and resid 34 and name H8   )  2.99 1.01 0.63
assign  (segid TW11 and resid 35 and name H2'' ) (segid TW11 and resid 35 and name H5   )  4.58 0.96 1.17
assign  (segid TW11 and resid 35 and name H2'' ) (segid TW11 and resid 35 and name H6   )  3.71 0.49 0.69
assign  (segid TW11 and resid 36 and name H2'' ) (segid TW11 and resid 36 and name H3'  )  2.97 0.43 0.63
assign  (segid TW11 and resid 36 and name H2'' ) (segid TW11 and resid 36 and name H8   )  3.80 0.54 0.91
assign  (segid TW11 and resid  1 and name H2'  ) (segid TW11 and resid  1 and name H3'  )  2.73 0.41 1.23
assign  (segid TW11 and resid  1 and name H2'  ) (segid TW11 and resid  1 and name H6   )  2.76 0.41 1.14
assign  (segid TW11 and resid  1 and name H2'  ) (segid TW11 and resid  2 and name H8   )  4.41 0.54 1.81
assign  (segid TW11 and resid  2 and name H2'  ) (segid TW11 and resid  3 and name H6   )  4.46 0.55 0.75
assign  (segid TW11 and resid  2 and name H2'  ) (segid TW11 and resid  2 and name H8   )  2.49 0.60 0.94
assign  (segid TW11 and resid  2 and name H2'  ) (segid TW11 and resid  3 and name H5#  )  4.08 0.52 1.89
assign  (segid TW11 and resid  3 and name H2'  ) (segid TW11 and resid  3 and name H6   )  2.83 0.82 1.61
assign  (segid TW11 and resid  4 and name H2'  ) (segid TW11 and resid  5 and name H5   )  4.12 0.52 1.40
assign  (segid TW11 and resid  4 and name H2'  ) (segid TW11 and resid  5 and name H6   )  4.21 0.53 0.73
assign  (segid TW11 and resid  4 and name H2'  ) (segid TW11 and resid  4 and name H8   )  2.69 0.41 1.23
assign  (segid TW11 and resid  5 and name H2'  ) (segid TW11 and resid  5 and name H5   )  3.87 0.50 0.70
assign  (segid TW11 and resid  5 and name H2'  ) (segid TW11 and resid  5 and name H6   )  2.60 1.31 1.24
assign  (segid TW11 and resid  5 and name H2'  ) (segid TW11 and resid  6 and name H8   )  5.05 1.08 1.48
assign  (segid TW11 and resid  6 and name H2'  ) (segid TW11 and resid  6 and name H8   )  2.71 0.41 1.17
assign  (segid TW11 and resid  6 and name H2'  ) (segid TW11 and resid  7 and name H8   )  3.49 0.47 1.13
assign  (segid TW11 and resid  7 and name H2'  ) (segid TW11 and resid  8 and name H5   )  4.63 0.56 1.41
assign  (segid TW11 and resid  7 and name H2'  ) (segid TW11 and resid  8 and name H6   )  4.73 0.99 1.73
assign  (segid TW11 and resid  7 and name H2'  ) (segid TW11 and resid  7 and name H8   )  2.69 0.41 0.61
assign  (segid TW11 and resid  8 and name H2'  ) (segid TW11 and resid  8 and name H5   )  4.24 1.27 0.81
assign  (segid TW11 and resid  8 and name H2'  ) (segid TW11 and resid  8 and name H6   )  3.08 0.44 1.56
assign  (segid TW11 and resid  8 and name H2'  ) (segid TW11 and resid  9 and name H8   )  4.74 0.57 1.22
assign  (segid TW11 and resid  9 and name H2'  ) (segid TW11 and resid  9 and name H8   )  2.89 0.42 1.29
assign  (segid TW11 and resid 10 and name H2'  ) (segid TW11 and resid 11 and name H5   )  4.13 0.52 0.72
assign  (segid TW11 and resid 10 and name H2'  ) (segid TW11 and resid 11 and name H6   )  3.23 0.45 1.22
assign  (segid TW11 and resid 10 and name H2'  ) (segid TW11 and resid 10 and name H8   )  2.74 0.41 1.09
assign  (segid TW11 and resid 11 and name H2'  ) (segid TW11 and resid 11 and name H5   )  3.89 0.50 0.70
assign  (segid TW11 and resid 11 and name H2'  ) (segid TW11 and resid 11 and name H6   )  2.53 0.58 0.95
assign  (segid TW11 and resid 12 and name H2'  ) (segid TW11 and resid 12 and name H6   )  3.20 0.45 1.16
assign  (segid TW11 and resid 13 and name H2'  ) (segid TW11 and resid 13 and name H3'  )  2.74 0.41 1.06
assign  (segid TW11 and resid 13 and name H2'  ) (segid TW11 and resid 13 and name H6   )  2.69 0.41 0.61
assign  (segid TW11 and resid 14 and name H2'  ) (segid TW11 and resid 15 and name H5   )  2.90 0.42 0.62
assign  (segid TW11 and resid 14 and name H2'  ) (segid TW11 and resid 14 and name H8   )  2.68 0.41 1.08
assign  (segid TW11 and resid 15 and name H2'  ) (segid TW11 and resid 15 and name H5   )  3.94 0.51 0.71
assign  (segid TW11 and resid 15 and name H2'  ) (segid TW11 and resid 16 and name H5   )  3.73 0.49 0.69
assign  (segid TW11 and resid 16 and name H2'  ) (segid TW11 and resid 16 and name H5   )  3.94 0.51 0.71
assign  (segid TW11 and resid 17 and name H2'  ) (segid TW11 and resid 17 and name H3'  )  2.99 1.05 0.63
assign  (segid TW11 and resid 17 and name H2'  ) (segid TW11 and resid 30 and name H5   )  4.16 0.60 0.80
assign  (segid TW11 and resid 17 and name H2'  ) (segid TW11 and resid 17 and name H8   )  3.08 0.44 1.06
assign  (segid TW11 and resid 18 and name H2'  ) (segid TW11 and resid 19 and name H5   )  4.04 1.07 1.40
assign  (segid TW11 and resid 18 and name H2'  ) (segid TW11 and resid 19 and name H6   )  3.82 0.50 0.70
assign  (segid TW11 and resid 18 and name H2'  ) (segid TW11 and resid 18 and name H8   )  2.77 0.41 0.61
assign  (segid TW11 and resid 19 and name H2'  ) (segid TW11 and resid 19 and name H6   )  2.59 0.64 1.15
assign  (segid TW11 and resid 19 and name H2'  ) (segid TW11 and resid 20 and name H8   )  3.43 0.47 0.67
assign  (segid TW11 and resid 20 and name H2'  ) (segid TW11 and resid 21 and name H5   )  3.64 0.48 0.68
assign  (segid TW11 and resid 20 and name H2'  ) (segid TW11 and resid 21 and name H6   )  3.75 0.49 0.69
assign  (segid TW11 and resid 20 and name H2'  ) (segid TW11 and resid 20 and name H8   )  2.62 0.40 1.01
assign  (segid TW11 and resid 21 and name H2'  ) (segid TW11 and resid 21 and name H5   )  4.50 0.41 0.61
assign  (segid TW11 and resid 21 and name H2'  ) (segid TW11 and resid 21 and name H6   )  2.81 0.42 1.27
assign  (segid TW11 and resid 22 and name H2'  ) (segid TW11 and resid 22 and name H6   )  2.87 0.42 0.62
assign  (segid TW11 and resid 23 and name H2'  ) (segid TW11 and resid 23 and name H3'  )  2.75 0.41 1.06
assign  (segid TW11 and resid 23 and name H2'  ) (segid TW11 and resid 23 and name H6   )  2.83 0.42 1.10
assign  (segid TW11 and resid 24 and name H2'  ) (segid TW11 and resid 24 and name H3'  )  2.77 0.41 0.61
assign  (segid TW11 and resid 24 and name H2'  ) (segid TW11 and resid 25 and name H6   )  3.07 0.44 1.06
assign  (segid TW11 and resid 24 and name H2'  ) (segid TW11 and resid 24 and name H8   )  2.61 0.40 1.01
assign  (segid TW11 and resid 24 and name H2'  ) (segid TW11 and resid 25 and name H5#  )  3.86 0.50 0.70
assign  (segid TW11 and resid 25 and name H2'  ) (segid TW11 and resid 25 and name H6   )  2.71 0.41 1.33
assign  (segid TW11 and resid 26 and name H2'  ) (segid TW11 and resid 27 and name H5   )  3.74 0.49 0.69
assign  (segid TW11 and resid 26 and name H2'  ) (segid TW11 and resid 27 and name H6   )  3.74 0.49 0.69
assign  (segid TW11 and resid 26 and name H2'  ) (segid TW11 and resid 26 and name H8   )  2.47 0.55 0.87
assign  (segid TW11 and resid 27 and name H2'  ) (segid TW11 and resid 27 and name H5   )  5.28 1.11 1.31
assign  (segid TW11 and resid 27 and name H2'  ) (segid TW11 and resid 27 and name H6   )  3.82 2.54 1.97
assign  (segid TW11 and resid 28 and name H2'  ) (segid TW11 and resid 28 and name H6   )  3.39 0.96 1.90
assign  (segid TW11 and resid 29 and name H2'  ) (segid TW11 and resid 29 and name H6   )  2.93 0.43 1.04
assign  (segid TW11 and resid 30 and name H2'  ) (segid TW11 and resid 30 and name H5   )  4.07 0.52 0.72
assign  (segid TW11 and resid 30 and name H2'  ) (segid TW11 and resid 30 and name H6   )  2.69 0.41 1.52
assign  (segid TW11 and resid 30 and name H2'  ) (segid TW11 and resid 31 and name H5#  )  3.80 0.50 0.70
assign  (segid TW11 and resid 31 and name H2'  ) (segid TW11 and resid 31 and name H6   )  2.61 0.40 1.29
assign  (segid TW11 and resid 31 and name H2'  ) (segid TW11 and resid 31 and name H5#  )  4.01 0.51 0.71
assign  (segid TW11 and resid 32 and name H2'  ) (segid TW11 and resid 33 and name H5   )  4.12 0.52 1.40
assign  (segid TW11 and resid 32 and name H2'  ) (segid TW11 and resid 32 and name H8   )  2.69 0.41 1.23
assign  (segid TW11 and resid 33 and name H2'  ) (segid TW11 and resid 33 and name H5   )  3.97 0.51 0.71
assign  (segid TW11 and resid 33 and name H2'  ) (segid TW11 and resid 33 and name H6   )  2.67 0.41 1.39
assign  (segid TW11 and resid 33 and name H2'  ) (segid TW11 and resid 34 and name H8   )  3.25 1.28 0.65
assign  (segid TW11 and resid 34 and name H2'  ) (segid TW11 and resid 35 and name H5   )  3.40 0.91 0.66
assign  (segid TW11 and resid 34 and name H2'  ) (segid TW11 and resid 35 and name H6   )  3.93 1.07 2.31
assign  (segid TW11 and resid 34 and name H2'  ) (segid TW11 and resid 34 and name H8   )  2.27 1.17 1.12
assign  (segid TW11 and resid 35 and name H2'  ) (segid TW11 and resid 35 and name H5   )  4.19 0.53 0.73
assign  (segid TW11 and resid 35 and name H2'  ) (segid TW11 and resid 35 and name H6   )  2.86 0.42 1.36
assign  (segid TW11 and resid 36 and name H2'  ) (segid TW11 and resid 36 and name H3'  )  3.09 0.44 0.64
assign  (segid TW11 and resid 36 and name H2'  ) (segid TW11 and resid 36 and name H8   )  3.29 0.46 0.66
assign  (segid TW11 and resid  1 and name H3'  ) (segid TW11 and resid  1 and name H6   )  4.03 0.51 1.26
assign  (segid TW11 and resid  1 and name H3'  ) (segid TW11 and resid  2 and name H8   )  4.56 0.56 0.76
assign  (segid TW11 and resid  2 and name H3'  ) (segid TW11 and resid  3 and name H6   )  4.95 0.59 0.79
assign  (segid TW11 and resid  2 and name H3'  ) (segid TW11 and resid  2 and name H8   )  3.81 0.50 1.35
assign  (segid TW11 and resid  2 and name H3'  ) (segid TW11 and resid  3 and name H5#  )  4.94 1.18 1.35
assign  (segid TW11 and resid  3 and name H3'  ) (segid TW11 and resid  3 and name H6   )  4.12 0.52 0.72
assign  (segid TW11 and resid  3 and name H3'  ) (segid TW11 and resid  4 and name H8   )  4.89 0.58 0.78
assign  (segid TW11 and resid  4 and name H3'  ) (segid TW11 and resid  5 and name H5   )  4.82 1.08 0.78
assign  (segid TW11 and resid  4 and name H3'  ) (segid TW11 and resid  5 and name H6   )  4.81 0.58 0.78
assign  (segid TW11 and resid 34 and name H3'  ) (segid TW11 and resid 35 and name H6   )  4.92 1.07 0.79
assign  (segid TW11 and resid  4 and name H3'  ) (segid TW11 and resid  4 and name H8   )  3.82 0.50 1.24
assign  (segid TW11 and resid  6 and name H3'  ) (segid TW11 and resid  6 and name H8   )  3.90 0.50 1.87
assign  (segid TW11 and resid  6 and name H3'  ) (segid TW11 and resid  7 and name H8   )  4.39 0.54 1.62
assign  (segid TW11 and resid  7 and name H3'  ) (segid TW11 and resid  8 and name H6   )  4.83 1.07 0.78
assign  (segid TW11 and resid  7 and name H3'  ) (segid TW11 and resid  7 and name H8   )  4.75 0.98 1.18
assign  (segid TW11 and resid  7 and name H3'  ) (segid TW11 and resid  7 and name H8   )  4.10 0.52 0.72
assign  (segid TW11 and resid  9 and name H3'  ) (segid TW11 and resid  9 and name H8   )  3.87 0.50 1.13
assign  (segid TW11 and resid  9 and name H3'  ) (segid TW11 and resid 10 and name H8   )  4.64 0.56 0.76
assign  (segid TW11 and resid 10 and name H3'  ) (segid TW11 and resid 11 and name H5   )  4.92 1.06 1.26
assign  (segid TW11 and resid 10 and name H3'  ) (segid TW11 and resid 11 and name H6   )  4.64 0.56 0.76
assign  (segid TW11 and resid 10 and name H3'  ) (segid TW11 and resid 10 and name H8   )  3.72 0.49 0.69
assign  (segid TW11 and resid 22 and name H3'  ) (segid TW11 and resid 22 and name H1'  )  4.66 0.98 0.77
assign  (segid TW11 and resid 11 and name H3'  ) (segid TW11 and resid 11 and name H6   )  4.50 0.55 0.75
assign  (segid TW11 and resid 12 and name H3'  ) (segid TW11 and resid 12 and name H6   )  4.15 1.02 1.83
assign  (segid TW11 and resid 12 and name H3'  ) (segid TW11 and resid 13 and name H5#  )  4.07 0.46 0.54
assign  (segid TW11 and resid 13 and name H3'  ) (segid TW11 and resid 13 and name H6   )  4.16 0.53 1.30
assign  (segid TW11 and resid 13 and name H3'  ) (segid TW11 and resid 13 and name H5#  )  4.30 0.54 0.74
assign  (segid TW11 and resid 15 and name H3'  ) (segid TW11 and resid 16 and name H5   )  4.97 0.60 0.80
assign  (segid TW11 and resid 15 and name H3'  ) (segid TW11 and resid 15 and name H6   )  3.55 0.48 0.68
assign  (segid TW11 and resid 15 and name H3'  ) (segid TW11 and resid 16 and name H6   )  3.94 0.51 0.71
assign  (segid TW11 and resid 16 and name H3'  ) (segid TW11 and resid 16 and name H6   )  4.25 1.10 1.38
assign  (segid TW11 and resid 17 and name H3'  ) (segid TW11 and resid 30 and name H5   )  4.98 0.62 0.82
assign  (segid TW11 and resid 17 and name H3'  ) (segid TW11 and resid 17 and name H8   )  3.70 0.49 0.69
assign  (segid TW11 and resid 18 and name H3'  ) (segid TW11 and resid 19 and name H5   )  4.18 0.53 0.73
assign  (segid TW11 and resid 18 and name H3'  ) (segid TW11 and resid 19 and name H6   )  5.04 1.03 0.79
assign  (segid TW11 and resid 18 and name H3'  ) (segid TW11 and resid 18 and name H8   )  4.04 0.52 1.35
assign  (segid TW11 and resid 19 and name H3'  ) (segid TW11 and resid 19 and name H6   )  4.04 0.52 1.28
assign  (segid TW11 and resid 19 and name H3'  ) (segid TW11 and resid 20 and name H8   )  4.85 0.58 0.78
assign  (segid TW11 and resid 20 and name H3'  ) (segid TW11 and resid 21 and name H5   )  4.30 0.54 0.74
assign  (segid TW11 and resid 20 and name H3'  ) (segid TW11 and resid 21 and name H6   )  4.61 0.56 0.76
assign  (segid TW11 and resid 20 and name H3'  ) (segid TW11 and resid 20 and name H8   )  3.44 0.47 0.67
assign  (segid TW11 and resid 21 and name H3'  ) (segid TW11 and resid 21 and name H6   )  4.49 1.34 1.54
assign  (segid TW11 and resid 22 and name H3'  ) (segid TW11 and resid 22 and name H6   )  4.56 0.56 0.76
assign  (segid TW11 and resid 22 and name H3'  ) (segid TW11 and resid 23 and name H5#  )  4.09 0.48 0.85
assign  (segid TW11 and resid 23 and name H3'  ) (segid TW11 and resid 23 and name H6   )  4.08 0.52 1.23
assign  (segid TW11 and resid 23 and name H3'  ) (segid TW11 and resid 23 and name H5#  )  4.36 0.54 0.74
assign  (segid TW11 and resid 24 and name H3'  ) (segid TW11 and resid 25 and name H6   )  4.96 0.61 0.81
assign  (segid TW11 and resid 24 and name H3'  ) (segid TW11 and resid 24 and name H8   )  3.87 0.50 1.11
assign  (segid TW11 and resid 24 and name H3'  ) (segid TW11 and resid 25 and name H5#  )  4.96 1.17 0.81
assign  (segid TW11 and resid 25 and name H3'  ) (segid TW11 and resid 25 and name H6   )  3.68 0.49 0.69
assign  (segid TW11 and resid 25 and name H3'  ) (segid TW11 and resid 26 and name H8   )  5.08 0.60 0.80
assign  (segid TW11 and resid 26 and name H3'  ) (segid TW11 and resid 27 and name H5   )  4.50 1.01 0.75
assign  (segid TW11 and resid 26 and name H3'  ) (segid TW11 and resid 26 and name H8   )  3.67 0.49 1.67
assign  (segid TW11 and resid 27 and name H3'  ) (segid TW11 and resid 27 and name H6   )  4.80 1.05 1.46
assign  (segid TW11 and resid 28 and name H3'  ) (segid TW11 and resid 28 and name H6   )  4.92 0.61 0.81
assign  (segid TW11 and resid 28 and name H3'  ) (segid TW11 and resid 29 and name H5#  )  4.07 0.46 0.54
assign  (segid TW11 and resid 29 and name H3'  ) (segid TW11 and resid 29 and name H6   )  3.82 0.50 0.70
assign  (segid TW11 and resid 30 and name H3'  ) (segid TW11 and resid 30 and name H6   )  3.54 0.47 1.17
assign  (segid TW11 and resid 30 and name H3'  ) (segid TW11 and resid 31 and name H5#  )  3.82 0.50 0.70
assign  (segid TW11 and resid 31 and name H3'  ) (segid TW11 and resid 31 and name H6   )  3.93 0.51 1.50
assign  (segid TW11 and resid 31 and name H3'  ) (segid TW11 and resid 32 and name H8   )  4.94 0.59 0.79
assign  (segid TW11 and resid 31 and name H3'  ) (segid TW11 and resid 31 and name H5#  )  4.92 0.62 0.82
assign  (segid TW11 and resid 32 and name H3'  ) (segid TW11 and resid 33 and name H5   )  4.82 1.09 0.78
assign  (segid TW11 and resid 32 and name H3'  ) (segid TW11 and resid 33 and name H6   )  4.77 0.57 0.77
assign  (segid TW11 and resid 32 and name H3'  ) (segid TW11 and resid 32 and name H8   )  3.82 0.50 1.24
assign  (segid TW11 and resid 33 and name H3'  ) (segid TW11 and resid 33 and name H6   )  4.10 0.52 1.28
assign  (segid TW11 and resid 33 and name H3'  ) (segid TW11 and resid 34 and name H8   )  4.74 0.57 0.77
assign  (segid TW11 and resid 34 and name H3'  ) (segid TW11 and resid 35 and name H5   )  5.01 1.29 1.49
assign  (segid TW11 and resid 34 and name H3'  ) (segid TW11 and resid 34 and name H8   )  3.40 0.46 0.66
assign  (segid TW11 and resid 36 and name H3'  ) (segid TW11 and resid 36 and name H8   )  3.47 0.47 0.67
assign  (segid TW11 and resid 11 and name H5   ) (segid TW11 and resid 13 and name H5#  )  4.38 1.17 1.16
assign  (segid TW11 and resid 15 and name H5   ) (segid TW11 and resid 16 and name H5   )  4.92 0.59 0.79
assign  (segid TW11 and resid 21 and name H5   ) (segid TW11 and resid 23 and name H5#  )  4.49 1.33 1.34
assign  (segid TW11 and resid 27 and name H5   ) (segid TW11 and resid 29 and name H5#  )  4.38 1.17 1.16
assign  (segid TW11 and resid 30 and name H5   ) (segid TW11 and resid 31 and name H5#  )  4.56 0.56 0.76
assign  (segid TW11 and resid  1 and name H6   ) (segid TW11 and resid  2 and name H8   )  5.00 0.63 0.83
assign  (segid TW11 and resid  3 and name H6   ) (segid TW11 and resid  4 and name H8   )  4.80 0.58 0.78
assign  (segid TW11 and resid  5 and name H6   ) (segid TW11 and resid  6 and name H8   )  5.05 0.63 0.83
assign  (segid TW11 and resid  8 and name H6   ) (segid TW11 and resid  9 and name H8   )  5.01 0.65 0.85
assign  (segid TW11 and resid 11 and name H6   ) (segid TW11 and resid 13 and name H5#  )  4.02 0.94 1.23
assign  (segid TW11 and resid 15 and name H6   ) (segid TW11 and resid 16 and name H5   )  3.43 0.47 0.67
assign  (segid TW11 and resid 16 and name H6   ) (segid TW11 and resid 17 and name H8   )  4.55 0.56 0.76
assign  (segid TW11 and resid 19 and name H6   ) (segid TW11 and resid 20 and name H8   )  4.70 0.57 0.77
assign  (segid TW11 and resid 21 and name H6   ) (segid TW11 and resid 23 and name H5#  )  4.30 1.08 1.35
assign  (segid TW11 and resid 22 and name H6   ) (segid TW11 and resid 23 and name H6   )  5.02 0.61 0.81
assign  (segid TW11 and resid 25 and name H6   ) (segid TW11 and resid 26 and name H8   )  4.75 0.57 1.52
assign  (segid TW11 and resid 27 and name H6   ) (segid TW11 and resid 29 and name H5#  )  4.26 0.61 0.81
assign  (segid TW11 and resid 30 and name H6   ) (segid TW11 and resid 31 and name H5#  )  3.82 0.50 0.70
assign  (segid TW11 and resid 31 and name H6   ) (segid TW11 and resid 32 and name H8   )  4.23 0.53 0.73
assign  (segid TW11 and resid 33 and name H6   ) (segid TW11 and resid 34 and name H8   )  5.06 1.17 0.82
assign  (segid TW11 and resid 35 and name H6   ) (segid TW11 and resid 36 and name H8   )  4.45 0.55 0.75
assign  (segid TW11 and resid  2 and name H8   ) (segid TW11 and resid  3 and name H6   )  4.57 0.56 0.76
assign  (segid TW11 and resid  2 and name H8   ) (segid TW11 and resid  3 and name H5#  )  3.75 0.49 0.69
assign  (segid TW11 and resid  4 and name H8   ) (segid TW11 and resid  5 and name H5   )  4.11 0.52 0.72
assign  (segid TW11 and resid  4 and name H8   ) (segid TW11 and resid  5 and name H6   )  4.80 1.07 0.78
assign  (segid TW11 and resid  6 and name H8   ) (segid TW11 and resid  7 and name H8   )  4.58 0.56 1.35
assign  (segid TW11 and resid  7 and name H8   ) (segid TW11 and resid  8 and name H5   )  4.56 0.56 0.76
assign  (segid TW11 and resid  7 and name H8   ) (segid TW11 and resid  8 and name H6   )  5.06 0.60 0.80
assign  (segid TW11 and resid  9 and name H8   ) (segid TW11 and resid 10 and name H8   )  5.00 1.00 0.80
assign  (segid TW11 and resid 10 and name H8   ) (segid TW11 and resid 11 and name H5   )  4.26 0.53 1.18
assign  (segid TW11 and resid 10 and name H8   ) (segid TW11 and resid 11 and name H6   )  4.91 0.58 1.34
assign  (segid TW11 and resid 14 and name H8   ) (segid TW11 and resid 15 and name H5   )  4.42 0.55 0.75
assign  (segid TW11 and resid 14 and name H8   ) (segid TW11 and resid 15 and name H6   )  4.32 0.54 0.74
assign  (segid TW11 and resid 17 and name H8   ) (segid TW11 and resid 30 and name H5   )  4.27 0.53 0.73
assign  (segid TW11 and resid 18 and name H8   ) (segid TW11 and resid 19 and name H5   )  4.57 0.56 1.51
assign  (segid TW11 and resid 18 and name H8   ) (segid TW11 and resid 19 and name H6   )  4.93 1.07 0.79
assign  (segid TW11 and resid 20 and name H8   ) (segid TW11 and resid 21 and name H5   )  3.83 0.50 0.70
assign  (segid TW11 and resid 20 and name H8   ) (segid TW11 and resid 21 and name H6   )  4.75 0.57 1.40
assign  (segid TW11 and resid 24 and name H8   ) (segid TW11 and resid 25 and name H6   )  5.04 1.06 0.80
assign  (segid TW11 and resid 24 and name H8   ) (segid TW11 and resid 25 and name H5#  )  3.95 0.51 0.71
assign  (segid TW11 and resid 26 and name H8   ) (segid TW11 and resid 27 and name H5   )  4.00 0.51 1.17
assign  (segid TW11 and resid 26 and name H8   ) (segid TW11 and resid 27 and name H6   )  4.74 0.57 0.77
assign  (segid TW11 and resid 32 and name H8   ) (segid TW11 and resid 33 and name H5   )  4.11 0.52 0.72
assign  (segid TW11 and resid 32 and name H8   ) (segid TW11 and resid 33 and name H6   )  4.60 0.56 1.47
assign  (segid TW11 and resid 34 and name H8   ) (segid TW11 and resid 35 and name H5   )  3.78 0.93 0.69
assign  (segid TW11 and resid 34 and name H8   ) (segid TW11 and resid 35 and name H6   )  4.59 1.08 1.99
assign  (segid TW11 and resid 35 and name H1'  ) (segid TW11 and resid 35 and name H5   )  4.98 0.68 0.68
assign  (segid TW11 and resid 12 and name H1'  ) (segid TW11 and resid 13 and name H6   )  4.96 0.45 0.54
assign  (segid TW11 and resid 21 and name H2'' ) (segid TW11 and resid 22 and name H6   )  3.43 0.41 1.28
assign  (segid TW11 and resid 27 and name H1'  ) (segid TW11 and resid 28 and name H1'  )  4.59 0.54 0.74
assign  (segid TW11 and resid 29 and name H2'' ) (segid TW11 and resid 29 and name H3'  )  2.89 0.42 0.62
assign  (segid TW11 and resid 29 and name H2'  ) (segid TW11 and resid 29 and name H3'  )  2.74 0.41 1.06
assign  (segid TW11 and resid 29 and name H3'  ) (segid TW11 and resid 29 and name H5#  )  4.56 0.54 0.74 
assign  (segid TW11 and resid  8 and name H1'  ) (segid TW11 and resid  9 and name H8   )  4.99 0.35 0.55 
assign  (segid TW11 and resid  1 and name H2'' ) (segid TW11 and resid  2 and name H8   )  3.61 0.65 0.55
assign  (segid TW11 and resid  9 and name H2'' ) (segid TW11 and resid 10 and name H8   )  2.54 0.55 0.65
assign  (segid TW11 and resid 14 and name H2'' ) (segid TW11 and resid 15 and name H6   )  2.48 0.75 0.53
assign  (segid TW11 and resid 15 and name H2'' ) (segid TW11 and resid 16 and name H6   )  2.55 0.54 0.51
assign  (segid TW11 and resid 16 and name H2'' ) (segid TW11 and resid 17 and name H8   )  2.44 0.54 0.56
assign  (segid TW11 and resid 17 and name H2'' ) (segid TW11 and resid 30 and name H6   )  3.22 0.53 0.45
assign  (segid TW11 and resid 25 and name H2'' ) (segid TW11 and resid 26 and name H8   )  2.77 0.54 0.57
assign  (segid TW11 and resid 30 and name H2'' ) (segid TW11 and resid 31 and name H6   )  3.42 0.55 0.56
assign  (segid TW11 and resid 32 and name H2'' ) (segid TW11 and resid 33 and name H6   )  2.52 0.56 0.54
assign  (segid TW11 and resid 35 and name H2'' ) (segid TW11 and resid 36 and name H8   )  2.56 0.58 0.53
assign  (segid TW11 and resid  3 and name H2'  ) (segid TW11 and resid  4 and name H8   )  3.33 0.59 0.52
assign  (segid TW11 and resid  9 and name H2'  ) (segid TW11 and resid 10 and name H8   )  3.60 0.52 0.51
assign  (segid TW11 and resid 14 and name H2'  ) (segid TW11 and resid 15 and name H6   )  2.94 0.53 0.59
assign  (segid TW11 and resid 15 and name H2'  ) (segid TW11 and resid 16 and name H6   )  3.26 0.50 0.58
assign  (segid TW11 and resid 16 and name H2'  ) (segid TW11 and resid 17 and name H8   )  3.48 0.52 0.57
assign  (segid TW11 and resid 17 and name H2'  ) (segid TW11 and resid 30 and name H6   )  4.29 0.52 0.56
assign  (segid TW11 and resid 25 and name H2'  ) (segid TW11 and resid 26 and name H8   )  2.81 0.58 0.53
assign  (segid TW11 and resid 30 and name H2'  ) (segid TW11 and resid 31 and name H6   )  3.01 0.57 0.52
assign  (segid TW11 and resid 31 and name H2'  ) (segid TW11 and resid 32 and name H8   )  3.10 0.54 0.53
assign  (segid TW11 and resid 32 and name H2'  ) (segid TW11 and resid 33 and name H6   )  3.77 0.55 0.52
assign  (segid TW11 and resid 35 and name H2'  ) (segid TW11 and resid 36 and name H8   )  3.02 0.65 0.53

{ Planarity constraints for twj11 }
set message=normal echo=on end
restraints plane
group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 1 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 36 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 2 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 35 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 3 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 34 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 4 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 33 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 5 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 32 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 6 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 31 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 7 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 30 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 8 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 17 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 9 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 16 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 10 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 15 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 11 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 14 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 18 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 27 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 19 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 26 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 20 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 25 ))
  weight=2.0
end

group
  selection=((not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 21 )
   or (not( name P or name O1P or name O2P or name O5' or name H5T
  or name O5T or name C5' or name H5' or name H5'' or name C4'
  or name H4' or name O4' or name C1' or name H1' or name C2'
  or name H2'' or name O2' or name H2' or name C3' or name H3'
  or name O3' or name H3T) and residue 24 ))
  weight=2.0
end


end

set message=normal echo=off end

{Dihedral constraints for twj11}
set echo=on message=normal end
restraints dihedral 
evaluate ($dih_force=1)
evaluate ($dih_value_alpha=-46)
evaluate ($dih_value_beta=-147)
evaluate ($dih_value_chi=-98)
evaluate ($dih_value_delta=157)
evaluate ($dih_value_epsilon=155)
evaluate ($dih_value_zeta=-96)
evaluate ($dih_value_gamma=36)
evaluate ($dih_value_V0=-4)
evaluate ($dih_value_V1=25)
evaluate ($dih_value_V2=-35)
evaluate ($dih_value_V3=33)
evaluate ($dih_value_V4=-18)
evaluate ($dih_range_alpha=50)
evaluate ($dih_range_beta=50)
evaluate ($dih_range_delta=50)
evaluate ($dih_range_epsilon=50)
evaluate ($dih_range_zeta=50)
evaluate ($dih_range_gamma=30)
evaluate ($dih_range_chi=60)
evaluate ($dih_range_v=25)
evaluate ($dih_exponent=2)

{alpha for fixed residues}
assign (resid  1  and name O3' )
       (resid  2  and name P )
       (resid  2  and name O5' )
       (resid  2  and name C5' ) 
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
       
assign (resid  2  and name O3' )
       (resid  3  and name P )
       (resid  3  and name O5' )
       (resid  3  and name C5' ) 
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

 
assign (resid  3  and name O3' )
       (resid  4  and name P )
       (resid  4  and name O5' )
       (resid  4  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  4  and name O3' )
       (resid  5  and name P )
       (resid  5  and name O5' )
       (resid  5  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  5  and name O3' )
       (resid  6  and name P )
       (resid  6  and name O5' )
       (resid  6  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  6  and name O3' )
       (resid  7  and name P )
       (resid  7  and name O5' )
       (resid  7  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  7  and name O3' )
       (resid  8  and name P )
       (resid  8  and name O5' )
       (resid  8  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  8  and name O3' )
       (resid  9  and name P )
       (resid  9  and name O5' )
       (resid  9  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  9  and name O3' )
       (resid  10  and name P )
       (resid  10  and name O5' )
       (resid  10  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  10  and name O3' )
       (resid  11  and name P )
       (resid  11  and name O5' )
       (resid  11  and name C5' )
$dih_force  248  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  11  and name O3' )
       (resid  12  and name P )
       (resid  12  and name O5' )
       (resid  12  and name C5' )
$dih_force  190  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  12  and name O3' )
       (resid  13  and name P )
       (resid  13  and name O5' )
       (resid  13  and name C5' )
$dih_force  300  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  13  and name O3' )
       (resid  14  and name P )
       (resid  14  and name O5' )
       (resid  14  and name C5' )
$dih_force  185  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  14  and name O3' )
       (resid  15  and name P )
       (resid  15  and name O5' )
       (resid  15  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  15  and name O3' )
       (resid  16  and name P )
       (resid  16  and name O5' )
       (resid  16  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent 

assign (resid  16  and name O3' )
       (resid  17  and name P )
       (resid  17  and name O5' )
       (resid  17  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent


assign (resid  18  and name O3' )
       (resid  19  and name P )
       (resid  19  and name O5' )
       (resid  19  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  19  and name O3' )
       (resid  20  and name P )
       (resid  20  and name O5' )
       (resid  20  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  20  and name O3' )
       (resid  21  and name P )
       (resid  21  and name O5' )
       (resid  21  and name C5' )
$dih_force  248  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  21  and name O3' )
       (resid  22  and name P )
       (resid  22  and name O5' )
       (resid  22  and name C5' )
$dih_force  190  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  22  and name O3' )
       (resid  23  and name P )
       (resid  23  and name O5' )
       (resid  23  and name C5' )
$dih_force  300  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  23  and name O3' )
       (resid  24  and name P )
       (resid  24  and name O5' )
       (resid  24  and name C5' )
$dih_force  185  $dih_range_alpha $dih_exponent {from Ippel Thesis p129}
 
assign (resid  24  and name O3' )
       (resid  25  and name P )
       (resid  25  and name O5' )
       (resid  25  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  25  and name O3' )
       (resid  26  and name P )
       (resid  26  and name O5' )
       (resid  26  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  29  and name O3' )
       (resid  30  and name P )
       (resid  30  and name O5' )
       (resid  30  and name C5' )

$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  30  and name O3' )
       (resid  31  and name P )
       (resid  31  and name O5' )
       (resid  31  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

assign (resid  31  and name O3' )
       (resid  32  and name P )
       (resid  32  and name O5' )
       (resid  32  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  32  and name O3' )
       (resid  33  and name P )
       (resid  33  and name O5' )
       (resid  33  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  33  and name O3' )
       (resid  34  and name P )
       (resid  34  and name O5' )
       (resid  34  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  34  and name O3' )
       (resid  35  and name P )
       (resid  35  and name O5' )
       (resid  35  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent
 
assign (resid  35  and name O3' )
       (resid  36  and name P )
       (resid  36  and name O5' )
       (resid  36  and name C5' )
$dih_force  $dih_value_alpha $dih_range_alpha $dih_exponent

{beta for fixed residues}

assign (resid  2  and name P )
       (resid  2  and name O5' )
       (resid  2  and name C5' )
       (resid  2  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  3  and name P )
       (resid  3  and name O5' )
       (resid  3  and name C5' )
       (resid  3  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  4  and name P )
       (resid  4  and name O5' )
       (resid  4  and name C5' )
       (resid  4  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  5  and name P )
       (resid  5  and name O5' )
       (resid  5  and name C5' )
       (resid  5  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  6  and name P )
       (resid  6  and name O5' )
       (resid  6  and name C5' )
       (resid  6  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  7  and name P )
       (resid  7  and name O5' )
       (resid  7  and name C5' )
       (resid  7  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  8  and name P )
       (resid  8  and name O5' )
       (resid  8  and name C5' )
       (resid  8  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  9  and name P )
       (resid  9  and name O5' )
       (resid  9  and name C5' )
       (resid  9  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  10  and name P )
       (resid  10  and name O5' )
       (resid  10  and name C5' )
       (resid  10  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  11  and name P )
       (resid  11  and name O5' )
       (resid  11  and name C5' )
       (resid  11  and name C4' )
$dih_force  67  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  12  and name P )
       (resid  12  and name O5' )
       (resid  12  and name C5' )
       (resid  12  and name C4' )
$dih_force  170  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  13  and name P )
       (resid  13  and name O5' )
       (resid  13  and name C5' )
       (resid  13  and name C4' )
$dih_force  208  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  14  and name P )
       (resid  14  and name O5' )
       (resid  14  and name C5' )
       (resid  14  and name C4' )
$dih_force  84  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  15  and name P )
       (resid  15  and name O5' )
       (resid  15  and name C5' )
       (resid  15  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  16  and name P )
       (resid  16  and name O5' )
       (resid  16  and name C5' )
       (resid  16  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  17  and name P )
       (resid  17  and name O5' )
       (resid  17  and name C5' )
       (resid  17  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  19  and name P )
       (resid  19  and name O5' )
       (resid  19  and name C5' )
       (resid  19  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  20  and name P )
       (resid  20  and name O5' )
       (resid  20  and name C5' )
       (resid  20  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  21  and name P )
       (resid  21  and name O5' )
       (resid  21  and name C5' )
       (resid  21  and name C4' )
$dih_force  67  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  22  and name P )
       (resid  22  and name O5' )
       (resid  22  and name C5' )
       (resid  22  and name C4' )
$dih_force  170  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  23  and name P )
       (resid  23  and name O5' )
       (resid  23  and name C5' )
       (resid  23  and name C4' )
$dih_force  208  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  24  and name P )
       (resid  24  and name O5' )
       (resid  24  and name C5' )
       (resid  24  and name C4' )
$dih_force  84  $dih_range_beta $dih_exponent {from Ippel Thesis p129}
 
assign (resid  25  and name P )
       (resid  25  and name O5' )
       (resid  25  and name C5' )
       (resid  25  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  26  and name P )
       (resid  26  and name O5' )
       (resid  26  and name C5' )
       (resid  26  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  30  and name P )
       (resid  30  and name O5' )
       (resid  30  and name C5' )
       (resid  30  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  31  and name P )
       (resid  31  and name O5' )
       (resid  31  and name C5' )
       (resid  31  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent

assign (resid  32  and name P )
       (resid  32  and name O5' )
       (resid  32  and name C5' )
       (resid  32  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  33  and name P )
       (resid  33  and name O5' )
       (resid  33  and name C5' )
       (resid  33  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  34  and name P )
       (resid  34  and name O5' )
       (resid  34  and name C5' )
       (resid  34  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  35  and name P )
       (resid  35  and name O5' )
       (resid  35  and name C5' )
       (resid  35  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent
 
assign (resid  36  and name P )
       (resid  36  and name O5' )
       (resid  36  and name C5' )
       (resid  36  and name C4' )
$dih_force  $dih_value_beta $dih_range_beta $dih_exponent


{chi for fixed residues}

assign (resid  1  and name O4' )
       (resid  1  and name C1' )
       (resid  1  and name  N1  )
       (resid  1  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  2  and name O4' )
       (resid  2  and name C1' )
       (resid  2  and name  N9  )
       (resid  2  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  3  and name O4' )
       (resid  3  and name C1' )
       (resid  3  and name  N1  )
       (resid  3  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  4  and name O4' )
       (resid  4  and name C1' )
       (resid  4  and name  N9  )
       (resid  4  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  5  and name O4' )
       (resid  5  and name C1' )
       (resid  5  and name  N1  )
       (resid  5  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  6  and name O4' )
       (resid  6  and name C1' )
       (resid  6  and name  N1  )
       (resid  6  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  7  and name O4' )
       (resid  7  and name C1' )
       (resid  7  and name  N1  )
       (resid  7  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  8  and name O4' )
       (resid  8  and name C1' )
       (resid  8  and name  N1  )
       (resid  8  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  9  and name O4' )
       (resid  9  and name C1' )
       (resid  9  and name  N1  )
       (resid  9  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  10  and name O4' )
       (resid  10  and name C1' )
       (resid  10  and name  N9  )
       (resid  10  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  11  and name O4' )
       (resid  11  and name C1' )
       (resid  11  and name  N1  )
       (resid  11  and name  C2  )
$dih_force  -138  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  12  and name O4' )
       (resid  12  and name C1' )
       (resid  12  and name  N1  )
       (resid  12  and name  C2  )
$dih_force  -127  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  13  and name O4' )
       (resid  13  and name C1' )
       (resid  13  and name  N1  )
       (resid  13  and name  C2  )
$dih_force  -148  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  14  and name O4' )
       (resid  14  and name C1' )
       (resid  14  and name  N9  )
       (resid  14  and name  C4  )
$dih_force  -88  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  15  and name O4' )
       (resid  15  and name C1' )
       (resid  15  and name  N1  )
       (resid  15  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  16  and name O4' )
       (resid  16  and name C1' )
       (resid  16  and name  N1  )
       (resid  16  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  17  and name O4' )
       (resid  17  and name C1' )
       (resid  17  and name  N1  )
       (resid  17  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  19  and name O4' )
       (resid  19  and name C1' )
       (resid  19  and name  N1  )
       (resid  19  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  20  and name O4' )
       (resid  20  and name C1' )
       (resid  20  and name  N9  )
       (resid  20  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  21  and name O4' )
       (resid  21  and name C1' )
       (resid  21  and name  N1  )
       (resid  21  and name  C2  )
$dih_force  -138  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  22  and name O4' )
       (resid  22  and name C1' )
       (resid  22  and name  N1  )
       (resid  22  and name  C2  )
$dih_force  -127  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  23  and name O4' )
       (resid  23  and name C1' )
       (resid  23  and name  N1  )
       (resid  23  and name  C2  )
$dih_force  -148  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  24  and name O4' )
       (resid  24  and name C1' )
       (resid  24  and name  N9  )
       (resid  24  and name  C4  )
$dih_force  -88  $dih_range_chi $dih_exponent {from Ippel Thesis p108}
 
assign (resid  25  and name O4' )
       (resid  25  and name C1' )
       (resid  25  and name  N1  )
       (resid  25  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
 
assign (resid  26  and name O4' )
       (resid  26  and name C1' )
       (resid  26  and name  N1  )
       (resid  26  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  30  and name O4' )
       (resid  30  and name C1' )
       (resid  30  and name  N1  )
       (resid  30  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  31  and name O4' )
       (resid  31  and name C1' )
       (resid  31  and name  N1  )
       (resid  31  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent

assign (resid  32  and name O4' )
       (resid  32  and name C1' )
       (resid  32  and name  N9  )
       (resid  32  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  33  and name O4' )
       (resid  33  and name C1' )
       (resid  33  and name  N1  )
       (resid  33  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  34  and name O4' )
       (resid  34  and name C1' )
       (resid  34  and name  N9  )
       (resid  34  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  35  and name O4' )
       (resid  35  and name C1' )
       (resid  35  and name  N1  )
       (resid  35  and name  C2  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
assign (resid  36  and name O4' )
       (resid  36  and name C1' )
       (resid  36  and name  N9  )
       (resid  36  and name  C4  )
$dih_force  $dih_value_chi $dih_range_chi $dih_exponent
 
 
 {delta for fixed residues}

assign (resid  1  and name C5' )
       (resid  1  and name C4' )
       (resid  1  and name C3' )
       (resid  1  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  2  and name C5' )
       (resid  2  and name C4' )
       (resid  2  and name C3' )
       (resid  2  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  3  and name C5' )
       (resid  3  and name C4' )
       (resid  3  and name C3' )
       (resid  3  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  4  and name C5' )
       (resid  4  and name C4' )
       (resid  4  and name C3' )
       (resid  4  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  5  and name C5' )
       (resid  5  and name C4' )
       (resid  5  and name C3' )
       (resid  5  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  6  and name C5' )
       (resid  6  and name C4' )
       (resid  6  and name C3' )
       (resid  6  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  7  and name C5' )
       (resid  7  and name C4' )
       (resid  7  and name C3' )
       (resid  7  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  8  and name C5' )
       (resid  8  and name C4' )
       (resid  8  and name C3' )
       (resid  8  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  9  and name C5' )
       (resid  9  and name C4' )
       (resid  9  and name C3' )
       (resid  9  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  10  and name C5' )
       (resid  10  and name C4' )
       (resid  10  and name C3' )
       (resid  10  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  11  and name C5' )
       (resid  11  and name C4' )
       (resid  11  and name C3' )
       (resid  11  and name O3' )
$dih_force  147  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  12  and name C5' )
       (resid  12  and name C4' )
       (resid  12  and name C3' )
       (resid  12  and name O3' )
$dih_force  147  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  13  and name C5' )
       (resid  13  and name C4' )
       (resid  13  and name C3' )
       (resid  13  and name O3' )
$dih_force  151  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  14  and name C5' )
       (resid  14  and name C4' )
       (resid  14  and name C3' )
       (resid  14  and name O3' )
$dih_force  158  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  15  and name C5' )
       (resid  15  and name C4' )
       (resid  15  and name C3' )
       (resid  15  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  16 and name C5' )
       (resid  16  and name C4' )
       (resid  16  and name C3' )
       (resid  16  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  17  and name C5' )
       (resid  17  and name C4' )
       (resid  17  and name C3' )
       (resid  17  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  19  and name C5' )
       (resid  19  and name C4' )
       (resid  19  and name C3' )
       (resid  19  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  20  and name C5' )
       (resid  20  and name C4' )
       (resid  20  and name C3' )
       (resid  20  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  21  and name C5' )
       (resid  21  and name C4' )
       (resid  21  and name C3' )
       (resid  21  and name O3' )
$dih_force  147  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  22  and name C5' )
       (resid  22  and name C4' )
       (resid  22  and name C3' )
       (resid  22  and name O3' )
$dih_force  147  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  23  and name C5' )
       (resid  23  and name C4' )
       (resid  23  and name C3' )
       (resid  23  and name O3' )
$dih_force  151  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  24  and name C5' )
       (resid  24  and name C4' )
       (resid  24  and name C3' )
       (resid  24  and name O3' )
$dih_force  158  $dih_range_delta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  25  and name C5' )
       (resid  25  and name C4' )
       (resid  25  and name C3' )
       (resid  25  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  26  and name C5' )
       (resid  26  and name C4' )
       (resid  26  and name C3' )
       (resid  26  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  30  and name C5' )
       (resid  30  and name C4' )
       (resid  30  and name C3' )
       (resid  30  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  31  and name C5' )
       (resid  31  and name C4' )
       (resid  31  and name C3' )
       (resid  31  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

assign (resid  32  and name C5' )
       (resid  32  and name C4' )
       (resid  32  and name C3' )
       (resid  32  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  33  and name C5' )
       (resid  33  and name C4' )
       (resid  33  and name C3' )
       (resid  33  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  34  and name C5' )
       (resid  34  and name C4' )
       (resid  34  and name C3' )
       (resid  34  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  35  and name C5' )
       (resid  35  and name C4' )
       (resid  35  and name C3' )
       (resid  35  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent
 
assign (resid  36  and name C5' )
       (resid  36  and name C4' )
       (resid  36  and name C3' )
       (resid  36  and name O3' )
$dih_force  $dih_value_delta $dih_range_delta $dih_exponent

{epsilon for fixed residues}

assign (resid  1  and name C4' )
       (resid  1  and name C3' )
       (resid  1  and name O3' )
       (resid  2  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  2  and name C4' )
       (resid  2  and name C3' )
       (resid  2  and name O3' )
       (resid  3  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  3  and name C4' )
       (resid  3  and name C3' )
       (resid  3  and name O3' )
       (resid  4  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  4  and name C4' )
       (resid  4  and name C3' )
       (resid  4  and name O3' )
       (resid  5  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  5  and name C4' )
       (resid  5  and name C3' )
       (resid  5  and name O3' )
       (resid  6  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  6  and name C4' )
       (resid  6  and name C3' )
       (resid  6  and name O3' )
       (resid  7  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  7  and name C4' )
       (resid  7  and name C3' )
       (resid  7  and name O3' )
       (resid  8  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  8  and name C4' )
       (resid  8  and name C3' )
       (resid  8  and name O3' )
       (resid  9  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  9  and name C4' )
       (resid  9  and name C3' )
       (resid  9  and name O3' )
       (resid  10  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  10  and name C4' )
       (resid  10  and name C3' )
       (resid  10  and name O3' )
       (resid  11  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  11  and name C4' )
       (resid  11  and name C3' )
       (resid  11  and name O3' )
       (resid  12  and name P )
$dih_force  195 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  12  and name C4' )
       (resid  12  and name C3' )
       (resid  12  and name O3' )
       (resid  13  and name P )
$dih_force  214 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  13  and name C4' )
       (resid  13  and name C3' )
       (resid  13  and name O3' )
       (resid  14  and name P )
$dih_force  290 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  14  and name C4' )
       (resid  14  and name C3' )
       (resid  14  and name O3' )
       (resid  15  and name P )
$dih_force  169 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  15  and name C4' )
       (resid  15  and name C3' )
       (resid  15  and name O3' )
       (resid  16  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  16  and name C4' )
       (resid  16  and name C3' )
       (resid  16  and name O3' )
       (resid  17  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  17  and name C4' )
       (resid  17  and name C3' )
       (resid  17  and name O3' )
       (resid  18  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  19  and name C4' )
       (resid  19  and name C3' )
       (resid  19  and name O3' )
       (resid  20  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  20  and name C4' )
       (resid  20  and name C3' )
       (resid  20  and name O3' )
       (resid  21  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  21  and name C4' )
       (resid  21  and name C3' )
       (resid  21  and name O3' )
       (resid  22  and name P )
$dih_force  195 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  22  and name C4' )
       (resid  22  and name C3' )
       (resid  22  and name O3' )
       (resid  23  and name P )
$dih_force  214 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  23  and name C4' )
       (resid  23  and name C3' )
       (resid  23  and name O3' )
       (resid  24  and name P )
$dih_force  290 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  24  and name C4' )
       (resid  24  and name C3' )
       (resid  24  and name O3' )
       (resid  25  and name P )
$dih_force  169 $dih_range_epsilon $dih_exponent {from Ippel Thesis p108}
 
assign (resid  25  and name C4' )
       (resid  25  and name C3' )
       (resid  25  and name O3' )
       (resid  26  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  26  and name C4' )
       (resid  26  and name C3' )
       (resid  26  and name O3' )
       (resid  27  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  30  and name C4' )
       (resid  30  and name C3' )
       (resid  30  and name O3' )
       (resid  31  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  31  and name C4' )
       (resid  31  and name C3' )
       (resid  31  and name O3' )
       (resid  32  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent

assign (resid  32  and name C4' )
       (resid  32  and name C3' )
       (resid  32  and name O3' )
       (resid  33  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  33  and name C4' )
       (resid  33  and name C3' )
       (resid  33  and name O3' )
       (resid  34  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  34  and name C4' )
       (resid  34  and name C3' )
       (resid  34  and name O3' )
       (resid  35  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
assign (resid  35  and name C4' )
       (resid  35  and name C3' )
       (resid  35  and name O3' )
       (resid  36  and name P )
$dih_force  $dih_value_epsilon $dih_range_epsilon $dih_exponent
 
 {gamma for fixed residues}

assign (resid  1  and name O5' )
       (resid  1  and name C5' )
       (resid  1  and name C4' )
       (resid  1  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  2  and name O5' )
       (resid  2  and name C5' )
       (resid  2  and name C4' )
       (resid  2  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  3  and name O5' )
       (resid  3  and name C5' )
       (resid  3  and name C4' )
       (resid  3  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  4  and name O5' )
       (resid  4  and name C5' )
       (resid  4  and name C4' )
       (resid  4  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  5  and name O5' )
       (resid  5  and name C5' )
       (resid  5  and name C4' )
       (resid  5  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  6  and name O5' )
       (resid  6  and name C5' )
       (resid  6  and name C4' )
       (resid  6  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  7  and name O5' )
       (resid  7  and name C5' )
       (resid  7  and name C4' )
       (resid  7  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  8  and name O5' )
       (resid  8  and name C5' )
       (resid  8  and name C4' )
       (resid  8  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  9  and name O5' )
       (resid  9  and name C5' )
       (resid  9  and name C4' )
       (resid  9  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  10  and name O5' )
       (resid  10  and name C5' )
       (resid  10  and name C4' )
       (resid  10  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  11  and name O5' )
       (resid  11  and name C5' )
       (resid  11  and name C4' )
       (resid  11  and name C3' )
$dih_force 166 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  12  and name O5' )
       (resid  12  and name C5' )
       (resid  12  and name C4' )
       (resid  12  and name C3' )
$dih_force 54 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  13  and name O5' )
       (resid  13  and name C5' )
       (resid  13  and name C4' )
       (resid  13  and name C3' )
$dih_force 51 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  14  and name O5' )
       (resid  14  and name C5' )
       (resid  14  and name C4' )
       (resid  14  and name C3' )
$dih_force 144 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  15  and name O5' )
       (resid  15  and name C5' )
       (resid  15  and name C4' )
       (resid  15  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  16  and name O5' )
       (resid  16  and name C5' )
       (resid  16  and name C4' )
       (resid  16  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  17  and name O5' )
       (resid  17  and name C5' )
       (resid  17  and name C4' )
       (resid  17  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  19  and name O5' )
       (resid  19  and name C5' )
       (resid  19  and name C4' )
       (resid  19  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  20  and name O5' )
       (resid  20  and name C5' )
       (resid  20  and name C4' )
       (resid  20  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  21  and name O5' )
       (resid  21  and name C5' )
       (resid  21  and name C4' )
       (resid  21  and name C3' )
$dih_force 166 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  22  and name O5' )
       (resid  22  and name C5' )
       (resid  22  and name C4' )
       (resid  22  and name C3' )
$dih_force 54 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  23  and name O5' )
       (resid  23  and name C5' )
       (resid  23  and name C4' )
       (resid  23  and name C3' )
$dih_force 51 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  24  and name O5' )
       (resid  24  and name C5' )
       (resid  24  and name C4' )
       (resid  24  and name C3' )
$dih_force 144 $dih_range_gamma $dih_exponent {from Ippel Thesis p108}
 
assign (resid  25  and name O5' )
       (resid  25  and name C5' )
       (resid  25  and name C4' )
       (resid  25  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  26  and name O5' )
       (resid  26  and name C5' )
       (resid  26  and name C4' )
       (resid  26  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  30  and name O5' )
       (resid  30  and name C5' )
       (resid  30  and name C4' )
       (resid  30  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  31  and name O5' )
       (resid  31  and name C5' )
       (resid  31  and name C4' )
       (resid  31  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent

assign (resid  32  and name O5' )
       (resid  32  and name C5' )
       (resid  32  and name C4' )
       (resid  32  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  33  and name O5' )
       (resid  33  and name C5' )
       (resid  33  and name C4' )
       (resid  33  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  34  and name O5' )
       (resid  34  and name C5' )
       (resid  34  and name C4' )
       (resid  34  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  35  and name O5' )
       (resid  35  and name C5' )
       (resid  35  and name C4' )
       (resid  35  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent
 
assign (resid  36  and name O5' )
       (resid  36  and name C5' )
       (resid  36  and name C4' )
       (resid  36  and name C3' )
$dih_force  $dih_value_gamma $dih_range_gamma $dih_exponent


{zeta for fixed residues}

assign (resid  1  and name C3' )
       (resid  1  and name O3' )
       (resid  2  and name P )
       (resid  2  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  2  and name C3' )
       (resid  2  and name O3' )
       (resid  3  and name P )
       (resid  3  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  3  and name C3' )
       (resid  3  and name O3' )
       (resid  4  and name P )
       (resid  4  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  4  and name C3' )
       (resid  4  and name O3' )
       (resid  5  and name P )
       (resid  5  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  5  and name C3' )
       (resid  5  and name O3' )
       (resid  6  and name P )
       (resid  6  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  6  and name C3' )
       (resid  6  and name O3' )
       (resid  7  and name P )
       (resid  7  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  7  and name C3' )
       (resid  7  and name O3' )
       (resid  8  and name P )
       (resid  8  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  8  and name C3' )
       (resid  8  and name O3' )
       (resid  9  and name P )
       (resid  9  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  9  and name C3' )
       (resid  9  and name O3' )
       (resid  10  and name P )
       (resid  10  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  10  and name C3' )
       (resid  10  and name O3' )
       (resid  11  and name P )
       (resid  11  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  11  and name C3' )
       (resid  11  and name O3' )
       (resid  12  and name P )
       (resid  12  and name O5' )
$dih_force 269  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  12  and name C3' )
       (resid  12  and name O3' )
       (resid  13  and name P )
       (resid  13  and name O5' )
$dih_force 274  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  13  and name C3' )
       (resid  13  and name O3' )
       (resid  14  and name P )
       (resid  14  and name O5' )
$dih_force 111  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  14  and name C3' )
       (resid  14  and name O3' )
       (resid  15  and name P )
       (resid  15  and name O5' )
$dih_force 262  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  15  and name C3' )
       (resid  15  and name O3' )
       (resid  16  and name P )
       (resid  16  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  16  and name C3' )
       (resid  16  and name O3' )
       (resid  17  and name P )
       (resid  17  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  17  and name C3' )
       (resid  17  and name O3' )
       (resid  18  and name P )
       (resid  18  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  19  and name C3' )
       (resid  19  and name O3' )
       (resid  20  and name P )
       (resid  20  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  20  and name C3' )
       (resid  20  and name O3' )
       (resid  21  and name P )
       (resid  21  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  21  and name C3' )
       (resid  21  and name O3' )
       (resid  22  and name P )
       (resid  22  and name O5' )
$dih_force 269  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  22  and name C3' )
       (resid  22  and name O3' )
       (resid  23  and name P )
       (resid  23  and name O5' )
$dih_force 274  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  23  and name C3' )
       (resid  23  and name O3' )
       (resid  24  and name P )
       (resid  24  and name O5' )
$dih_force 111   $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  24  and name C3' )
       (resid  24  and name O3' )
       (resid  25  and name P )
       (resid  25  and name O5' )
$dih_force 262  $dih_range_zeta $dih_exponent {from Ippel Thesis p108}
 
assign (resid  25  and name C3' )
       (resid  25  and name O3' )
       (resid  26  and name P )
       (resid  26  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  26  and name C3' )
       (resid  26  and name O3' )
       (resid  27  and name P )
       (resid  27  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  30  and name C3' )
       (resid  30  and name O3' )
       (resid  31  and name P )
       (resid  31  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  31  and name C3' )
       (resid  31  and name O3' )
       (resid  32  and name P )
       (resid  32  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent

assign (resid  32  and name C3' )
       (resid  32  and name O3' )
       (resid  33  and name P )
       (resid  33  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  33  and name C3' )
       (resid  33  and name O3' )
       (resid  34  and name P )
       (resid  34  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  34  and name C3' )
       (resid  34  and name O3' )
       (resid  35  and name P )
       (resid  35  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
assign (resid  35  and name C3' )
       (resid  35  and name O3' )
       (resid  36  and name P )
       (resid  36  and name O5' )
$dih_force  $dih_value_zeta $dih_range_zeta $dih_exponent
 
 
 {v0 for fixed residues}

assign (resid  1  and name C4' )
       (resid  1  and name O4' )
       (resid  1  and name C1' )
       (resid  1  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  2  and name C4' )
       (resid  2  and name O4' )
       (resid  2  and name C1' )
       (resid  2  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  3  and name C4' )
       (resid  3  and name O4' )
       (resid  3  and name C1' )
       (resid  3  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  4  and name C4' )
       (resid  4  and name O4' )
       (resid  4  and name C1' )
       (resid  4  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  5  and name C4' )
       (resid  5  and name O4' )
       (resid  5  and name C1' )
       (resid  5  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  6  and name C4' )
       (resid  6  and name O4' )
       (resid  6  and name C1' )
       (resid  6  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  7  and name C4' )
       (resid  7  and name O4' )
       (resid  7  and name C1' )
       (resid  7  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  8  and name C4' )
       (resid  8  and name O4' )
       (resid  8  and name C1' )
       (resid  8  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  9  and name C4' )
       (resid  9  and name O4' )
       (resid  9  and name C1' )
       (resid  9  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  10  and name C4' )
       (resid  10  and name O4' )
       (resid  10  and name C1' )
       (resid  10  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  11  and name C4' )
       (resid  11  and name O4' )
       (resid  11  and name C1' )
       (resid  11  and name C2' )
$dih_force -26  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  12  and name C4' )
       (resid  12  and name O4' )
       (resid  12  and name C1' )
       (resid  12  and name C2' )
$dih_force -18  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  13  and name C4' )
       (resid  13  and name O4' )
       (resid  13  and name C1' )
       (resid  13  and name C2' )
$dih_force -17  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  14  and name C4' )
       (resid  14  and name O4' )
       (resid  14  and name C1' )
       (resid  14  and name C2' )
$dih_force 6  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  15  and name C4' )
       (resid  15  and name O4' )
       (resid  15  and name C1' )
       (resid  15  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  16  and name C4' )
       (resid  16  and name O4' )
       (resid  16  and name C1' )
       (resid  16  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  17  and name C4' )
       (resid  17  and name O4' )
       (resid  17  and name C1' )
       (resid  17  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  19  and name C4' )
       (resid  19  and name O4' )
       (resid  19  and name C1' )
       (resid  19  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  20  and name C4' )
       (resid  20  and name O4' )
       (resid  20  and name C1' )
       (resid  20  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  21  and name C4' )
       (resid  21  and name O4' )
       (resid  21  and name C1' )
       (resid  21  and name C2' )
$dih_force -26  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  22  and name C4' )
       (resid  22  and name O4' )
       (resid  22  and name C1' )
       (resid  22  and name C2' )
$dih_force -18  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  23  and name C4' )
       (resid  23  and name O4' )
       (resid  23  and name C1' )
       (resid  23  and name C2' )
$dih_force -17  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  24  and name C4' )
       (resid  24  and name O4' )
       (resid  24  and name C1' )
       (resid  24  and name C2' )
$dih_force 6  $dih_range_v $dih_exponent{Ippel thesis,p108}
 
assign (resid  25  and name C4' )
       (resid  25  and name O4' )
       (resid  25  and name C1' )
       (resid  25  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  26  and name C4' )
       (resid  26  and name O4' )
       (resid  26  and name C1' )
       (resid  26  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  30  and name C4' )
       (resid  30  and name O4' )
       (resid  30  and name C1' )
       (resid  30  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  31  and name C4' )
       (resid  31  and name O4' )
       (resid  31  and name C1' )
       (resid  31  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent

assign (resid  32  and name C4' )
       (resid  32  and name O4' )
       (resid  32  and name C1' )
       (resid  32  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  33  and name C4' )
       (resid  33  and name O4' )
       (resid  33  and name C1' )
       (resid  33  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  34  and name C4' )
       (resid  34  and name O4' )
       (resid  34  and name C1' )
       (resid  34  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  35  and name C4' )
       (resid  35  and name O4' )
       (resid  35  and name C1' )
       (resid  35  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
 
assign (resid  36  and name C4' )
       (resid  36  and name O4' )
       (resid  36  and name C1' )
       (resid  36  and name C2' )
$dih_force  $dih_value_V0 $dih_range_v $dih_exponent
     
{v1 for fixed residues}

assign (resid  1  and name O4' )
       (resid  1  and name C1' )
       (resid  1  and name C2' )
       (resid  1  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  2  and name O4' )
       (resid  2  and name C1' )
       (resid  2  and name C2' )
       (resid  2  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  3  and name O4' )
       (resid  3  and name C1' )
       (resid  3  and name C2' )
       (resid  3  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  4  and name O4' )
       (resid  4  and name C1' )
       (resid  4  and name C2' )
       (resid  4  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  5  and name O4' )
       (resid  5  and name C1' )
       (resid  5  and name C2' )
       (resid  5  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  6  and name O4' )
       (resid  6  and name C1' )
       (resid  6  and name C2' )
       (resid  6  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  7  and name O4' )
       (resid  7  and name C1' )
       (resid  7  and name C2' )
       (resid  7  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  8  and name O4' )
       (resid  8  and name C1' )
       (resid  8  and name C2' )
       (resid  8  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  9  and name O4' )
       (resid  9  and name C1' )
       (resid  9  and name C2' )
       (resid  9  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  10  and name O4' )
       (resid  10  and name C1' )
       (resid  10  and name C2' )
       (resid  10  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  11  and name O4' )
       (resid  11  and name C1' )
       (resid  11  and name C2' )
       (resid  11  and name C3' )
$dih_force  60  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  12  and name O4' )
       (resid  12  and name C1' )
       (resid  12  and name C2' )
       (resid  12  and name C3' )
$dih_force  34  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  13  and name O4' )
       (resid  13  and name C1' )
       (resid  13  and name C2' )
       (resid  13  and name C3' )
$dih_force  31  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  14  and name O4' )
       (resid  14  and name C1' )
       (resid  14  and name C2' )
       (resid  14  and name C3' )
$dih_force  16  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  15  and name O4' )
       (resid  15  and name C1' )
       (resid  15  and name C2' )
       (resid  15  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  16  and name O4' )
       (resid  16  and name C1' )
       (resid  16  and name C2' )
       (resid  16  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  17  and name O4' )
       (resid  17  and name C1' )
       (resid  17  and name C2' )
       (resid  17  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  19  and name O4' )
       (resid  19  and name C1' )
       (resid  19  and name C2' )
       (resid  19  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  20  and name O4' )
       (resid  20  and name C1' )
       (resid  20  and name C2' )
       (resid  20  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  21  and name O4' )
       (resid  21  and name C1' )
       (resid  21  and name C2' )
       (resid  21  and name C3' )
$dih_force  60  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  22  and name O4' )
       (resid  22  and name C1' )
       (resid  22  and name C2' )
       (resid  22  and name C3' )
$dih_force  34  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  23  and name O4' )
       (resid  23  and name C1' )
       (resid  23  and name C2' )
       (resid  23  and name C3' )
$dih_force  31  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  24  and name O4' )
       (resid  24  and name C1' )
       (resid  24  and name C2' )
       (resid  24  and name C3' )
$dih_force  16  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  25  and name O4' )
       (resid  25  and name C1' )
       (resid  25  and name C2' )
       (resid  25  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  26  and name O4' )
       (resid  26  and name C1' )
       (resid  26  and name C2' )
       (resid  26  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  30  and name O4' )
       (resid  30  and name C1' )
       (resid  30  and name C2' )
       (resid  30  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  31  and name O4' )
       (resid  31  and name C1' )
       (resid  31  and name C2' )
       (resid  31  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

assign (resid  32  and name O4' )
       (resid  32  and name C1' )
       (resid  32  and name C2' )
       (resid  32  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  33  and name O4' )
       (resid  33  and name C1' )
       (resid  33  and name C2' )
       (resid  33  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  34  and name O4' )
       (resid  34  and name C1' )
       (resid  34  and name C2' )
       (resid  34  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  35  and name O4' )
       (resid  35  and name C1' )
       (resid  35  and name C2' )
       (resid  35  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent
 
assign (resid  36  and name O4' )
       (resid  36  and name C1' )
       (resid  36  and name C2' )
       (resid  36  and name C3' )
$dih_force  $dih_value_V1 $dih_range_v $dih_exponent

{v2 for fixed residues}

assign (resid  1  and name C1' )
       (resid  1  and name C2' )
       (resid  1  and name C3' )
       (resid  1  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  2  and name C1' )
       (resid  2  and name C2' )
       (resid  2  and name C3' )
       (resid  2  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  3  and name C1' )
       (resid  3  and name C2' )
       (resid  3  and name C3' )
       (resid  3  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  4  and name C1' )
       (resid  4  and name C2' )
       (resid  4  and name C3' )
       (resid  4  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  5  and name C1' )
       (resid  5  and name C2' )
       (resid  5  and name C3' )
       (resid  5  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  6  and name C1' )
       (resid  6  and name C2' )
       (resid  6  and name C3' )
       (resid  6  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  7  and name C1' )
       (resid  7  and name C2' )
       (resid  7  and name C3' )
       (resid  7  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  8  and name C1' )
       (resid  8  and name C2' )
       (resid  8  and name C3' )
       (resid  8  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  9  and name C1' )
       (resid  9  and name C2' )
       (resid  9  and name C3' )
       (resid  9  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  10  and name C1' )
       (resid  10  and name C2' )
       (resid  10  and name C3' )
       (resid  10  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  11  and name C1' )
       (resid  11  and name C2' )
       (resid  11  and name C3' )
       (resid  11  and name C4' )
$dih_force  -39  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  12  and name C1' )
       (resid  12  and name C2' )
       (resid  12  and name C3' )
       (resid  12  and name C4' )
$dih_force  -36  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  13  and name C1' )
       (resid  13  and name C2' )
       (resid  13  and name C3' )
       (resid  13  and name C4' )
$dih_force  -33  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  14  and name C1' )
       (resid  14  and name C2' )
       (resid  14  and name C3' )
       (resid  14  and name C4' )
$dih_force  -33  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  15  and name C1' )
       (resid  15  and name C2' )
       (resid  15  and name C3' )
       (resid  15  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  16  and name C1' )
       (resid  16  and name C2' )
       (resid  16  and name C3' )
       (resid  16  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  17  and name C1' )
       (resid  17  and name C2' )
       (resid  17  and name C3' )
       (resid  17  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  19  and name C1' )
       (resid  19  and name C2' )
       (resid  19  and name C3' )
       (resid  19  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  20  and name C1' )
       (resid  20  and name C2' )
       (resid  20  and name C3' )
       (resid  20  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  21  and name C1' )
       (resid  21  and name C2' )
       (resid  21  and name C3' )
       (resid  21  and name C4' )
$dih_force  -39  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  22  and name C1' )
       (resid  22  and name C2' )
       (resid  22  and name C3' )
       (resid  22  and name C4' )
$dih_force  -36  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  23  and name C1' )
       (resid  23  and name C2' )
       (resid  23  and name C3' )
       (resid  23  and name C4' )
$dih_force  -33  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  24  and name C1' )
       (resid  24  and name C2' )
       (resid  24  and name C3' )
       (resid  24  and name C4' )
$dih_force  -33  $dih_range_v $dih_exponent {Ippel thesis, p108}
 
assign (resid  25  and name C1' )
       (resid  25  and name C2' )
       (resid  25  and name C3' )
       (resid  25  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  26  and name C1' )
       (resid  26  and name C2' )
       (resid  26  and name C3' )
       (resid  26  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  30  and name C1' )
       (resid  30  and name C2' )
       (resid  30  and name C3' )
       (resid  30  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  31  and name C1' )
       (resid  31  and name C2' )
       (resid  31  and name C3' )
       (resid  31  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

assign (resid  32  and name C1' )
       (resid  32  and name C2' )
       (resid  32  and name C3' )
       (resid  32  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  33  and name C1' )
       (resid  33  and name C2' )
       (resid  33  and name C3' )
       (resid  33  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  34  and name C1' )
       (resid  34  and name C2' )
       (resid  34  and name C3' )
       (resid  34  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  35  and name C1' )
       (resid  35  and name C2' )
       (resid  35  and name C3' )
       (resid  35  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent
 
assign (resid  36  and name C1' )
       (resid  36  and name C2' )
       (resid  36  and name C3' )
       (resid  36  and name C4' )
$dih_force  $dih_value_V2 $dih_range_v $dih_exponent

{v3 for fixed residues}

assign (resid  1  and name C2' )
       (resid  1  and name C3' )
       (resid  1  and name C4' )
       (resid  1  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  2  and name C2' )
       (resid  2  and name C3' )
       (resid  2  and name C4' )
       (resid  2  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  3  and name C2' )
       (resid  3  and name C3' )
       (resid  3  and name C4' )
       (resid  3  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  4  and name C2' )
       (resid  4  and name C3' )
       (resid  4  and name C4' )
       (resid  4  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  5  and name C2' )
       (resid  5  and name C3' )
       (resid  5  and name C4' )
       (resid  5  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  6  and name C2' )
       (resid  6  and name C3' )
       (resid  6  and name C4' )
       (resid  6  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  7  and name C2' )
       (resid  7  and name C3' )
       (resid  7  and name C4' )
       (resid  7  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  8  and name C2' )
       (resid  8  and name C3' )
       (resid  8  and name C4' )
       (resid  8  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  9  and name C2' )
       (resid  9  and name C3' )
       (resid  9  and name C4' )
       (resid  9  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  10  and name C2' )
       (resid  10  and name C3' )
       (resid  10  and name C4' )
       (resid  10  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  11  and name C2' )
       (resid  11  and name C3' )
       (resid  11  and name C4' )
       (resid  11  and name O4' )
$dih_force  24  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  12  and name C2' )
       (resid  12  and name C3' )
       (resid  12  and name C4' )
       (resid  12  and name O4' )
$dih_force  25  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  13  and name C2' )
       (resid  13  and name C3' )
       (resid  13  and name C4' )
       (resid  13  and name O4' )
$dih_force  23  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  14  and name C2' )
       (resid  14  and name C3' )
       (resid  14  and name C4' )
       (resid  14  and name O4' )
$dih_force  37  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  15  and name C2' )
       (resid  15  and name C3' )
       (resid  15  and name C4' )
       (resid  15  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  16  and name C2' )
       (resid  16  and name C3' )
       (resid  16  and name C4' )
       (resid  16  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  17  and name C2' )
       (resid  17  and name C3' )
       (resid  17  and name C4' )
       (resid  17  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  19  and name C2' )
       (resid  19  and name C3' )
       (resid  19  and name C4' )
       (resid  19  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  20  and name C2' )
       (resid  20  and name C3' )
       (resid  20  and name C4' )
       (resid  20  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  21  and name C2' )
       (resid  21  and name C3' )
       (resid  21  and name C4' )
       (resid  21  and name O4' )
$dih_force  24  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  22  and name C2' )
       (resid  22  and name C3' )
       (resid  22  and name C4' )
       (resid  22  and name O4' )
$dih_force  25  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  23  and name C2' )
       (resid  23  and name C3' )
       (resid  23  and name C4' )
       (resid  23  and name O4' )
$dih_force  23  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  24  and name C2' )
       (resid  24  and name C3' )
       (resid  24  and name C4' )
       (resid  24  and name O4' )
$dih_force  37  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  25  and name C2' )
       (resid  25  and name C3' )
       (resid  25  and name C4' )
       (resid  25  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  26  and name C2' )
       (resid  26  and name C3' )
       (resid  26  and name C4' )
       (resid  26  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  30  and name C2' )
       (resid  30  and name C3' )
       (resid  30  and name C4' )
       (resid  30  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  31  and name C2' )
       (resid  31  and name C3' )
       (resid  31  and name C4' )
       (resid  31  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

assign (resid  32  and name C2' )
       (resid  32  and name C3' )
       (resid  32  and name C4' )
       (resid  32  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  33  and name C2' )
       (resid  33  and name C3' )
       (resid  33  and name C4' )
       (resid  33  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  34  and name C2' )
       (resid  34  and name C3' )
       (resid  34  and name C4' )
       (resid  34  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  35  and name C2' )
       (resid  35  and name C3' )
       (resid  35  and name C4' )
       (resid  35  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent
 
assign (resid  36  and name C2' )
       (resid  36  and name C3' )
       (resid  36  and name C4' )
       (resid  36  and name O4' )
$dih_force  $dih_value_V3 $dih_range_v $dih_exponent

{v4 for fixed residues}

assign (resid  1  and name C3' )
       (resid  1  and name C4' )
       (resid  1  and name O4' )
       (resid  1  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  2  and name C3' )
       (resid  2  and name C4' )
       (resid  2  and name O4' )
       (resid  2  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  3  and name C3' )
       (resid  3  and name C4' )
       (resid  3  and name O4' )
       (resid  3  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  4  and name C3' )
       (resid  4  and name C4' )
       (resid  4  and name O4' )
       (resid  4  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  5  and name C3' )
       (resid  5  and name C4' )
       (resid  5  and name O4' )
       (resid  5  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  6  and name C3' )
       (resid  6  and name C4' )
       (resid  6  and name O4' )
       (resid  6  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  7  and name C3' )
       (resid  7  and name C4' )
       (resid  7  and name O4' )
       (resid  7  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  8  and name C3' )
       (resid  8  and name C4' )
       (resid  8  and name O4' )
       (resid  8  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  9  and name C3' )
       (resid  9  and name C4' )
       (resid  9  and name O4' )
       (resid  9  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  10  and name C3' )
       (resid  10  and name C4' )
       (resid  10  and name O4' )
       (resid  10  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  11  and name C3' )
       (resid  11  and name C4' )
       (resid  11  and name O4' )
       (resid  11  and name C1' )
$dih_force  1  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  12  and name C3' )
       (resid  12  and name C4' )
       (resid  12  and name O4' )
       (resid  12  and name C1' )
$dih_force  -5  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  13  and name C3' )
       (resid  13  and name C4' )
       (resid  13  and name O4' )
       (resid  13  and name C1' )
$dih_force  -4  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  14  and name C3' )
       (resid  14  and name C4' )
       (resid  14  and name O4' )
       (resid  14  and name C1' )
$dih_force  -27  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  15  and name C3' )
       (resid  15  and name C4' )
       (resid  15  and name O4' )
       (resid  15  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  16  and name C3' )
       (resid  16  and name C4' )
       (resid  16  and name O4' )
       (resid  16  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  17  and name C3' )
       (resid  17  and name C4' )
       (resid  17  and name O4' )
       (resid  17  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  19  and name C3' )
       (resid  19  and name C4' )
       (resid  19  and name O4' )
       (resid  19  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  20  and name C3' )
       (resid  20  and name C4' )
       (resid  20  and name O4' )
       (resid  20  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  21  and name C3' )
       (resid  21  and name C4' )
       (resid  21  and name O4' )
       (resid  21  and name C1' )
$dih_force  1  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  22  and name C3' )
       (resid  22  and name C4' )
       (resid  22  and name O4' )
       (resid  22  and name C1' )
$dih_force  -5  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  23  and name C3' )
       (resid  23  and name C4' )
       (resid  23  and name O4' )
       (resid  23  and name C1' )
$dih_force  -4  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  24  and name C3' )
       (resid  24  and name C4' )
       (resid  24  and name O4' )
       (resid  24  and name C1' )
$dih_force  -27  $dih_range_v $dih_exponent {Ippel Thesis, p108}
 
assign (resid  25  and name C3' )
       (resid  25  and name C4' )
       (resid  25  and name O4' )
       (resid  25  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  26  and name C3' )
       (resid  26  and name C4' )
       (resid  26  and name O4' )
       (resid  26  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  30  and name C3' )
       (resid  30  and name C4' )
       (resid  30  and name O4' )
       (resid  30  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  31  and name C3' )
       (resid  31  and name C4' )
       (resid  31  and name O4' )
       (resid  31  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent

assign (resid  32  and name C3' )
       (resid  32  and name C4' )
       (resid  32  and name O4' )
       (resid  32  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  33  and name C3' )
       (resid  33  and name C4' )
       (resid  33  and name O4' )
       (resid  33  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  34  and name C3' )
       (resid  34  and name C4' )
       (resid  34  and name O4' )
       (resid  34  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  35  and name C3' )
       (resid  35  and name C4' )
       (resid  35  and name O4' )
       (resid  35  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
 
assign (resid  36  and name C3' )
       (resid  36  and name C4' )
       (resid  36  and name O4' )
       (resid  36  and name C1' )
$dih_force  $dih_value_V4 $dih_range_v $dih_exponent
end
set echo=off message=normal end

{RDC constraints for twj11}

assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 10 and name C1'  ) (segid TW11 and resid 10 and name H1'  )  -15.46  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 11 and name C1'  ) (segid TW11 and resid 11 and name H1'  ) 22.85  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 14 and name C1'  ) (segid TW11 and resid 14 and name H1'  ) -1.02  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 15 and name C1'  ) (segid TW11 and resid 15 and name H1'  )  8.60  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 16 and name C1'  ) (segid TW11 and resid 16 and name H1'  )  3.73  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  1 and name C1'  ) (segid TW11 and resid  1 and name H1'  ) 13.71  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  2 and name C1'  ) (segid TW11 and resid  2 and name H1'  )  5.11  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 31 and name C1'  ) (segid TW11 and resid 31 and name H1'  ) -21.19  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 32 and name C1'  ) (segid TW11 and resid 32 and name H1'  )  -7.17  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 33 and name C1'  ) (segid TW11 and resid 33 and name H1'  )  8.29  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 34 and name C1'  ) (segid TW11 and resid 34 and name H1'  ) 22.37  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 35 and name C1'  ) (segid TW11 and resid 35 and name H1'  )  7.46  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 36 and name C1'  ) (segid TW11 and resid 36 and name H1'  )  5.85  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  3 and name C1'  ) (segid TW11 and resid  3 and name H1'  ) -6.01  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  4 and name C1'  ) (segid TW11 and resid  4 and name H1'  ) -10.10  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  5 and name C1'  ) (segid TW11 and resid  5 and name H1'  )  6.97  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  6 and name C1'  ) (segid TW11 and resid  6 and name H1'  )  16.98  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  9 and name C1'  ) (segid TW11 and resid  9 and name H1'  )  -2.84  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 19 and name C1'  ) (segid TW11 and resid 19 and name H1'  )  5.59  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 20 and name C1'  ) (segid TW11 and resid 20 and name H1'  )  -3.55  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 21 and name C1'  ) (segid TW11 and resid 21 and name H1'  )  13.79   1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 24 and name C1'  ) (segid TW11 and resid 24 and name H1'  )  -14.32  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 25 and name C1'  ) (segid TW11 and resid 25 and name H1'  )  9.11  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 26 and name C1'  ) (segid TW11 and resid 26 and name H1'  )  14.35  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 15 and name C5   ) (segid TW11 and resid 15 and name H5   ) -13.05  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 16 and name C5   ) (segid TW11 and resid 16 and name H5   ) 11.24  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 10 and name C8   ) (segid TW11 and resid 10 and name H8   ) 18.34  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 11 and name C6   ) (segid TW11 and resid 11 and name H6   ) 30.00  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  1 and name C6   ) (segid TW11 and resid  1 and name H6   ) -9.26  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  2 and name C8   ) (segid TW11 and resid  2 and name H8   ) -15.45  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 31 and name C6   ) (segid TW11 and resid 31 and name H6   )  4.63  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 32 and name C8   ) (segid TW11 and resid 32 and name H8   )  8.36  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 33 and name C6   ) (segid TW11 and resid 33 and name H6   ) 15.93  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 34 and name C8   ) (segid TW11 and resid 34 and name H8   ) -1.74  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 35 and name C6   ) (segid TW11 and resid 35 and name H6   ) -20.59  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 36 and name C8   ) (segid TW11 and resid 36 and name H8   ) -2.52  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  3 and name C6   ) (segid TW11 and resid  3 and name H6   ) -18.16  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  4 and name C8   ) (segid TW11 and resid  4 and name H8   )  -5.815  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  5 and name C6   ) (segid TW11 and resid  5 and name H6   )  33.01  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  6 and name C8   ) (segid TW11 and resid  6 and name H8   ) 17.74  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid  9 and name C8   ) (segid TW11 and resid  9 and name H8   ) 16.67  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 19 and name C6   ) (segid TW11 and resid 19 and name H6   ) 2.90  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 20 and name C8   ) (segid TW11 and resid 20 and name H8   ) 12.27  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 21 and name C6   ) (segid TW11 and resid 21 and name H6   ) 37.03  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 25 and name C6   ) (segid TW11 and resid 25 and name H6   ) 24.05  1.50
assign  (segid SANI and resid 500 and name OO)
        (segid SANI and resid 500 and name X )
        (segid SANI and resid 500 and name Y )
        (segid SANI and resid 500 and name Z )
        (segid TW11 and resid 26 and name C8   ) (segid TW11 and resid 26 and name H8   ) 21.77  1.50


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    C   1          1H5*        C   1  13.831 -15.705   3.629
    2   2H5*    C   1          2H5*        C   1  14.523 -14.084   3.866
    3    H4*    C   1           H4*        C   1  14.243 -14.438   1.472
    4    H3*    C   1           H3*        C   1  12.917 -12.297   2.826
    5    H1*    C   1           H1*        C   1  11.013 -14.557   0.047
    6   1H4     C   1          1H4         C   1   5.684 -16.626   2.885
    7   2H4     C   1          2H4         C   1   6.315 -16.307   4.485
    8    H5     C   1           H5         C   1   8.545 -15.453   4.882
    9    H6     C   1           H6         C   1  10.619 -14.660   3.811
   10   1H2*    C   1          1H2*        C   1  10.732 -12.604   2.224
   11   2H2*    C   1          2H2*        C   1  11.248 -12.352   0.536
   12   1H5*    G   2          1H5*        G   2  12.936 -12.287  -1.637
   13   2H5*    G   2          2H5*        G   2  14.027 -10.995  -2.219
   14    H4*    G   2           H4*        G   2  12.315 -11.499  -3.918
   15    H3*    G   2           H3*        G   2  12.557  -8.883  -2.749
   16    H1*    G   2           H1*        G   2   9.118 -10.659  -3.699
   17    H8     G   2           H8         G   2   9.808  -9.621   0.024
   18    H1     G   2           H1         G   2   4.049 -12.156  -1.001
   19   1H2     G   2          1H2         G   2   5.148 -12.553  -4.311
   20   2H2     G   2          2H2         G   2   3.854 -12.773  -3.155
   21   1H2*    G   2          1H2*        G   2  10.445  -8.575  -1.997
   22   2H2*    G   2          2H2*        G   2   9.960  -8.512  -3.709
   23   1H5*    T   3          1H5*        T   3  10.143  -9.435  -6.654
   24   2H5*    T   3          2H5*        T   3  10.797  -8.326  -7.881
   25    H4*    T   3           H4*        T   3   8.449  -8.599  -8.353
   26    H3*    T   3           H3*        T   3   9.436  -5.997  -7.583
   27   1H2*    T   3          1H2*        T   3   7.934  -5.474  -5.964
   28   2H2*    T   3          2H2*        T   3   6.700  -5.467  -7.237
   29    H1*    T   3           H1*        T   3   5.898  -7.562  -6.757
   30    H3     T   3           H3         T   3   3.926  -8.011  -2.726
   31   1H5M    T   3          1H5M        T   3   8.766  -6.409  -1.434
   32   2H5M    T   3          2H5M        T   3   7.377  -5.812  -0.502
   33   3H5M    T   3          3H5M        T   3   8.017  -4.855  -1.860
   34    H6     T   3           H6         T   3   8.221  -6.298  -4.053
   35   1H5*    G   4          1H5*        G   4   5.486  -6.262  -9.655
   36   2H5*    G   4          2H5*        G   4   5.290  -5.165 -11.053
   37    H4*    G   4           H4*        G   4   3.187  -5.373  -9.764
   38    H3*    G   4           H3*        G   4   4.445  -2.824 -10.208
   39    H1*    G   4           H1*        G   4   2.428  -4.016  -7.087
   40    H8     G   4           H8         G   4   6.094  -2.888  -6.264
   41    H1     G   4           H1         G   4   2.522  -4.315  -1.186
   42   1H2     G   4          1H2         G   4   0.068  -5.161  -3.551
   43   2H2     G   4          2H2         G   4   0.496  -5.035  -1.860
   44   1H2*    G   4          1H2*        G   4   4.715  -2.224  -8.011
   45   2H2*    G   4          2H2*        G   4   2.973  -1.945  -8.059
   46   1H5*    C   5          1H5*        C   5  -0.401  -3.039  -9.335
   47   2H5*    C   5          2H5*        C   5  -1.037  -1.978 -10.611
   48    H4*    C   5           H4*        C   5  -2.534  -1.983  -8.644
   49    H3*    C   5           H3*        C   5  -1.405   0.451  -9.736
   50    H1*    C   5           H1*        C   5  -2.149  -0.333  -5.869
   51   1H4     C   5          1H4         C   5   4.014   1.302  -3.819
   52   2H4     C   5          2H4         C   5   2.943   1.497  -2.450
   53    H5     C   5           H5         C   5   3.263   0.581  -5.991
   54    H6     C   5           H6         C   5   1.338  -0.155  -7.303
   55   1H2*    C   5          1H2*        C   5  -0.681   1.439  -7.830
   56   2H2*    C   5          2H2*        C   5  -2.391   1.487  -7.322
   57   1H5*    A   6          1H5*        A   6  -5.129   0.762  -7.085
   58   2H5*    A   6          2H5*        A   6  -6.415   1.603  -7.980
   59    H4*    A   6           H4*        A   6  -6.544   2.047  -5.545
   60    H3*    A   6           H3*        A   6  -6.441   4.165  -7.515
   61    H1*    A   6           H1*        A   6  -5.030   4.117  -3.848
   62    H8     A   6           H8         A   6  -2.382   4.808  -6.701
   63   1H6     A   6          1H6         A   6   1.335   6.001  -3.926
   64   2H6     A   6          2H6         A   6   1.593   6.035  -2.195
   65    H2     A   6           H2         A   6  -2.254   4.757  -0.266
   66   1H2*    A   6          1H2*        A   6  -4.759   5.399  -6.584
   67   2H2*    A   6          2H2*        A   6  -5.921   5.755  -5.278
   68   1H5*    G   7          1H5*        G   7  -8.078   5.455  -3.149
   69   2H5*    G   7          2H5*        G   7  -9.578   6.349  -3.523
   70    H4*    G   7           H4*        G   7  -8.429   7.471  -1.696
   71    H3*    G   7           H3*        G   7  -8.825   8.861  -4.175
   72    H1*    G   7           H1*        G   7  -5.828   9.194  -1.699
   73    H8     G   7           H8         G   7  -4.697   8.126  -5.307
   74    H1     G   7           H1         G   7   0.057   9.096  -1.182
   75   1H2     G   7          1H2         G   7  -0.764   9.533   0.858
   76   2H2     G   7          2H2         G   7  -2.482   9.567   1.186
   77   1H2*    G   7          1H2*        G   7  -6.607   9.278  -4.645
   78   2H2*    G   7          2H2*        G   7  -6.785  10.527  -3.397
   79   1H5*    C   8          1H5*        C   8  -8.502  10.972   0.101
   80   2H5*    C   8          2H5*        C   8  -9.623  12.349   0.149
   81    H4*    C   8           H4*        C   8  -7.668  12.577   1.721
   82    H3*    C   8           H3*        C   8  -8.500  14.634  -0.158
   83    H1*    C   8           H1*        C   8  -4.735  13.753   0.901
   84   1H4     C   8          1H4         C   8  -2.665  13.220  -5.422
   85   2H4     C   8          2H4         C   8  -1.247  13.488  -4.433
   86    H5     C   8           H5         C   8  -4.897  13.120  -4.517
   87    H6     C   8           H6         C   8  -6.262  13.239  -2.506
   88   1H2*    C   8          1H2*        C   8  -6.486  15.279  -0.977
   89   2H2*    C   8          2H2*        C   8  -5.998  15.659   0.689
   90   1H5*    G   9          1H5*        G   9  -6.122  15.911   3.423
   91   2H5*    G   9          2H5*        G   9  -6.959  17.137   4.415
   92    H4*    G   9           H4*        G   9  -4.428  17.305   4.367
   93    H3*    G   9           H3*        G   9  -6.220  19.534   3.906
   94    H1*    G   9           H1*        G   9  -2.693  18.838   2.176
   95    H8     G   9           H8         G   9  -5.898  19.337  -0.077
   96    H1     G   9           H1         G   9  -0.409  18.618  -3.233
   97   1H2     G   9          1H2         G   9   1.278  18.336  -1.779
   98   2H2     G   9          2H2         G   9   1.023  18.310  -0.050
   99   1H2*    G   9          1H2*        G   9  -5.288  20.385   2.014
  100   2H2*    G   9          2H2*        G   9  -3.837  20.721   2.990
  101   1H5*    G  10          1H5*        G  10  -1.774  20.672   5.152
  102   2H5*    G  10          2H5*        G  10  -1.973  21.720   6.586
  103    H4*    G  10           H4*        G  10  -0.075  22.488   5.240
  104    H3*    G  10           H3*        G  10  -2.339  24.204   5.703
  105    H1*    G  10           H1*        G  10  -0.202  24.013   2.351
  106    H8     G  10           H8         G  10  -4.043  23.195   2.235
  107    H1     G  10           H1         G  10  -1.131  23.165  -3.435
  108   1H2     G  10          1H2         G  10   1.049  23.619  -3.182
  109   2H2     G  10          2H2         G  10   1.766  23.913  -1.614
  110   1H2*    G  10          1H2*        G  10  -2.833  24.808   3.555
  111   2H2*    G  10          2H2*        G  10  -1.266  25.657   3.562
  112   1H5*    C  11          1H5*        C  11  -0.578  28.991   5.873
  113   2H5*    C  11          2H5*        C  11  -1.838  28.937   4.619
  114    H4*    C  11           H4*        C  11   1.044  27.923   4.398
  115    H3*    C  11           H3*        C  11  -0.045  30.442   3.686
  116    H1*    C  11           H1*        C  11   0.611  27.541   1.136
  117   1H4     C  11          1H4         C  11  -4.524  25.850  -2.334
  118   2H4     C  11          2H4         C  11  -5.592  26.081  -0.967
  119    H5     C  11           H5         C  11  -4.826  26.829   1.196
  120    H6     C  11           H6         C  11  -2.902  27.642   2.475
  121   1H2*    C  11          1H2*        C  11  -1.343  29.738   1.882
  122   2H2*    C  11          2H2*        C  11   0.226  29.844   1.030
  123   1H5*    T  12          1H5*        T  12   3.996  32.006   0.108
  124   2H5*    T  12          2H5*        T  12   2.385  32.717  -0.144
  125    H4*    T  12           H4*        T  12   3.295  32.006  -2.315
  126    H3*    T  12           H3*        T  12   0.795  31.058  -1.359
  127   1H2*    T  12          1H2*        T  12   1.214  28.809  -1.187
  128   2H2*    T  12          2H2*        T  12   1.160  28.844  -2.978
  129    H1*    T  12           H1*        T  12   3.464  28.708  -3.190
  130    H3     T  12           H3         T  12   3.783  24.483  -1.447
  131   1H5M    T  12          1H5M        T  12   5.443  27.643   2.396
  132   2H5M    T  12          2H5M        T  12   4.681  26.095   2.830
  133   3H5M    T  12          3H5M        T  12   3.717  27.590   2.836
  134    H6     T  12           H6         T  12   3.859  28.906   0.475
  135   1H5*    T  13          1H5*        T  13   0.187  29.860  -5.174
  136   2H5*    T  13          2H5*        T  13  -0.003  31.117  -6.417
  137    H4*    T  13           H4*        T  13  -1.337  29.038  -6.920
  138    H3*    T  13           H3*        T  13  -2.350  31.697  -7.069
  139   1H2*    T  13          1H2*        T  13  -3.943  31.617  -5.409
  140   2H2*    T  13          2H2*        T  13  -4.856  30.645  -6.590
  141    H1*    T  13           H1*        T  13  -4.387  28.643  -5.508
  142    H3     T  13           H3         T  13  -6.790  29.270  -1.708
  143   1H5M    T  13          1H5M        T  13  -2.564  32.453  -1.095
  144   2H5M    T  13          2H5M        T  13  -2.061  30.931  -0.319
  145   3H5M    T  13          3H5M        T  13  -3.460  31.831   0.310
  146    H6     T  13           H6         T  13  -2.463  30.819  -3.169
  147   1H5*    G  14          1H5*        G  14  -1.519  29.056 -12.007
  148   2H5*    G  14          2H5*        G  14  -2.418  27.527 -11.882
  149    H4*    G  14           H4*        G  14   0.411  28.126 -11.368
  150    H3*    G  14           H3*        G  14  -1.090  25.787 -12.059
  151    H1*    G  14           H1*        G  14   0.598  26.109  -8.339
  152    H8     G  14           H8         G  14  -3.146  25.871  -9.426
  153    H1     G  14           H1         G  14  -2.216  26.126  -3.131
  154   1H2     G  14          1H2         G  14   1.173  26.483  -3.970
  155   2H2     G  14          2H2         G  14  -0.023  26.383  -2.697
  156   1H2*    G  14          1H2*        G  14  -1.189  24.620 -10.113
  157   2H2*    G  14          2H2*        G  14   0.581  24.622 -10.082
  158   1H5*    C  15          1H5*        C  15   3.179  25.681 -10.767
  159   2H5*    C  15          2H5*        C  15   4.276  24.524 -11.555
  160    H4*    C  15           H4*        C  15   4.785  24.698  -9.158
  161    H3*    C  15           H3*        C  15   4.096  22.168 -10.388
  162    H1*    C  15           H1*        C  15   3.298  23.364  -6.694
  163   1H4     C  15          1H4         C  15  -3.235  22.142  -6.366
  164   2H4     C  15          2H4         C  15  -2.692  22.681  -4.793
  165    H5     C  15           H5         C  15  -1.781  21.880  -8.220
  166    H6     C  15           H6         C  15   0.504  22.307  -9.117
  167   1H2*    C  15          1H2*        C  15   2.625  21.385  -8.844
  168   2H2*    C  15          2H2*        C  15   3.966  21.409  -7.674
  169   1H5*    C  16          1H5*        C  16   6.136  22.043  -6.379
  170   2H5*    C  16          2H5*        C  16   7.780  21.442  -6.696
  171    H4*    C  16           H4*        C  16   7.291  20.753  -4.472
  172    H3*    C  16           H3*        C  16   7.505  18.701  -6.480
  173    H1*    C  16           H1*        C  16   4.928  18.660  -3.433
  174   1H4     C  16          1H4         C  16  -0.674  18.314  -7.088
  175   2H4     C  16          2H4         C  16  -1.117  18.111  -5.408
  176    H5     C  16           H5         C  16   1.614  18.548  -7.828
  177    H6     C  16           H6         C  16   3.939  18.876  -7.096
  178   1H2*    C  16          1H2*        C  16   5.588  17.521  -6.093
  179   2H2*    C  16          2H2*        C  16   6.236  17.163  -4.482
  180   1H5*    G  17          1H5*        G  17   7.268  18.465  -2.267
  181   2H5*    G  17          2H5*        G  17   8.846  18.112  -1.508
  182    H4*    G  17           H4*        G  17   7.142  17.823   0.174
  183    H3*    G  17           H3*        G  17   8.659  15.556  -0.635
  184    H1*    G  17           H1*        G  17   4.796  15.509   0.273
  185    H8     G  17           H8         G  17   5.619  15.034  -3.554
  186    H1     G  17           H1         G  17  -0.356  13.563  -1.908
  187   1H2     G  17          1H2         G  17   0.653  14.396   1.348
  188   2H2     G  17          2H2         G  17  -0.639  13.855   0.301
  189   1H2*    G  17          1H2*        G  17   6.965  14.288  -1.477
  190   2H2*    G  17          2H2*        G  17   6.606  13.943   0.242
  191   1H5*    G  18          1H5*        G  18   6.608  16.843   4.026
  192   2H5*    G  18          2H5*        G  18   8.290  17.089   3.479
  193    H4*    G  18           H4*        G  18   7.205  16.252   6.226
  194    H3*    G  18           H3*        G  18   8.439  18.713   5.155
  195    H1*    G  18           H1*        G  18  10.084  16.070   7.689
  196    H8     G  18           H8         G  18  11.433  16.992   4.125
  197    H1     G  18           H1         G  18  15.756  14.521   8.094
  198   1H2     G  18          1H2         G  18  14.798  14.073  10.082
  199   2H2     G  18          2H2         G  18  13.106  14.390  10.391
  200   1H2*    G  18          1H2*        G  18  10.470  18.551   6.124
  201   2H2*    G  18          2H2*        G  18   9.686  18.333   7.711
  202   1H5*    C  19          1H5*        C  19   7.956  18.599   9.829
  203   2H5*    C  19          2H5*        C  19   6.916  20.006  10.153
  204    H4*    C  19           H4*        C  19   8.481  19.727  12.006
  205    H3*    C  19           H3*        C  19   8.441  22.153  10.434
  206    H1*    C  19           H1*        C  19  11.710  20.451  11.963
  207   1H4     C  19          1H4         C  19  14.868  19.998   6.089
  208   2H4     C  19          2H4         C  19  16.034  19.609   7.333
  209    H5     C  19           H5         C  19  12.579  20.583   6.578
  210    H6     C  19           H6         C  19  10.903  20.890   8.305
  211   1H2*    C  19          1H2*        C  19  10.670  22.486  10.090
  212   2H2*    C  19          2H2*        C  19  10.865  22.530  11.858
  213   1H5*    A  20          1H5*        A  20  10.068  22.352  14.787
  214   2H5*    A  20          2H5*        A  20   9.280  23.692  15.654
  215    H4*    A  20           H4*        A  20  11.625  23.471  16.386
  216    H3*    A  20           H3*        A  20  10.571  25.929  15.309
  217    H1*    A  20           H1*        A  20  14.242  24.491  14.739
  218    H8     A  20           H8         A  20  11.949  25.162  11.615
  219   1H6     A  20          1H6         A  20  16.698  23.297   8.212
  220   2H6     A  20          2H6         A  20  15.077  23.954   8.189
  221    H2     A  20           H2         A  20  17.846  22.802  12.527
  222   1H2*    A  20          1H2*        A  20  12.082  26.318  13.655
  223   2H2*    A  20          2H2*        A  20  13.260  26.582  14.968
  224   1H5*    C  21          1H5*        C  21  12.804  29.702  17.922
  225   2H5*    C  21          2H5*        C  21  12.846  30.215  16.221
  226    H4*    C  21           H4*        C  21  14.796  28.391  17.702
  227    H3*    C  21           H3*        C  21  15.022  31.091  16.939
  228    H1*    C  21           H1*        C  21  16.573  28.156  14.802
  229   1H4     C  21          1H4         C  21  14.430  27.605   8.824
  230   2H4     C  21          2H4         C  21  12.849  28.210   9.263
  231    H5     C  21           H5         C  21  12.277  28.903  11.514
  232    H6     C  21           H6         C  21  13.155  29.345  13.761
  233   1H2*    C  21          1H2*        C  21  15.082  30.796  14.626
  234   2H2*    C  21          2H2*        C  21  16.804  30.478  14.970
  235   1H5*    T  22          1H5*        T  22  20.733  31.054  17.407
  236   2H5*    T  22          2H5*        T  22  20.168  32.374  16.355
  237    H4*    T  22           H4*        T  22  22.068  31.260  15.263
  238    H3*    T  22           H3*        T  22  19.590  31.534  13.977
  239   1H2*    T  22          1H2*        T  22  18.881  29.333  13.916
  240   2H2*    T  22          2H2*        T  22  20.060  29.201  12.588
  241    H1*    T  22           H1*        T  22  21.638  28.110  13.885
  242    H3     T  22           H3         T  22  19.766  24.105  14.830
  243   1H5M    T  22          1H5M        T  22  16.460  26.347  17.550
  244   2H5M    T  22          2H5M        T  22  17.334  27.816  18.036
  245   3H5M    T  22          3H5M        T  22  17.792  26.244  18.727
  246    H6     T  22           H6         T  22  18.931  28.573  16.429
  247   1H5*    T  23          1H5*        T  23  21.001  28.732  10.411
  248   2H5*    T  23          2H5*        T  23  21.894  30.087   9.693
  249    H4*    T  23           H4*        T  23  20.636  28.670   8.017
  250    H3*    T  23           H3*        T  23  20.479  31.594   8.227
  251   1H2*    T  23          1H2*        T  23  18.297  31.922   7.741
  252   2H2*    T  23          2H2*        T  23  18.482  30.920   6.280
  253    H1*    T  23           H1*        T  23  17.407  29.163   7.265
  254    H3     T  23           H3         T  23  13.618  31.295   8.684
  255   1H5M    T  23          1H5M        T  23  17.551  32.993  11.780
  256   2H5M    T  23          2H5M        T  23  16.724  31.826  12.845
  257   3H5M    T  23          3H5M        T  23  15.855  33.260  12.263
  258    H6     T  23           H6         T  23  18.025  30.770  10.575
  259   1H5*    G  24          1H5*        G  24  24.577  28.766   5.606
  260   2H5*    G  24          2H5*        G  24  23.819  27.858   4.283
  261    H4*    G  24           H4*        G  24  24.583  26.992   6.960
  262    H3*    G  24           H3*        G  24  24.008  25.679   4.481
  263    H1*    G  24           H1*        G  24  21.944  25.073   7.886
  264    H8     G  24           H8         G  24  19.993  26.012   4.638
  265    H1     G  24           H1         G  24  16.571  26.498   9.986
  266   1H2     G  24          1H2         G  24  19.636  25.963  11.618
  267   2H2     G  24          2H2         G  24  17.919  26.256  11.777
  268   1H2*    G  24          1H2*        G  24  21.889  24.890   4.872
  269   2H2*    G  24          2H2*        G  24  22.659  23.847   6.073
  270   1H5*    T  25          1H5*        T  25  25.724  23.386   8.373
  271   2H5*    T  25          2H5*        T  25  26.649  21.956   7.865
  272    H4*    T  25           H4*        T  25  25.540  21.681  10.096
  273    H3*    T  25           H3*        T  25  25.297  19.769   7.925
  274   1H2*    T  25          1H2*        T  25  23.066  19.331   8.027
  275   2H2*    T  25          2H2*        T  25  23.314  18.801   9.707
  276    H1*    T  25           H1*        T  25  22.510  20.725  10.598
  277    H3     T  25           H3         T  25  18.329  22.037   9.658
  278   1H5M    T  25          1H5M        T  25  20.196  20.650   4.949
  279   2H5M    T  25          2H5M        T  25  20.689  22.357   4.969
  280   3H5M    T  25          3H5M        T  25  18.965  21.928   5.054
  281    H6     T  25           H6         T  25  22.106  21.022   6.841
  282   1H5*    G  26          1H5*        G  26  24.865  18.328  12.340
  283   2H5*    G  26          2H5*        G  26  25.769  16.810  12.606
  284    H4*    G  26           H4*        G  26  23.633  16.876  13.882
  285    H3*    G  26           H3*        G  26  24.258  14.774  12.003
  286    H1*    G  26           H1*        G  26  20.663  16.373  12.633
  287    H8     G  26           H8         G  26  22.238  16.377   9.044
  288    H1     G  26           H1         G  26  16.398  18.911   9.398
  289   1H2     G  26          1H2         G  26  16.669  18.299  12.840
  290   2H2     G  26          2H2         G  26  15.688  18.915  11.528
  291   1H2*    G  26          1H2*        G  26  22.358  14.756  10.768
  292   2H2*    G  26          2H2*        G  26  21.500  14.273  12.243
  293   1H5*    C  27          1H5*        C  27  21.752  10.376  14.219
  294   2H5*    C  27          2H5*        C  27  21.634  11.065  12.581
  295    H4*    C  27           H4*        C  27  19.500  11.224  14.771
  296    H3*    C  27           H3*        C  27  19.911   9.225  12.679
  297    H1*    C  27           H1*        C  27  17.213  12.273  12.589
  298   1H4     C  27          1H4         C  27  19.503  14.454   6.696
  299   2H4     C  27          2H4         C  27  17.793  14.816   6.756
  300    H5     C  27           H5         C  27  20.674  13.326   8.482
  301    H6     C  27           H6         C  27  20.434  12.169  10.628
  302   1H2*    C  27          1H2*        C  27  18.550  10.088  11.043
  303   2H2*    C  27          2H2*        C  27  17.191  10.002  12.195
  304   1H5*    T  28          1H5*        T  28  14.898   7.022  13.951
  305   2H5*    T  28          2H5*        T  28  15.330   6.641  12.269
  306    H4*    T  28           H4*        T  28  13.021   7.575  12.430
  307    H3*    T  28           H3*        T  28  15.054   8.655  10.687
  308   1H2*    T  28          1H2*        T  28  14.981  10.856  11.311
  309   2H2*    T  28          2H2*        T  28  13.338  10.870  10.618
  310    H1*    T  28           H1*        T  28  12.333  10.789  12.731
  311    H3     T  28           H3         T  28  14.294  14.942  13.603
  312   1H5M    T  28          1H5M        T  28  15.919  11.594  17.291
  313   2H5M    T  28          2H5M        T  28  16.949  12.989  16.894
  314   3H5M    T  28          3H5M        T  28  17.288  11.402  16.167
  315    H6     T  28           H6         T  28  15.139  10.372  14.898
  316   1H5*    T  29          1H5*        T  29  11.521  10.304   8.846
  317   2H5*    T  29          2H5*        T  29  10.711   8.943   8.037
  318    H4*    T  29           H4*        T  29  10.174  11.120   6.929
  319    H3*    T  29           H3*        T  29  11.110   8.804   5.543
  320   1H2*    T  29          1H2*        T  29  13.054   9.588   4.625
  321   2H2*    T  29          2H2*        T  29  11.997  10.571   3.588
  322    H1*    T  29           H1*        T  29  12.451  12.516   4.756
  323    H3     T  29           H3         T  29  16.910  13.155   4.244
  324   1H5M    T  29          1H5M        T  29  16.612  10.224   8.575
  325   2H5M    T  29          2H5M        T  29  18.028  10.026   7.516
  326   3H5M    T  29          3H5M        T  29  16.662   8.893   7.391
  327    H6     T  29           H6         T  29  14.309  10.128   6.942
  328   1H5*    C  30          1H5*        C  30   6.744  11.947   3.093
  329   2H5*    C  30          2H5*        C  30   7.264  12.074   4.780
  330    H4*    C  30           H4*        C  30   5.101  11.846   5.425
  331    H3*    C  30           H3*        C  30   5.697   9.146   4.586
  332    H1*    C  30           H1*        C  30   2.366  11.192   3.678
  333   1H4     C  30          1H4         C  30   3.231  10.013  -2.866
  334   2H4     C  30          2H4         C  30   1.537   9.722  -2.544
  335    H5     C  30           H5         C  30   4.815  10.589  -1.149
  336    H6     C  30           H6         C  30   5.124  11.050   1.243
  337   1H2*    C  30          1H2*        C  30   4.073   8.820   3.065
  338   2H2*    C  30          2H2*        C  30   2.899   9.059   4.370
  339   1H5*    T  31          1H5*        T  31   1.546   8.501   6.531
  340   2H5*    T  31          2H5*        T  31   2.031   7.616   7.994
  341    H4*    T  31           H4*        T  31   0.096   6.495   7.082
  342    H3*    T  31           H3*        T  31   2.635   5.107   7.192
  343   1H2*    T  31          1H2*        T  31   2.714   4.205   5.111
  344   2H2*    T  31          2H2*        T  31   1.220   3.334   5.519
  345    H1*    T  31           H1*        T  31  -0.136   4.745   4.354
  346    H3     T  31           H3         T  31   0.653   5.050  -0.047
  347   1H5M    T  31          1H5M        T  31   5.321   5.440   0.976
  348   2H5M    T  31          2H5M        T  31   5.283   6.267   2.544
  349   3H5M    T  31          3H5M        T  31   4.895   7.161   1.056
  350    H6     T  31           H6         T  31   3.378   5.889   3.826
  351   1H5*    G  32          1H5*        G  32  -1.354   2.728   7.188
  352   2H5*    G  32          2H5*        G  32  -1.333   1.497   8.484
  353    H4*    G  32           H4*        G  32  -2.634   0.704   6.557
  354    H3*    G  32           H3*        G  32  -0.289  -0.720   7.457
  355    H1*    G  32           H1*        G  32  -1.536  -0.317   3.708
  356    H8     G  32           H8         G  32   2.022   1.098   4.664
  357    H1     G  32           H1         G  32   0.747   0.900  -1.578
  358   1H2     G  32          1H2         G  32  -1.335   0.121  -1.911
  359   2H2     G  32          2H2         G  32  -2.386  -0.330  -0.587
  360   1H2*    G  32          1H2*        G  32   0.818  -0.927   5.474
  361   2H2*    G  32          2H2*        G  32  -0.528  -1.974   4.957
  362   1H5*    C  33          1H5*        C  33  -3.680  -2.923   5.111
  363   2H5*    C  33          2H5*        C  33  -4.143  -4.389   6.007
  364    H4*    C  33           H4*        C  33  -4.445  -4.707   3.568
  365    H3*    C  33           H3*        C  33  -2.839  -6.471   5.194
  366    H1*    C  33           H1*        C  33  -2.189  -5.389   1.416
  367   1H4     C  33          1H4         C  33   3.850  -3.480   0.479
  368   2H4     C  33          2H4         C  33   4.109  -3.221   2.190
  369    H5     C  33           H5         C  33   2.416  -3.667   3.856
  370    H6     C  33           H6         C  33   0.115  -4.343   4.251
  371   1H2*    C  33          1H2*        C  33  -0.913  -6.474   3.988
  372   2H2*    C  33          2H2*        C  33  -1.846  -7.309   2.723
  373   1H5*    A  34          1H5*        A  34  -5.347  -8.340   1.341
  374   2H5*    A  34          2H5*        A  34  -5.988  -9.838   2.057
  375    H4*    A  34           H4*        A  34  -5.626 -10.145  -0.363
  376    H3*    A  34           H3*        A  34  -4.369 -11.831   1.607
  377    H1*    A  34           H1*        A  34  -2.471 -10.504  -1.717
  378    H8     A  34           H8         A  34  -1.600  -9.773   1.990
  379   1H6     A  34          1H6         A  34   3.730  -7.523  -0.051
  380   2H6     A  34          2H6         A  34   2.742  -7.838   1.358
  381    H2     A  34           H2         A  34   1.339  -8.882  -3.623
  382   1H2*    A  34          1H2*        A  34  -2.217 -11.858   0.901
  383   2H2*    A  34          2H2*        A  34  -2.780 -12.481  -0.646
  384   1H5*    C  35          1H5*        C  35  -4.395 -13.237  -2.631
  385   2H5*    C  35          2H5*        C  35  -4.957 -14.910  -2.848
  386    H4*    C  35           H4*        C  35  -3.077 -14.389  -4.373
  387    H3*    C  35           H3*        C  35  -3.015 -16.610  -2.517
  388    H1*    C  35           H1*        C  35   0.067 -14.316  -3.656
  389   1H4     C  35          1H4         C  35   3.337 -12.276   1.447
  390   2H4     C  35          2H4         C  35   2.045 -12.709   2.544
  391    H5     C  35           H5         C  35  -0.017 -13.727   1.817
  392    H6     C  35           H6         C  35  -1.303 -14.522  -0.099
  393   1H2*    C  35          1H2*        C  35  -0.942 -16.355  -1.631
  394   2H2*    C  35          2H2*        C  35  -0.297 -16.586  -3.282
  395   1H5*    G  36          1H5*        G  36   0.040 -16.815  -5.910
  396   2H5*    G  36          2H5*        G  36  -0.547 -18.144  -6.950
  397    H4*    G  36           H4*        G  36   1.870 -18.045  -7.126
  398    H3*    G  36           H3*        G  36   0.630 -20.366  -5.973
  399    H1*    G  36           H1*        G  36   4.095 -18.748  -4.846
  400    H8     G  36           H8         G  36   1.074 -18.553  -2.309
  401    H1     G  36           H1         G  36   6.753 -17.257   0.248
  402   1H2     G  36          1H2         G  36   7.983 -17.604  -3.011
  403   2H2     G  36          2H2         G  36   8.330 -17.234  -1.336
  404   1H2*    G  36          1H2*        G  36   1.855 -20.523  -3.975
  405   2H2*    G  36          2H2*        G  36   3.254 -20.856  -5.036
  Start of MODEL    2
    1   1H5*    C   1          1H5*        C   1  10.979 -20.611  -0.175
    2   2H5*    C   1          2H5*        C   1  12.069 -19.487   0.672
    3    H4*    C   1           H4*        C   1  12.024 -18.956  -1.732
    4    H3*    C   1           H3*        C   1  11.323 -17.022   0.281
    5    H1*    C   1           H1*        C   1   9.318 -17.433  -3.221
    6   1H4     C   1          1H4         C   1   3.156 -17.923  -1.539
    7   2H4     C   1          2H4         C   1   3.566 -18.495   0.063
    8    H5     C   1           H5         C   1   5.845 -18.786   0.823
    9    H6     C   1           H6         C   1   8.223 -18.507   0.212
   10   1H2*    C   1          1H2*        C   1   9.338 -16.222  -0.513
   11   2H2*    C   1          2H2*        C   1  10.215 -15.706  -1.979
   12   1H5*    G   2          1H5*        G   2  12.262 -15.166  -3.621
   13   2H5*    G   2          2H5*        G   2  13.726 -14.142  -3.557
   14    H4*    G   2           H4*        G   2  12.010 -13.235  -5.104
   15    H3*    G   2           H3*        G   2  13.053 -11.716  -2.877
   16    H1*    G   2           H1*        G   2   9.338 -11.644  -4.294
   17    H8     G   2           H8         G   2   9.990 -12.432  -0.518
   18    H1     G   2           H1         G   2   3.834 -12.263  -2.130
   19   1H2     G   2          1H2         G   2   5.008 -11.530  -5.349
   20   2H2     G   2          2H2         G   2   3.624 -11.770  -4.307
   21   1H2*    G   2          1H2*        G   2  11.111 -11.008  -1.944
   22   2H2*    G   2          2H2*        G   2  10.825 -10.089  -3.441
   23   1H5*    T   3          1H5*        T   3  11.006  -9.974  -6.403
   24   2H5*    T   3          2H5*        T   3  11.900  -8.671  -7.219
   25    H4*    T   3           H4*        T   3   9.555  -8.277  -7.588
   26    H3*    T   3           H3*        T   3  11.080  -6.357  -6.063
   27   1H2*    T   3          1H2*        T   3   9.692  -6.105  -4.280
   28   2H2*    T   3          2H2*        T   3   8.510  -5.407  -5.399
   29    H1*    T   3           H1*        T   3   7.268  -7.345  -5.610
   30    H3     T   3           H3         T   3   5.172  -8.722  -1.863
   31   1H5M    T   3          1H5M        T   3   9.807  -7.044  -0.154
   32   2H5M    T   3          2H5M        T   3  10.267  -8.730  -0.486
   33   3H5M    T   3          3H5M        T   3   9.027  -8.370   0.739
   34    H6     T   3           H6         T   3   9.743  -7.538  -2.769
   35   1H5*    G   4          1H5*        G   4   7.332  -5.628  -7.907
   36   2H5*    G   4          2H5*        G   4   7.246  -4.445  -9.243
   37    H4*    G   4           H4*        G   4   5.046  -4.694  -8.172
   38    H3*    G   4           H3*        G   4   6.365  -2.156  -8.292
   39    H1*    G   4           H1*        G   4   4.097  -3.486  -5.425
   40    H8     G   4           H8         G   4   7.754  -2.725  -4.231
   41    H1     G   4           H1         G   4   3.643  -4.066   0.453
   42   1H2     G   4          1H2         G   4   1.319  -4.508  -2.142
   43   2H2     G   4          2H2         G   4   1.619  -4.514  -0.419
   44   1H2*    G   4          1H2*        G   4   6.565  -1.812  -6.018
   45   2H2*    G   4          2H2*        G   4   4.852  -1.386  -6.139
   46   1H5*    C   5          1H5*        C   5   1.892  -2.698  -7.082
   47   2H5*    C   5          2H5*        C   5   1.079  -2.008  -8.505
   48    H4*    C   5           H4*        C   5  -0.565  -2.000  -6.774
   49    H3*    C   5           H3*        C   5   0.443   0.548  -7.686
   50    H1*    C   5           H1*        C   5  -0.488  -0.334  -3.846
   51   1H4     C   5          1H4         C   5   5.533   1.563  -1.622
   52   2H4     C   5          2H4         C   5   4.430   1.609  -0.265
   53    H5     C   5           H5         C   5   4.855   0.946  -3.859
   54    H6     C   5           H6         C   5   2.988   0.195  -5.254
   55   1H2*    C   5          1H2*        C   5   0.844   1.594  -5.720
   56   2H2*    C   5          2H2*        C   5  -0.889   1.404  -5.348
   57   1H5*    A   6          1H5*        A   6  -3.581   0.347  -5.661
   58   2H5*    A   6          2H5*        A   6  -4.881   1.140  -6.578
   59    H4*    A   6           H4*        A   6  -5.178   1.322  -4.094
   60    H3*    A   6           H3*        A   6  -5.332   3.564  -5.909
   61    H1*    A   6           H1*        A   6  -4.007   3.482  -2.216
   62    H8     A   6           H8         A   6  -1.414   4.714  -4.930
   63   1H6     A   6          1H6         A   6   2.131   6.027  -1.988
   64   2H6     A   6          2H6         A   6   2.336   5.999  -0.250
   65    H2     A   6           H2         A   6  -1.402   4.228   1.486
   66   1H2*    A   6          1H2*        A   6  -3.800   4.910  -4.888
   67   2H2*    A   6          2H2*        A   6  -5.030   5.093  -3.606
   68   1H5*    G   7          1H5*        G   7  -7.316   4.803  -1.555
   69   2H5*    G   7          2H5*        G   7  -8.872   5.461  -2.133
   70    H4*    G   7           H4*        G   7  -7.975   6.921  -0.397
   71    H3*    G   7           H3*        G   7  -8.387   7.934  -3.049
   72    H1*    G   7           H1*        G   7  -5.568   8.937  -0.531
   73    H8     G   7           H8         G   7  -4.184   7.637  -3.960
   74    H1     G   7           H1         G   7   0.300   9.298   0.237
   75   1H2     G   7          1H2         G   7  -0.624   9.857   2.196
   76   2H2     G   7          2H2         G   7  -2.353   9.805   2.460
   77   1H2*    G   7          1H2*        G   7  -6.215   8.554  -3.484
   78   2H2*    G   7          2H2*        G   7  -6.593   9.922  -2.419
   79   1H5*    C   8          1H5*        C   8  -8.126  10.352   0.902
   80   2H5*    C   8          2H5*        C   8  -9.456  11.531   0.962
   81    H4*    C   8           H4*        C   8  -7.638  12.193   2.475
   82    H3*    C   8           H3*        C   8  -8.554  13.935   0.339
   83    H1*    C   8           H1*        C   8  -4.769  13.586   1.649
   84   1H4     C   8          1H4         C   8  -2.504  12.580  -4.560
   85   2H4     C   8          2H4         C   8  -1.115  12.932  -3.558
   86    H5     C   8           H5         C   8  -4.751  12.494  -3.703
   87    H6     C   8           H6         C   8  -6.174  12.739  -1.753
   88   1H2*    C   8          1H2*        C   8  -6.582  14.777  -0.389
   89   2H2*    C   8          2H2*        C   8  -6.242  15.305   1.271
   90   1H5*    G   9          1H5*        G   9  -6.770  15.710   3.911
   91   2H5*    G   9          2H5*        G   9  -7.624  17.047   4.727
   92    H4*    G   9           H4*        G   9  -5.081  17.191   4.674
   93    H3*    G   9           H3*        G   9  -6.869  19.367   3.954
   94    H1*    G   9           H1*        G   9  -3.334  18.412   2.364
   95    H8     G   9           H8         G   9  -6.486  18.865   0.018
   96    H1     G   9           H1         G   9  -0.950  17.746  -2.950
   97   1H2     G   9          1H2         G   9   0.691  17.499  -1.438
   98   2H2     G   9          2H2         G   9   0.390  17.591   0.282
   99   1H2*    G   9          1H2*        G   9  -5.900  20.010   2.031
  100   2H2*    G   9          2H2*        G   9  -4.452  20.435   2.978
  101   1H5*    G  10          1H5*        G  10  -2.541  21.084   5.266
  102   2H5*    G  10          2H5*        G  10  -2.982  22.372   6.422
  103    H4*    G  10           H4*        G  10  -1.142  23.070   4.926
  104    H3*    G  10           H3*        G  10  -3.618  24.549   5.085
  105    H1*    G  10           H1*        G  10  -1.317  24.021   1.890
  106    H8     G  10           H8         G  10  -5.012  22.695   1.749
  107    H1     G  10           H1         G  10  -1.867  22.626  -3.793
  108   1H2     G  10          1H2         G  10   0.229  23.362  -3.488
  109   2H2     G  10          2H2         G  10   0.820  23.863  -1.921
  110   1H2*    G  10          1H2*        G  10  -4.096  24.708   2.857
  111   2H2*    G  10          2H2*        G  10  -2.649  25.739   2.738
  112   1H5*    C  11          1H5*        C  11  -2.432  29.456   4.377
  113   2H5*    C  11          2H5*        C  11  -3.619  29.023   3.124
  114    H4*    C  11           H4*        C  11  -0.660  28.233   3.167
  115    H3*    C  11           H3*        C  11  -1.829  30.594   2.122
  116    H1*    C  11           H1*        C  11  -0.913  27.444  -0.057
  117   1H4     C  11          1H4         C  11  -5.826  25.457  -3.650
  118   2H4     C  11          2H4         C  11  -6.908  25.511  -2.277
  119    H5     C  11           H5         C  11  -6.206  26.285  -0.066
  120    H6     C  11           H6         C  11  -4.366  27.249   1.222
  121   1H2*    C  11          1H2*        C  11  -2.987  29.625   0.348
  122   2H2*    C  11          2H2*        C  11  -1.381  29.715  -0.428
  123   1H5*    T  12          1H5*        T  12   2.528  31.942  -1.204
  124   2H5*    T  12          2H5*        T  12   0.960  32.572  -1.761
  125    H4*    T  12           H4*        T  12   2.183  31.636  -3.680
  126    H3*    T  12           H3*        T  12  -0.423  30.742  -2.979
  127   1H2*    T  12          1H2*        T  12  -0.030  28.531  -2.519
  128   2H2*    T  12          2H2*        T  12   0.207  28.377  -4.289
  129    H1*    T  12           H1*        T  12   2.510  28.258  -4.111
  130    H3     T  12           H3         T  12   2.829  24.324  -1.834
  131   1H5M    T  12          1H5M        T  12   2.450  26.409   2.322
  132   2H5M    T  12          2H5M        T  12   1.599  27.915   1.915
  133   3H5M    T  12          3H5M        T  12   3.378  27.871   1.916
  134    H6     T  12           H6         T  12   2.112  28.893  -0.465
  135   1H5*    T  13          1H5*        T  13  -0.700  29.083  -6.634
  136   2H5*    T  13          2H5*        T  13  -0.415  30.236  -7.960
  137    H4*    T  13           H4*        T  13  -1.866  28.369  -8.724
  138    H3*    T  13           H3*        T  13  -2.547  31.103  -9.064
  139   1H2*    T  13          1H2*        T  13  -4.342  31.239  -7.612
  140   2H2*    T  13          2H2*        T  13  -5.206  30.437  -8.951
  141    H1*    T  13           H1*        T  13  -5.169  28.352  -7.908
  142    H3     T  13           H3         T  13  -8.137  29.298  -4.599
  143   1H5M    T  13          1H5M        T  13  -3.658  31.670  -2.992
  144   2H5M    T  13          2H5M        T  13  -3.522  30.036  -2.294
  145   3H5M    T  13          3H5M        T  13  -4.865  31.100  -1.816
  146    H6     T  13           H6         T  13  -3.419  30.131  -5.154
  147   1H5*    G  14          1H5*        G  14  -1.273  27.651 -13.522
  148   2H5*    G  14          2H5*        G  14  -2.334  26.261 -13.191
  149    H4*    G  14           H4*        G  14   0.337  27.043 -12.058
  150    H3*    G  14           H3*        G  14  -0.833  24.616 -13.041
  151    H1*    G  14           H1*        G  14  -0.111  25.237  -9.090
  152    H8     G  14           H8         G  14  -3.650  24.546 -10.605
  153    H1     G  14           H1         G  14  -3.500  25.578  -4.313
  154   1H2     G  14          1H2         G  14  -0.075  26.136  -4.841
  155   2H2     G  14          2H2         G  14  -1.393  26.073  -3.692
  156   1H2*    G  14          1H2*        G  14  -1.542  23.614 -11.122
  157   2H2*    G  14          2H2*        G  14   0.160  23.552 -10.628
  158   1H5*    C  15          1H5*        C  15   3.009  24.835 -10.690
  159   2H5*    C  15          2H5*        C  15   4.339  23.832 -11.313
  160    H4*    C  15           H4*        C  15   4.584  23.960  -8.925
  161    H3*    C  15           H3*        C  15   4.041  21.381 -10.130
  162    H1*    C  15           H1*        C  15   2.887  22.675  -6.576
  163   1H4     C  15          1H4         C  15  -3.658  21.427  -6.853
  164   2H4     C  15          2H4         C  15  -3.271  21.986  -5.241
  165    H5     C  15           H5         C  15  -2.032  21.198  -8.581
  166    H6     C  15           H6         C  15   0.332  21.574  -9.228
  167   1H2*    C  15          1H2*        C  15   2.421  20.639  -8.718
  168   2H2*    C  15          2H2*        C  15   3.644  20.712  -7.427
  169   1H5*    C  16          1H5*        C  16   5.437  21.279  -5.694
  170   2H5*    C  16          2H5*        C  16   7.153  21.010  -6.068
  171    H4*    C  16           H4*        C  16   6.977  20.011  -3.971
  172    H3*    C  16           H3*        C  16   7.081  18.154  -6.156
  173    H1*    C  16           H1*        C  16   4.662  17.645  -2.983
  174   1H4     C  16          1H4         C  16  -0.956  17.667  -6.637
  175   2H4     C  16          2H4         C  16  -1.398  17.361  -4.973
  176    H5     C  16           H5         C  16   1.318  17.965  -7.361
  177    H6     C  16           H6         C  16   3.673  18.172  -6.619
  178   1H2*    C  16          1H2*        C  16   5.317  16.785  -5.704
  179   2H2*    C  16          2H2*        C  16   6.081  16.404  -4.152
  180   1H5*    G  17          1H5*        G  17   7.078  17.838  -2.015
  181   2H5*    G  17          2H5*        G  17   8.738  17.648  -1.386
  182    H4*    G  17           H4*        G  17   7.241  17.314   0.470
  183    H3*    G  17           H3*        G  17   8.835  15.149  -0.413
  184    H1*    G  17           H1*        G  17   5.028  14.814   0.760
  185    H8     G  17           H8         G  17   5.715  14.231  -3.093
  186    H1     G  17           H1         G  17  -0.268  13.056  -1.265
  187   1H2     G  17          1H2         G  17   0.815  14.030   1.924
  188   2H2     G  17          2H2         G  17  -0.511  13.480   0.924
  189   1H2*    G  17          1H2*        G  17   7.186  13.714  -1.091
  190   2H2*    G  17          2H2*        G  17   6.972  13.419   0.661
  191   1H5*    G  18          1H5*        G  18  11.431  12.901   0.904
  192   2H5*    G  18          2H5*        G  18  10.496  11.434   1.266
  193    H4*    G  18           H4*        G  18  10.673  12.374   3.757
  194    H3*    G  18           H3*        G  18  12.763  14.013   2.367
  195    H1*    G  18           H1*        G  18  13.095  11.035   4.988
  196    H8     G  18           H8         G  18  14.865  11.291   1.498
  197    H1     G  18           H1         G  18  17.398   7.049   5.530
  198   1H2     G  18          1H2         G  18  16.299   7.127   7.492
  199   2H2     G  18          2H2         G  18  14.962   8.222   7.769
  200   1H2*    G  18          1H2*        G  18  14.535  13.126   3.465
  201   2H2*    G  18          2H2*        G  18  13.668  13.247   5.018
  202   1H5*    C  19          1H5*        C  19  11.917  14.082   6.764
  203   2H5*    C  19          2H5*        C  19  11.513  15.744   7.257
  204    H4*    C  19           H4*        C  19  12.445  14.626   9.186
  205    H3*    C  19           H3*        C  19  13.816  16.888   8.039
  206    H1*    C  19           H1*        C  19  15.633  13.669   9.549
  207   1H4     C  19          1H4         C  19  18.977  12.258   3.922
  208   2H4     C  19          2H4         C  19  19.542  11.149   5.151
  209    H5     C  19           H5         C  19  17.288  13.932   4.346
  210    H6     C  19           H6         C  19  15.759  14.876   5.970
  211   1H2*    C  19          1H2*        C  19  15.960  16.113   7.940
  212   2H2*    C  19          2H2*        C  19  15.890  15.884   9.702
  213   1H5*    A  20          1H5*        A  20  14.430  15.556  12.223
  214   2H5*    A  20          2H5*        A  20  14.276  16.794  13.491
  215    H4*    A  20           H4*        A  20  15.945  15.141  14.184
  216    H3*    A  20           H3*        A  20  16.600  17.926  13.923
  217    H1*    A  20           H1*        A  20  18.962  14.855  13.082
  218    H8     A  20           H8         A  20  18.297  17.423  10.175
  219   1H6     A  20          1H6         A  20  21.772  13.751   6.684
  220   2H6     A  20          2H6         A  20  20.882  15.255   6.753
  221    H2     A  20           H2         A  20  21.335  11.790  10.701
  222   1H2*    A  20          1H2*        A  20  18.364  17.768  12.475
  223   2H2*    A  20          2H2*        A  20  19.240  17.037  13.849
  224   1H5*    C  21          1H5*        C  21  19.607  19.369  17.646
  225   2H5*    C  21          2H5*        C  21  20.186  20.174  16.173
  226    H4*    C  21           H4*        C  21  21.008  17.456  17.297
  227    H3*    C  21           H3*        C  21  22.324  19.925  17.395
  228    H1*    C  21           H1*        C  21  23.190  17.248  14.642
  229   1H4     C  21          1H4         C  21  22.277  18.992   8.580
  230   2H4     C  21          2H4         C  21  20.907  19.995   8.999
  231    H5     C  21           H5         C  21  20.129  20.283  11.278
  232    H6     C  21           H6         C  21  20.586  19.775  13.638
  233   1H2*    C  21          1H2*        C  21  22.684  20.203  15.093
  234   2H2*    C  21          2H2*        C  21  24.120  19.211  15.470
  235   1H5*    T  22          1H5*        T  22  27.416  17.490  17.993
  236   2H5*    T  22          2H5*        T  22  27.664  18.849  16.872
  237    H4*    T  22           H4*        T  22  28.827  16.825  16.036
  238    H3*    T  22           H3*        T  22  26.847  18.228  14.480
  239   1H2*    T  22          1H2*        T  22  25.463  16.489  14.080
  240   2H2*    T  22          2H2*        T  22  26.730  15.916  12.961
  241    H1*    T  22           H1*        T  22  27.635  14.404  14.520
  242    H3     T  22           H3         T  22  25.173  11.216  16.903
  243   1H5M    T  22          1H5M        T  22  21.529  14.008  14.401
  244   2H5M    T  22          2H5M        T  22  21.456  12.232  14.307
  245   3H5M    T  22          3H5M        T  22  22.199  13.161  12.984
  246    H6     T  22           H6         T  22  24.161  14.744  13.791
  247   1H5*    T  23          1H5*        T  23  27.368  16.244  10.488
  248   2H5*    T  23          2H5*        T  23  29.099  16.606  10.653
  249    H4*    T  23           H4*        T  23  28.317  16.754   8.278
  250    H3*    T  23           H3*        T  23  29.685  18.931   9.690
  251   1H2*    T  23          1H2*        T  23  28.556  20.731   8.911
  252   2H2*    T  23          2H2*        T  23  28.827  20.164   7.244
  253    H1*    T  23           H1*        T  23  26.645  19.480   7.062
  254    H3     T  23           H3         T  23  24.402  23.197   8.558
  255   1H5M    T  23          1H5M        T  23  26.688  21.031  12.810
  256   2H5M    T  23          2H5M        T  23  25.019  20.412  12.948
  257   3H5M    T  23          3H5M        T  23  25.325  22.162  13.021
  258    H6     T  23           H6         T  23  26.499  19.471  10.768
  259   1H5*    G  24          1H5*        G  24  31.753  14.481   6.962
  260   2H5*    G  24          2H5*        G  24  30.494  14.659   5.709
  261    H4*    G  24           H4*        G  24  30.663  12.875   8.140
  262    H3*    G  24           H3*        G  24  30.076  12.426   5.394
  263    H1*    G  24           H1*        G  24  27.125  12.570   8.216
  264    H8     G  24           H8         G  24  27.125  14.856   5.051
  265    H1     G  24           H1         G  24  23.151  16.714   9.661
  266   1H2     G  24          1H2         G  24  24.711  14.215  11.569
  267   2H2     G  24          2H2         G  24  23.514  15.490  11.517
  268   1H2*    G  24          1H2*        G  24  27.808  12.759   5.292
  269   2H2*    G  24          2H2*        G  24  27.679  11.338   6.341
  270   1H5*    T  25          1H5*        T  25  29.002   9.204   8.766
  271   2H5*    T  25          2H5*        T  25  29.430   7.598   8.137
  272    H4*    T  25           H4*        T  25  27.560   7.498   9.772
  273    H3*    T  25           H3*        T  25  27.386   6.359   7.110
  274   1H2*    T  25          1H2*        T  25  25.294   7.042   6.515
  275   2H2*    T  25          2H2*        T  25  24.676   6.181   7.941
  276    H1*    T  25           H1*        T  25  24.432   8.060   9.170
  277    H3     T  25           H3         T  25  21.837  11.405   7.662
  278   1H5M    T  25          1H5M        T  25  24.117  11.776   3.619
  279   2H5M    T  25          2H5M        T  25  24.791  10.138   3.463
  280   3H5M    T  25          3H5M        T  25  25.757  11.431   4.211
  281    H6     T  25           H6         T  25  25.673   9.178   5.788
  282   1H5*    G  26          1H5*        G  26  24.838   4.978  10.631
  283   2H5*    G  26          2H5*        G  26  25.088   3.227  10.890
  284    H4*    G  26           H4*        G  26  22.878   3.745  11.683
  285    H3*    G  26           H3*        G  26  23.106   2.100   9.335
  286    H1*    G  26           H1*        G  26  20.307   4.914   9.818
  287    H8     G  26           H8         G  26  22.695   4.892   6.729
  288    H1     G  26           H1         G  26  18.993  10.065   7.101
  289   1H2     G  26          1H2         G  26  18.034   8.802  10.224
  290   2H2     G  26          2H2         G  26  17.867  10.076   9.039
  291   1H2*    G  26          1H2*        G  26  21.715   3.169   7.896
  292   2H2*    G  26          2H2*        G  26  20.415   2.820   9.046
  293   1H5*    C  27          1H5*        C  27  18.704  -0.810  10.712
  294   2H5*    C  27          2H5*        C  27  18.144  -0.453   9.066
  295    H4*    C  27           H4*        C  27  17.634   1.042  11.642
  296    H3*    C  27           H3*        C  27  15.937  -0.190   9.701
  297    H1*    C  27           H1*        C  27  16.508   3.852   9.864
  298   1H4     C  27          1H4         C  27  19.403   4.225   3.847
  299   2H4     C  27          2H4         C  27  18.519   5.714   4.091
  300    H5     C  27           H5         C  27  19.439   2.431   5.473
  301    H6     C  27           H6         C  27  18.444   1.587   7.541
  302   1H2*    C  27          1H2*        C  27  15.697   1.520   8.167
  303   2H2*    C  27          2H2*        C  27  14.783   2.374   9.441
  304   1H5*    T  28          1H5*        T  28  11.455   2.179  12.246
  305   2H5*    T  28          2H5*        T  28  11.022   1.876  10.548
  306    H4*    T  28           H4*        T  28  10.388   4.184  11.242
  307    H3*    T  28           H3*        T  28  11.964   3.617   8.919
  308   1H2*    T  28          1H2*        T  28  13.860   4.816   9.409
  309   2H2*    T  28          2H2*        T  28  12.836   6.254   9.142
  310    H1*    T  28           H1*        T  28  12.651   6.676  11.440
  311    H3     T  28           H3         T  28  17.270   7.384  11.510
  312   1H5M    T  28          1H5M        T  28  16.430   2.469  13.426
  313   2H5M    T  28          2H5M        T  28  16.372   3.538  14.849
  314   3H5M    T  28          3H5M        T  28  17.862   3.417  13.885
  315    H6     T  28           H6         T  28  14.298   3.822  12.827
  316   1H5*    T  29          1H5*        T  29  12.088   8.352   7.824
  317   2H5*    T  29          2H5*        T  29  10.326   8.136   7.764
  318    H4*    T  29           H4*        T  29  11.135   9.743   6.023
  319    H3*    T  29           H3*        T  29   9.463   7.470   5.462
  320   1H2*    T  29          1H2*        T  29  10.627   6.458   3.777
  321   2H2*    T  29          2H2*        T  29  10.367   7.935   2.825
  322    H1*    T  29           H1*        T  29  12.539   8.643   3.117
  323    H3     T  29           H3         T  29  15.275   5.410   1.507
  324   1H5M    T  29          1H5M        T  29  14.586   2.582   5.149
  325   2H5M    T  29          2H5M        T  29  12.939   3.052   5.631
  326   3H5M    T  29          3H5M        T  29  14.349   3.808   6.416
  327    H6     T  29           H6         T  29  12.526   5.716   5.452
  328   1H5*    C  30          1H5*        C  30   7.296  12.399   4.871
  329   2H5*    C  30          2H5*        C  30   7.788  10.987   5.827
  330    H4*    C  30           H4*        C  30   5.567  11.913   6.553
  331    H3*    C  30           H3*        C  30   6.050   9.147   5.916
  332    H1*    C  30           H1*        C  30   2.697  11.145   4.901
  333   1H4     C  30          1H4         C  30   3.559   9.646  -1.575
  334   2H4     C  30          2H4         C  30   1.845   9.505  -1.255
  335    H5     C  30           H5         C  30   5.166  10.179   0.128
  336    H6     C  30           H6         C  30   5.502  10.731   2.497
  337   1H2*    C  30          1H2*        C  30   4.370   8.729   4.455
  338   2H2*    C  30          2H2*        C  30   3.242   9.091   5.772
  339   1H5*    T  31          1H5*        T  31   2.040   8.456   8.599
  340   2H5*    T  31          2H5*        T  31   2.821   7.418   9.812
  341    H4*    T  31           H4*        T  31   0.696   6.448   8.895
  342    H3*    T  31           H3*        T  31   3.223   5.017   9.022
  343   1H2*    T  31          1H2*        T  31   3.247   4.044   6.977
  344   2H2*    T  31          2H2*        T  31   1.707   3.262   7.393
  345    H1*    T  31           H1*        T  31   0.434   4.751   6.164
  346    H3     T  31           H3         T  31   1.440   4.862   1.799
  347   1H5M    T  31          1H5M        T  31   5.886   6.389   4.534
  348   2H5M    T  31          2H5M        T  31   5.672   6.841   2.827
  349   3H5M    T  31          3H5M        T  31   6.075   5.166   3.265
  350    H6     T  31           H6         T  31   3.979   5.817   5.769
  351   1H5*    G  32          1H5*        G  32  -0.678   2.477   9.116
  352   2H5*    G  32          2H5*        G  32  -0.559   1.213  10.375
  353    H4*    G  32           H4*        G  32  -1.723   0.414   8.330
  354    H3*    G  32           H3*        G  32   0.625  -0.899   9.395
  355    H1*    G  32           H1*        G  32  -0.328  -0.490   5.540
  356    H8     G  32           H8         G  32   3.109   0.993   6.824
  357    H1     G  32           H1         G  32   2.272   0.914   0.507
  358   1H2     G  32          1H2         G  32   0.272   0.017   0.010
  359   2H2     G  32          2H2         G  32  -0.842  -0.520   1.249
  360   1H2*    G  32          1H2*        G  32   1.877  -1.059   7.495
  361   2H2*    G  32          2H2*        G  32   0.604  -2.128   6.862
  362   1H5*    C  33          1H5*        C  33  -2.522  -2.621   6.817
  363   2H5*    C  33          2H5*        C  33  -3.255  -4.153   7.344
  364    H4*    C  33           H4*        C  33  -3.445  -3.889   4.899
  365    H3*    C  33           H3*        C  33  -2.197  -6.184   6.118
  366    H1*    C  33           H1*        C  33  -1.184  -4.413   2.681
  367   1H4     C  33          1H4         C  33   5.113  -3.271   2.427
  368   2H4     C  33          2H4         C  33   5.254  -3.307   4.170
  369    H5     C  33           H5         C  33   3.375  -3.755   5.632
  370    H6     C  33           H6         C  33   1.004  -4.254   5.759
  371   1H2*    C  33          1H2*        C  33  -0.228  -6.217   4.967
  372   2H2*    C  33          2H2*        C  33  -1.203  -6.603   3.527
  373   1H5*    A  34          1H5*        A  34  -3.799  -6.050   1.959
  374   2H5*    A  34          2H5*        A  34  -5.283  -7.032   1.911
  375    H4*    A  34           H4*        A  34  -4.541  -6.852  -0.370
  376    H3*    A  34           H3*        A  34  -4.547  -9.410   0.907
  377    H1*    A  34           H1*        A  34  -1.603  -8.187  -1.540
  378    H8     A  34           H8         A  34  -1.045  -8.949   2.236
  379   1H6     A  34          1H6         A  34   4.964  -8.297   1.063
  380   2H6     A  34          2H6         A  34   3.769  -8.599   2.306
  381    H2     A  34           H2         A  34   2.712  -7.642  -2.774
  382   1H2*    A  34          1H2*        A  34  -2.389 -10.078   0.609
  383   2H2*    A  34          2H2*        A  34  -2.736 -10.095  -1.120
  384   1H5*    C  35          1H5*        C  35  -4.010  -8.838  -3.421
  385   2H5*    C  35          2H5*        C  35  -5.208  -9.645  -4.458
  386    H4*    C  35           H4*        C  35  -3.167  -9.436  -5.737
  387    H3*    C  35           H3*        C  35  -4.183 -12.054  -5.075
  388    H1*    C  35           H1*        C  35  -0.327 -10.998  -5.310
  389   1H4     C  35          1H4         C  35   2.880 -12.311   0.064
  390   2H4     C  35          2H4         C  35   1.429 -12.803   0.907
  391    H5     C  35           H5         C  35  -0.752 -12.799  -0.114
  392    H6     C  35           H6         C  35  -2.010 -12.391  -2.157
  393   1H2*    C  35          1H2*        C  35  -2.302 -13.075  -4.318
  394   2H2*    C  35          2H2*        C  35  -1.606 -12.810  -5.936
  395   1H5*    G  36          1H5*        G  36  -1.322 -11.638  -8.526
  396   2H5*    G  36          2H5*        G  36  -2.169 -12.049 -10.047
  397    H4*    G  36           H4*        G  36   0.208 -12.531 -10.293
  398    H3*    G  36           H3*        G  36  -1.719 -14.659 -10.454
  399    H1*    G  36           H1*        G  36   1.909 -14.929  -8.752
  400    H8     G  36           H8         G  36  -1.354 -15.264  -6.549
  401    H1     G  36           H1         G  36   4.048 -17.133  -3.718
  402   1H2     G  36          1H2         G  36   5.577 -16.252  -6.750
  403   2H2     G  36          2H2         G  36   5.778 -16.877  -5.129
  404   1H2*    G  36          1H2*        G  36  -0.764 -16.211  -8.978
  405   2H2*    G  36          2H2*        G  36   0.626 -16.233 -10.099
  Start of MODEL    3
    1   1H5*    C   1          1H5*        C   1  13.811 -18.175   1.455
    2   2H5*    C   1          2H5*        C   1  14.766 -16.685   1.645
    3    H4*    C   1           H4*        C   1  14.254 -16.933  -0.721
    4    H3*    C   1           H3*        C   1  13.333 -14.661   0.760
    5    H1*    C   1           H1*        C   1  10.976 -16.598  -1.917
    6   1H4     C   1          1H4         C   1   5.607 -17.991   1.247
    7   2H4     C   1          2H4         C   1   6.405 -17.895   2.801
    8    H5     C   1           H5         C   1   8.757 -17.387   3.050
    9    H6     C   1           H6         C   1  10.824 -16.785   1.863
   10   1H2*    C   1          1H2*        C   1  11.096 -14.653   0.301
   11   2H2*    C   1          2H2*        C   1  11.533 -14.429  -1.415
   12   1H5*    G   2          1H5*        G   2  12.813 -14.126  -3.709
   13   2H5*    G   2          2H5*        G   2  14.027 -12.911  -4.212
   14    H4*    G   2           H4*        G   2  12.019 -12.776  -5.634
   15    H3*    G   2           H3*        G   2  12.901 -10.535  -4.049
   16    H1*    G   2           H1*        G   2   9.158 -11.547  -4.848
   17    H8     G   2           H8         G   2  10.248 -11.193  -1.096
   18    H1     G   2           H1         G   2   4.164 -12.917  -1.892
   19   1H2     G   2          1H2         G   2   4.934 -12.929  -5.317
   20   2H2     G   2          2H2         G   2   3.722 -13.176  -4.081
   21   1H2*    G   2          1H2*        G   2  10.967 -10.046  -2.966
   22   2H2*    G   2          2H2*        G   2  10.322  -9.567  -4.556
   23   1H5*    T   3          1H5*        T   3  10.187  -9.816  -7.795
   24   2H5*    T   3          2H5*        T   3  10.890  -8.508  -8.775
   25    H4*    T   3           H4*        T   3   8.474  -8.397  -8.974
   26    H3*    T   3           H3*        T   3   9.937  -6.186  -7.827
   27   1H2*    T   3          1H2*        T   3   8.713  -5.846  -5.950
   28   2H2*    T   3          2H2*        T   3   7.363  -5.392  -7.007
   29    H1*    T   3           H1*        T   3   6.306  -7.443  -6.858
   30    H3     T   3           H3         T   3   4.772  -8.684  -2.809
   31   1H5M    T   3          1H5M        T   3   9.204  -6.087  -1.809
   32   2H5M    T   3          2H5M        T   3   9.857  -7.739  -1.850
   33   3H5M    T   3          3H5M        T   3   8.645  -7.295  -0.628
   34    H6     T   3           H6         T   3   9.030  -6.998  -4.278
   35   1H5*    G   4          1H5*        G   4   5.896  -5.640  -9.680
   36   2H5*    G   4          2H5*        G   4   5.740  -4.295 -10.845
   37    H4*    G   4           H4*        G   4   3.652  -4.697  -9.540
   38    H3*    G   4           H3*        G   4   4.950  -2.129  -9.676
   39    H1*    G   4           H1*        G   4   2.965  -3.687  -6.694
   40    H8     G   4           H8         G   4   6.687  -2.796  -5.862
   41    H1     G   4           H1         G   4   3.114  -4.346  -0.815
   42   1H2     G   4          1H2         G   4   0.590  -4.915  -3.190
   43   2H2     G   4          2H2         G   4   1.047  -4.914  -1.501
   44   1H2*    G   4          1H2*        G   4   5.247  -1.812  -7.431
   45   2H2*    G   4          2H2*        G   4   3.508  -1.524  -7.416
   46   1H5*    C   5          1H5*        C   5   0.266  -2.486  -8.475
   47   2H5*    C   5          2H5*        C   5  -0.455  -1.485  -9.754
   48    H4*    C   5           H4*        C   5  -1.948  -1.491  -7.829
   49    H3*    C   5           H3*        C   5  -0.786   0.977  -8.798
   50    H1*    C   5           H1*        C   5  -1.569   0.044  -4.971
   51   1H4     C   5          1H4         C   5   4.596   1.505  -2.803
   52   2H4     C   5          2H4         C   5   3.500   1.705  -1.455
   53    H5     C   5           H5         C   5   3.865   0.845  -5.011
   54    H6     C   5           H6         C   5   1.940   0.188  -6.367
   55   1H2*    C   5          1H2*        C   5  -0.089   1.890  -6.842
   56   2H2*    C   5          2H2*        C   5  -1.804   1.914  -6.353
   57   1H5*    A   6          1H5*        A   6  -4.306   1.078  -6.065
   58   2H5*    A   6          2H5*        A   6  -5.697   1.745  -6.946
   59    H4*    A   6           H4*        A   6  -6.008   2.153  -4.571
   60    H3*    A   6           H3*        A   6  -5.856   4.370  -6.418
   61    H1*    A   6           H1*        A   6  -4.660   4.231  -2.661
   62    H8     A   6           H8         A   6  -1.923   5.103  -5.369
   63   1H6     A   6          1H6         A   6   1.640   6.305  -2.408
   64   2H6     A   6          2H6         A   6   1.824   6.286  -0.668
   65    H2     A   6           H2         A   6  -2.041   4.804   1.054
   66   1H2*    A   6          1H2*        A   6  -4.310   5.637  -5.316
   67   2H2*    A   6          2H2*        A   6  -5.570   5.858  -4.072
   68   1H5*    G   7          1H5*        G   7  -8.266   5.560  -2.196
   69   2H5*    G   7          2H5*        G   7  -9.655   6.444  -2.890
   70    H4*    G   7           H4*        G   7  -8.806   7.592  -0.876
   71    H3*    G   7           H3*        G   7  -8.967   8.930  -3.395
   72    H1*    G   7           H1*        G   7  -6.257   9.427  -0.656
   73    H8     G   7           H8         G   7  -4.656   8.335  -4.070
   74    H1     G   7           H1         G   7  -0.496   9.197   0.665
   75   1H2     G   7          1H2         G   7  -1.571   9.641   2.582
   76   2H2     G   7          2H2         G   7  -3.317   9.697   2.679
   77   1H2*    G   7          1H2*        G   7  -6.697   9.292  -3.675
   78   2H2*    G   7          2H2*        G   7  -7.007  10.636  -2.555
   79   1H5*    C   8          1H5*        C   8  -8.412  11.216   0.816
   80   2H5*    C   8          2H5*        C   8  -9.635  12.504   0.790
   81    H4*    C   8           H4*        C   8  -7.762  13.080   2.293
   82    H3*    C   8           H3*        C   8  -8.550  14.805   0.090
   83    H1*    C   8           H1*        C   8  -4.835  14.235   1.484
   84   1H4     C   8          1H4         C   8  -2.371  12.919  -4.585
   85   2H4     C   8          2H4         C   8  -1.013  13.278  -3.542
   86    H5     C   8           H5         C   8  -4.655  12.929  -3.812
   87    H6     C   8           H6         C   8  -6.139  13.318  -1.930
   88   1H2*    C   8          1H2*        C   8  -6.511  15.447  -0.669
   89   2H2*    C   8          2H2*        C   8  -6.148  16.044   0.963
   90   1H5*    G   9          1H5*        G   9  -6.490  16.691   3.579
   91   2H5*    G   9          2H5*        G   9  -7.405  18.045   4.295
   92    H4*    G   9           H4*        G   9  -4.891  18.275   4.370
   93    H3*    G   9           H3*        G   9  -6.676  20.331   3.351
   94    H1*    G   9           H1*        G   9  -2.995  19.407   2.086
   95    H8     G   9           H8         G   9  -6.037  19.555  -0.424
   96    H1     G   9           H1         G   9  -0.375  18.350  -3.093
   97   1H2     G   9          1H2         G   9   1.217  18.274  -1.519
   98   2H2     G   9          2H2         G   9   0.865  18.507   0.179
   99   1H2*    G   9          1H2*        G   9  -5.537  20.931   1.490
  100   2H2*    G   9          2H2*        G   9  -4.180  21.386   2.550
  101   1H5*    G  10          1H5*        G  10  -2.528  22.000   5.133
  102   2H5*    G  10          2H5*        G  10  -3.055  23.258   6.288
  103    H4*    G  10           H4*        G  10  -0.988  23.936   5.127
  104    H3*    G  10           H3*        G  10  -3.396  25.509   4.964
  105    H1*    G  10           H1*        G  10  -0.743  24.955   2.027
  106    H8     G  10           H8         G  10  -4.456  23.754   1.592
  107    H1     G  10           H1         G  10  -0.874  23.281  -3.654
  108   1H2     G  10          1H2         G  10   1.218  23.956  -3.231
  109   2H2     G  10          2H2         G  10   1.716  24.519  -1.652
  110   1H2*    G  10          1H2*        G  10  -3.562  25.756   2.699
  111   2H2*    G  10          2H2*        G  10  -2.057  26.705   2.800
  112   1H5*    C  11          1H5*        C  11  -2.203  30.385   4.899
  113   2H5*    C  11          2H5*        C  11  -3.315  30.052   3.549
  114    H4*    C  11           H4*        C  11  -0.328  29.387   3.689
  115    H3*    C  11           H3*        C  11  -1.625  31.692   2.656
  116    H1*    C  11           H1*        C  11  -0.406  28.651   0.437
  117   1H4     C  11          1H4         C  11  -5.014  26.381  -3.354
  118   2H4     C  11          2H4         C  11  -6.187  26.449  -2.058
  119    H5     C  11           H5         C  11  -5.659  27.301   0.158
  120    H6     C  11           H6         C  11  -3.938  28.353   1.546
  121   1H2*    C  11          1H2*        C  11  -2.606  30.718   0.790
  122   2H2*    C  11          2H2*        C  11  -0.968  30.917   0.109
  123   1H5*    T  12          1H5*        T  12   2.599  33.490  -0.535
  124   2H5*    T  12          2H5*        T  12   0.986  33.951  -1.130
  125    H4*    T  12           H4*        T  12   2.355  33.125  -3.012
  126    H3*    T  12           H3*        T  12  -0.179  32.017  -2.382
  127   1H2*    T  12          1H2*        T  12   0.371  29.859  -1.854
  128   2H2*    T  12          2H2*        T  12   0.699  29.681  -3.603
  129    H1*    T  12           H1*        T  12   2.990  29.717  -3.314
  130    H3     T  12           H3         T  12   3.141  25.897  -0.765
  131   1H5M    T  12          1H5M        T  12   3.144  28.329   3.210
  132   2H5M    T  12          2H5M        T  12   2.117  29.708   2.755
  133   3H5M    T  12          3H5M        T  12   3.889  29.836   2.628
  134    H6     T  12           H6         T  12   2.664  30.586   0.244
  135   1H5*    T  13          1H5*        T  13   0.002  30.226  -6.017
  136   2H5*    T  13          2H5*        T  13  -0.072  31.314  -7.420
  137    H4*    T  13           H4*        T  13  -1.103  29.060  -7.881
  138    H3*    T  13           H3*        T  13  -2.306  31.561  -8.524
  139   1H2*    T  13          1H2*        T  13  -4.130  31.495  -7.116
  140   2H2*    T  13          2H2*        T  13  -4.763  30.337  -8.313
  141    H1*    T  13           H1*        T  13  -4.309  28.492  -6.972
  142    H3     T  13           H3         T  13  -7.404  29.205  -3.729
  143   1H5M    T  13          1H5M        T  13  -3.159  31.422  -1.713
  144   2H5M    T  13          2H5M        T  13  -4.712  32.242  -1.438
  145   3H5M    T  13          3H5M        T  13  -3.621  32.820  -2.716
  146    H6     T  13           H6         T  13  -3.028  31.048  -4.578
  147   1H5*    G  14          1H5*        G  14  -0.394  28.410 -12.820
  148   2H5*    G  14          2H5*        G  14  -1.227  26.847 -12.674
  149    H4*    G  14           H4*        G  14   1.420  27.682 -11.743
  150    H3*    G  14           H3*        G  14   0.148  25.180 -12.327
  151    H1*    G  14           H1*        G  14   1.190  26.122  -8.481
  152    H8     G  14           H8         G  14  -2.313  25.417 -10.064
  153    H1     G  14           H1         G  14  -2.411  26.611  -3.806
  154   1H2     G  14          1H2         G  14   1.033  27.182  -4.190
  155   2H2     G  14          2H2         G  14  -0.339  27.141  -3.104
  156   1H2*    G  14          1H2*        G  14  -0.201  24.272 -10.278
  157   2H2*    G  14          2H2*        G  14   1.540  24.406  -9.972
  158   1H5*    C  15          1H5*        C  15   4.257  25.189 -10.449
  159   2H5*    C  15          2H5*        C  15   5.398  24.013 -11.140
  160    H4*    C  15           H4*        C  15   5.726  24.114  -8.733
  161    H3*    C  15           H3*        C  15   4.921  21.632  -9.996
  162    H1*    C  15           H1*        C  15   3.915  22.927  -6.386
  163   1H4     C  15          1H4         C  15  -2.691  22.135  -6.681
  164   2H4     C  15          2H4         C  15  -2.293  22.800  -5.113
  165    H5     C  15           H5         C  15  -1.069  21.642  -8.325
  166    H6     C  15           H6         C  15   1.299  21.964  -9.034
  167   1H2*    C  15          1H2*        C  15   3.288  20.973  -8.563
  168   2H2*    C  15          2H2*        C  15   4.527  20.933  -7.288
  169   1H5*    C  16          1H5*        C  16   6.605  21.415  -5.807
  170   2H5*    C  16          2H5*        C  16   8.243  20.771  -6.055
  171    H4*    C  16           H4*        C  16   7.680  20.074  -3.864
  172    H3*    C  16           H3*        C  16   7.808  18.030  -5.884
  173    H1*    C  16           H1*        C  16   5.129  18.096  -2.914
  174   1H4     C  16          1H4         C  16  -0.284  18.079  -6.873
  175   2H4     C  16          2H4         C  16  -0.833  17.915  -5.219
  176    H5     C  16           H5         C  16   2.044  18.227  -7.477
  177    H6     C  16           H6         C  16   4.349  18.394  -6.621
  178   1H2*    C  16          1H2*        C  16   5.836  16.934  -5.534
  179   2H2*    C  16          2H2*        C  16   6.421  16.567  -3.901
  180   1H5*    G  17          1H5*        G  17   7.847  17.888  -1.612
  181   2H5*    G  17          2H5*        G  17   9.357  17.289  -0.868
  182    H4*    G  17           H4*        G  17   7.588  17.257   0.803
  183    H3*    G  17           H3*        G  17   8.829  14.811  -0.033
  184    H1*    G  17           H1*        G  17   4.996  15.307   0.945
  185    H8     G  17           H8         G  17   5.765  14.527  -2.843
  186    H1     G  17           H1         G  17  -0.317  13.723  -1.157
  187   1H2     G  17          1H2         G  17   0.741  14.655   2.053
  188   2H2     G  17          2H2         G  17  -0.589  14.170   1.024
  189   1H2*    G  17          1H2*        G  17   6.978  13.677  -0.694
  190   2H2*    G  17          2H2*        G  17   6.607  13.541   1.048
  191   1H5*    G  18          1H5*        G  18   6.563  15.339   4.766
  192   2H5*    G  18          2H5*        G  18   7.810  16.226   3.864
  193    H4*    G  18           H4*        G  18   7.419  15.780   6.780
  194    H3*    G  18           H3*        G  18   8.793  17.807   5.049
  195    H1*    G  18           H1*        G  18  10.122  15.783   8.216
  196    H8     G  18           H8         G  18  11.708  15.804   4.648
  197    H1     G  18           H1         G  18  15.811  14.734   9.407
  198   1H2     G  18          1H2         G  18  14.757  14.977  11.376
  199   2H2     G  18          2H2         G  18  13.059  15.380  11.480
  200   1H2*    G  18          1H2*        G  18  10.684  17.932   6.269
  201   2H2*    G  18          2H2*        G  18   9.745  18.002   7.785
  202   1H5*    C  19          1H5*        C  19   7.665  18.462   9.320
  203   2H5*    C  19          2H5*        C  19   6.803  19.998   9.572
  204    H4*    C  19           H4*        C  19   8.098  19.473  11.573
  205    H3*    C  19           H3*        C  19   8.592  21.896  10.071
  206    H1*    C  19           H1*        C  19  11.358  19.710  11.929
  207   1H4     C  19          1H4         C  19  15.184  18.830   6.524
  208   2H4     C  19          2H4         C  19  16.077  18.214   7.897
  209    H5     C  19           H5         C  19  12.981  19.790   6.717
  210    H6     C  19           H6         C  19  11.170  20.387   8.214
  211   1H2*    C  19          1H2*        C  19  10.870  21.897   9.998
  212   2H2*    C  19          2H2*        C  19  10.861  21.894  11.775
  213   1H5*    A  20          1H5*        A  20   9.709  21.461  14.351
  214   2H5*    A  20          2H5*        A  20   9.104  22.743  15.427
  215    H4*    A  20           H4*        A  20  11.254  21.910  16.264
  216    H3*    A  20           H3*        A  20  10.866  24.692  15.597
  217    H1*    A  20           H1*        A  20  14.183  22.561  15.133
  218    H8     A  20           H8         A  20  12.544  24.176  11.933
  219   1H6     A  20          1H6         A  20  17.419  22.095   8.856
  220   2H6     A  20          2H6         A  20  15.931  23.010   8.755
  221    H2     A  20           H2         A  20  17.828  20.739  13.120
  222   1H2*    A  20          1H2*        A  20  12.632  24.994  14.194
  223   2H2*    A  20          2H2*        A  20  13.649  24.765  15.639
  224   1H5*    C  21          1H5*        C  21  13.478  27.345  19.079
  225   2H5*    C  21          2H5*        C  21  13.872  28.089  17.514
  226    H4*    C  21           H4*        C  21  15.106  25.599  18.787
  227    H3*    C  21           H3*        C  21  16.057  28.240  18.675
  228    H1*    C  21           H1*        C  21  17.217  25.485  16.117
  229   1H4     C  21          1H4         C  21  15.993  26.509   9.957
  230   2H4     C  21          2H4         C  21  14.508  27.357  10.320
  231    H5     C  21           H5         C  21  13.729  27.752  12.591
  232    H6     C  21           H6         C  21  14.327  27.604  14.965
  233   1H2*    C  21          1H2*        C  21  16.360  28.389  16.358
  234   2H2*    C  21          2H2*        C  21  17.911  27.616  16.786
  235   1H5*    T  22          1H5*        T  22  21.483  26.618  19.647
  236   2H5*    T  22          2H5*        T  22  21.381  28.262  18.978
  237    H4*    T  22           H4*        T  22  23.136  27.052  17.772
  238    H3*    T  22           H3*        T  22  20.982  28.225  16.415
  239   1H2*    T  22          1H2*        T  22  19.853  26.346  15.669
  240   2H2*    T  22          2H2*        T  22  21.166  26.284  14.464
  241    H1*    T  22           H1*        T  22  22.264  24.545  15.530
  242    H3     T  22           H3         T  22  19.445  21.027  15.158
  243   1H5M    T  22          1H5M        T  22  17.614  22.602  19.452
  244   2H5M    T  22          2H5M        T  22  16.401  23.051  18.231
  245   3H5M    T  22          3H5M        T  22  17.384  24.309  19.011
  246    H6     T  22           H6         T  22  19.419  24.978  17.916
  247   1H5*    T  23          1H5*        T  23  22.581  26.176  12.484
  248   2H5*    T  23          2H5*        T  23  23.718  27.498  12.154
  249    H4*    T  23           H4*        T  23  22.549  26.600  10.098
  250    H3*    T  23           H3*        T  23  22.718  29.428  10.866
  251   1H2*    T  23          1H2*        T  23  20.673  30.154  10.230
  252   2H2*    T  23          2H2*        T  23  20.927  29.424   8.624
  253    H1*    T  23           H1*        T  23  19.520  27.693   9.114
  254    H3     T  23           H3         T  23  15.882  30.066  10.552
  255   1H5M    T  23          1H5M        T  23  18.490  29.293  15.019
  256   2H5M    T  23          2H5M        T  23  17.848  30.914  14.687
  257   3H5M    T  23          3H5M        T  23  19.552  30.539  14.313
  258    H6     T  23           H6         T  23  19.899  28.523  12.728
  259   1H5*    G  24          1H5*        G  24  26.718  26.550   7.787
  260   2H5*    G  24          2H5*        G  24  25.741  25.869   6.467
  261    H4*    G  24           H4*        G  24  26.225  24.915   9.246
  262    H3*    G  24           H3*        G  24  25.917  23.663   6.695
  263    H1*    G  24           H1*        G  24  23.354  23.262   9.736
  264    H8     G  24           H8         G  24  21.960  24.754   6.374
  265    H1     G  24           H1         G  24  17.841  24.726  11.235
  266   1H2     G  24          1H2         G  24  20.563  23.510  13.097
  267   2H2     G  24          2H2         G  24  18.880  23.986  13.099
  268   1H2*    G  24          1H2*        G  24  23.656  23.212   6.719
  269   2H2*    G  24          2H2*        G  24  24.095  22.006   7.940
  270   1H5*    T  25          1H5*        T  25  26.324  21.142  10.779
  271   2H5*    T  25          2H5*        T  25  27.202  19.634  10.446
  272    H4*    T  25           H4*        T  25  25.535  19.407  12.295
  273    H3*    T  25           H3*        T  25  25.652  17.613  10.018
  274   1H2*    T  25          1H2*        T  25  23.429  17.452   9.530
  275   2H2*    T  25          2H2*        T  25  23.185  16.824  11.176
  276    H1*    T  25           H1*        T  25  22.412  18.787  11.989
  277    H3     T  25           H3         T  25  18.727  20.602  10.221
  278   1H5M    T  25          1H5M        T  25  20.405  20.639   5.884
  279   2H5M    T  25          2H5M        T  25  21.576  19.304   5.974
  280   3H5M    T  25          3H5M        T  25  22.111  20.977   6.253
  281    H6     T  25           H6         T  25  22.918  19.272   8.262
  282   1H5*    G  26          1H5*        G  26  24.025  16.378  14.140
  283   2H5*    G  26          2H5*        G  26  24.757  14.841  14.685
  284    H4*    G  26           H4*        G  26  22.502  15.040  15.603
  285    H3*    G  26           H3*        G  26  23.140  12.892  13.790
  286    H1*    G  26           H1*        G  26  19.672  14.828  13.977
  287    H8     G  26           H8         G  26  21.681  14.753  10.606
  288    H1     G  26           H1         G  26  16.100  17.812  10.291
  289   1H2     G  26          1H2         G  26  15.849  17.103  13.717
  290   2H2     G  26          2H2         G  26  15.113  17.832  12.307
  291   1H2*    G  26          1H2*        G  26  21.436  13.103  12.292
  292   2H2*    G  26          2H2*        G  26  20.349  12.684  13.630
  293   1H5*    C  27          1H5*        C  27  19.508   8.947  15.981
  294   2H5*    C  27          2H5*        C  27  19.767   9.728  14.403
  295    H4*    C  27           H4*        C  27  17.637  10.508  16.458
  296    H3*    C  27           H3*        C  27  17.542   8.597  14.206
  297    H1*    C  27           H1*        C  27  16.020  12.389  14.180
  298   1H4     C  27          1H4         C  27  19.163  13.054   8.290
  299   2H4     C  27          2H4         C  27  17.939  14.300   8.378
  300    H5     C  27           H5         C  27  19.620  11.530  10.104
  301    H6     C  27           H6         C  27  18.832  10.691  12.263
  302   1H2*    C  27          1H2*        C  27  16.323   9.837  12.716
  303   2H2*    C  27          2H2*        C  27  15.156  10.260  14.000
  304   1H5*    T  28          1H5*        T  28  12.613   6.617  15.821
  305   2H5*    T  28          2H5*        T  28  13.026   6.040  14.190
  306    H4*    T  28           H4*        T  28  10.689   6.906  14.276
  307    H3*    T  28           H3*        T  28  12.625   7.770  12.358
  308   1H2*    T  28          1H2*        T  28  12.695  10.014  12.793
  309   2H2*    T  28          2H2*        T  28  11.042  10.058  12.124
  310    H1*    T  28           H1*        T  28  10.088  10.284  14.246
  311    H3     T  28           H3         T  28  12.445  14.295  14.719
  312   1H5M    T  28          1H5M        T  28  13.888  11.133  18.644
  313   2H5M    T  28          2H5M        T  28  15.027  12.382  18.089
  314   3H5M    T  28          3H5M        T  28  15.182  10.713  17.493
  315    H6     T  28           H6         T  28  12.882   9.799  16.411
  316   1H5*    T  29          1H5*        T  29   8.818   6.814   7.828
  317   2H5*    T  29          2H5*        T  29  10.284   7.799   8.008
  318    H4*    T  29           H4*        T  29   7.368   8.656   8.317
  319    H3*    T  29           H3*        T  29   9.242   9.026   6.186
  320   1H2*    T  29          1H2*        T  29  10.377  10.896   6.883
  321   2H2*    T  29          2H2*        T  29   8.840  11.765   6.697
  322    H1*    T  29           H1*        T  29   8.478  11.863   8.969
  323    H3     T  29           H3         T  29  11.736  13.718  11.425
  324   1H5M    T  29          1H5M        T  29  14.858  10.388  10.472
  325   2H5M    T  29          2H5M        T  29  14.448  10.174   8.753
  326   3H5M    T  29          3H5M        T  29  13.816   9.036   9.968
  327    H6     T  29           H6         T  29  11.626   9.769   8.675
  328   1H5*    C  30          1H5*        C  30   5.593  13.227   5.917
  329   2H5*    C  30          2H5*        C  30   6.305  11.889   6.837
  330    H4*    C  30           H4*        C  30   3.874  12.104   7.290
  331    H3*    C  30           H3*        C  30   5.113   9.655   6.392
  332    H1*    C  30           H1*        C  30   1.489  10.970   5.393
  333   1H4     C  30          1H4         C  30   2.400  10.628  -1.226
  334   2H4     C  30          2H4         C  30   0.720  10.255  -0.916
  335    H5     C  30           H5         C  30   3.978  11.050   0.509
  336    H6     C  30           H6         C  30   4.333  11.327   2.920
  337   1H2*    C  30          1H2*        C  30   3.749   9.141   4.659
  338   2H2*    C  30          2H2*        C  30   2.464   8.928   5.871
  339   1H5*    T  31          1H5*        T  31   1.037   8.080   8.443
  340   2H5*    T  31          2H5*        T  31   1.765   7.059   9.705
  341    H4*    T  31           H4*        T  31  -0.093   5.872   8.611
  342    H3*    T  31           H3*        T  31   2.601   4.799   8.669
  343   1H2*    T  31          1H2*        T  31   2.821   4.094   6.526
  344   2H2*    T  31          2H2*        T  31   1.410   3.047   6.786
  345    H1*    T  31           H1*        T  31  -0.041   4.442   5.691
  346    H3     T  31           H3         T  31   0.827   5.397   1.415
  347   1H5M    T  31          1H5M        T  31   4.930   7.517   2.736
  348   2H5M    T  31          2H5M        T  31   5.460   5.824   2.800
  349   3H5M    T  31          3H5M        T  31   5.243   6.739   4.303
  350    H6     T  31           H6         T  31   3.390   5.924   5.453
  351   1H5*    G  32          1H5*        G  32  -1.012   2.136   8.195
  352   2H5*    G  32          2H5*        G  32  -1.043   0.836   9.421
  353    H4*    G  32           H4*        G  32  -2.153   0.053   7.412
  354    H3*    G  32           H3*        G  32   0.287  -1.234   8.265
  355    H1*    G  32           H1*        G  32  -0.937  -0.653   4.533
  356    H8     G  32           H8         G  32   2.480   0.970   5.657
  357    H1     G  32           H1         G  32   1.370   1.025  -0.620
  358   1H2     G  32          1H2         G  32  -0.636   0.114  -1.054
  359   2H2     G  32          2H2         G  32  -1.683  -0.483   0.213
  360   1H2*    G  32          1H2*        G  32   1.437  -1.207   6.294
  361   2H2*    G  32          2H2*        G  32   0.185  -2.313   5.674
  362   1H5*    C  33          1H5*        C  33  -2.832  -3.277   5.648
  363   2H5*    C  33          2H5*        C  33  -3.401  -4.766   6.438
  364    H4*    C  33           H4*        C  33  -3.694  -4.985   4.023
  365    H3*    C  33           H3*        C  33  -2.033  -6.819   5.503
  366    H1*    C  33           H1*        C  33  -1.454  -5.506   1.777
  367   1H4     C  33          1H4         C  33   4.558  -3.475   0.947
  368   2H4     C  33          2H4         C  33   4.786  -3.231   2.664
  369    H5     C  33           H5         C  33   3.063  -3.714   4.301
  370    H6     C  33           H6         C  33   0.794  -4.504   4.653
  371   1H2*    C  33          1H2*        C  33  -0.130  -6.730   4.258
  372   2H2*    C  33          2H2*        C  33  -1.078  -7.499   2.960
  373   1H5*    A  34          1H5*        A  34  -4.295  -8.112   1.532
  374   2H5*    A  34          2H5*        A  34  -5.262  -9.508   2.067
  375    H4*    A  34           H4*        A  34  -4.889  -9.778  -0.307
  376    H3*    A  34           H3*        A  34  -3.784 -11.681   1.551
  377    H1*    A  34           H1*        A  34  -1.786 -10.354  -1.701
  378    H8     A  34           H8         A  34  -0.738  -9.926   2.019
  379   1H6     A  34          1H6         A  34   4.692  -7.996  -0.138
  380   2H6     A  34          2H6         A  34   3.755  -8.330   1.302
  381    H2     A  34           H2         A  34   2.032  -8.887  -3.655
  382   1H2*    A  34          1H2*        A  34  -1.637 -11.842   0.849
  383   2H2*    A  34          2H2*        A  34  -2.249 -12.343  -0.726
  384   1H5*    C  35          1H5*        C  35  -4.463 -12.979  -2.816
  385   2H5*    C  35          2H5*        C  35  -5.168 -14.605  -2.966
  386    H4*    C  35           H4*        C  35  -3.484 -14.129  -4.749
  387    H3*    C  35           H3*        C  35  -3.389 -16.456  -3.024
  388    H1*    C  35           H1*        C  35  -0.226 -14.362  -4.391
  389   1H4     C  35          1H4         C  35   3.567 -12.991   0.571
  390   2H4     C  35          2H4         C  35   2.333 -13.425   1.733
  391    H5     C  35           H5         C  35   0.149 -14.225   1.096
  392    H6     C  35           H6         C  35  -1.319 -14.802  -0.766
  393   1H2*    C  35          1H2*        C  35  -1.199 -16.495  -2.458
  394   2H2*    C  35          2H2*        C  35  -0.816 -16.610  -4.198
  395   1H5*    G  36          1H5*        G  36  -1.064 -16.866  -6.911
  396   2H5*    G  36          2H5*        G  36  -1.805 -18.195  -7.849
  397    H4*    G  36           H4*        G  36   0.614 -18.095  -8.256
  398    H3*    G  36           H3*        G  36  -0.619 -20.448  -7.142
  399    H1*    G  36           H1*        G  36   2.994 -18.998  -6.216
  400    H8     G  36           H8         G  36   0.168 -18.863  -3.474
  401    H1     G  36           H1         G  36   6.124 -18.369  -1.255
  402   1H2     G  36          1H2         G  36   7.056 -18.579  -4.634
  403   2H2     G  36          2H2         G  36   7.579 -18.399  -2.975
  404   1H2*    G  36          1H2*        G  36   0.798 -20.809  -5.307
  405   2H2*    G  36          2H2*        G  36   2.080 -21.070  -6.527
  Start of MODEL    4
    1   1H5*    C   1          1H5*        C   1  16.106 -15.556   1.446
    2   2H5*    C   1          2H5*        C   1  16.604 -13.860   1.658
    3    H4*    C   1           H4*        C   1  16.069 -14.183  -0.695
    4    H3*    C   1           H3*        C   1  14.616 -12.308   0.906
    5    H1*    C   1           H1*        C   1  12.782 -14.758  -1.755
    6   1H4     C   1          1H4         C   1   8.050 -17.476   1.578
    7   2H4     C   1          2H4         C   1   8.871 -17.211   3.100
    8    H5     C   1           H5         C   1  11.052 -16.189   3.266
    9    H6     C   1           H6         C   1  12.877 -15.125   2.016
   10   1H2*    C   1          1H2*        C   1  12.455 -12.936   0.546
   11   2H2*    C   1          2H2*        C   1  12.711 -12.542  -1.174
   12   1H5*    G   2          1H5*        G   2  13.867 -12.072  -3.462
   13   2H5*    G   2          2H5*        G   2  14.677 -10.625  -4.130
   14    H4*    G   2           H4*        G   2  12.704 -11.248  -5.488
   15    H3*    G   2           H3*        G   2  12.948  -8.666  -4.242
   16    H1*    G   2           H1*        G   2   9.622 -10.740  -4.727
   17    H8     G   2           H8         G   2  10.733  -9.961  -1.036
   18    H1     G   2           H1         G   2   4.971 -12.627  -1.525
   19   1H2     G   2          1H2         G   2   5.640 -12.756  -4.966
   20   2H2     G   2          2H2         G   2   4.518 -13.109  -3.670
   21   1H2*    G   2          1H2*        G   2  11.008  -8.650  -3.048
   22   2H2*    G   2          2H2*        G   2  10.195  -8.492  -4.627
   23   1H5*    T   3          1H5*        T   3   9.691  -9.275  -7.529
   24   2H5*    T   3          2H5*        T   3  10.079  -8.101  -8.809
   25    H4*    T   3           H4*        T   3   7.702  -8.368  -8.863
   26    H3*    T   3           H3*        T   3   8.761  -5.809  -8.063
   27   1H2*    T   3          1H2*        T   3   7.621  -5.524  -6.114
   28   2H2*    T   3          2H2*        T   3   6.161  -5.381  -7.114
   29    H1*    T   3           H1*        T   3   5.467  -7.546  -6.765
   30    H3     T   3           H3         T   3   4.215  -8.519  -2.540
   31   1H5M    T   3          1H5M        T   3   9.162  -6.889  -1.883
   32   2H5M    T   3          2H5M        T   3   7.936  -6.432  -0.680
   33   3H5M    T   3          3H5M        T   3   8.336  -5.319  -2.010
   34    H6     T   3           H6         T   3   8.179  -6.496  -4.357
   35   1H5*    G   4          1H5*        G   4   4.491  -6.175  -9.511
   36   2H5*    G   4          2H5*        G   4   4.138  -5.065 -10.867
   37    H4*    G   4           H4*        G   4   2.126  -5.419  -9.502
   38    H3*    G   4           H3*        G   4   3.245  -2.785  -9.837
   39    H1*    G   4           H1*        G   4   1.422  -4.253  -6.694
   40    H8     G   4           H8         G   4   5.068  -2.971  -6.054
   41    H1     G   4           H1         G   4   1.938  -4.809  -0.817
   42   1H2     G   4          1H2         G   4  -0.615  -5.733  -3.041
   43   2H2     G   4          2H2         G   4  -0.076  -5.639  -1.380
   44   1H2*    G   4          1H2*        G   4   3.519  -2.260  -7.626
   45   2H2*    G   4          2H2*        G   4   1.761  -2.133  -7.606
   46   1H5*    C   5          1H5*        C   5  -1.683  -3.165  -8.877
   47   2H5*    C   5          2H5*        C   5  -2.267  -2.042 -10.125
   48    H4*    C   5           H4*        C   5  -3.789  -2.054  -8.189
   49    H3*    C   5           H3*        C   5  -2.518   0.376  -9.139
   50    H1*    C   5           H1*        C   5  -3.391  -0.579  -5.334
   51   1H4     C   5          1H4         C   5   2.798   0.844  -3.164
   52   2H4     C   5          2H4         C   5   1.719   0.985  -1.794
   53    H5     C   5           H5         C   5   2.045   0.238  -5.375
   54    H6     C   5           H6         C   5   0.118  -0.427  -6.721
   55   1H2*    C   5          1H2*        C   5  -1.857   1.264  -7.172
   56   2H2*    C   5          2H2*        C   5  -3.579   1.324  -6.708
   57   1H5*    A   6          1H5*        A   6  -6.475   0.846  -6.789
   58   2H5*    A   6          2H5*        A   6  -7.593   1.867  -7.719
   59    H4*    A   6           H4*        A   6  -7.771   2.182  -5.236
   60    H3*    A   6           H3*        A   6  -7.515   4.359  -7.130
   61    H1*    A   6           H1*        A   6  -6.191   4.087  -3.435
   62    H8     A   6           H8         A   6  -3.441   4.707  -6.203
   63   1H6     A   6          1H6         A   6   0.275   5.651  -3.325
   64   2H6     A   6          2H6         A   6   0.487   5.652  -1.588
   65    H2     A   6           H2         A   6  -3.460   4.559   0.227
   66   1H2*    A   6          1H2*        A   6  -5.781   5.450  -6.126
   67   2H2*    A   6          2H2*        A   6  -6.950   5.847  -4.835
   68   1H5*    G   7          1H5*        G   7  -9.318   5.814  -2.847
   69   2H5*    G   7          2H5*        G   7 -10.704   6.830  -3.335
   70    H4*    G   7           H4*        G   7  -9.470   7.894  -1.494
   71    H3*    G   7           H3*        G   7  -9.834   9.240  -3.990
   72    H1*    G   7           H1*        G   7  -6.786   9.464  -1.622
   73    H8     G   7           H8         G   7  -5.655   8.225  -5.173
   74    H1     G   7           H1         G   7  -0.955   8.956  -0.932
   75   1H2     G   7          1H2         G   7  -1.811   9.412   1.094
   76   2H2     G   7          2H2         G   7  -3.534   9.522   1.375
   77   1H2*    G   7          1H2*        G   7  -7.588   9.346  -4.568
   78   2H2*    G   7          2H2*        G   7  -7.613  10.738  -3.458
   79   1H5*    C   8          1H5*        C   8  -8.977  11.318   0.253
   80   2H5*    C   8          2H5*        C   8 -10.128  12.672   0.304
   81    H4*    C   8           H4*        C   8  -8.305  13.051   1.903
   82    H3*    C   8           H3*        C   8  -8.855  14.940  -0.231
   83    H1*    C   8           H1*        C   8  -5.254  14.020   1.278
   84   1H4     C   8          1H4         C   8  -2.685  12.894  -4.786
   85   2H4     C   8          2H4         C   8  -1.348  13.276  -3.726
   86    H5     C   8           H5         C   8  -4.976  12.823  -4.033
   87    H6     C   8           H6         C   8  -6.487  13.150  -2.151
   88   1H2*    C   8          1H2*        C   8  -6.742  15.412  -0.907
   89   2H2*    C   8          2H2*        C   8  -6.397  15.949   0.754
   90   1H5*    G   9          1H5*        G   9  -6.677  16.510   3.313
   91   2H5*    G   9          2H5*        G   9  -7.571  17.826   4.124
   92    H4*    G   9           H4*        G   9  -5.055  18.005   4.244
   93    H3*    G   9           H3*        G   9  -6.793  20.157   3.370
   94    H1*    G   9           H1*        G   9  -3.130  19.280   2.042
   95    H8     G   9           H8         G   9  -6.160  19.506  -0.476
   96    H1     G   9           H1         G   9  -0.429  18.668  -3.145
   97   1H2     G   9          1H2         G   9   1.144  18.545  -1.548
   98   2H2     G   9          2H2         G   9   0.754  18.649   0.154
   99   1H2*    G   9          1H2*        G   9  -5.676  20.818   1.509
  100   2H2*    G   9          2H2*        G   9  -4.312  21.237   2.579
  101   1H5*    G  10          1H5*        G  10  -2.524  21.531   5.142
  102   2H5*    G  10          2H5*        G  10  -2.980  22.721   6.396
  103    H4*    G  10           H4*        G  10  -0.879  23.378   5.286
  104    H3*    G  10           H3*        G  10  -3.191  25.084   5.272
  105    H1*    G  10           H1*        G  10  -0.592  24.675   2.290
  106    H8     G  10           H8         G  10  -4.347  23.676   1.706
  107    H1     G  10           H1         G  10  -0.734  23.544  -3.543
  108   1H2     G  10          1H2         G  10   1.377  24.090  -3.051
  109   2H2     G  10          2H2         G  10   1.887  24.474  -1.424
  110   1H2*    G  10          1H2*        G  10  -3.387  25.476   3.029
  111   2H2*    G  10          2H2*        G  10  -1.857  26.375   3.180
  112   1H5*    C  11          1H5*        C  11  -1.074  29.847   5.194
  113   2H5*    C  11          2H5*        C  11  -2.188  29.862   3.807
  114    H4*    C  11           H4*        C  11   0.618  28.644   3.930
  115    H3*    C  11           H3*        C  11  -0.220  31.192   3.018
  116    H1*    C  11           H1*        C  11   0.520  28.163   0.665
  117   1H4     C  11          1H4         C  11  -4.276  26.807  -3.388
  118   2H4     C  11          2H4         C  11  -5.467  26.985  -2.119
  119    H5     C  11           H5         C  11  -4.892  27.628   0.150
  120    H6     C  11           H6         C  11  -3.077  28.321   1.640
  121   1H2*    C  11          1H2*        C  11  -1.390  30.477   1.125
  122   2H2*    C  11          2H2*        C  11   0.256  30.478   0.426
  123   1H5*    T  12          1H5*        T  12   4.366  32.401  -0.038
  124   2H5*    T  12          2H5*        T  12   2.852  33.167  -0.575
  125    H4*    T  12           H4*        T  12   4.085  32.327  -2.538
  126    H3*    T  12           H3*        T  12   1.409  31.554  -1.996
  127   1H2*    T  12          1H2*        T  12   1.645  29.293  -1.698
  128   2H2*    T  12          2H2*        T  12   1.921  29.262  -3.468
  129    H1*    T  12           H1*        T  12   4.205  28.970  -3.246
  130    H3     T  12           H3         T  12   3.929  24.844  -1.272
  131   1H5M    T  12          1H5M        T  12   5.104  28.166   2.634
  132   2H5M    T  12          2H5M        T  12   4.239  26.657   3.009
  133   3H5M    T  12          3H5M        T  12   3.329  28.169   2.786
  134    H6     T  12           H6         T  12   3.975  29.363   0.412
  135   1H5*    T  13          1H5*        T  13   1.278  30.253  -5.829
  136   2H5*    T  13          2H5*        T  13   1.474  31.494  -7.088
  137    H4*    T  13           H4*        T  13   0.011  29.605  -7.859
  138    H3*    T  13           H3*        T  13  -0.668  32.352  -8.127
  139   1H2*    T  13          1H2*        T  13  -2.433  32.458  -6.635
  140   2H2*    T  13          2H2*        T  13  -3.323  31.680  -7.971
  141    H1*    T  13           H1*        T  13  -3.253  29.571  -6.976
  142    H3     T  13           H3         T  13  -6.170  30.315  -3.591
  143   1H5M    T  13          1H5M        T  13  -1.791  32.969  -2.113
  144   2H5M    T  13          2H5M        T  13  -1.620  31.377  -1.331
  145   3H5M    T  13          3H5M        T  13  -2.994  32.428  -0.921
  146    H6     T  13           H6         T  13  -1.518  31.423  -4.229
  147   1H5*    G  14          1H5*        G  14   0.432  29.274 -12.846
  148   2H5*    G  14          2H5*        G  14  -0.647  27.872 -12.663
  149    H4*    G  14           H4*        G  14   2.101  28.368 -11.659
  150    H3*    G  14           H3*        G  14   0.619  26.067 -12.532
  151    H1*    G  14           H1*        G  14   1.628  26.567  -8.602
  152    H8     G  14           H8         G  14  -1.916  26.405 -10.248
  153    H1     G  14           H1         G  14  -1.922  26.853  -3.894
  154   1H2     G  14          1H2         G  14   1.566  27.026  -4.236
  155   2H2     G  14          2H2         G  14   0.194  27.028  -3.150
  156   1H2*    G  14          1H2*        G  14   0.079  25.035 -10.578
  157   2H2*    G  14          2H2*        G  14   1.810  24.945 -10.212
  158   1H5*    C  15          1H5*        C  15   4.474  25.930 -10.411
  159   2H5*    C  15          2H5*        C  15   5.728  24.818 -11.005
  160    H4*    C  15           H4*        C  15   5.925  24.930  -8.606
  161    H3*    C  15           H3*        C  15   5.218  22.410  -9.841
  162    H1*    C  15           H1*        C  15   4.079  23.783  -6.318
  163   1H4     C  15          1H4         C  15  -2.528  22.990  -6.682
  164   2H4     C  15          2H4         C  15  -2.145  23.624  -5.097
  165    H5     C  15           H5         C  15  -0.897  22.498  -8.298
  166    H6     C  15           H6         C  15   1.485  22.818  -8.988
  167   1H2*    C  15          1H2*        C  15   3.477  21.806  -8.492
  168   2H2*    C  15          2H2*        C  15   4.655  21.745  -7.160
  169   1H5*    C  16          1H5*        C  16   6.600  22.217  -5.482
  170   2H5*    C  16          2H5*        C  16   8.235  21.537  -5.630
  171    H4*    C  16           H4*        C  16   7.461  20.824  -3.492
  172    H3*    C  16           H3*        C  16   7.824  18.826  -5.527
  173    H1*    C  16           H1*        C  16   4.913  18.802  -2.805
  174   1H4     C  16          1H4         C  16  -0.271  18.810  -7.051
  175   2H4     C  16          2H4         C  16  -0.897  18.532  -5.442
  176    H5     C  16           H5         C  16   2.093  19.050  -7.524
  177    H6     C  16           H6         C  16   4.333  19.249  -6.531
  178   1H2*    C  16          1H2*        C  16   5.813  17.742  -5.427
  179   2H2*    C  16          2H2*        C  16   6.255  17.279  -3.770
  180   1H5*    G  17          1H5*        G  17   7.331  18.162  -1.228
  181   2H5*    G  17          2H5*        G  17   8.876  17.640  -0.498
  182    H4*    G  17           H4*        G  17   7.207  17.024   1.080
  183    H3*    G  17           H3*        G  17   8.391  14.878  -0.425
  184    H1*    G  17           H1*        G  17   4.631  15.106   0.821
  185    H8     G  17           H8         G  17   5.287  15.109  -3.067
  186    H1     G  17           H1         G  17  -0.753  14.030  -1.412
  187   1H2     G  17          1H2         G  17   0.363  14.385   1.884
  188   2H2     G  17          2H2         G  17  -0.985  14.093   0.807
  189   1H2*    G  17          1H2*        G  17   6.549  13.897  -1.209
  190   2H2*    G  17          2H2*        G  17   6.233  13.357   0.458
  191   1H5*    G  18          1H5*        G  18   7.189  16.771   3.918
  192   2H5*    G  18          2H5*        G  18   8.887  16.319   3.560
  193    H4*    G  18           H4*        G  18   7.478  16.424   6.296
  194    H3*    G  18           H3*        G  18   9.135  18.421   4.873
  195    H1*    G  18           H1*        G  18  10.224  16.116   7.989
  196    H8     G  18           H8         G  18  11.950  16.402   4.470
  197    H1     G  18           H1         G  18  15.387  13.437   8.933
  198   1H2     G  18          1H2         G  18  14.220  13.343  10.856
  199   2H2     G  18          2H2         G  18  12.613  14.019  11.002
  200   1H2*    G  18          1H2*        G  18  11.034  18.242   6.110
  201   2H2*    G  18          2H2*        G  18  10.077  18.364   7.608
  202   1H5*    C  19          1H5*        C  19   8.105  18.810   9.259
  203   2H5*    C  19          2H5*        C  19   7.237  20.342   9.509
  204    H4*    C  19           H4*        C  19   8.449  19.811  11.549
  205    H3*    C  19           H3*        C  19   9.039  22.219  10.071
  206    H1*    C  19           H1*        C  19  11.756  19.985  11.964
  207   1H4     C  19          1H4         C  19  15.558  19.041   6.539
  208   2H4     C  19          2H4         C  19  16.415  18.348   7.897
  209    H5     C  19           H5         C  19  13.387  20.078   6.750
  210    H6     C  19           H6         C  19  11.587  20.690   8.255
  211   1H2*    C  19          1H2*        C  19  11.318  22.177  10.041
  212   2H2*    C  19          2H2*        C  19  11.275  22.169  11.818
  213   1H5*    A  20          1H5*        A  20   9.899  22.041  14.553
  214   2H5*    A  20          2H5*        A  20   9.247  23.444  15.432
  215    H4*    A  20           H4*        A  20  11.365  22.727  16.458
  216    H3*    A  20           H3*        A  20  10.983  25.401  15.448
  217    H1*    A  20           H1*        A  20  14.346  23.274  15.291
  218    H8     A  20           H8         A  20  12.772  24.620  11.945
  219   1H6     A  20          1H6         A  20  17.543  21.991   9.115
  220   2H6     A  20          2H6         A  20  16.107  22.969   8.912
  221    H2     A  20           H2         A  20  17.858  21.027  13.489
  222   1H2*    A  20          1H2*        A  20  12.796  25.581  14.090
  223   2H2*    A  20          2H2*        A  20  13.772  25.499  15.581
  224   1H5*    C  21          1H5*        C  21  13.571  28.363  18.757
  225   2H5*    C  21          2H5*        C  21  14.027  28.996  17.162
  226    H4*    C  21           H4*        C  21  15.195  26.606  18.661
  227    H3*    C  21           H3*        C  21  16.186  29.201  18.364
  228    H1*    C  21           H1*        C  21  17.374  26.296  15.972
  229   1H4     C  21          1H4         C  21  16.124  26.863   9.782
  230   2H4     C  21          2H4         C  21  14.628  27.717  10.084
  231    H5     C  21           H5         C  21  13.845  28.267  12.321
  232    H6     C  21           H6         C  21  14.435  28.281  14.704
  233   1H2*    C  21          1H2*        C  21  16.472  29.191  16.033
  234   2H2*    C  21          2H2*        C  21  18.031  28.468  16.514
  235   1H5*    T  22          1H5*        T  22  21.605  27.501  19.437
  236   2H5*    T  22          2H5*        T  22  21.533  29.103  18.666
  237    H4*    T  22           H4*        T  22  23.250  27.803  17.515
  238    H3*    T  22           H3*        T  22  21.078  28.879  16.110
  239   1H2*    T  22          1H2*        T  22  19.926  26.945  15.556
  240   2H2*    T  22          2H2*        T  22  21.193  26.802  14.308
  241    H1*    T  22           H1*        T  22  22.374  25.173  15.467
  242    H3     T  22           H3         T  22  19.694  21.536  15.377
  243   1H5M    T  22          1H5M        T  22  17.059  23.066  18.915
  244   2H5M    T  22          2H5M        T  22  16.746  24.665  18.205
  245   3H5M    T  22          3H5M        T  22  17.952  24.488  19.502
  246    H6     T  22           H6         T  22  19.488  25.697  17.803
  247   1H5*    T  23          1H5*        T  23  22.603  26.394  12.381
  248   2H5*    T  23          2H5*        T  23  23.790  27.645  11.965
  249    H4*    T  23           H4*        T  23  22.643  26.576   9.970
  250    H3*    T  23           H3*        T  23  22.930  29.454  10.453
  251   1H2*    T  23          1H2*        T  23  20.942  30.209   9.687
  252   2H2*    T  23          2H2*        T  23  21.194  29.305   8.172
  253    H1*    T  23           H1*        T  23  19.677  27.715   8.798
  254    H3     T  23           H3         T  23  16.193  30.466   9.936
  255   1H5M    T  23          1H5M        T  23  18.656  29.859  14.517
  256   2H5M    T  23          2H5M        T  23  18.114  31.485  14.053
  257   3H5M    T  23          3H5M        T  23  19.801  30.987  13.746
  258    H6     T  23           H6         T  23  20.040  28.817  12.334
  259   1H5*    G  24          1H5*        G  24  26.857  26.107   7.905
  260   2H5*    G  24          2H5*        G  24  25.970  25.367   6.555
  261    H4*    G  24           H4*        G  24  26.285  24.505   9.359
  262    H3*    G  24           H3*        G  24  25.864  23.196   6.854
  263    H1*    G  24           H1*        G  24  23.291  23.094   9.915
  264    H8     G  24           H8         G  24  22.013  24.491   6.474
  265    H1     G  24           H1         G  24  17.841  24.991  11.263
  266   1H2     G  24          1H2         G  24  20.481  23.810  13.252
  267   2H2     G  24          2H2         G  24  18.823  24.362  13.191
  268   1H2*    G  24          1H2*        G  24  23.587  22.895   6.906
  269   2H2*    G  24          2H2*        G  24  23.947  21.720   8.180
  270   1H5*    T  25          1H5*        T  25  26.260  20.606  10.974
  271   2H5*    T  25          2H5*        T  25  27.074  19.086  10.544
  272    H4*    T  25           H4*        T  25  25.469  18.822  12.438
  273    H3*    T  25           H3*        T  25  25.421  17.151  10.064
  274   1H2*    T  25          1H2*        T  25  23.179  17.087   9.674
  275   2H2*    T  25          2H2*        T  25  22.984  16.388  11.300
  276    H1*    T  25           H1*        T  25  22.311  18.354  12.233
  277    H3     T  25           H3         T  25  18.632  20.359  10.658
  278   1H5M    T  25          1H5M        T  25  21.961  20.674   6.580
  279   2H5M    T  25          2H5M        T  25  20.210  20.585   6.287
  280   3H5M    T  25          3H5M        T  25  21.192  19.102   6.267
  281    H6     T  25           H6         T  25  22.739  19.019   8.529
  282   1H5*    G  26          1H5*        G  26  23.922  15.331  14.169
  283   2H5*    G  26          2H5*        G  26  24.585  13.680  14.337
  284    H4*    G  26           H4*        G  26  22.288  13.861  15.257
  285    H3*    G  26           H3*        G  26  22.965  11.986  13.161
  286    H1*    G  26           H1*        G  26  19.524  13.992  13.483
  287    H8     G  26           H8         G  26  21.706  14.135  10.233
  288    H1     G  26           H1         G  26  16.400  17.662  10.028
  289   1H2     G  26          1H2         G  26  15.943  16.651  13.352
  290   2H2     G  26          2H2         G  26  15.333  17.575  11.998
  291   1H2*    G  26          1H2*        G  26  21.262  12.351  11.703
  292   2H2*    G  26          2H2*        G  26  20.152  11.866  12.994
  293   1H5*    C  27          1H5*        C  27  19.293   7.741  15.444
  294   2H5*    C  27          2H5*        C  27  19.533   8.419  13.817
  295    H4*    C  27           H4*        C  27  17.592   9.488  15.927
  296    H3*    C  27           H3*        C  27  17.187   7.412  13.897
  297    H1*    C  27           H1*        C  27  15.967  11.289  13.674
  298   1H4     C  27          1H4         C  27  18.947  12.073   7.738
  299   2H4     C  27          2H4         C  27  17.553  13.130   7.766
  300    H5     C  27           H5         C  27  19.542  10.631   9.584
  301    H6     C  27           H6         C  27  18.825   9.739  11.749
  302   1H2*    C  27          1H2*        C  27  16.259   8.689  12.230
  303   2H2*    C  27          2H2*        C  27  15.005   9.217  13.383
  304   1H5*    T  28          1H5*        T  28  11.689   7.445  15.092
  305   2H5*    T  28          2H5*        T  28  11.988   6.922  13.418
  306    H4*    T  28           H4*        T  28  10.231   8.695  13.535
  307    H3*    T  28           H3*        T  28  12.566   8.875  11.834
  308   1H2*    T  28          1H2*        T  28  13.338  10.936  12.462
  309   2H2*    T  28          2H2*        T  28  11.843  11.579  11.727
  310    H1*    T  28           H1*        T  28  10.831  11.902  13.815
  311    H3     T  28           H3         T  28  14.172  15.031  14.728
  312   1H5M    T  28          1H5M        T  28  15.675  10.656  17.273
  313   2H5M    T  28          2H5M        T  28  14.431  11.270  18.390
  314   3H5M    T  28          3H5M        T  28  15.878  12.245  18.044
  315    H6     T  28           H6         T  28  13.259  10.473  16.022
  316   1H5*    T  29          1H5*        T  29   9.471  11.160   9.618
  317   2H5*    T  29          2H5*        T  29   8.264  10.019   8.978
  318    H4*    T  29           H4*        T  29   8.452  11.976   7.480
  319    H3*    T  29           H3*        T  29   8.813   9.292   6.559
  320   1H2*    T  29          1H2*        T  29  10.931   9.427   5.688
  321   2H2*    T  29          2H2*        T  29  10.202  10.455   4.435
  322    H1*    T  29           H1*        T  29  11.037  12.407   5.361
  323    H3     T  29           H3         T  29  15.525  11.906   4.947
  324   1H5M    T  29          1H5M        T  29  15.838   9.068   8.634
  325   2H5M    T  29          2H5M        T  29  14.202   8.372   8.702
  326   3H5M    T  29          3H5M        T  29  14.587   9.839   9.637
  327    H6     T  29           H6         T  29  12.265  10.016   7.950
  328   1H5*    C  30          1H5*        C  30   5.237  12.641   4.491
  329   2H5*    C  30          2H5*        C  30   5.819  11.618   5.817
  330    H4*    C  30           H4*        C  30   3.450  11.644   6.056
  331    H3*    C  30           H3*        C  30   4.666   9.167   5.215
  332    H1*    C  30           H1*        C  30   1.118  10.575   4.091
  333   1H4     C  30          1H4         C  30   2.176  10.224  -2.523
  334   2H4     C  30          2H4         C  30   0.487   9.856  -2.249
  335    H5     C  30           H5         C  30   3.729  10.693  -0.739
  336    H6     C  30           H6         C  30   4.032  10.801   1.702
  337   1H2*    C  30          1H2*        C  30   3.375   8.696   3.421
  338   2H2*    C  30          2H2*        C  30   2.030   8.491   4.572
  339   1H5*    T  31          1H5*        T  31   0.413   7.971   7.091
  340   2H5*    T  31          2H5*        T  31   0.994   7.071   8.511
  341    H4*    T  31           H4*        T  31  -0.916   5.878   7.625
  342    H3*    T  31           H3*        T  31   1.700   4.634   7.626
  343   1H2*    T  31          1H2*        T  31   1.766   3.758   5.538
  344   2H2*    T  31          2H2*        T  31   0.314   2.828   5.958
  345    H1*    T  31           H1*        T  31  -1.108   4.196   4.827
  346    H3     T  31           H3         T  31  -0.433   4.759   0.441
  347   1H5M    T  31          1H5M        T  31   3.837   6.828   1.493
  348   2H5M    T  31          2H5M        T  31   4.263   5.107   1.406
  349   3H5M    T  31          3H5M        T  31   4.247   5.930   2.975
  350    H6     T  31           H6         T  31   2.368   5.472   4.290
  351   1H5*    G  32          1H5*        G  32  -2.122   1.857   7.812
  352   2H5*    G  32          2H5*        G  32  -1.849   0.656   9.106
  353    H4*    G  32           H4*        G  32  -3.154  -0.340   7.286
  354    H3*    G  32           H3*        G  32  -0.549  -1.389   7.975
  355    H1*    G  32           H1*        G  32  -2.099  -1.158   4.297
  356    H8     G  32           H8         G  32   1.304   0.625   5.187
  357    H1     G  32           H1         G  32  -0.279   0.688  -0.981
  358   1H2     G  32          1H2         G  32  -2.289  -0.263  -1.274
  359   2H2     G  32          2H2         G  32  -3.224  -0.897   0.061
  360   1H2*    G  32          1H2*        G  32   0.390  -1.544   5.914
  361   2H2*    G  32          2H2*        G  32  -0.895  -2.706   5.501
  362   1H5*    C  33          1H5*        C  33  -3.685  -4.082   5.921
  363   2H5*    C  33          2H5*        C  33  -3.912  -5.559   6.888
  364    H4*    C  33           H4*        C  33  -4.307  -6.039   4.507
  365    H3*    C  33           H3*        C  33  -2.317  -7.453   6.050
  366    H1*    C  33           H1*        C  33  -2.133  -6.448   2.194
  367   1H4     C  33          1H4         C  33   3.471  -3.718   0.747
  368   2H4     C  33          2H4         C  33   3.826  -3.388   2.428
  369    H5     C  33           H5         C  33   2.339  -4.005   4.231
  370    H6     C  33           H6         C  33   0.192  -4.982   4.822
  371   1H2*    C  33          1H2*        C  33  -0.520  -7.235   4.681
  372   2H2*    C  33          2H2*        C  33  -1.418  -8.249   3.522
  373   1H5*    A  34          1H5*        A  34  -4.641  -9.654   2.472
  374   2H5*    A  34          2H5*        A  34  -5.135 -11.231   3.132
  375    H4*    A  34           H4*        A  34  -4.762 -11.442   0.715
  376    H3*    A  34           H3*        A  34  -3.272 -13.012   2.625
  377    H1*    A  34           H1*        A  34  -1.723 -11.448  -0.741
  378    H8     A  34           H8         A  34  -0.530 -10.604   2.863
  379   1H6     A  34          1H6         A  34   4.287  -7.861   0.214
  380   2H6     A  34          2H6         A  34   3.519  -8.269   1.731
  381    H2     A  34           H2         A  34   1.614  -9.437  -3.049
  382   1H2*    A  34          1H2*        A  34  -1.150 -12.714   1.887
  383   2H2*    A  34          2H2*        A  34  -1.649 -13.427   0.355
  384   1H5*    C  35          1H5*        C  35  -3.485 -14.224  -1.701
  385   2H5*    C  35          2H5*        C  35  -3.987 -15.915  -1.939
  386    H4*    C  35           H4*        C  35  -2.425 -15.216  -3.713
  387    H3*    C  35           H3*        C  35  -1.906 -17.498  -2.015
  388    H1*    C  35           H1*        C  35   0.784 -14.953  -3.532
  389   1H4     C  35          1H4         C  35   4.750 -12.877   1.046
  390   2H4     C  35          2H4         C  35   3.672 -13.401   2.321
  391    H5     C  35           H5         C  35   1.552 -14.470   1.899
  392    H6     C  35           H6         C  35   0.029 -15.310   0.187
  393   1H2*    C  35          1H2*        C  35   0.251 -17.096  -1.432
  394   2H2*    C  35          2H2*        C  35   0.652 -17.250  -3.167
  395   1H5*    G  36          1H5*        G  36   0.594 -17.271  -5.795
  396   2H5*    G  36          2H5*        G  36  -0.043 -18.570  -6.846
  397    H4*    G  36           H4*        G  36   2.289 -18.273  -7.388
  398    H3*    G  36           H3*        G  36   1.449 -20.738  -6.174
  399    H1*    G  36           H1*        G  36   4.918 -18.874  -5.588
  400    H8     G  36           H8         G  36   2.445 -19.045  -2.508
  401    H1     G  36           H1         G  36   8.446 -17.550  -1.008
  402   1H2     G  36          1H2         G  36   9.007 -17.553  -4.467
  403   2H2     G  36          2H2         G  36   9.665 -17.292  -2.867
  404   1H2*    G  36          1H2*        G  36   3.006 -20.865  -4.423
  405   2H2*    G  36          2H2*        G  36   4.218 -21.047  -5.723
  Start of MODEL    5
    1   1H5*    C   1          1H5*        C   1  16.524 -13.167   1.819
    2   2H5*    C   1          2H5*        C   1  16.814 -11.411   1.863
    3    H4*    C   1           H4*        C   1  16.333 -12.004  -0.443
    4    H3*    C   1           H3*        C   1  14.664 -10.185   0.972
    5    H1*    C   1           H1*        C   1  13.135 -13.090  -1.385
    6   1H4     C   1          1H4         C   1   8.862 -16.229   2.196
    7   2H4     C   1          2H4         C   1   9.650 -15.748   3.682
    8    H5     C   1           H5         C   1  11.681 -14.455   3.740
    9    H6     C   1           H6         C   1  13.325 -13.228   2.405
   10   1H2*    C   1          1H2*        C   1  12.623 -11.206   0.848
   11   2H2*    C   1          2H2*        C   1  12.693 -10.895  -0.907
   12   1H5*    G   2          1H5*        G   2  13.807 -10.776  -3.278
   13   2H5*    G   2          2H5*        G   2  14.399  -9.398  -4.250
   14    H4*    G   2           H4*        G   2  12.579 -10.589  -5.425
   15    H3*    G   2           H3*        G   2  12.382  -7.801  -4.750
   16    H1*    G   2           H1*        G   2   9.440 -10.432  -4.783
   17    H8     G   2           H8         G   2  10.399  -8.930  -1.276
   18    H1     G   2           H1         G   2   4.814 -11.980  -1.376
   19   1H2     G   2          1H2         G   2   5.566 -12.656  -4.732
   20   2H2     G   2          2H2         G   2   4.440 -12.854  -3.408
   21   1H2*    G   2          1H2*        G   2  10.441  -7.859  -3.553
   22   2H2*    G   2          2H2*        G   2   9.649  -8.137  -5.128
   23   1H5*    T   3          1H5*        T   3   9.164  -9.497  -7.479
   24   2H5*    T   3          2H5*        T   3   9.547  -8.827  -9.078
   25    H4*    T   3           H4*        T   3   7.240  -9.100  -9.254
   26    H3*    T   3           H3*        T   3   8.010  -6.362  -8.771
   27   1H2*    T   3          1H2*        T   3   6.685  -5.900  -6.982
   28   2H2*    T   3          2H2*        T   3   5.309  -6.071  -8.088
   29    H1*    T   3           H1*        T   3   4.783  -8.199  -7.444
   30    H3     T   3           H3         T   3   3.319  -8.608  -3.184
   31   1H5M    T   3          1H5M        T   3   6.758  -5.961  -1.483
   32   2H5M    T   3          2H5M        T   3   7.128  -5.021  -2.947
   33   3H5M    T   3          3H5M        T   3   8.086  -6.466  -2.552
   34    H6     T   3           H6         T   3   7.242  -6.582  -5.078
   35   1H5*    G   4          1H5*        G   4   3.790  -7.142 -10.120
   36   2H5*    G   4          2H5*        G   4   3.345  -6.184 -11.559
   37    H4*    G   4           H4*        G   4   1.404  -6.372 -10.123
   38    H3*    G   4           H3*        G   4   2.563  -3.760 -10.559
   39    H1*    G   4           H1*        G   4   0.714  -5.133  -7.398
   40    H8     G   4           H8         G   4   4.341  -3.807  -6.745
   41    H1     G   4           H1         G   4   1.080  -5.257  -1.463
   42   1H2     G   4          1H2         G   4  -1.453  -6.266  -3.667
   43   2H2     G   4          2H2         G   4  -0.937  -6.071  -2.007
   44   1H2*    G   4          1H2*        G   4   2.802  -3.155  -8.375
   45   2H2*    G   4          2H2*        G   4   1.046  -3.043  -8.375
   46   1H5*    C   5          1H5*        C   5  -2.594  -3.641  -9.809
   47   2H5*    C   5          2H5*        C   5  -2.886  -2.337 -10.979
   48    H4*    C   5           H4*        C   5  -4.403  -2.235  -8.994
   49    H3*    C   5           H3*        C   5  -2.823   0.036  -9.904
   50    H1*    C   5           H1*        C   5  -3.884  -0.937  -6.164
   51   1H4     C   5          1H4         C   5   2.342  -0.024  -3.814
   52   2H4     C   5          2H4         C   5   1.245   0.330  -2.496
   53    H5     C   5           H5         C   5   1.600  -0.696  -6.001
   54    H6     C   5           H6         C   5  -0.342  -1.217  -7.381
   55   1H2*    C   5          1H2*        C   5  -2.097   0.792  -7.908
   56   2H2*    C   5          2H2*        C   5  -3.807   1.052  -7.462
   57   1H5*    A   6          1H5*        A   6  -6.630   1.040  -7.572
   58   2H5*    A   6          2H5*        A   6  -7.618   2.214  -8.469
   59    H4*    A   6           H4*        A   6  -7.703   2.519  -5.980
   60    H3*    A   6           H3*        A   6  -7.188   4.681  -7.847
   61    H1*    A   6           H1*        A   6  -5.886   4.173  -4.175
   62    H8     A   6           H8         A   6  -3.085   4.394  -6.950
   63   1H6     A   6          1H6         A   6   0.660   5.253  -4.073
   64   2H6     A   6          2H6         A   6   0.848   5.352  -2.336
   65    H2     A   6           H2         A   6  -3.200   4.683  -0.525
   66   1H2*    A   6          1H2*        A   6  -5.337   5.546  -6.826
   67   2H2*    A   6          2H2*        A   6  -6.442   6.032  -5.512
   68   1H5*    G   7          1H5*        G   7  -8.318   5.889  -3.428
   69   2H5*    G   7          2H5*        G   7  -9.786   6.883  -3.631
   70    H4*    G   7           H4*        G   7  -8.602   7.858  -1.808
   71    H3*    G   7           H3*        G   7  -8.664   9.395  -4.236
   72    H1*    G   7           H1*        G   7  -5.855   9.242  -1.548
   73    H8     G   7           H8         G   7  -4.589   7.968  -5.056
   74    H1     G   7           H1         G   7  -0.007   9.128  -0.768
   75   1H2     G   7          1H2         G   7  -0.924   9.723   1.191
   76   2H2     G   7          2H2         G   7  -2.656   9.823   1.421
   77   1H2*    G   7          1H2*        G   7  -6.381   9.552  -4.535
   78   2H2*    G   7          2H2*        G   7  -6.504  10.762  -3.243
   79   1H5*    C   8          1H5*        C   8  -7.980  11.223   0.112
   80   2H5*    C   8          2H5*        C   8  -9.159  12.551   0.211
   81    H4*    C   8           H4*        C   8  -7.369  12.922   1.832
   82    H3*    C   8           H3*        C   8  -7.888  14.852  -0.272
   83    H1*    C   8           H1*        C   8  -4.302  13.909   1.263
   84   1H4     C   8          1H4         C   8  -1.650  12.810  -4.768
   85   2H4     C   8          2H4         C   8  -0.324  13.043  -3.652
   86    H5     C   8           H5         C   8  -3.964  12.896  -4.089
   87    H6     C   8           H6         C   8  -5.503  13.239  -2.242
   88   1H2*    C   8          1H2*        C   8  -5.768  15.367  -0.891
   89   2H2*    C   8          2H2*        C   8  -5.452  15.848   0.791
   90   1H5*    G   9          1H5*        G   9  -5.845  16.493   3.397
   91   2H5*    G   9          2H5*        G   9  -6.835  17.776   4.145
   92    H4*    G   9           H4*        G   9  -4.334  18.088   4.349
   93    H3*    G   9           H3*        G   9  -6.159  20.122   3.370
   94    H1*    G   9           H1*        G   9  -2.416  19.418   2.124
   95    H8     G   9           H8         G   9  -5.451  19.475  -0.396
   96    H1     G   9           H1         G   9   0.274  18.540  -3.041
   97   1H2     G   9          1H2         G   9   1.855  18.510  -1.445
   98   2H2     G   9          2H2         G   9   1.472  18.708   0.250
   99   1H2*    G   9          1H2*        G   9  -5.015  20.836   1.547
  100   2H2*    G   9          2H2*        G   9  -3.697  21.310   2.648
  101   1H5*    G  10          1H5*        G  10  -2.023  21.677   5.156
  102   2H5*    G  10          2H5*        G  10  -2.534  22.803   6.447
  103    H4*    G  10           H4*        G  10  -0.463  23.608   5.425
  104    H3*    G  10           H3*        G  10  -2.860  25.188   5.309
  105    H1*    G  10           H1*        G  10  -0.143  24.881   2.388
  106    H8     G  10           H8         G  10  -3.852  23.753   1.784
  107    H1     G  10           H1         G  10  -0.121  23.380  -3.369
  108   1H2     G  10          1H2         G  10   1.970  24.007  -2.870
  109   2H2     G  10          2H2         G  10   2.435  24.507  -1.260
  110   1H2*    G  10          1H2*        G  10  -2.979  25.594   3.061
  111   2H2*    G  10          2H2*        G  10  -1.485  26.543   3.269
  112   1H5*    C  11          1H5*        C  11  -1.579  30.067   5.606
  113   2H5*    C  11          2H5*        C  11  -2.662  29.855   4.210
  114    H4*    C  11           H4*        C  11   0.304  29.113   4.387
  115    H3*    C  11           H3*        C  11  -0.922  31.486   3.428
  116    H1*    C  11           H1*        C  11   0.299  28.532   1.110
  117   1H4     C  11          1H4         C  11  -4.232  26.392  -2.863
  118   2H4     C  11          2H4         C  11  -5.457  26.507  -1.620
  119    H5     C  11           H5         C  11  -4.998  27.331   0.616
  120    H6     C  11           H6         C  11  -3.304  28.328   2.081
  121   1H2*    C  11          1H2*        C  11  -1.884  30.612   1.503
  122   2H2*    C  11          2H2*        C  11  -0.229  30.814   0.864
  123   1H5*    T  12          1H5*        T  12   3.355  33.320   0.339
  124   2H5*    T  12          2H5*        T  12   1.746  33.821  -0.232
  125    H4*    T  12           H4*        T  12   3.109  33.053  -2.148
  126    H3*    T  12           H3*        T  12   0.555  31.969  -1.576
  127   1H2*    T  12          1H2*        T  12   1.080  29.789  -1.090
  128   2H2*    T  12          2H2*        T  12   1.383  29.651  -2.847
  129    H1*    T  12           H1*        T  12   3.677  29.657  -2.593
  130    H3     T  12           H3         T  12   3.828  25.729  -0.222
  131   1H5M    T  12          1H5M        T  12   4.610  29.513   3.341
  132   2H5M    T  12          2H5M        T  12   3.881  27.975   3.860
  133   3H5M    T  12          3H5M        T  12   2.840  29.366   3.481
  134    H6     T  12           H6         T  12   3.379  30.369   1.008
  135   1H5*    T  13          1H5*        T  13   0.591  30.238  -5.189
  136   2H5*    T  13          2H5*        T  13   0.788  31.369  -6.546
  137    H4*    T  13           H4*        T  13  -0.449  29.285  -7.216
  138    H3*    T  13           H3*        T  13  -1.293  31.924  -7.835
  139   1H2*    T  13          1H2*        T  13  -3.187  32.054  -6.520
  140   2H2*    T  13          2H2*        T  13  -3.899  31.059  -7.816
  141    H1*    T  13           H1*        T  13  -3.799  29.103  -6.560
  142    H3     T  13           H3         T  13  -6.990  30.222  -3.515
  143   1H5M    T  13          1H5M        T  13  -2.694  32.945  -1.938
  144   2H5M    T  13          2H5M        T  13  -2.561  31.402  -1.055
  145   3H5M    T  13          3H5M        T  13  -3.958  32.469  -0.782
  146    H6     T  13           H6         T  13  -2.290  31.228  -3.918
  147   1H5*    G  14          1H5*        G  14   0.202  28.608 -12.240
  148   2H5*    G  14          2H5*        G  14  -0.668  27.087 -11.937
  149    H4*    G  14           H4*        G  14   2.085  27.913 -11.248
  150    H3*    G  14           H3*        G  14   0.774  25.437 -11.840
  151    H1*    G  14           H1*        G  14   1.951  26.223  -7.987
  152    H8     G  14           H8         G  14  -1.563  25.658  -9.594
  153    H1     G  14           H1         G  14  -1.683  26.717  -3.312
  154   1H2     G  14          1H2         G  14   1.782  27.179  -3.646
  155   2H2     G  14          2H2         G  14   0.397  27.159  -2.576
  156   1H2*    G  14          1H2*        G  14   0.527  24.447  -9.811
  157   2H2*    G  14          2H2*        G  14   2.279  24.589  -9.575
  158   1H5*    C  15          1H5*        C  15   4.957  25.358 -10.193
  159   2H5*    C  15          2H5*        C  15   6.062  24.158 -10.902
  160    H4*    C  15           H4*        C  15   6.412  24.257  -8.491
  161    H3*    C  15           H3*        C  15   5.575  21.794  -9.768
  162    H1*    C  15           H1*        C  15   4.604  23.077  -6.139
  163   1H4     C  15          1H4         C  15  -1.997  22.279  -6.388
  164   2H4     C  15          2H4         C  15  -1.589  22.965  -4.833
  165    H5     C  15           H5         C  15  -0.384  21.741  -8.018
  166    H6     C  15           H6         C  15   1.976  22.101  -8.772
  167   1H2*    C  15          1H2*        C  15   3.964  21.125  -8.316
  168   2H2*    C  15          2H2*        C  15   5.215  21.082  -7.051
  169   1H5*    C  16          1H5*        C  16   7.437  21.535  -5.657
  170   2H5*    C  16          2H5*        C  16   9.017  20.751  -5.887
  171    H4*    C  16           H4*        C  16   8.328  20.187  -3.667
  172    H3*    C  16           H3*        C  16   8.493  18.081  -5.625
  173    H1*    C  16           H1*        C  16   5.721  18.316  -2.757
  174   1H4     C  16          1H4         C  16   0.408  18.196  -6.832
  175   2H4     C  16          2H4         C  16  -0.174  18.059  -5.188
  176    H5     C  16           H5         C  16   2.758  18.314  -7.392
  177    H6     C  16           H6         C  16   5.034  18.542  -6.485
  178   1H2*    C  16          1H2*        C  16   6.476  17.054  -5.329
  179   2H2*    C  16          2H2*        C  16   6.986  16.704  -3.666
  180   1H5*    G  17          1H5*        G  17   7.874  17.916  -1.489
  181   2H5*    G  17          2H5*        G  17   9.378  17.530  -0.610
  182    H4*    G  17           H4*        G  17   7.506  17.365   0.934
  183    H3*    G  17           H3*        G  17   9.129  15.102   0.429
  184    H1*    G  17           H1*        G  17   5.221  14.995   0.921
  185    H8     G  17           H8         G  17   6.263  14.604  -2.850
  186    H1     G  17           H1         G  17   0.306  12.799  -1.497
  187   1H2     G  17          1H2         G  17   1.125  13.631   1.808
  188   2H2     G  17          2H2         G  17  -0.096  13.056   0.698
  189   1H2*    G  17          1H2*        G  17   7.551  13.826  -0.682
  190   2H2*    G  17          2H2*        G  17   7.058  13.434   1.002
  191   1H5*    G  18          1H5*        G  18  11.383  13.031   2.383
  192   2H5*    G  18          2H5*        G  18  10.449  11.522   2.486
  193    H4*    G  18           H4*        G  18  10.056  12.195   4.971
  194    H3*    G  18           H3*        G  18  11.900  14.399   4.204
  195    H1*    G  18           H1*        G  18  12.490  11.278   6.605
  196    H8     G  18           H8         G  18  14.596  11.870   3.368
  197    H1     G  18           H1         G  18  17.703   8.897   8.074
  198   1H2     G  18          1H2         G  18  16.386   8.787   9.899
  199   2H2     G  18          2H2         G  18  14.764   9.440   9.913
  200   1H2*    G  18          1H2*        G  18  13.702  13.693   5.358
  201   2H2*    G  18          2H2*        G  18  12.699  13.558   6.828
  202   1H5*    C  19          1H5*        C  19  10.998  13.990   8.752
  203   2H5*    C  19          2H5*        C  19  10.059  15.472   9.034
  204    H4*    C  19           H4*        C  19  11.230  15.041  11.078
  205    H3*    C  19           H3*        C  19  11.935  17.385   9.558
  206    H1*    C  19           H1*        C  19  14.548  15.117  11.540
  207   1H4     C  19          1H4         C  19  18.391  13.907   6.202
  208   2H4     C  19          2H4         C  19  19.226  13.258   7.596
  209    H5     C  19           H5         C  19  16.222  14.952   6.344
  210    H6     C  19           H6         C  19  14.411  15.636   7.807
  211   1H2*    C  19          1H2*        C  19  14.211  17.232   9.524
  212   2H2*    C  19          2H2*        C  19  14.168  17.297  11.300
  213   1H5*    A  20          1H5*        A  20  12.852  16.997  13.948
  214   2H5*    A  20          2H5*        A  20  12.270  18.357  14.936
  215    H4*    A  20           H4*        A  20  14.306  17.478  15.953
  216    H3*    A  20           H3*        A  20  14.163  20.206  15.052
  217    H1*    A  20           H1*        A  20  17.336  17.834  14.905
  218    H8     A  20           H8         A  20  16.095  19.385  11.509
  219   1H6     A  20          1H6         A  20  20.719  16.319   8.886
  220   2H6     A  20          2H6         A  20  19.407  17.445   8.628
  221    H2     A  20           H2         A  20  20.679  15.245  13.247
  222   1H2*    A  20          1H2*        A  20  15.975  20.244  13.667
  223   2H2*    A  20          2H2*        A  20  16.942  20.110  15.162
  224   1H5*    C  21          1H5*        C  21  16.826  23.035  18.291
  225   2H5*    C  21          2H5*        C  21  17.251  23.605  16.663
  226    H4*    C  21           H4*        C  21  18.433  21.250  18.213
  227    H3*    C  21           H3*        C  21  19.421  23.847  17.834
  228    H1*    C  21           H1*        C  21  20.575  20.850  15.546
  229   1H4     C  21          1H4         C  21  19.366  21.211   9.338
  230   2H4     C  21          2H4         C  21  17.894  22.122   9.596
  231    H5     C  21           H5         C  21  17.125  22.790  11.804
  232    H6     C  21           H6         C  21  17.694  22.869  14.192
  233   1H2*    C  21          1H2*        C  21  19.723  23.761  15.511
  234   2H2*    C  21          2H2*        C  21  21.270  23.024  16.017
  235   1H5*    T  22          1H5*        T  22  24.787  22.121  19.055
  236   2H5*    T  22          2H5*        T  22  24.814  23.665  18.170
  237    H4*    T  22           H4*        T  22  26.501  22.188  17.180
  238    H3*    T  22           H3*        T  22  24.462  23.314  15.624
  239   1H2*    T  22          1H2*        T  22  23.194  21.438  15.143
  240   2H2*    T  22          2H2*        T  22  24.494  21.120  13.964
  241    H1*    T  22           H1*        T  22  25.485  19.472  15.266
  242    H3     T  22           H3         T  22  22.419  16.137  15.281
  243   1H5M    T  22          1H5M        T  22  20.650  19.975  18.757
  244   2H5M    T  22          2H5M        T  22  20.577  18.273  19.262
  245   3H5M    T  22          3H5M        T  22  19.502  18.866  17.974
  246    H6     T  22           H6         T  22  22.650  20.397  17.521
  247   1H5*    T  23          1H5*        T  23  25.862  20.538  12.036
  248   2H5*    T  23          2H5*        T  23  27.156  21.677  11.614
  249    H4*    T  23           H4*        T  23  25.995  20.686   9.611
  250    H3*    T  23           H3*        T  23  26.386  23.557  10.082
  251   1H2*    T  23          1H2*        T  23  24.445  24.377   9.264
  252   2H2*    T  23          2H2*        T  23  24.701  23.455   7.762
  253    H1*    T  23           H1*        T  23  23.123  21.914   8.359
  254    H3     T  23           H3         T  23  19.654  24.726   9.334
  255   1H5M    T  23          1H5M        T  23  23.180  25.366  13.188
  256   2H5M    T  23          2H5M        T  23  22.038  24.253  13.983
  257   3H5M    T  23          3H5M        T  23  21.487  25.859  13.463
  258    H6     T  23           H6         T  23  23.424  23.119  11.877
  259   1H5*    G  24          1H5*        G  24  30.183  19.976   7.574
  260   2H5*    G  24          2H5*        G  24  29.220  19.253   6.266
  261    H4*    G  24           H4*        G  24  29.497  18.503   9.119
  262    H3*    G  24           H3*        G  24  29.052  17.094   6.671
  263    H1*    G  24           H1*        G  24  26.458  17.255   9.704
  264    H8     G  24           H8         G  24  25.256  18.550   6.194
  265    H1     G  24           H1         G  24  21.067  19.360  10.924
  266   1H2     G  24          1H2         G  24  23.650  18.161  12.981
  267   2H2     G  24          2H2         G  24  22.012  18.769  12.884
  268   1H2*    G  24          1H2*        G  24  26.763  16.896   6.706
  269   2H2*    G  24          2H2*        G  24  27.056  15.766   8.039
  270   1H5*    T  25          1H5*        T  25  29.287  14.627  10.918
  271   2H5*    T  25          2H5*        T  25  30.017  13.056  10.520
  272    H4*    T  25           H4*        T  25  28.382  12.937  12.412
  273    H3*    T  25           H3*        T  25  28.282  11.192  10.090
  274   1H2*    T  25          1H2*        T  25  26.043  11.198   9.693
  275   2H2*    T  25          2H2*        T  25  25.811  10.575  11.343
  276    H1*    T  25           H1*        T  25  25.210  12.595  12.190
  277    H3     T  25           H3         T  25  21.591  14.585  10.457
  278   1H5M    T  25          1H5M        T  25  24.284  13.196   6.174
  279   2H5M    T  25          2H5M        T  25  25.037  14.777   6.478
  280   3H5M    T  25          3H5M        T  25  23.299  14.677   6.128
  281    H6     T  25           H6         T  25  25.742  13.146   8.486
  282   1H5*    G  26          1H5*        G  26  26.410   9.670  14.103
  283   2H5*    G  26          2H5*        G  26  26.900   7.972  14.367
  284    H4*    G  26           H4*        G  26  24.585   8.311  15.085
  285    H3*    G  26           H3*        G  26  25.191   6.460  12.939
  286    H1*    G  26           H1*        G  26  21.949   8.755  13.226
  287    H8     G  26           H8         G  26  24.278   8.885  10.079
  288    H1     G  26           H1         G  26  19.105  12.583   9.712
  289   1H2     G  26          1H2         G  26  18.508  11.571  13.013
  290   2H2     G  26          2H2         G  26  17.971  12.523  11.647
  291   1H2*    G  26          1H2*        G  26  23.614   7.060  11.427
  292   2H2*    G  26          2H2*        G  26  22.401   6.620  12.639
  293   1H5*    C  27          1H5*        C  27  20.711   2.809  14.566
  294   2H5*    C  27          2H5*        C  27  21.231   3.635  13.079
  295    H4*    C  27           H4*        C  27  19.449   4.912  15.199
  296    H3*    C  27           H3*        C  27  18.667   3.060  13.041
  297    H1*    C  27           H1*        C  27  18.251   7.109  13.086
  298   1H4     C  27          1H4         C  27  21.290   7.551   7.144
  299   2H4     C  27          2H4         C  27  20.071   8.803   7.187
  300    H5     C  27           H5         C  27  21.650   5.998   8.969
  301    H6     C  27           H6         C  27  20.722   5.131  11.057
  302   1H2*    C  27          1H2*        C  27  17.897   4.595  11.522
  303   2H2*    C  27          2H2*        C  27  16.854   5.306  12.782
  304   1H5*    T  28          1H5*        T  28  13.353   4.153  14.707
  305   2H5*    T  28          2H5*        T  28  13.337   3.725  12.980
  306    H4*    T  28           H4*        T  28  12.079   5.831  13.385
  307    H3*    T  28           H3*        T  28  14.264   5.644  11.496
  308   1H2*    T  28          1H2*        T  28  15.528   7.417  12.213
  309   2H2*    T  28          2H2*        T  28  14.177   8.435  11.642
  310    H1*    T  28           H1*        T  28  13.369   8.771  13.815
  311    H3     T  28           H3         T  28  17.306  11.123  14.671
  312   1H5M    T  28          1H5M        T  28  18.871   7.607  17.312
  313   2H5M    T  28          2H5M        T  28  17.911   6.220  16.751
  314   3H5M    T  28          3H5M        T  28  17.298   7.253  18.064
  315    H6     T  28           H6         T  28  15.635   6.712  15.684
  316   1H5*    T  29          1H5*        T  29  11.772   8.665   9.472
  317   2H5*    T  29          2H5*        T  29  10.150   7.938   9.373
  318    H4*    T  29           H4*        T  29  10.347   9.539   7.547
  319    H3*    T  29           H3*        T  29   9.836   6.799   7.036
  320   1H2*    T  29          1H2*        T  29  11.732   6.213   5.883
  321   2H2*    T  29          2H2*        T  29  11.000   7.137   4.554
  322    H1*    T  29           H1*        T  29  12.413   8.948   4.856
  323    H3     T  29           H3         T  29  16.436   7.156   3.755
  324   1H5M    T  29          1H5M        T  29  16.166   6.551   8.969
  325   2H5M    T  29          2H5M        T  29  17.144   5.412   8.016
  326   3H5M    T  29          3H5M        T  29  15.481   4.981   8.478
  327    H6     T  29           H6         T  29  13.690   6.927   7.711
  328   1H5*    C  30          1H5*        C  30   6.719  10.870   4.108
  329   2H5*    C  30          2H5*        C  30   7.005  10.886   5.856
  330    H4*    C  30           H4*        C  30   4.769  11.151   6.170
  331    H3*    C  30           H3*        C  30   4.912   8.368   5.433
  332    H1*    C  30           H1*        C  30   2.235  11.018   4.139
  333   1H4     C  30          1H4         C  30   3.421   9.882  -2.365
  334   2H4     C  30          2H4         C  30   1.690   9.719  -2.169
  335    H5     C  30           H5         C  30   4.926  10.332  -0.515
  336    H6     C  30           H6         C  30   5.091  10.610   1.916
  337   1H2*    C  30          1H2*        C  30   3.608   8.396   3.592
  338   2H2*    C  30          2H2*        C  30   2.264   8.765   4.685
  339   1H5*    T  31          1H5*        T  31   0.268   8.222   6.290
  340   2H5*    T  31          2H5*        T  31   0.469   7.506   7.902
  341    H4*    T  31           H4*        T  31  -1.203   6.172   6.917
  342    H3*    T  31           H3*        T  31   1.398   4.928   7.175
  343   1H2*    T  31          1H2*        T  31   1.638   4.032   5.113
  344   2H2*    T  31          2H2*        T  31   0.189   3.069   5.450
  345    H1*    T  31           H1*        T  31  -1.204   4.379   4.229
  346    H3     T  31           H3         T  31  -0.324   4.699  -0.152
  347   1H5M    T  31          1H5M        T  31   4.297   5.672   2.487
  348   2H5M    T  31          2H5M        T  31   3.875   6.948   1.320
  349   3H5M    T  31          3H5M        T  31   4.253   5.311   0.750
  350    H6     T  31           H6         T  31   2.298   5.636   3.769
  351   1H5*    G  32          1H5*        G  32  -2.558   2.355   7.037
  352   2H5*    G  32          2H5*        G  32  -2.477   1.174   8.376
  353    H4*    G  32           H4*        G  32  -3.752   0.217   6.537
  354    H3*    G  32           H3*        G  32  -1.254  -1.004   7.325
  355    H1*    G  32           H1*        G  32  -2.739  -0.767   3.641
  356    H8     G  32           H8         G  32   0.761   0.870   4.418
  357    H1     G  32           H1         G  32  -0.752   0.530  -1.758
  358   1H2     G  32          1H2         G  32  -2.810  -0.328  -2.010
  359   2H2     G  32          2H2         G  32  -3.796  -0.801  -0.646
  360   1H2*    G  32          1H2*        G  32  -0.266  -1.217   5.287
  361   2H2*    G  32          2H2*        G  32  -1.585  -2.343   4.872
  362   1H5*    C  33          1H5*        C  33  -4.505  -3.639   5.143
  363   2H5*    C  33          2H5*        C  33  -4.816  -4.992   6.255
  364    H4*    C  33           H4*        C  33  -5.186  -5.765   3.978
  365    H3*    C  33           H3*        C  33  -3.136  -6.969   5.624
  366    H1*    C  33           H1*        C  33  -3.033  -6.380   1.663
  367   1H4     C  33          1H4         C  33   2.575  -3.782  -0.007
  368   2H4     C  33          2H4         C  33   2.937  -3.332   1.644
  369    H5     C  33           H5         C  33   1.444  -3.790   3.488
  370    H6     C  33           H6         C  33  -0.697  -4.721   4.159
  371   1H2*    C  33          1H2*        C  33  -1.394  -6.972   4.179
  372   2H2*    C  33          2H2*        C  33  -2.364  -8.055   3.152
  373   1H5*    A  34          1H5*        A  34  -5.417  -9.911   2.414
  374   2H5*    A  34          2H5*        A  34  -5.593 -11.451   3.286
  375    H4*    A  34           H4*        A  34  -5.130 -11.844   0.886
  376    H3*    A  34           H3*        A  34  -3.462 -12.923   3.000
  377    H1*    A  34           H1*        A  34  -2.184 -11.600  -0.562
  378    H8     A  34           H8         A  34  -0.995 -10.204   2.869
  379   1H6     A  34          1H6         A  34   3.402  -7.284  -0.258
  380   2H6     A  34          2H6         A  34   2.712  -7.584   1.322
  381    H2     A  34           H2         A  34   0.851  -9.538  -3.219
  382   1H2*    A  34          1H2*        A  34  -1.403 -12.453   2.191
  383   2H2*    A  34          2H2*        A  34  -1.805 -13.407   0.763
  384   1H5*    C  35          1H5*        C  35  -3.436 -14.678  -1.093
  385   2H5*    C  35          2H5*        C  35  -3.666 -16.441  -1.142
  386    H4*    C  35           H4*        C  35  -2.189 -15.688  -2.974
  387    H3*    C  35           H3*        C  35  -1.387 -17.702  -1.059
  388    H1*    C  35           H1*        C  35   0.904 -14.985  -2.864
  389   1H4     C  35          1H4         C  35   4.731 -11.965   1.286
  390   2H4     C  35          2H4         C  35   3.708 -12.376   2.644
  391    H5     C  35           H5         C  35   1.700 -13.699   2.429
  392    H6     C  35           H6         C  35   0.235 -14.894   0.884
  393   1H2*    C  35          1H2*        C  35   0.666 -16.904  -0.495
  394   2H2*    C  35          2H2*        C  35   1.139 -17.220  -2.191
  395   1H5*    G  36          1H5*        G  36   1.259 -17.472  -4.764
  396   2H5*    G  36          2H5*        G  36   0.729 -18.905  -5.687
  397    H4*    G  36           H4*        G  36   3.007 -18.548  -6.285
  398    H3*    G  36           H3*        G  36   2.438 -20.855  -4.657
  399    H1*    G  36           H1*        G  36   5.698 -18.581  -4.526
  400    H8     G  36           H8         G  36   3.334 -18.461  -1.361
  401    H1     G  36           H1         G  36   9.251 -16.393  -0.323
  402   1H2     G  36          1H2         G  36   9.688 -16.754  -3.781
  403   2H2     G  36          2H2         G  36  10.383 -16.254  -2.256
  404   1H2*    G  36          1H2*        G  36   4.041 -20.541  -2.978
  405   2H2*    G  36          2H2*        G  36   5.238 -20.809  -4.280
  Start of MODEL    6
    1   1H5*    C   1          1H5*        C   1  14.572 -17.431   1.688
    2   2H5*    C   1          2H5*        C   1  15.394 -15.914   2.125
    3    H4*    C   1           H4*        C   1  14.991 -15.895  -0.283
    4    H3*    C   1           H3*        C   1  13.861 -13.891   1.433
    5    H1*    C   1           H1*        C   1  11.796 -15.596  -1.610
    6   1H4     C   1          1H4         C   1   6.282 -17.481   1.032
    7   2H4     C   1          2H4         C   1   6.997 -17.587   2.624
    8    H5     C   1           H5         C   1   9.326 -17.095   3.066
    9    H6     C   1           H6         C   1  11.438 -16.295   2.077
   10   1H2*    C   1          1H2*        C   1  11.659 -13.942   0.842
   11   2H2*    C   1          2H2*        C   1  12.170 -13.474  -0.802
   12   1H5*    G   2          1H5*        G   2  13.609 -12.874  -2.927
   13   2H5*    G   2          2H5*        G   2  14.722 -11.515  -3.256
   14    H4*    G   2           H4*        G   2  12.759 -11.486  -4.771
   15    H3*    G   2           H3*        G   2  13.414  -9.261  -3.053
   16    H1*    G   2           H1*        G   2   9.797 -10.503  -4.071
   17    H8     G   2           H8         G   2  10.732 -10.413  -0.260
   18    H1     G   2           H1         G   2   4.645 -11.891  -1.443
   19   1H2     G   2          1H2         G   2   5.561 -11.624  -4.821
   20   2H2     G   2          2H2         G   2   4.290 -11.941  -3.663
   21   1H2*    G   2          1H2*        G   2  11.406  -8.982  -2.023
   22   2H2*    G   2          2H2*        G   2  10.792  -8.461  -3.611
   23   1H5*    T   3          1H5*        T   3  10.570  -8.824  -6.562
   24   2H5*    T   3          2H5*        T   3  11.182  -7.585  -7.681
   25    H4*    T   3           H4*        T   3   8.792  -7.598  -7.914
   26    H3*    T   3           H3*        T   3  10.061  -5.233  -6.861
   27   1H2*    T   3          1H2*        T   3   8.824  -4.974  -4.960
   28   2H2*    T   3          2H2*        T   3   7.466  -4.578  -6.031
   29    H1*    T   3           H1*        T   3   6.514  -6.681  -5.928
   30    H3     T   3           H3         T   3   4.788  -7.711  -1.903
   31   1H5M    T   3          1H5M        T   3   9.868  -6.966  -0.797
   32   2H5M    T   3          2H5M        T   3   8.645  -6.449   0.385
   33   3H5M    T   3          3H5M        T   3   9.297  -5.283  -0.789
   34    H6     T   3           H6         T   3   9.137  -6.169  -3.253
   35   1H5*    G   4          1H5*        G   4   5.971  -5.309  -8.569
   36   2H5*    G   4          2H5*        G   4   5.776  -4.272 -10.013
   37    H4*    G   4           H4*        G   4   3.608  -4.572  -8.905
   38    H3*    G   4           H3*        G   4   4.752  -1.964  -9.218
   39    H1*    G   4           H1*        G   4   2.610  -3.241  -6.209
   40    H8     G   4           H8         G   4   6.222  -2.091  -5.233
   41    H1     G   4           H1         G   4   2.471  -3.549  -0.290
   42   1H2     G   4          1H2         G   4   0.111  -4.408  -2.747
   43   2H2     G   4          2H2         G   4   0.476  -4.278  -1.041
   44   1H2*    G   4          1H2*        G   4   4.895  -1.403  -6.995
   45   2H2*    G   4          2H2*        G   4   3.151  -1.172  -7.133
   46   1H5*    C   5          1H5*        C   5  -0.013  -2.482  -8.361
   47   2H5*    C   5          2H5*        C   5  -0.678  -1.616  -9.765
   48    H4*    C   5           H4*        C   5  -2.320  -1.551  -7.969
   49    H3*    C   5           H3*        C   5  -1.184   0.897  -9.014
   50    H1*    C   5           H1*        C   5  -2.202   0.191  -5.186
   51   1H4     C   5          1H4         C   5   3.770   1.949  -2.724
   52   2H4     C   5          2H4         C   5   2.609   2.061  -1.420
   53    H5     C   5           H5         C   5   3.179   1.291  -4.967
   54    H6     C   5           H6         C   5   1.362   0.534  -6.424
   55   1H2*    C   5          1H2*        C   5  -0.683   1.973  -7.085
   56   2H2*    C   5          2H2*        C   5  -2.426   1.939  -6.717
   57   1H5*    A   6          1H5*        A   6  -5.325   1.059  -6.983
   58   2H5*    A   6          2H5*        A   6  -6.499   1.970  -7.958
   59    H4*    A   6           H4*        A   6  -6.802   2.250  -5.470
   60    H3*    A   6           H3*        A   6  -6.732   4.438  -7.365
   61    H1*    A   6           H1*        A   6  -5.444   4.356  -3.648
   62    H8     A   6           H8         A   6  -2.761   5.259  -6.407
   63   1H6     A   6          1H6         A   6   0.895   6.353  -3.504
   64   2H6     A   6          2H6         A   6   1.102   6.347  -1.767
   65    H2     A   6           H2         A   6  -2.769   4.954   0.018
   66   1H2*    A   6          1H2*        A   6  -5.138   5.708  -6.347
   67   2H2*    A   6          2H2*        A   6  -6.359   5.986  -5.075
   68   1H5*    G   7          1H5*        G   7  -8.392   5.435  -3.066
   69   2H5*    G   7          2H5*        G   7  -9.947   6.282  -3.296
   70    H4*    G   7           H4*        G   7  -8.711   7.277  -1.421
   71    H3*    G   7           H3*        G   7  -9.496   8.878  -3.646
   72    H1*    G   7           H1*        G   7  -6.330   9.249  -1.508
   73    H8     G   7           H8         G   7  -5.255   8.409  -5.203
   74    H1     G   7           H1         G   7  -0.486   9.864  -1.243
   75   1H2     G   7          1H2         G   7  -1.273  10.225   0.821
   76   2H2     G   7          2H2         G   7  -2.975  10.099   1.205
   77   1H2*    G   7          1H2*        G   7  -7.323   9.315  -4.402
   78   2H2*    G   7          2H2*        G   7  -7.444  10.584  -3.160
   79   1H5*    C   8          1H5*        C   8  -8.154  10.481   0.777
   80   2H5*    C   8          2H5*        C   8  -9.323  11.773   1.120
   81    H4*    C   8           H4*        C   8  -7.304  12.094   2.468
   82    H3*    C   8           H3*        C   8  -8.187  14.135   0.599
   83    H1*    C   8           H1*        C   8  -4.403  13.227   1.559
   84   1H4     C   8          1H4         C   8  -2.537  12.606  -4.828
   85   2H4     C   8          2H4         C   8  -1.082  12.876  -3.893
   86    H5     C   8           H5         C   8  -4.733  12.539  -3.842
   87    H6     C   8           H6         C   8  -6.022  12.718  -1.789
   88   1H2*    C   8          1H2*        C   8  -6.193  14.755  -0.282
   89   2H2*    C   8          2H2*        C   8  -5.651  15.149   1.365
   90   1H5*    G   9          1H5*        G   9  -5.645  15.488   4.027
   91   2H5*    G   9          2H5*        G   9  -6.430  16.762   4.999
   92    H4*    G   9           H4*        G   9  -3.912  16.930   4.822
   93    H3*    G   9           H3*        G   9  -5.730  19.128   4.294
   94    H1*    G   9           H1*        G   9  -2.252  18.311   2.528
   95    H8     G   9           H8         G   9  -5.488  18.759   0.302
   96    H1     G   9           H1         G   9  -0.055  17.866  -2.918
   97   1H2     G   9          1H2         G   9   1.654  17.613  -1.476
   98   2H2     G   9          2H2         G   9   1.424  17.655   0.257
   99   1H2*    G   9          1H2*        G   9  -4.855  19.865   2.344
  100   2H2*    G   9          2H2*        G   9  -3.375  20.268   3.255
  101   1H5*    G  10          1H5*        G  10  -1.332  20.494   5.279
  102   2H5*    G  10          2H5*        G  10  -1.509  21.624   6.652
  103    H4*    G  10           H4*        G  10   0.251  22.429   5.181
  104    H3*    G  10           H3*        G  10  -2.131  24.016   5.538
  105    H1*    G  10           H1*        G  10   0.037  23.665   2.229
  106    H8     G  10           H8         G  10  -3.748  22.608   2.105
  107    H1     G  10           H1         G  10  -0.721  22.418  -3.505
  108   1H2     G  10          1H2         G  10   1.437  22.983  -3.228
  109   2H2     G  10          2H2         G  10   2.100  23.398  -1.663
  110   1H2*    G  10          1H2*        G  10  -2.669  24.388   3.349
  111   2H2*    G  10          2H2*        G  10  -1.171  25.352   3.269
  112   1H5*    C  11          1H5*        C  11  -0.883  28.899   5.453
  113   2H5*    C  11          2H5*        C  11  -2.166  28.617   4.253
  114    H4*    C  11           H4*        C  11   0.802  27.907   3.984
  115    H3*    C  11           H3*        C  11  -0.585  30.260   3.179
  116    H1*    C  11           H1*        C  11   0.373  27.284   0.785
  117   1H4     C  11          1H4         C  11  -4.581  25.079  -2.623
  118   2H4     C  11          2H4         C  11  -5.651  25.191  -1.245
  119    H5     C  11           H5         C  11  -4.935  26.022   0.921
  120    H6     C  11           H6         C  11  -3.090  27.044   2.168
  121   1H2*    C  11          1H2*        C  11  -1.774  29.344   1.403
  122   2H2*    C  11          2H2*        C  11  -0.217  29.549   0.555
  123   1H5*    T  12          1H5*        T  12   3.220  32.117  -0.469
  124   2H5*    T  12          2H5*        T  12   1.538  32.606  -0.780
  125    H4*    T  12           H4*        T  12   2.579  31.865  -2.890
  126    H3*    T  12           H3*        T  12   0.178  30.708  -1.903
  127   1H2*    T  12          1H2*        T  12   0.799  28.525  -1.612
  128   2H2*    T  12          2H2*        T  12   0.848  28.460  -3.400
  129    H1*    T  12           H1*        T  12   3.156  28.503  -3.471
  130    H3     T  12           H3         T  12   3.820  24.553  -1.253
  131   1H5M    T  12          1H5M        T  12   4.792  28.360   2.293
  132   2H5M    T  12          2H5M        T  12   4.391  26.714   2.834
  133   3H5M    T  12          3H5M        T  12   3.106  27.937   2.689
  134    H6     T  12           H6         T  12   3.307  29.132   0.168
  135   1H5*    T  13          1H5*        T  13  -0.196  29.180  -5.650
  136   2H5*    T  13          2H5*        T  13  -0.425  30.370  -6.950
  137    H4*    T  13           H4*        T  13  -1.504  28.157  -7.465
  138    H3*    T  13           H3*        T  13  -2.774  30.684  -7.769
  139   1H2*    T  13          1H2*        T  13  -4.440  30.498  -6.190
  140   2H2*    T  13          2H2*        T  13  -5.188  29.408  -7.384
  141    H1*    T  13           H1*        T  13  -4.598  27.496  -6.207
  142    H3     T  13           H3         T  13  -7.266  28.075  -2.569
  143   1H5M    T  13          1H5M        T  13  -3.279  31.530  -1.817
  144   2H5M    T  13          2H5M        T  13  -2.732  30.059  -0.974
  145   3H5M    T  13          3H5M        T  13  -4.214  30.888  -0.447
  146    H6     T  13           H6         T  13  -2.975  29.867  -3.845
  147   1H5*    G  14          1H5*        G  14  -1.294  27.904 -12.451
  148   2H5*    G  14          2H5*        G  14  -2.085  26.317 -12.345
  149    H4*    G  14           H4*        G  14   0.640  27.110 -11.668
  150    H3*    G  14           H3*        G  14  -0.693  24.639 -12.238
  151    H1*    G  14           H1*        G  14   0.784  25.350  -8.483
  152    H8     G  14           H8         G  14  -2.886  24.811  -9.708
  153    H1     G  14           H1         G  14  -2.219  25.436  -3.399
  154   1H2     G  14          1H2         G  14   1.167  25.985  -4.141
  155   2H2     G  14          2H2         G  14  -0.065  25.865  -2.907
  156   1H2*    G  14          1H2*        G  14  -0.812  23.617 -10.215
  157   2H2*    G  14          2H2*        G  14   0.951  23.743 -10.106
  158   1H5*    C  15          1H5*        C  15   3.538  24.723 -10.751
  159   2H5*    C  15          2H5*        C  15   4.672  23.598 -11.534
  160    H4*    C  15           H4*        C  15   5.178  23.740  -9.151
  161    H3*    C  15           H3*        C  15   4.452  21.213 -10.369
  162    H1*    C  15           H1*        C  15   3.635  22.432  -6.674
  163   1H4     C  15          1H4         C  15  -2.909  21.249  -6.509
  164   2H4     C  15          2H4         C  15  -2.403  21.779  -4.920
  165    H5     C  15           H5         C  15  -1.412  21.012  -8.342
  166    H6     C  15           H6         C  15   0.893  21.429  -9.169
  167   1H2*    C  15          1H2*        C  15   2.983  20.443  -8.818
  168   2H2*    C  15          2H2*        C  15   4.321  20.477  -7.644
  169   1H5*    C  16          1H5*        C  16   6.496  21.004  -6.304
  170   2H5*    C  16          2H5*        C  16   8.123  20.412  -6.706
  171    H4*    C  16           H4*        C  16   7.755  19.602  -4.517
  172    H3*    C  16           H3*        C  16   7.743  17.645  -6.626
  173    H1*    C  16           H1*        C  16   5.354  17.555  -3.427
  174   1H4     C  16          1H4         C  16  -0.454  17.580  -6.768
  175   2H4     C  16          2H4         C  16  -0.817  17.370  -5.069
  176    H5     C  16           H5         C  16   1.801  17.730  -7.626
  177    H6     C  16           H6         C  16   4.166  17.961  -7.023
  178   1H2*    C  16          1H2*        C  16   5.809  16.520  -6.165
  179   2H2*    C  16          2H2*        C  16   6.540  16.066  -4.612
  180   1H5*    G  17          1H5*        G  17   8.104  17.150  -2.360
  181   2H5*    G  17          2H5*        G  17   9.648  16.450  -1.791
  182    H4*    G  17           H4*        G  17   7.988  16.186  -0.034
  183    H3*    G  17           H3*        G  17   9.077  13.863  -1.323
  184    H1*    G  17           H1*        G  17   5.397  14.318   0.047
  185    H8     G  17           H8         G  17   5.722  13.872  -3.853
  186    H1     G  17           H1         G  17  -0.189  13.205  -1.606
  187   1H2     G  17          1H2         G  17   1.234  13.846   1.533
  188   2H2     G  17          2H2         G  17  -0.215  13.495   0.619
  189   1H2*    G  17          1H2*        G  17   7.160  12.903  -2.006
  190   2H2*    G  17          2H2*        G  17   6.906  12.467  -0.295
  191   1H5*    G  18          1H5*        G  18   7.627  16.159   2.802
  192   2H5*    G  18          2H5*        G  18   9.361  15.883   2.439
  193    H4*    G  18           H4*        G  18   7.990  16.157   5.180
  194    H3*    G  18           H3*        G  18   9.385  18.107   3.477
  195    H1*    G  18           H1*        G  18  10.949  16.297   6.736
  196    H8     G  18           H8         G  18  12.213  16.168   3.016
  197    H1     G  18           H1         G  18  16.444  14.269   7.380
  198   1H2     G  18          1H2         G  18  15.533  14.416   9.434
  199   2H2     G  18          2H2         G  18  13.899  14.983   9.688
  200   1H2*    G  18          1H2*        G  18  11.381  18.210   4.550
  201   2H2*    G  18          2H2*        G  18  10.536  18.451   6.100
  202   1H5*    C  19          1H5*        C  19   8.548  18.951   7.782
  203   2H5*    C  19          2H5*        C  19   7.715  20.503   8.034
  204    H4*    C  19           H4*        C  19   9.201  20.028   9.928
  205    H3*    C  19           H3*        C  19   9.488  22.424   8.329
  206    H1*    C  19           H1*        C  19  12.465  20.337   9.966
  207   1H4     C  19          1H4         C  19  15.815  19.488   4.253
  208   2H4     C  19          2H4         C  19  16.848  18.933   5.550
  209    H5     C  19           H5         C  19  13.600  20.366   4.626
  210    H6     C  19           H6         C  19  11.899  20.907   6.266
  211   1H2*    C  19          1H2*        C  19  11.746  22.477   8.046
  212   2H2*    C  19          2H2*        C  19  11.904  22.516   9.819
  213   1H5*    A  20          1H5*        A  20  11.152  22.293  12.506
  214   2H5*    A  20          2H5*        A  20  10.472  23.588  13.520
  215    H4*    A  20           H4*        A  20  12.752  23.138  14.256
  216    H3*    A  20           H3*        A  20  11.990  25.748  13.291
  217    H1*    A  20           H1*        A  20  15.511  23.952  12.744
  218    H8     A  20           H8         A  20  13.353  24.986   9.618
  219   1H6     A  20          1H6         A  20  17.998  22.915   6.192
  220   2H6     A  20          2H6         A  20  16.429  23.689   6.180
  221    H2     A  20           H2         A  20  19.035  22.144  10.497
  222   1H2*    A  20          1H2*        A  20  13.601  26.075  11.723
  223   2H2*    A  20          2H2*        A  20  14.750  26.122  13.084
  224   1H5*    C  21          1H5*        C  21  14.362  29.187  16.173
  225   2H5*    C  21          2H5*        C  21  14.577  29.719  14.492
  226    H4*    C  21           H4*        C  21  16.212  27.657  16.046
  227    H3*    C  21           H3*        C  21  16.763  30.352  15.464
  228    H1*    C  21           H1*        C  21  18.195  27.395  13.275
  229   1H4     C  21          1H4         C  21  16.486  27.197   7.162
  230   2H4     C  21          2H4         C  21  14.930  27.924   7.495
  231    H5     C  21           H5         C  21  14.268  28.677   9.711
  232    H6     C  21           H6         C  21  14.998  28.957  12.038
  233   1H2*    C  21          1H2*        C  21  16.976  30.171  13.146
  234   2H2*    C  21          2H2*        C  21  18.628  29.667  13.598
  235   1H5*    T  22          1H5*        T  22  22.374  29.698  16.361
  236   2H5*    T  22          2H5*        T  22  22.041  31.139  15.372
  237    H4*    T  22           H4*        T  22  23.901  29.899  14.353
  238    H3*    T  22           H3*        T  22  21.575  30.522  12.900
  239   1H2*    T  22          1H2*        T  22  20.681  28.418  12.571
  240   2H2*    T  22          2H2*        T  22  21.982  28.269  11.358
  241    H1*    T  22           H1*        T  22  23.288  26.914  12.709
  242    H3     T  22           H3         T  22  20.864  23.112  13.111
  243   1H5M    T  22          1H5M        T  22  18.902  25.145  17.082
  244   2H5M    T  22          2H5M        T  22  17.670  25.476  15.842
  245   3H5M    T  22          3H5M        T  22  18.654  26.805  16.494
  246    H6     T  22           H6         T  22  20.464  27.487  15.091
  247   1H5*    T  23          1H5*        T  23  23.246  28.162   9.299
  248   2H5*    T  23          2H5*        T  23  24.143  29.525   8.605
  249    H4*    T  23           H4*        T  23  22.913  28.108   6.902
  250    H3*    T  23           H3*        T  23  22.720  31.044   7.147
  251   1H2*    T  23          1H2*        T  23  20.566  31.352   6.558
  252   2H2*    T  23          2H2*        T  23  20.813  30.342   5.112
  253    H1*    T  23           H1*        T  23  19.719  28.574   6.077
  254    H3     T  23           H3         T  23  15.903  30.772   7.356
  255   1H5M    T  23          1H5M        T  23  18.010  32.629  11.068
  256   2H5M    T  23          2H5M        T  23  19.720  32.389  10.620
  257   3H5M    T  23          3H5M        T  23  18.880  31.190  11.636
  258    H6     T  23           H6         T  23  20.220  30.151   9.409
  259   1H5*    G  24          1H5*        G  24  26.401  27.506   4.466
  260   2H5*    G  24          2H5*        G  24  25.071  26.814   3.494
  261    H4*    G  24           H4*        G  24  26.415  25.839   6.047
  262    H3*    G  24           H3*        G  24  26.247  24.734   3.476
  263    H1*    G  24           H1*        G  24  23.800  23.541   6.437
  264    H8     G  24           H8         G  24  21.875  24.303   3.268
  265    H1     G  24           H1         G  24  18.652  26.182   8.422
  266   1H2     G  24          1H2         G  24  21.666  25.609  10.132
  267   2H2     G  24          2H2         G  24  19.996  26.120  10.230
  268   1H2*    G  24          1H2*        G  24  24.034  24.054   3.443
  269   2H2*    G  24          2H2*        G  24  24.661  22.710   4.405
  270   1H5*    T  25          1H5*        T  25  26.914  22.266   7.461
  271   2H5*    T  25          2H5*        T  25  27.930  20.831   7.199
  272    H4*    T  25           H4*        T  25  26.385  20.481   9.079
  273    H3*    T  25           H3*        T  25  26.434  18.697   6.794
  274   1H2*    T  25          1H2*        T  25  24.192  18.397   6.477
  275   2H2*    T  25          2H2*        T  25  24.107  17.783   8.141
  276    H1*    T  25           H1*        T  25  23.287  19.698   8.992
  277    H3     T  25           H3         T  25  19.424  21.433   7.531
  278   1H5M    T  25          1H5M        T  25  21.656  19.771   3.124
  279   2H5M    T  25          2H5M        T  25  22.417  21.375   3.159
  280   3H5M    T  25          3H5M        T  25  20.648  21.233   3.041
  281    H6     T  25           H6         T  25  23.436  20.102   5.225
  282   1H5*    G  26          1H5*        G  26  25.250  17.385  11.036
  283   2H5*    G  26          2H5*        G  26  26.131  15.909  11.526
  284    H4*    G  26           H4*        G  26  23.961  15.965  12.644
  285    H3*    G  26           H3*        G  26  24.570  13.853  10.783
  286    H1*    G  26           H1*        G  26  21.008  15.577  11.246
  287    H8     G  26           H8         G  26  22.761  15.554   7.738
  288    H1     G  26           H1         G  26  17.048  18.381   7.828
  289   1H2     G  26          1H2         G  26  17.114  17.735  11.276
  290   2H2     G  26          2H2         G  26  16.233  18.408   9.922
  291   1H2*    G  26          1H2*        G  26  22.725  13.925   9.449
  292   2H2*    G  26          2H2*        G  26  21.790  13.476  10.886
  293   1H5*    C  27          1H5*        C  27  21.612   9.709  13.949
  294   2H5*    C  27          2H5*        C  27  21.584  10.179  12.233
  295    H4*    C  27           H4*        C  27  19.708  11.234  14.409
  296    H3*    C  27           H3*        C  27  19.456   8.887  12.658
  297    H1*    C  27           H1*        C  27  17.620  12.490  12.154
  298   1H4     C  27          1H4         C  27  19.907  12.863   5.880
  299   2H4     C  27          2H4         C  27  18.368  13.692   5.921
  300    H5     C  27           H5         C  27  20.879  11.793   7.815
  301    H6     C  27           H6         C  27  20.497  11.112  10.135
  302   1H2*    C  27          1H2*        C  27  18.122   9.779  11.020
  303   2H2*    C  27          2H2*        C  27  16.959  10.287  12.276
  304   1H5*    T  28          1H5*        T  28  14.265   7.920  14.447
  305   2H5*    T  28          2H5*        T  28  14.691   7.052  12.954
  306    H4*    T  28           H4*        T  28  12.556   8.259  12.664
  307    H3*    T  28           H3*        T  28  14.875   8.766  10.969
  308   1H2*    T  28          1H2*        T  28  14.854  11.032  10.970
  309   2H2*    T  28          2H2*        T  28  13.268  10.946  10.162
  310    H1*    T  28           H1*        T  28  12.111  11.401  12.154
  311    H3     T  28           H3         T  28  14.245  15.578  12.029
  312   1H5M    T  28          1H5M        T  28  15.404  13.295  16.605
  313   2H5M    T  28          2H5M        T  28  16.538  14.492  15.936
  314   3H5M    T  28          3H5M        T  28  16.831  12.756  15.685
  315    H6     T  28           H6         T  28  14.705  11.510  14.582
  316   1H5*    T  29          1H5*        T  29  10.625  11.813   9.330
  317   2H5*    T  29          2H5*        T  29   9.382  10.552   9.166
  318    H4*    T  29           H4*        T  29   9.255  12.014   7.213
  319    H3*    T  29           H3*        T  29   9.960   9.198   6.928
  320   1H2*    T  29          1H2*        T  29  11.637   9.382   5.393
  321   2H2*    T  29          2H2*        T  29  10.468  10.157   4.301
  322    H1*    T  29           H1*        T  29  11.278  12.279   4.732
  323    H3     T  29           H3         T  29  15.589  12.282   3.356
  324   1H5M    T  29          1H5M        T  29  15.881  10.452   8.293
  325   2H5M    T  29          2H5M        T  29  17.121   9.985   7.107
  326   3H5M    T  29          3H5M        T  29  15.730   8.916   7.404
  327    H6     T  29           H6         T  29  13.364  10.323   7.156
  328   1H5*    C  30          1H5*        C  30   6.386  11.305   3.307
  329   2H5*    C  30          2H5*        C  30   6.876  11.493   4.999
  330    H4*    C  30           H4*        C  30   4.716  11.990   5.495
  331    H3*    C  30           H3*        C  30   4.663   9.129   5.182
  332    H1*    C  30           H1*        C  30   1.946  11.669   3.634
  333   1H4     C  30          1H4         C  30   2.920   9.403  -2.589
  334   2H4     C  30          2H4         C  30   1.188   9.546  -2.402
  335    H5     C  30           H5         C  30   4.467   9.803  -0.810
  336    H6     C  30           H6         C  30   4.734  10.470   1.533
  337   1H2*    C  30          1H2*        C  30   3.072   8.902   3.579
  338   2H2*    C  30          2H2*        C  30   1.931   9.637   4.714
  339   1H5*    T  31          1H5*        T  31   0.301   9.192   6.694
  340   2H5*    T  31          2H5*        T  31   0.608   8.434   8.273
  341    H4*    T  31           H4*        T  31  -1.166   7.190   7.227
  342    H3*    T  31           H3*        T  31   1.384   5.885   7.694
  343   1H2*    T  31          1H2*        T  31   1.666   4.802   5.731
  344   2H2*    T  31          2H2*        T  31   0.134   3.961   6.046
  345    H1*    T  31           H1*        T  31  -1.085   5.283   4.625
  346    H3     T  31           H3         T  31   0.091   5.382   0.323
  347   1H5M    T  31          1H5M        T  31   4.558   6.408   3.248
  348   2H5M    T  31          2H5M        T  31   4.365   7.299   1.719
  349   3H5M    T  31          3H5M        T  31   4.650   5.548   1.700
  350    H6     T  31           H6         T  31   2.526   6.302   4.367
  351   1H5*    G  32          1H5*        G  32  -2.528   3.193   7.735
  352   2H5*    G  32          2H5*        G  32  -2.399   2.067   9.118
  353    H4*    G  32           H4*        G  32  -3.490   0.982   7.201
  354    H3*    G  32           H3*        G  32  -1.014  -0.050   8.284
  355    H1*    G  32           H1*        G  32  -2.093  -0.038   4.434
  356    H8     G  32           H8         G  32   1.276   1.654   5.594
  357    H1     G  32           H1         G  32   0.311   1.504  -0.707
  358   1H2     G  32          1H2         G  32  -1.686   0.579  -1.154
  359   2H2     G  32          2H2         G  32  -2.764   0.027   0.108
  360   1H2*    G  32          1H2*        G  32   0.172  -0.356   6.366
  361   2H2*    G  32          2H2*        G  32  -1.080  -1.518   5.866
  362   1H5*    C  33          1H5*        C  33  -3.906  -2.402   5.884
  363   2H5*    C  33          2H5*        C  33  -4.467  -3.909   6.645
  364    H4*    C  33           H4*        C  33  -4.570  -4.104   4.198
  365    H3*    C  33           H3*        C  33  -3.041  -5.946   5.811
  366    H1*    C  33           H1*        C  33  -2.235  -4.643   2.144
  367   1H4     C  33          1H4         C  33   3.831  -2.679   1.512
  368   2H4     C  33          2H4         C  33   4.017  -2.478   3.240
  369    H5     C  33           H5         C  33   2.259  -2.989   4.822
  370    H6     C  33           H6         C  33  -0.041  -3.719   5.102
  371   1H2*    C  33          1H2*        C  33  -1.050  -5.848   4.711
  372   2H2*    C  33          2H2*        C  33  -1.895  -6.639   3.353
  373   1H5*    A  34          1H5*        A  34  -4.799  -7.165   1.670
  374   2H5*    A  34          2H5*        A  34  -5.799  -8.613   1.934
  375    H4*    A  34           H4*        A  34  -4.994  -8.685  -0.356
  376    H3*    A  34           H3*        A  34  -4.226 -10.733   1.525
  377    H1*    A  34           H1*        A  34  -1.861  -9.210  -1.320
  378    H8     A  34           H8         A  34  -1.026  -8.957   2.474
  379   1H6     A  34          1H6         A  34   4.586  -7.156   0.701
  380   2H6     A  34          2H6         A  34   3.555  -7.503   2.072
  381    H2     A  34           H2         A  34   2.101  -7.821  -2.991
  382   1H2*    A  34          1H2*        A  34  -1.978 -10.763   1.226
  383   2H2*    A  34          2H2*        A  34  -2.284 -11.261  -0.438
  384   1H5*    C  35          1H5*        C  35  -3.924 -11.430  -2.951
  385   2H5*    C  35          2H5*        C  35  -4.746 -12.928  -3.443
  386    H4*    C  35           H4*        C  35  -2.856 -12.498  -4.936
  387    H3*    C  35           H3*        C  35  -3.013 -14.927  -3.367
  388    H1*    C  35           H1*        C  35   0.311 -12.891  -4.337
  389   1H4     C  35          1H4         C  35   3.845 -11.943   0.914
  390   2H4     C  35          2H4         C  35   2.526 -12.386   1.973
  391    H5     C  35           H5         C  35   0.348 -13.033   1.167
  392    H6     C  35           H6         C  35  -1.017 -13.471  -0.809
  393   1H2*    C  35          1H2*        C  35  -0.892 -15.064  -2.582
  394   2H2*    C  35          2H2*        C  35  -0.341 -15.124  -4.278
  395   1H5*    G  36          1H5*        G  36  -0.266 -14.967  -6.912
  396   2H5*    G  36          2H5*        G  36  -1.002 -16.044  -8.134
  397    H4*    G  36           H4*        G  36   1.403 -16.066  -8.438
  398    H3*    G  36           H3*        G  36   0.057 -18.480  -7.647
  399    H1*    G  36           H1*        G  36   3.685 -17.302  -6.487
  400    H8     G  36           H8         G  36   0.847 -17.387  -3.742
  401    H1     G  36           H1         G  36   6.801 -17.246  -1.458
  402   1H2     G  36          1H2         G  36   7.761 -17.070  -4.829
  403   2H2     G  36          2H2         G  36   8.267 -17.096  -3.155
  404   1H2*    G  36          1H2*        G  36   1.374 -19.074  -5.796
  405   2H2*    G  36          2H2*        G  36   2.686 -19.294  -6.991
  Start of MODEL    7
    1   1H5*    C   1          1H5*        C   1  12.494 -16.984   3.233
    2   2H5*    C   1          2H5*        C   1  13.336 -15.528   3.814
    3    H4*    C   1           H4*        C   1  13.248 -15.421   1.381
    4    H3*    C   1           H3*        C   1  12.013 -13.405   2.999
    5    H1*    C   1           H1*        C   1  10.212 -14.932  -0.308
    6   1H4     C   1          1H4         C   1   4.446 -16.873   1.676
    7   2H4     C   1          2H4         C   1   4.968 -16.981   3.341
    8    H5     C   1           H5         C   1   7.228 -16.446   4.060
    9    H6     C   1           H6         C   1   9.447 -15.639   3.303
   10   1H2*    C   1          1H2*        C   1   9.889 -13.336   2.152
   11   2H2*    C   1          2H2*        C   1  10.610 -12.864   0.589
   12   1H5*    G   2          1H5*        G   2  12.504 -12.652  -1.295
   13   2H5*    G   2          2H5*        G   2  13.766 -11.426  -1.615
   14    H4*    G   2           H4*        G   2  12.155 -11.471  -3.466
   15    H3*    G   2           H3*        G   2  12.541  -9.106  -1.882
   16    H1*    G   2           H1*        G   2   9.020 -10.362  -3.296
   17    H8     G   2           H8         G   2   9.586  -9.882   0.550
   18    H1     G   2           H1         G   2   3.701 -11.736  -1.058
   19   1H2     G   2          1H2         G   2   4.943 -11.742  -4.340
   20   2H2     G   2          2H2         G   2   3.572 -12.005  -3.285
   21   1H2*    G   2          1H2*        G   2  10.410  -8.660  -1.262
   22   2H2*    G   2          2H2*        G   2  10.075  -8.342  -2.980
   23   1H5*    T   3          1H5*        T   3  10.402  -9.015  -5.818
   24   2H5*    T   3          2H5*        T   3  11.165  -7.889  -6.964
   25    H4*    T   3           H4*        T   3   8.852  -7.959  -7.556
   26    H3*    T   3           H3*        T   3   9.894  -5.491  -6.477
   27   1H2*    T   3          1H2*        T   3   8.304  -5.043  -4.925
   28   2H2*    T   3          2H2*        T   3   7.153  -4.886  -6.264
   29    H1*    T   3           H1*        T   3   6.251  -6.987  -5.999
   30    H3     T   3           H3         T   3   4.102  -7.802  -2.118
   31   1H5M    T   3          1H5M        T   3   7.506  -5.934   0.460
   32   2H5M    T   3          2H5M        T   3   8.157  -4.806  -0.752
   33   3H5M    T   3          3H5M        T   3   8.921  -6.393  -0.517
   34    H6     T   3           H6         T   3   8.454  -6.006  -3.095
   35   1H5*    G   4          1H5*        G   4   6.173  -5.549  -8.824
   36   2H5*    G   4          2H5*        G   4   6.103  -4.440 -10.224
   37    H4*    G   4           H4*        G   4   3.877  -4.692  -9.208
   38    H3*    G   4           H3*        G   4   5.149  -2.119  -9.391
   39    H1*    G   4           H1*        G   4   2.772  -3.430  -6.585
   40    H8     G   4           H8         G   4   6.322  -2.361  -5.301
   41    H1     G   4           H1         G   4   2.199  -3.935  -0.705
   42   1H2     G   4          1H2         G   4  -0.031  -4.569  -3.332
   43   2H2     G   4          2H2         G   4   0.236  -4.535  -1.604
   44   1H2*    G   4          1H2*        G   4   5.128  -1.593  -7.154
   45   2H2*    G   4          2H2*        G   4   3.403  -1.341  -7.414
   46   1H5*    C   5          1H5*        C   5   0.218  -2.366  -9.070
   47   2H5*    C   5          2H5*        C   5  -0.274  -1.246 -10.362
   48    H4*    C   5           H4*        C   5  -1.947  -1.305  -8.536
   49    H3*    C   5           H3*        C   5  -0.698   1.154  -9.432
   50    H1*    C   5           H1*        C   5  -1.777   0.231  -5.672
   51   1H4     C   5          1H4         C   5   4.242   1.723  -3.128
   52   2H4     C   5          2H4         C   5   3.082   1.846  -1.826
   53    H5     C   5           H5         C   5   3.632   1.163  -5.391
   54    H6     C   5           H6         C   5   1.789   0.510  -6.867
   55   1H2*    C   5          1H2*        C   5  -0.180   2.085  -7.440
   56   2H2*    C   5          2H2*        C   5  -1.928   2.102  -7.084
   57   1H5*    A   6          1H5*        A   6  -4.702   1.406  -7.265
   58   2H5*    A   6          2H5*        A   6  -5.868   2.412  -8.151
   59    H4*    A   6           H4*        A   6  -6.083   2.593  -5.656
   60    H3*    A   6           H3*        A   6  -5.935   4.873  -7.433
   61    H1*    A   6           H1*        A   6  -4.621   4.510  -3.749
   62    H8     A   6           H8         A   6  -1.880   5.436  -6.440
   63   1H6     A   6          1H6         A   6   1.776   6.275  -3.469
   64   2H6     A   6          2H6         A   6   1.982   6.148  -1.736
   65    H2     A   6           H2         A   6  -1.929   4.754  -0.044
   66   1H2*    A   6          1H2*        A   6  -4.256   5.998  -6.369
   67   2H2*    A   6          2H2*        A   6  -5.449   6.273  -5.070
   68   1H5*    G   7          1H5*        G   7  -7.568   5.667  -3.109
   69   2H5*    G   7          2H5*        G   7  -9.058   6.646  -3.231
   70    H4*    G   7           H4*        G   7  -7.674   7.372  -1.320
   71    H3*    G   7           H3*        G   7  -8.467   9.207  -3.355
   72    H1*    G   7           H1*        G   7  -5.169   9.205  -1.376
   73    H8     G   7           H8         G   7  -4.363   8.715  -5.201
   74    H1     G   7           H1         G   7   0.705   9.294  -1.380
   75   1H2     G   7          1H2         G   7   0.039   9.432   0.760
   76   2H2     G   7          2H2         G   7  -1.648   9.365   1.215
   77   1H2*    G   7          1H2*        G   7  -6.317   9.605  -4.181
   78   2H2*    G   7          2H2*        G   7  -6.295  10.747  -2.817
   79   1H5*    C   8          1H5*        C   8  -6.716  10.285   0.994
   80   2H5*    C   8          2H5*        C   8  -7.988  11.360   1.611
   81    H4*    C   8           H4*        C   8  -6.043  11.761   2.956
   82    H3*    C   8           H3*        C   8  -6.976  13.900   1.238
   83    H1*    C   8           H1*        C   8  -3.146  13.079   2.125
   84   1H4     C   8          1H4         C   8  -1.392  12.883  -4.323
   85   2H4     C   8          2H4         C   8   0.076  13.135  -3.405
   86    H5     C   8           H5         C   8  -3.557  12.689  -3.300
   87    H6     C   8           H6         C   8  -4.806  12.693  -1.216
   88   1H2*    C   8          1H2*        C   8  -5.010  14.639   0.396
   89   2H2*    C   8          2H2*        C   8  -4.483  14.960   2.063
   90   1H5*    G   9          1H5*        G   9  -4.549  15.306   4.763
   91   2H5*    G   9          2H5*        G   9  -5.431  16.503   5.750
   92    H4*    G   9           H4*        G   9  -2.935  16.904   5.505
   93    H3*    G   9           H3*        G   9  -4.968  18.923   5.065
   94    H1*    G   9           H1*        G   9  -1.507  18.440   3.164
   95    H8     G   9           H8         G   9  -4.814  18.620   1.007
   96    H1     G   9           H1         G   9   0.586  18.009  -2.330
   97   1H2     G   9          1H2         G   9   2.343  17.883  -0.940
   98   2H2     G   9          2H2         G   9   2.166  17.943   0.800
   99   1H2*    G   9          1H2*        G   9  -4.279  19.691   3.057
  100   2H2*    G   9          2H2*        G   9  -2.820  20.292   3.888
  101   1H5*    G  10          1H5*        G  10  -0.661  21.192   6.181
  102   2H5*    G  10          2H5*        G  10  -1.284  22.466   7.266
  103    H4*    G  10           H4*        G  10   0.409  23.285   5.608
  104    H3*    G  10           H3*        G  10  -2.195  24.495   5.943
  105    H1*    G  10           H1*        G  10  -0.117  24.108   2.580
  106    H8     G  10           H8         G  10  -3.690  22.477   2.743
  107    H1     G  10           H1         G  10  -0.833  22.190  -2.947
  108   1H2     G  10          1H2         G  10   1.231  23.062  -2.810
  109   2H2     G  10          2H2         G  10   1.872  23.708  -1.316
  110   1H2*    G  10          1H2*        G  10  -2.869  24.522   3.761
  111   2H2*    G  10          2H2*        G  10  -1.560  25.700   3.493
  112   1H5*    C  11          1H5*        C  11  -1.822  29.462   5.161
  113   2H5*    C  11          2H5*        C  11  -3.073  28.812   4.076
  114    H4*    C  11           H4*        C  11  -0.040  28.585   3.715
  115    H3*    C  11           H3*        C  11  -1.820  30.600   2.781
  116    H1*    C  11           H1*        C  11  -0.504  27.582   0.602
  117   1H4     C  11          1H4         C  11  -5.214  24.397  -2.317
  118   2H4     C  11          2H4         C  11  -6.183  24.387  -0.860
  119    H5     C  11           H5         C  11  -5.468  25.466   1.211
  120    H6     C  11           H6         C  11  -3.756  26.874   2.247
  121   1H2*    C  11          1H2*        C  11  -2.917  29.344   1.163
  122   2H2*    C  11          2H2*        C  11  -1.448  29.705   0.214
  123   1H5*    T  12          1H5*        T  12   1.679  32.650  -1.118
  124   2H5*    T  12          2H5*        T  12  -0.040  32.901  -1.502
  125    H4*    T  12           H4*        T  12   1.127  32.094  -3.514
  126    H3*    T  12           H3*        T  12  -1.133  30.750  -2.450
  127   1H2*    T  12          1H2*        T  12  -0.243  28.714  -1.890
  128   2H2*    T  12          2H2*        T  12  -0.157  28.449  -3.659
  129    H1*    T  12           H1*        T  12   2.127  28.779  -3.734
  130    H3     T  12           H3         T  12   3.269  25.215  -1.097
  131   1H5M    T  12          1H5M        T  12   2.121  29.125   2.348
  132   2H5M    T  12          2H5M        T  12   3.870  29.288   2.063
  133   3H5M    T  12          3H5M        T  12   3.220  27.798   2.787
  134    H6     T  12           H6         T  12   2.136  29.810  -0.184
  135   1H5*    T  13          1H5*        T  13  -1.368  28.687  -5.935
  136   2H5*    T  13          2H5*        T  13  -1.602  29.738  -7.351
  137    H4*    T  13           H4*        T  13  -2.588  27.478  -7.732
  138    H3*    T  13           H3*        T  13  -4.012  29.919  -8.131
  139   1H2*    T  13          1H2*        T  13  -5.674  29.686  -6.560
  140   2H2*    T  13          2H2*        T  13  -6.335  28.484  -7.698
  141    H1*    T  13           H1*        T  13  -5.614  26.684  -6.420
  142    H3     T  13           H3         T  13  -8.323  27.287  -2.817
  143   1H5M    T  13          1H5M        T  13  -5.434  30.357  -0.830
  144   2H5M    T  13          2H5M        T  13  -4.565  31.011  -2.236
  145   3H5M    T  13          3H5M        T  13  -3.903  29.616  -1.348
  146    H6     T  13           H6         T  13  -4.144  29.267  -4.189
  147   1H5*    G  14          1H5*        G  14  -2.187  27.000 -12.630
  148   2H5*    G  14          2H5*        G  14  -2.870  25.372 -12.413
  149    H4*    G  14           H4*        G  14  -0.337  26.560 -11.452
  150    H3*    G  14           H3*        G  14  -1.228  23.942 -12.203
  151    H1*    G  14           H1*        G  14  -0.194  24.866  -8.385
  152    H8     G  14           H8         G  14  -3.718  23.547  -9.459
  153    H1     G  14           H1         G  14  -3.109  25.018  -3.283
  154   1H2     G  14          1H2         G  14   0.088  26.120  -4.209
  155   2H2     G  14          2H2         G  14  -1.079  25.909  -2.923
  156   1H2*    G  14          1H2*        G  14  -1.567  22.951 -10.186
  157   2H2*    G  14          2H2*        G  14   0.168  23.168  -9.887
  158   1H5*    C  15          1H5*        C  15   2.806  24.725 -10.255
  159   2H5*    C  15          2H5*        C  15   4.150  23.930 -11.107
  160    H4*    C  15           H4*        C  15   4.760  24.001  -8.793
  161    H3*    C  15           H3*        C  15   4.248  21.409  -9.983
  162    H1*    C  15           H1*        C  15   3.490  22.521  -6.236
  163   1H4     C  15          1H4         C  15  -2.876  20.647  -5.786
  164   2H4     C  15          2H4         C  15  -2.360  21.250  -4.227
  165    H5     C  15           H5         C  15  -1.437  20.558  -7.692
  166    H6     C  15           H6         C  15   0.774  21.202  -8.612
  167   1H2*    C  15          1H2*        C  15   2.981  20.468  -8.353
  168   2H2*    C  15          2H2*        C  15   4.366  20.672  -7.252
  169   1H5*    C  16          1H5*        C  16   6.602  21.421  -6.079
  170   2H5*    C  16          2H5*        C  16   8.246  20.978  -6.587
  171    H4*    C  16           H4*        C  16   8.105  20.138  -4.388
  172    H3*    C  16           H3*        C  16   8.088  18.173  -6.494
  173    H1*    C  16           H1*        C  16   5.941  17.918  -3.131
  174   1H4     C  16          1H4         C  16  -0.030  17.403  -6.135
  175   2H4     C  16          2H4         C  16  -0.287  17.245  -4.412
  176    H5     C  16           H5         C  16   2.156  17.678  -7.119
  177    H6     C  16           H6         C  16   4.522  18.130  -6.660
  178   1H2*    C  16          1H2*        C  16   6.315  16.877  -5.874
  179   2H2*    C  16          2H2*        C  16   7.187  16.535  -4.368
  180   1H5*    G  17          1H5*        G  17   8.728  17.640  -2.253
  181   2H5*    G  17          2H5*        G  17  10.412  17.182  -1.871
  182    H4*    G  17           H4*        G  17   9.110  16.631   0.057
  183    H3*    G  17           H3*        G  17  10.143  14.442  -1.504
  184    H1*    G  17           H1*        G  17   6.594  14.531   0.366
  185    H8     G  17           H8         G  17   6.805  14.316  -3.561
  186    H1     G  17           H1         G  17   1.026  13.139  -1.181
  187   1H2     G  17          1H2         G  17   2.489  13.717   1.945
  188   2H2     G  17          2H2         G  17   1.041  13.320   1.048
  189   1H2*    G  17          1H2*        G  17   8.292  13.234  -1.782
  190   2H2*    G  17          2H2*        G  17   8.322  12.934  -0.022
  191   1H5*    G  18          1H5*        G  18   9.169  13.191   3.500
  192   2H5*    G  18          2H5*        G  18   9.679  14.707   2.724
  193    H4*    G  18           H4*        G  18   9.879  14.103   5.429
  194    H3*    G  18           H3*        G  18  11.327  16.071   3.703
  195    H1*    G  18           H1*        G  18  12.692  13.861   6.741
  196    H8     G  18           H8         G  18  14.153  14.173   3.101
  197    H1     G  18           H1         G  18  18.214  11.952   7.477
  198   1H2     G  18          1H2         G  18  17.178  11.815   9.468
  199   2H2     G  18          2H2         G  18  15.505  12.278   9.682
  200   1H2*    G  18          1H2*        G  18  13.277  16.048   4.853
  201   2H2*    G  18          2H2*        G  18  12.406  16.105   6.408
  202   1H5*    C  19          1H5*        C  19  10.496  16.684   8.090
  203   2H5*    C  19          2H5*        C  19   9.675  18.242   8.340
  204    H4*    C  19           H4*        C  19  11.015  17.684  10.317
  205    H3*    C  19           H3*        C  19  11.457  20.117   8.818
  206    H1*    C  19           H1*        C  19  14.307  17.926  10.557
  207   1H4     C  19          1H4         C  19  17.855  17.157   4.945
  208   2H4     C  19          2H4         C  19  18.870  16.641   6.272
  209    H5     C  19           H5         C  19  15.604  17.977   5.257
  210    H6     C  19           H6         C  19  13.862  18.509   6.857
  211   1H2*    C  19          1H2*        C  19  13.731  20.123   8.665
  212   2H2*    C  19          2H2*        C  19  13.786  20.111  10.443
  213   1H5*    A  20          1H5*        A  20  12.869  19.621  12.955
  214   2H5*    A  20          2H5*        A  20  12.274  20.842  14.105
  215    H4*    A  20           H4*        A  20  14.482  20.113  14.828
  216    H3*    A  20           H3*        A  20  13.993  22.873  14.156
  217    H1*    A  20           H1*        A  20  17.327  20.820  13.555
  218    H8     A  20           H8         A  20  15.563  22.364  10.378
  219   1H6     A  20          1H6         A  20  20.377  20.310   7.186
  220   2H6     A  20          2H6         A  20  18.881  21.215   7.122
  221    H2     A  20           H2         A  20  20.897  18.957  11.435
  222   1H2*    A  20          1H2*        A  20  15.649  23.176  12.622
  223   2H2*    A  20          2H2*        A  20  16.766  23.042  14.006
  224   1H5*    C  21          1H5*        C  21  16.343  25.954  17.276
  225   2H5*    C  21          2H5*        C  21  16.578  26.571  15.627
  226    H4*    C  21           H4*        C  21  18.255  24.504  17.130
  227    H3*    C  21           H3*        C  21  18.706  27.243  16.712
  228    H1*    C  21           H1*        C  21  20.340  24.484  14.413
  229   1H4     C  21          1H4         C  21  18.847  24.643   8.223
  230   2H4     C  21          2H4         C  21  17.259  25.305   8.548
  231    H5     C  21           H5         C  21  16.470  25.814  10.786
  232    H6     C  21           H6         C  21  17.110  25.962  13.154
  233   1H2*    C  21          1H2*        C  21  18.973  27.193  14.387
  234   2H2*    C  21          2H2*        C  21  20.642  26.759  14.846
  235   1H5*    T  22          1H5*        T  22  24.259  26.876  17.364
  236   2H5*    T  22          2H5*        T  22  24.000  28.003  16.012
  237    H4*    T  22           H4*        T  22  25.775  26.395  15.418
  238    H3*    T  22           H3*        T  22  23.353  26.643  13.857
  239   1H2*    T  22          1H2*        T  22  22.737  24.479  13.880
  240   2H2*    T  22          2H2*        T  22  24.111  24.204  12.776
  241    H1*    T  22           H1*        T  22  25.537  23.466  14.488
  242    H3     T  22           H3         T  22  24.480  20.155  17.627
  243   1H5M    T  22          1H5M        T  22  19.994  20.885  15.097
  244   2H5M    T  22          2H5M        T  22  20.603  19.219  15.244
  245   3H5M    T  22          3H5M        T  22  20.864  20.129  13.741
  246    H6     T  22           H6         T  22  22.179  22.370  14.024
  247   1H5*    T  23          1H5*        T  23  24.908  25.130  10.561
  248   2H5*    T  23          2H5*        T  23  26.285  26.142  10.078
  249    H4*    T  23           H4*        T  23  25.259  25.157   8.085
  250    H3*    T  23           H3*        T  23  25.389  28.043   8.481
  251   1H2*    T  23          1H2*        T  23  23.383  28.691   7.650
  252   2H2*    T  23          2H2*        T  23  23.721  27.776   6.159
  253    H1*    T  23           H1*        T  23  22.242  26.135   6.773
  254    H3     T  23           H3         T  23  18.621  28.741   7.909
  255   1H5M    T  23          1H5M        T  23  20.467  29.727  12.087
  256   2H5M    T  23          2H5M        T  23  22.166  29.255  11.818
  257   3H5M    T  23          3H5M        T  23  21.008  28.086  12.510
  258    H6     T  23           H6         T  23  22.531  27.236  10.284
  259   1H5*    G  24          1H5*        G  24  29.600  24.976   6.195
  260   2H5*    G  24          2H5*        G  24  28.910  24.217   4.744
  261    H4*    G  24           H4*        G  24  29.176  23.188   7.458
  262    H3*    G  24           H3*        G  24  28.782  22.032   4.870
  263    H1*    G  24           H1*        G  24  26.256  21.603   7.953
  264    H8     G  24           H8         G  24  24.861  23.050   4.584
  265    H1     G  24           H1         G  24  20.771  23.284   9.466
  266   1H2     G  24          1H2         G  24  23.514  22.225  11.391
  267   2H2     G  24          2H2         G  24  21.829  22.690  11.368
  268   1H2*    G  24          1H2*        G  24  26.535  21.567   4.940
  269   2H2*    G  24          2H2*        G  24  26.987  20.362   6.154
  270   1H5*    T  25          1H5*        T  25  29.190  19.541   8.844
  271   2H5*    T  25          2H5*        T  25  30.199  18.105   8.555
  272    H4*    T  25           H4*        T  25  28.599  17.714  10.392
  273    H3*    T  25           H3*        T  25  28.717  15.998   8.058
  274   1H2*    T  25          1H2*        T  25  26.491  15.761   7.627
  275   2H2*    T  25          2H2*        T  25  26.320  15.063   9.253
  276    H1*    T  25           H1*        T  25  25.488  16.963  10.160
  277    H3     T  25           H3         T  25  21.683  18.696   8.557
  278   1H5M    T  25          1H5M        T  25  24.935  19.315   4.508
  279   2H5M    T  25          2H5M        T  25  23.234  18.926   4.177
  280   3H5M    T  25          3H5M        T  25  24.454  17.633   4.193
  281    H6     T  25           H6         T  25  25.868  17.594   6.441
  282   1H5*    G  26          1H5*        G  26  27.109  14.597  12.078
  283   2H5*    G  26          2H5*        G  26  27.862  13.064  12.604
  284    H4*    G  26           H4*        G  26  25.593  13.131  13.450
  285    H3*    G  26           H3*        G  26  26.290  11.139  11.481
  286    H1*    G  26           H1*        G  26  22.801  13.007  11.817
  287    H8     G  26           H8         G  26  24.753  13.170   8.419
  288    H1     G  26           H1         G  26  19.143  16.194   8.403
  289   1H2     G  26          1H2         G  26  19.002  15.342  11.798
  290   2H2     G  26          2H2         G  26  18.220  16.127  10.445
  291   1H2*    G  26          1H2*        G  26  24.584  11.434   9.998
  292   2H2*    G  26          2H2*        G  26  23.498  10.901  11.296
  293   1H5*    C  27          1H5*        C  27  23.003   6.878  13.958
  294   2H5*    C  27          2H5*        C  27  23.054   7.468  12.279
  295    H4*    C  27           H4*        C  27  21.003   8.268  14.402
  296    H3*    C  27           H3*        C  27  20.979   6.030  12.546
  297    H1*    C  27           H1*        C  27  19.014   9.532  12.031
  298   1H4     C  27          1H4         C  27  21.848  10.897   6.124
  299   2H4     C  27          2H4         C  27  20.247  11.601   6.117
  300    H5     C  27           H5         C  27  22.735   9.653   8.007
  301    H6     C  27           H6         C  27  22.201   8.662  10.187
  302   1H2*    C  27          1H2*        C  27  20.044   7.026  10.718
  303   2H2*    C  27          2H2*        C  27  18.570   7.271  11.695
  304   1H5*    T  28          1H5*        T  28  15.551   6.958  14.516
  305   2H5*    T  28          2H5*        T  28  15.647   6.081  12.974
  306    H4*    T  28           H4*        T  28  13.771   7.692  12.935
  307    H3*    T  28           H3*        T  28  15.937   7.751  10.996
  308   1H2*    T  28          1H2*        T  28  16.479   9.950  11.069
  309   2H2*    T  28          2H2*        T  28  14.850  10.284  10.417
  310    H1*    T  28           H1*        T  28  14.032  10.926  12.520
  311    H3     T  28           H3         T  28  17.028  14.494  12.393
  312   1H5M    T  28          1H5M        T  28  18.327  11.449  16.519
  313   2H5M    T  28          2H5M        T  28  19.519  12.571  15.824
  314   3H5M    T  28          3H5M        T  28  19.480  10.876  15.287
  315    H6     T  28           H6         T  28  16.868  10.212  14.607
  316   1H5*    T  29          1H5*        T  29  11.023   7.983   8.101
  317   2H5*    T  29          2H5*        T  29  12.774   7.729   7.907
  318    H4*    T  29           H4*        T  29  11.192  10.090   6.765
  319    H3*    T  29           H3*        T  29  11.551   7.434   5.666
  320   1H2*    T  29          1H2*        T  29  13.557   7.708   4.622
  321   2H2*    T  29          2H2*        T  29  12.709   8.834   3.545
  322    H1*    T  29           H1*        T  29  13.589  10.705   4.587
  323    H3     T  29           H3         T  29  17.985  10.047   3.537
  324   1H5M    T  29          1H5M        T  29  17.166   6.710   7.575
  325   2H5M    T  29          2H5M        T  29  17.487   8.238   8.434
  326   3H5M    T  29          3H5M        T  29  18.738   7.523   7.390
  327    H6     T  29           H6         T  29  15.085   8.335   6.974
  328   1H5*    C  30          1H5*        C  30   7.620  11.110   3.144
  329   2H5*    C  30          2H5*        C  30   8.090  11.229   4.847
  330    H4*    C  30           H4*        C  30   5.893  11.207   5.414
  331    H3*    C  30           H3*        C  30   6.296   8.451   4.668
  332    H1*    C  30           H1*        C  30   3.185  10.731   3.601
  333   1H4     C  30          1H4         C  30   4.037   9.632  -2.952
  334   2H4     C  30          2H4         C  30   2.313   9.567  -2.662
  335    H5     C  30           H5         C  30   5.660   9.920  -1.189
  336    H6     C  30           H6         C  30   5.990  10.206   1.227
  337   1H2*    C  30          1H2*        C  30   4.739   8.239   3.053
  338   2H2*    C  30          2H2*        C  30   3.520   8.558   4.300
  339   1H5*    T  31          1H5*        T  31   1.929   8.170   6.595
  340   2H5*    T  31          2H5*        T  31   2.435   7.338   8.084
  341    H4*    T  31           H4*        T  31   0.422   6.250   7.280
  342    H3*    T  31           H3*        T  31   2.909   4.790   7.439
  343   1H2*    T  31          1H2*        T  31   2.957   3.758   5.419
  344   2H2*    T  31          2H2*        T  31   1.420   2.986   5.853
  345    H1*    T  31           H1*        T  31   0.164   4.355   4.556
  346    H3     T  31           H3         T  31   1.038   4.728   0.176
  347   1H5M    T  31          1H5M        T  31   5.461   6.306   1.209
  348   2H5M    T  31          2H5M        T  31   5.710   4.564   1.448
  349   3H5M    T  31          3H5M        T  31   5.693   5.649   2.847
  350    H6     T  31           H6         T  31   3.754   5.310   4.105
  351   1H5*    G  32          1H5*        G  32  -1.141   2.718   7.522
  352   2H5*    G  32          2H5*        G  32  -1.290   1.489   8.811
  353    H4*    G  32           H4*        G  32  -2.619   0.850   6.846
  354    H3*    G  32           H3*        G  32  -0.469  -0.827   7.794
  355    H1*    G  32           H1*        G  32  -1.563  -0.267   4.015
  356    H8     G  32           H8         G  32   2.112   0.673   5.093
  357    H1     G  32           H1         G  32   0.996   0.893  -1.172
  358   1H2     G  32          1H2         G  32  -1.149   0.398  -1.597
  359   2H2     G  32          2H2         G  32  -2.289   0.024  -0.322
  360   1H2*    G  32          1H2*        G  32   0.654  -1.152   5.840
  361   2H2*    G  32          2H2*        G  32  -0.787  -2.035   5.278
  362   1H5*    C  33          1H5*        C  33  -3.997  -2.449   5.376
  363   2H5*    C  33          2H5*        C  33  -4.722  -3.905   6.099
  364    H4*    C  33           H4*        C  33  -4.943  -3.929   3.630
  365    H3*    C  33           H3*        C  33  -3.698  -6.073   5.116
  366    H1*    C  33           H1*        C  33  -2.674  -4.729   1.488
  367   1H4     C  33          1H4         C  33   3.633  -3.673   1.164
  368   2H4     C  33          2H4         C  33   3.795  -3.691   2.905
  369    H5     C  33           H5         C  33   1.938  -4.117   4.391
  370    H6     C  33           H6         C  33  -0.458  -4.458   4.565
  371   1H2*    C  33          1H2*        C  33  -1.774  -6.320   3.945
  372   2H2*    C  33          2H2*        C  33  -2.789  -6.805   2.566
  373   1H5*    A  34          1H5*        A  34  -5.679  -7.056   0.919
  374   2H5*    A  34          2H5*        A  34  -6.699  -8.496   1.153
  375    H4*    A  34           H4*        A  34  -5.749  -8.545  -1.102
  376    H3*    A  34           H3*        A  34  -5.220 -10.655   0.800
  377    H1*    A  34           H1*        A  34  -2.607  -9.228  -1.879
  378    H8     A  34           H8         A  34  -1.994  -9.172   1.963
  379   1H6     A  34          1H6         A  34   3.719  -7.328   0.642
  380   2H6     A  34          2H6         A  34   2.587  -7.695   1.925
  381    H2     A  34           H2         A  34   1.499  -7.870  -3.236
  382   1H2*    A  34          1H2*        A  34  -2.971 -10.854   0.597
  383   2H2*    A  34          2H2*        A  34  -3.228 -11.271  -1.098
  384   1H5*    C  35          1H5*        C  35  -4.675 -11.245  -3.614
  385   2H5*    C  35          2H5*        C  35  -5.429 -12.718  -4.264
  386    H4*    C  35           H4*        C  35  -3.361 -12.199  -5.494
  387    H3*    C  35           H3*        C  35  -3.761 -14.732  -4.158
  388    H1*    C  35           H1*        C  35  -0.321 -12.736  -4.557
  389   1H4     C  35          1H4         C  35   2.661 -11.893   1.040
  390   2H4     C  35          2H4         C  35   1.269 -12.424   1.955
  391    H5     C  35           H5         C  35  -0.799 -13.129   0.920
  392    H6     C  35           H6         C  35  -1.960 -13.515  -1.185
  393   1H2*    C  35          1H2*        C  35  -1.790 -14.931  -3.045
  394   2H2*    C  35          2H2*        C  35  -0.995 -14.956  -4.641
  395   1H5*    G  36          1H5*        G  36  -0.452 -14.590  -7.265
  396   2H5*    G  36          2H5*        G  36  -1.055 -15.565  -8.635
  397    H4*    G  36           H4*        G  36   1.349 -15.698  -8.653
  398    H3*    G  36           H3*        G  36  -0.149 -18.085  -8.071
  399    H1*    G  36           H1*        G  36   3.349 -17.052  -6.410
  400    H8     G  36           H8         G  36   0.105 -17.250  -4.164
  401    H1     G  36           H1         G  36   5.600 -16.888  -0.958
  402   1H2     G  36          1H2         G  36   7.068 -16.607  -4.138
  403   2H2     G  36          2H2         G  36   7.312 -16.636  -2.405
  404   1H2*    G  36          1H2*        G  36   0.969 -18.815  -6.145
  405   2H2*    G  36          2H2*        G  36   2.409 -18.959  -7.191
  Start of MODEL    8
    1   1H5*    C   1          1H5*        C   1  12.142 -19.917   1.672
    2   2H5*    C   1          2H5*        C   1  13.116 -18.620   2.407
    3    H4*    C   1           H4*        C   1  13.052 -18.283  -0.018
    4    H3*    C   1           H3*        C   1  12.055 -16.299   1.809
    5    H1*    C   1           H1*        C   1  10.220 -17.253  -1.675
    6   1H4     C   1          1H4         C   1   4.104 -18.201  -0.023
    7   2H4     C   1          2H4         C   1   4.546 -18.699   1.595
    8    H5     C   1           H5         C   1   6.841 -18.775   2.378
    9    H6     C   1           H6         C   1   9.194 -18.301   1.774
   10   1H2*    C   1          1H2*        C   1  10.002 -15.852   0.935
   11   2H2*    C   1          2H2*        C   1  10.831 -15.323  -0.554
   12   1H5*    G   2          1H5*        G   2  12.726 -14.838  -2.296
   13   2H5*    G   2          2H5*        G   2  13.999 -13.588  -2.392
   14    H4*    G   2           H4*        G   2  12.168 -13.266  -4.065
   15    H3*    G   2           H3*        G   2  12.987 -11.223  -2.196
   16    H1*    G   2           H1*        G   2   9.305 -11.921  -3.504
   17    H8     G   2           H8         G   2  10.050 -12.120   0.339
   18    H1     G   2           H1         G   2   3.877 -12.509  -1.182
   19   1H2     G   2          1H2         G   2   4.985 -12.139  -4.489
   20   2H2     G   2          2H2         G   2   3.623 -12.320  -3.407
   21   1H2*    G   2          1H2*        G   2  10.964 -10.669  -1.326
   22   2H2*    G   2          2H2*        G   2  10.548 -10.053  -2.945
   23   1H5*    T   3          1H5*        T   3  10.361 -10.460  -5.615
   24   2H5*    T   3          2H5*        T   3  11.166  -9.430  -6.820
   25    H4*    T   3           H4*        T   3   8.894  -9.015  -7.209
   26    H3*    T   3           H3*        T   3  10.305  -6.874  -5.878
   27   1H2*    T   3          1H2*        T   3   8.860  -6.463  -4.178
   28   2H2*    T   3          2H2*        T   3   7.684  -5.958  -5.405
   29    H1*    T   3           H1*        T   3   6.524  -7.957  -5.395
   30    H3     T   3           H3         T   3   4.407  -9.009  -1.561
   31   1H5M    T   3          1H5M        T   3   9.446  -8.551  -0.067
   32   2H5M    T   3          2H5M        T   3   8.152  -8.101   1.067
   33   3H5M    T   3          3H5M        T   3   8.894  -6.863   0.027
   34    H6     T   3           H6         T   3   8.936  -7.699  -2.504
   35   1H5*    G   4          1H5*        G   4   6.583  -6.247  -8.118
   36   2H5*    G   4          2H5*        G   4   6.718  -5.120  -9.499
   37    H4*    G   4           H4*        G   4   4.420  -5.145  -8.628
   38    H3*    G   4           H3*        G   4   5.979  -2.727  -8.670
   39    H1*    G   4           H1*        G   4   3.294  -3.809  -6.020
   40    H8     G   4           H8         G   4   6.884  -3.128  -4.613
   41    H1     G   4           H1         G   4   2.479  -4.167  -0.132
   42   1H2     G   4          1H2         G   4   0.266  -4.601  -2.812
   43   2H2     G   4          2H2         G   4   0.488  -4.563  -1.077
   44   1H2*    G   4          1H2*        G   4   5.826  -2.195  -6.450
   45   2H2*    G   4          2H2*        G   4   4.150  -1.805  -6.820
   46   1H5*    C   5          1H5*        C   5   1.172  -2.568  -8.564
   47   2H5*    C   5          2H5*        C   5   0.780  -1.516  -9.944
   48    H4*    C   5           H4*        C   5  -0.997  -1.368  -8.263
   49    H3*    C   5           H3*        C   5   0.515   0.966  -9.085
   50    H1*    C   5           H1*        C   5  -0.901   0.218  -5.384
   51   1H4     C   5          1H4         C   5   5.087   1.317  -2.574
   52   2H4     C   5          2H4         C   5   3.878   1.546  -1.330
   53    H5     C   5           H5         C   5   4.545   0.750  -4.851
   54    H6     C   5           H6         C   5   2.730   0.233  -6.415
   55   1H2*    C   5          1H2*        C   5   0.896   1.940  -7.081
   56   2H2*    C   5          2H2*        C   5  -0.871   2.032  -6.863
   57   1H5*    A   6          1H5*        A   6  -3.580   1.417  -7.366
   58   2H5*    A   6          2H5*        A   6  -4.678   2.415  -8.343
   59    H4*    A   6           H4*        A   6  -5.092   2.585  -5.873
   60    H3*    A   6           H3*        A   6  -4.814   4.861  -7.638
   61    H1*    A   6           H1*        A   6  -3.726   4.544  -3.853
   62    H8     A   6           H8         A   6  -0.912   5.385  -6.490
   63   1H6     A   6          1H6         A   6   2.649   6.351  -3.429
   64   2H6     A   6          2H6         A   6   2.781   6.341  -1.684
   65    H2     A   6           H2         A   6  -1.216   5.097  -0.070
   66   1H2*    A   6          1H2*        A   6  -3.286   6.052  -6.434
   67   2H2*    A   6          2H2*        A   6  -4.572   6.240  -5.214
   68   1H5*    G   7          1H5*        G   7  -6.643   5.581  -3.496
   69   2H5*    G   7          2H5*        G   7  -8.271   6.288  -3.706
   70    H4*    G   7           H4*        G   7  -7.222   7.228  -1.702
   71    H3*    G   7           H3*        G   7  -8.026   8.940  -3.836
   72    H1*    G   7           H1*        G   7  -4.956   9.390  -1.539
   73    H8     G   7           H8         G   7  -3.758   8.757  -5.245
   74    H1     G   7           H1         G   7   0.813  10.473  -1.157
   75   1H2     G   7          1H2         G   7  -0.041  10.730   0.901
   76   2H2     G   7          2H2         G   7  -1.737  10.476   1.244
   77   1H2*    G   7          1H2*        G   7  -5.878   9.626  -4.443
   78   2H2*    G   7          2H2*        G   7  -6.147  10.753  -3.096
   79   1H5*    C   8          1H5*        C   8  -6.965  10.271   0.669
   80   2H5*    C   8          2H5*        C   8  -8.316  11.333   1.125
   81    H4*    C   8           H4*        C   8  -6.407  11.805   2.566
   82    H3*    C   8           H3*        C   8  -7.495  13.876   0.848
   83    H1*    C   8           H1*        C   8  -3.636  13.375   1.818
   84   1H4     C   8          1H4         C   8  -1.643  13.417  -4.558
   85   2H4     C   8          2H4         C   8  -0.220  13.674  -3.574
   86    H5     C   8           H5         C   8  -3.843  13.164  -3.634
   87    H6     C   8           H6         C   8  -5.172  13.035  -1.605
   88   1H2*    C   8          1H2*        C   8  -5.587  14.815   0.078
   89   2H2*    C   8          2H2*        C   8  -5.125  15.131   1.765
   90   1H5*    G   9          1H5*        G   9  -5.384  15.268   4.520
   91   2H5*    G   9          2H5*        G   9  -6.222  16.500   5.499
   92    H4*    G   9           H4*        G   9  -3.701  16.770   5.268
   93    H3*    G   9           H3*        G   9  -5.626  18.903   4.863
   94    H1*    G   9           H1*        G   9  -2.175  18.264   3.009
   95    H8     G   9           H8         G   9  -5.404  18.788   0.782
   96    H1     G   9           H1         G   9   0.008  17.872  -2.464
   97   1H2     G   9          1H2         G   9   1.722  17.579  -1.045
   98   2H2     G   9          2H2         G   9   1.509  17.591   0.691
   99   1H2*    G   9          1H2*        G   9  -4.864  19.691   2.895
  100   2H2*    G   9          2H2*        G   9  -3.386  20.178   3.763
  101   1H5*    G  10          1H5*        G  10  -1.260  20.919   6.208
  102   2H5*    G  10          2H5*        G  10  -1.849  22.235   7.260
  103    H4*    G  10           H4*        G  10  -0.042  22.905   5.623
  104    H3*    G  10           H3*        G  10  -2.534  24.333   5.962
  105    H1*    G  10           H1*        G  10  -0.487  23.801   2.599
  106    H8     G  10           H8         G  10  -4.170  22.447   2.765
  107    H1     G  10           H1         G  10  -1.405  22.123  -2.971
  108   1H2     G  10          1H2         G  10   0.713  22.865  -2.834
  109   2H2     G  10          2H2         G  10   1.407  23.431  -1.332
  110   1H2*    G  10          1H2*        G  10  -3.193  24.443   3.779
  111   2H2*    G  10          2H2*        G  10  -1.782  25.500   3.528
  112   1H5*    C  11          1H5*        C  11  -1.704  29.250   5.153
  113   2H5*    C  11          2H5*        C  11  -3.012  28.718   4.070
  114    H4*    C  11           H4*        C  11  -0.011  28.225   3.704
  115    H3*    C  11           H3*        C  11  -1.613  30.377   2.764
  116    H1*    C  11           H1*        C  11  -0.574  27.254   0.593
  117   1H4     C  11          1H4         C  11  -5.547  24.413  -2.254
  118   2H4     C  11          2H4         C  11  -6.503  24.500  -0.791
  119    H5     C  11           H5         C  11  -5.694  25.550   1.258
  120    H6     C  11           H6         C  11  -3.867  26.829   2.264
  121   1H2*    C  11          1H2*        C  11  -2.833  29.203   1.168
  122   2H2*    C  11          2H2*        C  11  -1.350  29.440   0.202
  123   1H5*    T  12          1H5*        T  12   1.928  32.167  -1.191
  124   2H5*    T  12          2H5*        T  12   0.215  32.552  -1.477
  125    H4*    T  12           H4*        T  12   1.213  31.708  -3.563
  126    H3*    T  12           H3*        T  12  -1.078  30.499  -2.397
  127   1H2*    T  12          1H2*        T  12  -0.304  28.387  -1.954
  128   2H2*    T  12          2H2*        T  12  -0.340  28.175  -3.731
  129    H1*    T  12           H1*        T  12   1.954  28.363  -3.937
  130    H3     T  12           H3         T  12   3.102  24.643  -1.558
  131   1H5M    T  12          1H5M        T  12   3.368  26.996   2.455
  132   2H5M    T  12          2H5M        T  12   2.142  28.258   2.197
  133   3H5M    T  12          3H5M        T  12   3.850  28.582   1.811
  134    H6     T  12           H6         T  12   2.136  29.205  -0.323
  135   1H5*    T  13          1H5*        T  13  -1.566  28.522  -5.944
  136   2H5*    T  13          2H5*        T  13  -1.909  29.634  -7.289
  137    H4*    T  13           H4*        T  13  -2.946  27.395  -7.670
  138    H3*    T  13           H3*        T  13  -4.368  29.867  -7.853
  139   1H2*    T  13          1H2*        T  13  -5.936  29.568  -6.201
  140   2H2*    T  13          2H2*        T  13  -6.662  28.400  -7.336
  141    H1*    T  13           H1*        T  13  -5.860  26.566  -6.164
  142    H3     T  13           H3         T  13  -8.198  26.906  -2.291
  143   1H5M    T  13          1H5M        T  13  -5.239  29.987  -0.438
  144   2H5M    T  13          2H5M        T  13  -4.770  30.887  -1.899
  145   3H5M    T  13          3H5M        T  13  -3.750  29.553  -1.308
  146    H6     T  13           H6         T  13  -4.288  29.163  -3.989
  147   1H5*    G  14          1H5*        G  14  -2.729  27.168 -12.518
  148   2H5*    G  14          2H5*        G  14  -3.469  25.555 -12.422
  149    H4*    G  14           H4*        G  14  -0.876  26.550 -11.427
  150    H3*    G  14           H3*        G  14  -1.902  24.031 -12.314
  151    H1*    G  14           H1*        G  14  -0.758  24.664  -8.478
  152    H8     G  14           H8         G  14  -4.389  23.576  -9.440
  153    H1     G  14           H1         G  14  -3.465  24.877  -3.263
  154   1H2     G  14          1H2         G  14  -0.261  25.860  -4.299
  155   2H2     G  14          2H2         G  14  -1.383  25.671  -2.969
  156   1H2*    G  14          1H2*        G  14  -2.341  22.979 -10.343
  157   2H2*    G  14          2H2*        G  14  -0.591  23.012 -10.057
  158   1H5*    C  15          1H5*        C  15   2.064  24.711 -10.282
  159   2H5*    C  15          2H5*        C  15   3.440  23.961 -11.124
  160    H4*    C  15           H4*        C  15   4.039  24.063  -8.808
  161    H3*    C  15           H3*        C  15   3.628  21.453  -9.995
  162    H1*    C  15           H1*        C  15   2.819  22.539  -6.252
  163   1H4     C  15          1H4         C  15  -3.529  20.596  -5.839
  164   2H4     C  15          2H4         C  15  -3.003  21.122  -4.256
  165    H5     C  15           H5         C  15  -2.103  20.596  -7.759
  166    H6     C  15           H6         C  15   0.125  21.219  -8.647
  167   1H2*    C  15          1H2*        C  15   2.365  20.483  -8.379
  168   2H2*    C  15          2H2*        C  15   3.740  20.711  -7.272
  169   1H5*    C  16          1H5*        C  16   5.860  21.538  -6.040
  170   2H5*    C  16          2H5*        C  16   7.540  21.226  -6.526
  171    H4*    C  16           H4*        C  16   7.444  20.350  -4.344
  172    H3*    C  16           H3*        C  16   7.572  18.413  -6.466
  173    H1*    C  16           H1*        C  16   5.390  17.969  -3.139
  174   1H4     C  16          1H4         C  16  -0.516  17.309  -6.240
  175   2H4     C  16          2H4         C  16  -0.789  17.099  -4.526
  176    H5     C  16           H5         C  16   1.666  17.665  -7.188
  177    H6     C  16           H6         C  16   4.021  18.171  -6.688
  178   1H2*    C  16          1H2*        C  16   5.864  17.008  -5.893
  179   2H2*    C  16          2H2*        C  16   6.736  16.688  -4.381
  180   1H5*    G  17          1H5*        G  17   8.317  18.051  -2.234
  181   2H5*    G  17          2H5*        G  17   9.971  17.567  -1.765
  182    H4*    G  17           H4*        G  17   8.484  17.155   0.111
  183    H3*    G  17           H3*        G  17   9.787  14.946  -1.180
  184    H1*    G  17           H1*        G  17   6.117  14.957   0.372
  185    H8     G  17           H8         G  17   6.461  14.445  -3.526
  186    H1     G  17           H1         G  17   0.629  13.365  -1.244
  187   1H2     G  17          1H2         G  17   1.987  14.185   1.877
  188   2H2     G  17          2H2         G  17   0.573  13.704   0.967
  189   1H2*    G  17          1H2*        G  17   7.987  13.680  -1.663
  190   2H2*    G  17          2H2*        G  17   7.889  13.373   0.094
  191   1H5*    G  18          1H5*        G  18   8.328  14.212   3.811
  192   2H5*    G  18          2H5*        G  18   9.208  15.596   3.125
  193    H4*    G  18           H4*        G  18   9.073  14.873   5.821
  194    H3*    G  18           H3*        G  18  10.970  16.596   4.279
  195    H1*    G  18           H1*        G  18  11.680  14.083   7.302
  196    H8     G  18           H8         G  18  13.408  14.162   3.779
  197    H1     G  18           H1         G  18  16.791  11.330   8.374
  198   1H2     G  18          1H2         G  18  15.639  11.388  10.309
  199   2H2     G  18          2H2         G  18  14.058  12.125  10.430
  200   1H2*    G  18          1H2*        G  18  12.797  16.171   5.542
  201   2H2*    G  18          2H2*        G  18  11.850  16.351   7.041
  202   1H5*    C  19          1H5*        C  19   9.992  17.217   8.620
  203   2H5*    C  19          2H5*        C  19   9.411  18.879   8.875
  204    H4*    C  19           H4*        C  19  10.521  18.083  10.905
  205    H3*    C  19           H3*        C  19  11.450  20.430   9.494
  206    H1*    C  19           H1*        C  19  13.797  17.767  11.328
  207   1H4     C  19          1H4         C  19  17.477  16.546   5.884
  208   2H4     C  19          2H4         C  19  18.322  15.845   7.245
  209    H5     C  19           H5         C  19  15.372  17.704   6.104
  210    H6     C  19           H6         C  19  13.650  18.475   7.627
  211   1H2*    C  19          1H2*        C  19  13.698  20.062   9.471
  212   2H2*    C  19          2H2*        C  19  13.644  20.007  11.247
  213   1H5*    A  20          1H5*        A  20  12.479  19.705  13.716
  214   2H5*    A  20          2H5*        A  20  12.063  21.018  14.842
  215    H4*    A  20           H4*        A  20  14.074  19.865  15.633
  216    H3*    A  20           H3*        A  20  14.087  22.695  15.064
  217    H1*    A  20           H1*        A  20  17.059  20.124  14.539
  218    H8     A  20           H8         A  20  15.670  22.004  11.364
  219   1H6     A  20          1H6         A  20  20.422  19.582   8.343
  220   2H6     A  20          2H6         A  20  19.026  20.630   8.234
  221    H2     A  20           H2         A  20  20.587  18.063  12.568
  222   1H2*    A  20          1H2*        A  20  15.886  22.786  13.670
  223   2H2*    A  20          2H2*        A  20  16.850  22.366  15.107
  224   1H5*    C  21          1H5*        C  21  17.030  24.803  18.675
  225   2H5*    C  21          2H5*        C  21  17.559  25.557  17.155
  226    H4*    C  21           H4*        C  21  18.440  22.887  18.351
  227    H3*    C  21           H3*        C  21  19.716  25.379  18.379
  228    H1*    C  21           H1*        C  21  20.602  22.642  15.690
  229   1H4     C  21          1H4         C  21  19.608  24.106   9.580
  230   2H4     C  21          2H4         C  21  18.205  25.077   9.966
  231    H5     C  21           H5         C  21  17.424  25.429  12.245
  232    H6     C  21           H6         C  21  17.951  25.088  14.616
  233   1H2*    C  21          1H2*        C  21  20.052  25.605  16.065
  234   2H2*    C  21          2H2*        C  21  21.505  24.653  16.471
  235   1H5*    T  22          1H5*        T  22  24.900  22.998  19.278
  236   2H5*    T  22          2H5*        T  22  24.988  24.698  18.761
  237    H4*    T  22           H4*        T  22  26.610  23.441  17.441
  238    H3*    T  22           H3*        T  22  24.573  24.905  16.193
  239   1H2*    T  22          1H2*        T  22  23.276  23.189  15.327
  240   2H2*    T  22          2H2*        T  22  24.563  23.119  14.095
  241    H1*    T  22           H1*        T  22  25.543  21.226  15.009
  242    H3     T  22           H3         T  22  22.518  17.931  14.366
  243   1H5M    T  22          1H5M        T  22  19.903  20.899  17.699
  244   2H5M    T  22          2H5M        T  22  21.059  20.317  18.921
  245   3H5M    T  22          3H5M        T  22  19.989  19.167  18.086
  246    H6     T  22           H6         T  22  22.696  21.674  17.398
  247   1H5*    T  23          1H5*        T  23  26.020  22.905  12.152
  248   2H5*    T  23          2H5*        T  23  27.294  24.120  11.927
  249    H4*    T  23           H4*        T  23  26.102  23.434   9.793
  250    H3*    T  23           H3*        T  23  26.580  26.184  10.695
  251   1H2*    T  23          1H2*        T  23  24.657  27.178  10.049
  252   2H2*    T  23          2H2*        T  23  24.865  26.497   8.417
  253    H1*    T  23           H1*        T  23  23.240  24.935   8.794
  254    H3     T  23           H3         T  23  19.914  27.698  10.302
  255   1H5M    T  23          1H5M        T  23  21.856  28.023  14.521
  256   2H5M    T  23          2H5M        T  23  23.506  27.448  14.158
  257   3H5M    T  23          3H5M        T  23  22.271  26.313  14.761
  258    H6     T  23           H6         T  23  23.628  25.498  12.455
  259   1H5*    G  24          1H5*        G  24  30.300  22.982   7.593
  260   2H5*    G  24          2H5*        G  24  29.290  22.481   6.217
  261    H4*    G  24           H4*        G  24  29.560  21.361   8.964
  262    H3*    G  24           H3*        G  24  29.204  20.257   6.357
  263    H1*    G  24           H1*        G  24  26.496  20.049   9.278
  264    H8     G  24           H8         G  24  25.404  21.903   5.982
  265    H1     G  24           H1         G  24  21.142  22.062  10.719
  266   1H2     G  24          1H2         G  24  23.643  20.422  12.567
  267   2H2     G  24          2H2         G  24  22.029  21.094  12.559
  268   1H2*    G  24          1H2*        G  24  26.898  20.144   6.270
  269   2H2*    G  24          2H2*        G  24  27.116  18.812   7.417
  270   1H5*    T  25          1H5*        T  25  29.005  17.597  10.355
  271   2H5*    T  25          2H5*        T  25  29.765  16.026  10.021
  272    H4*    T  25           H4*        T  25  27.995  15.860  11.758
  273    H3*    T  25           H3*        T  25  28.031  14.193   9.385
  274   1H2*    T  25          1H2*        T  25  25.833  14.332   8.778
  275   2H2*    T  25          2H2*        T  25  25.435  13.614  10.356
  276    H1*    T  25           H1*        T  25  24.849  15.583  11.296
  277    H3     T  25           H3         T  25  21.424  17.864   9.551
  278   1H5M    T  25          1H5M        T  25  24.274  16.557   5.313
  279   2H5M    T  25          2H5M        T  25  24.964  18.147   5.705
  280   3H5M    T  25          3H5M        T  25  23.247  18.007   5.272
  281    H6     T  25           H6         T  25  25.544  16.277   7.633
  282   1H5*    G  26          1H5*        G  26  26.064  12.857  13.411
  283   2H5*    G  26          2H5*        G  26  26.596  11.198  13.808
  284    H4*    G  26           H4*        G  26  24.344  11.573  14.681
  285    H3*    G  26           H3*        G  26  24.811   9.544  12.688
  286    H1*    G  26           H1*        G  26  21.574  11.827  12.975
  287    H8     G  26           H8         G  26  23.671  11.871   9.658
  288    H1     G  26           H1         G  26  18.401  15.451   9.511
  289   1H2     G  26          1H2         G  26  18.019  14.515  12.868
  290   2H2     G  26          2H2         G  26  17.383  15.416  11.510
  291   1H2*    G  26          1H2*        G  26  23.211  10.100  11.163
  292   2H2*    G  26          2H2*        G  26  22.028   9.674  12.413
  293   1H5*    C  27          1H5*        C  27  20.753   5.814  15.021
  294   2H5*    C  27          2H5*        C  27  20.988   6.425  13.364
  295    H4*    C  27           H4*        C  27  19.075   7.598  15.446
  296    H3*    C  27           H3*        C  27  18.638   5.455  13.499
  297    H1*    C  27           H1*        C  27  17.464   9.334  13.128
  298   1H4     C  27          1H4         C  27  20.448   9.938   7.175
  299   2H4     C  27          2H4         C  27  19.022  10.952   7.147
  300    H5     C  27           H5         C  27  21.076   8.595   9.088
  301    H6     C  27           H6         C  27  20.357   7.772  11.283
  302   1H2*    C  27          1H2*        C  27  17.754   6.684  11.773
  303   2H2*    C  27          2H2*        C  27  16.488   7.260  12.889
  304   1H5*    T  28          1H5*        T  28  13.160   5.601  14.803
  305   2H5*    T  28          2H5*        T  28  13.377   4.944  13.164
  306    H4*    T  28           H4*        T  28  11.656   6.750  13.201
  307    H3*    T  28           H3*        T  28  13.929   6.763  11.425
  308   1H2*    T  28          1H2*        T  28  14.785   8.835  11.889
  309   2H2*    T  28          2H2*        T  28  13.290   9.476  11.156
  310    H1*    T  28           H1*        T  28  12.361   9.982  13.246
  311    H3     T  28           H3         T  28  15.892  12.990  13.867
  312   1H5M    T  28          1H5M        T  28  16.040   9.646  17.843
  313   2H5M    T  28          2H5M        T  28  17.595  10.287  17.264
  314   3H5M    T  28          3H5M        T  28  17.061   8.667  16.760
  315    H6     T  28           H6         T  28  14.750   8.599  15.504
  316   1H5*    T  29          1H5*        T  29  11.459   9.506   9.236
  317   2H5*    T  29          2H5*        T  29  10.074   8.536   8.678
  318    H4*    T  29           H4*        T  29  10.418  10.464   7.165
  319    H3*    T  29           H3*        T  29  10.347   7.763   6.243
  320   1H2*    T  29          1H2*        T  29  12.387   7.577   5.219
  321   2H2*    T  29          2H2*        T  29  11.761   8.737   4.029
  322    H1*    T  29           H1*        T  29  13.009  10.479   4.888
  323    H3     T  29           H3         T  29  17.315   9.113   4.432
  324   1H5M    T  29          1H5M        T  29  17.170   6.461   8.263
  325   2H5M    T  29          2H5M        T  29  15.458   5.981   8.283
  326   3H5M    T  29          3H5M        T  29  15.995   7.408   9.206
  327    H6     T  29           H6         T  29  13.802   7.969   7.522
  328   1H5*    C  30          1H5*        C  30   7.763  11.751   3.400
  329   2H5*    C  30          2H5*        C  30   8.278  11.111   4.972
  330    H4*    C  30           H4*        C  30   6.198  11.941   5.576
  331    H3*    C  30           H3*        C  30   6.099   9.118   5.054
  332    H1*    C  30           H1*        C  30   3.232  11.710   3.833
  333   1H4     C  30          1H4         C  30   4.197   9.796  -2.505
  334   2H4     C  30          2H4         C  30   2.464   9.873  -2.291
  335    H5     C  30           H5         C  30   5.758  10.145  -0.713
  336    H6     C  30           H6         C  30   6.020  10.720   1.655
  337   1H2*    C  30          1H2*        C  30   4.359   8.973   3.605
  338   2H2*    C  30          2H2*        C  30   3.335   9.665   4.872
  339   1H5*    T  31          1H5*        T  31   1.899   9.185   7.033
  340   2H5*    T  31          2H5*        T  31   2.314   8.271   8.500
  341    H4*    T  31           H4*        T  31   0.339   7.271   7.459
  342    H3*    T  31           H3*        T  31   2.777   5.758   7.852
  343   1H2*    T  31          1H2*        T  31   2.984   4.738   5.836
  344   2H2*    T  31          2H2*        T  31   1.397   3.994   6.123
  345    H1*    T  31           H1*        T  31   0.284   5.440   4.743
  346    H3     T  31           H3         T  31   1.520   5.780   0.456
  347   1H5M    T  31          1H5M        T  31   5.857   7.316   1.885
  348   2H5M    T  31          2H5M        T  31   6.080   5.563   2.052
  349   3H5M    T  31          3H5M        T  31   5.964   6.581   3.500
  350    H6     T  31           H6         T  31   3.943   6.253   4.585
  351   1H5*    G  32          1H5*        G  32  -1.277   3.561   7.650
  352   2H5*    G  32          2H5*        G  32  -1.443   2.410   9.008
  353    H4*    G  32           H4*        G  32  -2.571   1.532   7.023
  354    H3*    G  32           H3*        G  32  -0.343   0.107   8.183
  355    H1*    G  32           H1*        G  32  -1.240   0.368   4.310
  356    H8     G  32           H8         G  32   2.293   1.610   5.560
  357    H1     G  32           H1         G  32   1.534   1.512  -0.764
  358   1H2     G  32          1H2         G  32  -0.534   0.813  -1.284
  359   2H2     G  32          2H2         G  32  -1.718   0.401  -0.064
  360   1H2*    G  32          1H2*        G  32   0.909  -0.247   6.315
  361   2H2*    G  32          2H2*        G  32  -0.431  -1.262   5.727
  362   1H5*    C  33          1H5*        C  33  -3.757  -1.880   5.868
  363   2H5*    C  33          2H5*        C  33  -4.398  -3.335   6.664
  364    H4*    C  33           H4*        C  33  -4.664  -3.462   4.199
  365    H3*    C  33           H3*        C  33  -3.322  -5.499   5.746
  366    H1*    C  33           H1*        C  33  -2.411  -4.266   2.050
  367   1H4     C  33          1H4         C  33   3.854  -2.973   1.586
  368   2H4     C  33          2H4         C  33   4.021  -2.841   3.322
  369    H5     C  33           H5         C  33   2.188  -3.215   4.850
  370    H6     C  33           H6         C  33  -0.178  -3.714   5.065
  371   1H2*    C  33          1H2*        C  33  -1.393  -5.695   4.563
  372   2H2*    C  33          2H2*        C  33  -2.394  -6.305   3.220
  373   1H5*    A  34          1H5*        A  34  -5.061  -6.307   1.722
  374   2H5*    A  34          2H5*        A  34  -6.340  -7.544   1.755
  375    H4*    A  34           H4*        A  34  -5.297  -7.533  -0.462
  376    H3*    A  34           H3*        A  34  -5.313  -9.887   1.190
  377    H1*    A  34           H1*        A  34  -2.318  -8.753  -1.176
  378    H8     A  34           H8         A  34  -1.779  -9.047   2.672
  379   1H6     A  34          1H6         A  34   4.210  -8.257   1.472
  380   2H6     A  34          2H6         A  34   3.018  -8.481   2.732
  381    H2     A  34           H2         A  34   1.968  -8.122  -2.426
  382   1H2*    A  34          1H2*        A  34  -3.087 -10.373   1.222
  383   2H2*    A  34          2H2*        A  34  -3.245 -10.724  -0.500
  384   1H5*    C  35          1H5*        C  35  -4.140  -9.611  -2.964
  385   2H5*    C  35          2H5*        C  35  -5.243 -10.460  -4.071
  386    H4*    C  35           H4*        C  35  -3.171 -10.252  -5.252
  387    H3*    C  35           H3*        C  35  -4.062 -12.880  -4.490
  388    H1*    C  35           H1*        C  35  -0.286 -11.622  -4.612
  389   1H4     C  35          1H4         C  35   2.896 -12.336   0.892
  390   2H4     C  35          2H4         C  35   1.455 -12.816   1.759
  391    H5     C  35           H5         C  35  -0.722 -12.938   0.728
  392    H6     C  35           H6         C  35  -1.958 -12.785  -1.360
  393   1H2*    C  35          1H2*        C  35  -2.200 -13.673  -3.449
  394   2H2*    C  35          2H2*        C  35  -1.403 -13.592  -5.043
  395   1H5*    G  36          1H5*        G  36  -0.662 -12.547  -7.373
  396   2H5*    G  36          2H5*        G  36  -1.366 -12.908  -8.975
  397    H4*    G  36           H4*        G  36   0.979 -13.398  -9.119
  398    H3*    G  36           H3*        G  36  -0.861 -15.598  -9.260
  399    H1*    G  36           H1*        G  36   2.707 -15.648  -7.472
  400    H8     G  36           H8         G  36  -0.514 -16.108  -5.211
  401    H1     G  36           H1         G  36   5.055 -17.264  -2.325
  402   1H2     G  36          1H2         G  36   6.478 -16.342  -5.402
  403   2H2     G  36          2H2         G  36   6.751 -16.865  -3.755
  404   1H2*    G  36          1H2*        G  36   0.057 -17.008  -7.619
  405   2H2*    G  36          2H2*        G  36   1.473 -17.104  -8.702
  Start of MODEL    9
    1   1H5*    C   1          1H5*        C   1  16.110 -15.470  -0.033
    2   2H5*    C   1          2H5*        C   1  16.568 -13.800   0.378
    3    H4*    C   1           H4*        C   1  15.972 -13.866  -1.986
    4    H3*    C   1           H3*        C   1  14.537 -12.213  -0.132
    5    H1*    C   1           H1*        C   1  12.693 -14.350  -3.047
    6   1H4     C   1          1H4         C   1   8.114 -17.633   0.003
    7   2H4     C   1          2H4         C   1   8.967 -17.541   1.527
    8    H5     C   1           H5         C   1  11.091 -16.421   1.788
    9    H6     C   1           H6         C   1  12.835 -15.120   0.648
   10   1H2*    C   1          1H2*        C   1  12.371 -12.795  -0.550
   11   2H2*    C   1          2H2*        C   1  12.616 -12.208  -2.217
   12   1H5*    G   2          1H5*        G   2  13.740 -11.385  -4.426
   13   2H5*    G   2          2H5*        G   2  14.484  -9.821  -4.871
   14    H4*    G   2           H4*        G   2  12.487 -10.304  -6.254
   15    H3*    G   2           H3*        G   2  12.708  -7.936  -4.624
   16    H1*    G   2           H1*        G   2   9.412 -10.006  -5.344
   17    H8     G   2           H8         G   2  10.606  -9.595  -1.625
   18    H1     G   2           H1         G   2   5.012 -12.569  -2.232
   19   1H2     G   2          1H2         G   2   5.534 -12.245  -5.682
   20   2H2     G   2          2H2         G   2   4.493 -12.819  -4.398
   21   1H2*    G   2          1H2*        G   2  10.772  -8.093  -3.459
   22   2H2*    G   2          2H2*        G   2   9.948  -7.781  -5.004
   23   1H5*    T   3          1H5*        T   3   9.590  -8.154  -7.971
   24   2H5*    T   3          2H5*        T   3   9.924  -6.834  -9.115
   25    H4*    T   3           H4*        T   3   7.572  -7.222  -9.251
   26    H3*    T   3           H3*        T   3   8.456  -4.719  -8.119
   27   1H2*    T   3          1H2*        T   3   7.221  -4.692  -6.212
   28   2H2*    T   3          2H2*        T   3   5.784  -4.593  -7.248
   29    H1*    T   3           H1*        T   3   5.259  -6.819  -7.080
   30    H3     T   3           H3         T   3   4.141  -8.274  -2.951
   31   1H5M    T   3          1H5M        T   3   7.752  -6.126  -0.944
   32   2H5M    T   3          2H5M        T   3   8.022  -4.856  -2.160
   33   3H5M    T   3          3H5M        T   3   8.982  -6.350  -2.208
   34    H6     T   3           H6         T   3   7.938  -5.832  -4.608
   35   1H5*    G   4          1H5*        G   4   4.295  -5.200  -9.464
   36   2H5*    G   4          2H5*        G   4   3.723  -3.991 -10.649
   37    H4*    G   4           H4*        G   4   1.890  -4.670  -9.162
   38    H3*    G   4           H3*        G   4   2.756  -1.926  -9.297
   39    H1*    G   4           H1*        G   4   1.347  -3.872  -6.213
   40    H8     G   4           H8         G   4   4.930  -2.383  -5.692
   41    H1     G   4           H1         G   4   2.313  -4.913  -0.452
   42   1H2     G   4          1H2         G   4  -0.332  -5.795  -2.587
   43   2H2     G   4          2H2         G   4   0.319  -5.819  -0.964
   44   1H2*    G   4          1H2*        G   4   3.211  -1.626  -7.075
   45   2H2*    G   4          2H2*        G   4   1.458  -1.632  -6.888
   46   1H5*    C   5          1H5*        C   5  -2.014  -2.845  -7.922
   47   2H5*    C   5          2H5*        C   5  -2.772  -1.711  -9.063
   48    H4*    C   5           H4*        C   5  -4.184  -1.914  -7.075
   49    H3*    C   5           H3*        C   5  -3.049   0.651  -7.830
   50    H1*    C   5           H1*        C   5  -3.691  -0.719  -4.102
   51   1H4     C   5          1H4         C   5   2.543   0.919  -2.197
   52   2H4     C   5          2H4         C   5   1.555   0.904  -0.754
   53    H5     C   5           H5         C   5   1.680   0.438  -4.389
   54    H6     C   5           H6         C   5  -0.279  -0.274  -5.656
   55   1H2*    C   5          1H2*        C   5  -2.328   1.368  -5.824
   56   2H2*    C   5          2H2*        C   5  -4.026   1.312  -5.272
   57   1H5*    A   6          1H5*        A   6  -7.030   0.908  -5.431
   58   2H5*    A   6          2H5*        A   6  -8.131   2.057  -6.219
   59    H4*    A   6           H4*        A   6  -8.188   2.143  -3.703
   60    H3*    A   6           H3*        A   6  -7.938   4.477  -5.410
   61    H1*    A   6           H1*        A   6  -6.443   3.815  -1.823
   62    H8     A   6           H8         A   6  -3.858   4.687  -4.692
   63   1H6     A   6          1H6         A   6   0.045   5.257  -1.981
   64   2H6     A   6          2H6         A   6   0.367   5.070  -0.273
   65    H2     A   6           H2         A   6  -3.456   3.796   1.670
   66   1H2*    A   6          1H2*        A   6  -6.167   5.453  -4.376
   67   2H2*    A   6          2H2*        A   6  -7.266   5.715  -2.993
   68   1H5*    G   7          1H5*        G   7  -9.448   6.123  -0.998
   69   2H5*    G   7          2H5*        G   7 -10.812   7.114  -1.589
   70    H4*    G   7           H4*        G   7  -9.561   8.417   0.020
   71    H3*    G   7           H3*        G   7  -9.646   9.302  -2.719
   72    H1*    G   7           H1*        G   7  -6.719   9.701  -0.130
   73    H8     G   7           H8         G   7  -5.615   8.198  -3.559
   74    H1     G   7           H1         G   7  -1.029   8.258   0.850
   75   1H2     G   7          1H2         G   7  -1.857   8.873   2.838
   76   2H2     G   7          2H2         G   7  -3.549   9.251   3.068
   77   1H2*    G   7          1H2*        G   7  -7.397   9.449  -3.084
   78   2H2*    G   7          2H2*        G   7  -7.468  10.870  -2.025
   79   1H5*    C   8          1H5*        C   8  -9.278  12.060   1.043
   80   2H5*    C   8          2H5*        C   8 -10.400  13.425   0.847
   81    H4*    C   8           H4*        C   8  -8.553  13.954   2.431
   82    H3*    C   8           H3*        C   8  -9.183  15.597   0.126
   83    H1*    C   8           H1*        C   8  -5.489  14.851   1.529
   84   1H4     C   8          1H4         C   8  -3.323  12.993  -4.518
   85   2H4     C   8          2H4         C   8  -1.910  13.287  -3.530
   86    H5     C   8           H5         C   8  -5.580  13.199  -3.676
   87    H6     C   8           H6         C   8  -6.974  13.767  -1.769
   88   1H2*    C   8          1H2*        C   8  -7.108  16.027  -0.677
   89   2H2*    C   8          2H2*        C   8  -6.692  16.707   0.910
   90   1H5*    G   9          1H5*        G   9  -6.884  17.668   3.444
   91   2H5*    G   9          2H5*        G   9  -7.845  19.050   4.041
   92    H4*    G   9           H4*        G   9  -5.377  19.411   4.150
   93    H3*    G   9           H3*        G   9  -7.186  21.233   2.792
   94    H1*    G   9           H1*        G   9  -3.423  20.313   1.804
   95    H8     G   9           H8         G   9  -6.325  20.069  -0.856
   96    H1     G   9           H1         G   9  -0.534  18.486  -2.995
   97   1H2     G   9          1H2         G   9   0.950  18.554  -1.322
   98   2H2     G   9          2H2         G   9   0.499  18.987   0.312
   99   1H2*    G   9          1H2*        G   9  -5.994  21.636   0.915
  100   2H2*    G   9          2H2*        G   9  -4.699  22.285   1.951
  101   1H5*    G  10          1H5*        G  10  -3.203  23.344   4.692
  102   2H5*    G  10          2H5*        G  10  -3.971  24.641   5.653
  103    H4*    G  10           H4*        G  10  -1.831  25.411   4.725
  104    H3*    G  10           H3*        G  10  -4.305  26.728   4.074
  105    H1*    G  10           H1*        G  10  -1.210  26.208   1.631
  106    H8     G  10           H8         G  10  -4.673  24.584   0.700
  107    H1     G  10           H1         G  10  -0.232  24.078  -3.827
  108   1H2     G  10          1H2         G  10   1.714  24.906  -3.130
  109   2H2     G  10          2H2         G  10   1.917  25.599  -1.538
  110   1H2*    G  10          1H2*        G  10  -4.169  26.719   1.792
  111   2H2*    G  10          2H2*        G  10  -2.802  27.846   1.990
  112   1H5*    C  11          1H5*        C  11  -3.004  31.686   3.525
  113   2H5*    C  11          2H5*        C  11  -3.818  31.273   1.998
  114    H4*    C  11           H4*        C  11  -0.934  30.593   2.775
  115    H3*    C  11           H3*        C  11  -1.913  32.905   1.485
  116    H1*    C  11           H1*        C  11  -0.453  29.809  -0.503
  117   1H4     C  11          1H4         C  11  -4.506  27.716  -4.963
  118   2H4     C  11          2H4         C  11  -5.827  27.686  -3.817
  119    H5     C  11           H5         C  11  -5.605  28.482  -1.518
  120    H6     C  11           H6         C  11  -4.063  29.419   0.133
  121   1H2*    C  11          1H2*        C  11  -2.650  31.903  -0.480
  122   2H2*    C  11          2H2*        C  11  -0.931  32.071  -0.920
  123   1H5*    T  12          1H5*        T  12   2.950  34.380  -0.959
  124   2H5*    T  12          2H5*        T  12   1.529  34.819  -1.935
  125    H4*    T  12           H4*        T  12   3.275  33.847  -3.393
  126    H3*    T  12           H3*        T  12   0.629  32.836  -3.318
  127   1H2*    T  12          1H2*        T  12   0.967  30.717  -2.513
  128   2H2*    T  12          2H2*        T  12   1.670  30.396  -4.128
  129    H1*    T  12           H1*        T  12   3.841  30.417  -3.336
  130    H3     T  12           H3         T  12   3.319  26.777  -0.582
  131   1H5M    T  12          1H5M        T  12   1.590  30.893   2.302
  132   2H5M    T  12          2H5M        T  12   3.330  30.847   2.678
  133   3H5M    T  12          3H5M        T  12   2.293  29.461   3.090
  134    H6     T  12           H6         T  12   2.712  31.522  -0.012
  135   1H5*    T  13          1H5*        T  13   1.465  30.737  -6.680
  136   2H5*    T  13          2H5*        T  13   1.956  31.764  -8.045
  137    H4*    T  13           H4*        T  13   0.874  29.631  -8.813
  138    H3*    T  13           H3*        T  13   0.205  32.204  -9.795
  139   1H2*    T  13          1H2*        T  13  -1.902  32.432  -8.858
  140   2H2*    T  13          2H2*        T  13  -2.369  31.382 -10.223
  141    H1*    T  13           H1*        T  13  -2.527  29.477  -8.886
  142    H3     T  13           H3         T  13  -6.311  30.688  -6.674
  143   1H5M    T  13          1H5M        T  13  -2.543  32.102  -3.380
  144   2H5M    T  13          2H5M        T  13  -3.970  33.158  -3.490
  145   3H5M    T  13          3H5M        T  13  -2.481  33.584  -4.366
  146    H6     T  13           H6         T  13  -1.646  31.773  -6.101
  147   1H5*    G  14          1H5*        G  14   2.580  28.355 -13.326
  148   2H5*    G  14          2H5*        G  14   1.501  26.949 -13.180
  149    H4*    G  14           H4*        G  14   3.928  27.705 -11.665
  150    H3*    G  14           H3*        G  14   2.643  25.247 -12.423
  151    H1*    G  14           H1*        G  14   2.886  26.447  -8.546
  152    H8     G  14           H8         G  14  -0.329  25.835 -10.693
  153    H1     G  14           H1         G  14  -1.533  27.555  -4.683
  154   1H2     G  14          1H2         G  14   1.949  27.821  -4.377
  155   2H2     G  14          2H2         G  14   0.389  27.983  -3.604
  156   1H2*    G  14          1H2*        G  14   1.696  24.559 -10.477
  157   2H2*    G  14          2H2*        G  14   3.320  24.550  -9.760
  158   1H5*    C  15          1H5*        C  15   6.068  25.143  -9.504
  159   2H5*    C  15          2H5*        C  15   7.323  23.962  -9.944
  160    H4*    C  15           H4*        C  15   7.215  23.900  -7.565
  161    H3*    C  15           H3*        C  15   6.277  21.558  -8.980
  162    H1*    C  15           H1*        C  15   4.850  22.997  -5.602
  163   1H4     C  15          1H4         C  15  -1.663  23.347  -7.072
  164   2H4     C  15          2H4         C  15  -1.430  24.204  -5.565
  165    H5     C  15           H5         C  15   0.110  22.303  -8.239
  166    H6     C  15           H6         C  15   2.568  22.252  -8.573
  167   1H2*    C  15          1H2*        C  15   4.290  21.226  -7.937
  168   2H2*    C  15          2H2*        C  15   5.225  20.945  -6.451
  169   1H5*    C  16          1H5*        C  16   6.821  20.968  -4.455
  170   2H5*    C  16          2H5*        C  16   8.474  20.322  -4.541
  171    H4*    C  16           H4*        C  16   7.687  19.372  -2.555
  172    H3*    C  16           H3*        C  16   7.839  17.569  -4.787
  173    H1*    C  16           H1*        C  16   4.846  17.532  -2.111
  174   1H4     C  16          1H4         C  16   0.046  18.513  -6.675
  175   2H4     C  16          2H4         C  16  -0.729  18.210  -5.137
  176    H5     C  16           H5         C  16   2.449  18.541  -6.957
  177    H6     C  16           H6         C  16   4.622  18.391  -5.802
  178   1H2*    C  16          1H2*        C  16   5.777  16.598  -4.743
  179   2H2*    C  16          2H2*        C  16   6.150  16.019  -3.109
  180   1H5*    G  17          1H5*        G  17   6.888  16.986  -0.742
  181   2H5*    G  17          2H5*        G  17   8.384  16.492   0.094
  182    H4*    G  17           H4*        G  17   6.583  16.211   1.664
  183    H3*    G  17           H3*        G  17   8.037  13.959   0.840
  184    H1*    G  17           H1*        G  17   4.116  13.966   1.339
  185    H8     G  17           H8         G  17   5.149  13.856  -2.477
  186    H1     G  17           H1         G  17  -1.084  13.227  -1.360
  187   1H2     G  17          1H2         G  17  -0.232  13.651   2.009
  188   2H2     G  17          2H2         G  17  -1.502  13.415   0.829
  189   1H2*    G  17          1H2*        G  17   6.382  12.947  -0.451
  190   2H2*    G  17          2H2*        G  17   5.870  12.332   1.154
  191   1H5*    G  18          1H5*        G  18  10.169  11.667   2.242
  192   2H5*    G  18          2H5*        G  18   9.247  10.156   2.076
  193    H4*    G  18           H4*        G  18   9.001  10.262   4.651
  194    H3*    G  18           H3*        G  18  10.757  12.636   4.297
  195    H1*    G  18           H1*        G  18  11.530   9.088   5.936
  196    H8     G  18           H8         G  18  13.471  10.656   2.924
  197    H1     G  18           H1         G  18  16.752   6.375   6.312
  198   1H2     G  18          1H2         G  18  15.519   5.682   8.059
  199   2H2     G  18          2H2         G  18  13.904   6.283   8.355
  200   1H2*    G  18          1H2*        G  18  12.583  11.781   5.282
  201   2H2*    G  18          2H2*        G  18  11.606  11.269   6.683
  202   1H5*    C  19          1H5*        C  19   9.814  11.343   8.665
  203   2H5*    C  19          2H5*        C  19   8.797  12.703   9.195
  204    H4*    C  19           H4*        C  19   9.948  11.960  11.161
  205    H3*    C  19           H3*        C  19  10.539  14.563  10.110
  206    H1*    C  19           H1*        C  19  13.362  12.115  11.547
  207   1H4     C  19          1H4         C  19  16.842  12.029   5.830
  208   2H4     C  19          2H4         C  19  17.712  11.019   6.962
  209    H5     C  19           H5         C  19  14.816  13.169   6.392
  210    H6     C  19           H6         C  19  13.044  13.437   8.011
  211   1H2*    C  19          1H2*        C  19  12.823  14.531   9.996
  212   2H2*    C  19          2H2*        C  19  12.829  14.252  11.751
  213   1H5*    A  20          1H5*        A  20  11.562  13.602  14.440
  214   2H5*    A  20          2H5*        A  20  11.057  14.843  15.610
  215    H4*    A  20           H4*        A  20  13.205  13.913  16.321
  216    H3*    A  20           H3*        A  20  12.904  16.720  15.752
  217    H1*    A  20           H1*        A  20  16.104  14.488  14.991
  218    H8     A  20           H8         A  20  14.573  16.544  12.008
  219   1H6     A  20          1H6         A  20  18.596  13.608   8.424
  220   2H6     A  20          2H6         A  20  17.351  14.835   8.491
  221    H2     A  20           H2         A  20  18.995  11.921  12.565
  222   1H2*    A  20          1H2*        A  20  14.593  17.004  14.249
  223   2H2*    A  20          2H2*        A  20  15.694  16.682  15.619
  224   1H5*    C  21          1H5*        C  21  15.921  19.087  19.143
  225   2H5*    C  21          2H5*        C  21  16.235  19.905  17.597
  226    H4*    C  21           H4*        C  21  17.416  17.289  18.638
  227    H3*    C  21           H3*        C  21  18.524  19.859  18.512
  228    H1*    C  21           H1*        C  21  19.234  17.177  15.713
  229   1H4     C  21          1H4         C  21  17.327  18.480   9.804
  230   2H4     C  21          2H4         C  21  15.983  19.448  10.369
  231    H5     C  21           H5         C  21  15.545  19.853  12.722
  232    H6     C  21           H6         C  21  16.382  19.544  15.004
  233   1H2*    C  21          1H2*        C  21  18.582  20.097  16.183
  234   2H2*    C  21          2H2*        C  21  20.117  19.211  16.404
  235   1H5*    T  22          1H5*        T  22  23.876  17.755  18.828
  236   2H5*    T  22          2H5*        T  22  23.887  19.397  18.143
  237    H4*    T  22           H4*        T  22  25.355  17.977  16.783
  238    H3*    T  22           H3*        T  22  23.211  19.392  15.640
  239   1H2*    T  22          1H2*        T  22  21.822  17.662  15.000
  240   2H2*    T  22          2H2*        T  22  23.017  17.444  13.691
  241    H1*    T  22           H1*        T  22  23.982  15.583  14.681
  242    H3     T  22           H3         T  22  20.672  12.487  14.577
  243   1H5M    T  22          1H5M        T  22  18.307  14.909  17.992
  244   2H5M    T  22          2H5M        T  22  19.601  15.865  18.746
  245   3H5M    T  22          3H5M        T  22  19.507  14.114  19.037
  246    H6     T  22           H6         T  22  21.483  16.342  17.351
  247   1H5*    T  23          1H5*        T  23  24.160  17.507  11.586
  248   2H5*    T  23          2H5*        T  23  25.366  18.710  11.090
  249    H4*    T  23           H4*        T  23  23.831  18.014   9.225
  250    H3*    T  23           H3*        T  23  24.327  20.791  10.039
  251   1H2*    T  23          1H2*        T  23  22.274  21.681   9.723
  252   2H2*    T  23          2H2*        T  23  22.243  20.996   8.079
  253    H1*    T  23           H1*        T  23  20.801  19.345   8.716
  254    H3     T  23           H3         T  23  17.567  21.912  10.680
  255   1H5M    T  23          1H5M        T  23  20.761  20.852  14.712
  256   2H5M    T  23          2H5M        T  23  20.109  22.493  14.537
  257   3H5M    T  23          3H5M        T  23  21.724  22.103  13.887
  258    H6     T  23           H6         T  23  21.723  20.047  12.259
  259   1H5*    G  24          1H5*        G  24  27.654  17.779   6.354
  260   2H5*    G  24          2H5*        G  24  26.470  17.253   5.135
  261    H4*    G  24           H4*        G  24  27.185  16.121   7.797
  262    H3*    G  24           H3*        G  24  26.481  15.027   5.253
  263    H1*    G  24           H1*        G  24  24.276  14.685   8.553
  264    H8     G  24           H8         G  24  22.571  16.419   5.463
  265    H1     G  24           H1         G  24  19.121  16.443  10.817
  266   1H2     G  24          1H2         G  24  21.991  15.020  12.271
  267   2H2     G  24          2H2         G  24  20.354  15.587  12.511
  268   1H2*    G  24          1H2*        G  24  24.204  14.800   5.519
  269   2H2*    G  24          2H2*        G  24  24.657  13.485   6.612
  270   1H5*    T  25          1H5*        T  25  27.213  11.992   9.108
  271   2H5*    T  25          2H5*        T  25  27.929  10.534   8.390
  272    H4*    T  25           H4*        T  25  26.538  10.062  10.423
  273    H3*    T  25           H3*        T  25  26.219   8.662   7.899
  274   1H2*    T  25          1H2*        T  25  23.946   8.639   7.744
  275   2H2*    T  25          2H2*        T  25  23.918   7.775   9.299
  276    H1*    T  25           H1*        T  25  23.354   9.624  10.492
  277    H3     T  25           H3         T  25  19.558  11.752   9.452
  278   1H5M    T  25          1H5M        T  25  21.849  11.129   4.773
  279   2H5M    T  25          2H5M        T  25  22.568  12.686   5.242
  280   3H5M    T  25          3H5M        T  25  20.809  12.545   5.045
  281    H6     T  25           H6         T  25  23.526  10.790   6.905
  282   1H5*    G  26          1H5*        G  26  24.912   6.342  11.861
  283   2H5*    G  26          2H5*        G  26  25.551   4.678  11.729
  284    H4*    G  26           H4*        G  26  23.290   4.733  12.762
  285    H3*    G  26           H3*        G  26  23.864   3.196  10.387
  286    H1*    G  26           H1*        G  26  20.469   5.187  11.083
  287    H8     G  26           H8         G  26  22.586   5.838   7.870
  288    H1     G  26           H1         G  26  17.459   9.577   8.495
  289   1H2     G  26          1H2         G  26  17.102   8.043  11.627
  290   2H2     G  26          2H2         G  26  16.482   9.216  10.486
  291   1H2*    G  26          1H2*        G  26  22.165   3.858   9.030
  292   2H2*    G  26          2H2*        G  26  21.055   3.169  10.228
  293   1H5*    C  27          1H5*        C  27  20.529  -0.852  10.931
  294   2H5*    C  27          2H5*        C  27  20.119  -0.240   9.317
  295    H4*    C  27           H4*        C  27  18.990   0.556  12.021
  296    H3*    C  27           H3*        C  27  17.859  -0.746   9.724
  297    H1*    C  27           H1*        C  27  17.254   3.199  10.579
  298   1H4     C  27          1H4         C  27  20.192   5.343   4.961
  299   2H4     C  27          2H4         C  27  18.973   6.522   5.389
  300    H5     C  27           H5         C  27  20.601   3.349   6.258
  301    H6     C  27           H6         C  27  19.761   1.927   8.057
  302   1H2*    C  27          1H2*        C  27  17.200   1.072   8.470
  303   2H2*    C  27          2H2*        C  27  16.030   1.415   9.772
  304   1H5*    T  28          1H5*        T  28  12.656  -0.134  11.754
  305   2H5*    T  28          2H5*        T  28  12.610  -0.145   9.977
  306    H4*    T  28           H4*        T  28  11.269   1.741  10.943
  307    H3*    T  28           H3*        T  28  13.250   2.075   8.890
  308   1H2*    T  28          1H2*        T  28  14.638   3.592   9.899
  309   2H2*    T  28          2H2*        T  28  13.282   4.739   9.713
  310    H1*    T  28           H1*        T  28  12.718   4.596  11.981
  311    H3     T  28           H3         T  28  16.927   6.384  12.953
  312   1H5M    T  28          1H5M        T  28  18.327   2.245  14.593
  313   2H5M    T  28          2H5M        T  28  17.219   1.104  13.800
  314   3H5M    T  28          3H5M        T  28  16.780   1.828  15.367
  315    H6     T  28           H6         T  28  14.911   2.005  13.106
  316   1H5*    T  29          1H5*        T  29  11.028   5.715   8.011
  317   2H5*    T  29          2H5*        T  29   9.362   5.145   7.754
  318    H4*    T  29           H4*        T  29   9.682   7.272   6.547
  319    H3*    T  29           H3*        T  29   8.752   4.950   5.260
  320   1H2*    T  29          1H2*        T  29  10.567   4.459   3.914
  321   2H2*    T  29          2H2*        T  29   9.920   5.781   2.913
  322    H1*    T  29           H1*        T  29  11.534   7.292   3.618
  323    H3     T  29           H3         T  29  15.325   5.592   1.818
  324   1H5M    T  29          1H5M        T  29  15.932   2.510   5.260
  325   2H5M    T  29          2H5M        T  29  14.251   2.182   5.743
  326   3H5M    T  29          3H5M        T  29  15.192   3.442   6.581
  327    H6     T  29           H6         T  29  12.669   4.373   5.649
  328   1H5*    C  30          1H5*        C  30   6.576   9.893   4.253
  329   2H5*    C  30          2H5*        C  30   7.065   8.670   5.442
  330    H4*    C  30           H4*        C  30   5.153   9.671   6.418
  331    H3*    C  30           H3*        C  30   4.819   7.000   5.432
  332    H1*    C  30           H1*        C  30   2.018   9.896   5.100
  333   1H4     C  30          1H4         C  30   1.981   9.257  -1.568
  334   2H4     C  30          2H4         C  30   0.299   9.140  -1.097
  335    H5     C  30           H5         C  30   3.776   9.468   0.013
  336    H6     C  30           H6         C  30   4.379   9.527   2.385
  337   1H2*    C  30          1H2*        C  30   2.939   7.227   4.166
  338   2H2*    C  30          2H2*        C  30   2.096   7.670   5.651
  339   1H5*    T  31          1H5*        T  31   0.784   6.655   7.893
  340   2H5*    T  31          2H5*        T  31   1.562   5.813   9.254
  341    H4*    T  31           H4*        T  31  -0.435   4.565   8.638
  342    H3*    T  31           H3*        T  31   2.176   3.357   8.456
  343   1H2*    T  31          1H2*        T  31   2.134   2.438   6.382
  344   2H2*    T  31          2H2*        T  31   0.718   1.503   6.902
  345    H1*    T  31           H1*        T  31  -0.758   2.798   5.772
  346    H3     T  31           H3         T  31  -0.259   3.613   1.414
  347   1H5M    T  31          1H5M        T  31   4.042   5.589   2.264
  348   2H5M    T  31          2H5M        T  31   4.495   3.874   2.359
  349   3H5M    T  31          3H5M        T  31   4.460   4.857   3.831
  350    H6     T  31           H6         T  31   2.665   4.192   5.187
  351   1H5*    G  32          1H5*        G  32  -1.564   0.241   9.164
  352   2H5*    G  32          2H5*        G  32  -0.906  -1.040  10.220
  353    H4*    G  32           H4*        G  32  -2.461  -1.883   8.436
  354    H3*    G  32           H3*        G  32   0.210  -2.919   8.853
  355    H1*    G  32           H1*        G  32  -1.603  -2.438   5.308
  356    H8     G  32           H8         G  32   1.812  -0.676   6.167
  357    H1     G  32           H1         G  32  -0.107  -0.095   0.126
  358   1H2     G  32          1H2         G  32  -2.130  -1.012  -0.147
  359   2H2     G  32          2H2         G  32  -2.993  -1.768   1.173
  360   1H2*    G  32          1H2*        G  32   0.984  -2.934   6.718
  361   2H2*    G  32          2H2*        G  32  -0.334  -4.061   6.319
  362   1H5*    C  33          1H5*        C  33  -2.890  -5.278   6.591
  363   2H5*    C  33          2H5*        C  33  -3.164  -6.875   7.327
  364    H4*    C  33           H4*        C  33  -3.568  -7.009   4.917
  365    H3*    C  33           H3*        C  33  -1.582  -8.659   6.202
  366    H1*    C  33           H1*        C  33  -1.455  -7.112   2.539
  367   1H4     C  33          1H4         C  33   4.096  -4.234   1.230
  368   2H4     C  33          2H4         C  33   4.518  -4.115   2.924
  369    H5     C  33           H5         C  33   3.111  -4.972   4.694
  370    H6     C  33           H6         C  33   0.971  -5.986   5.248
  371   1H2*    C  33          1H2*        C  33   0.210  -8.217   4.868
  372   2H2*    C  33          2H2*        C  33  -0.689  -9.067   3.589
  373   1H5*    A  34          1H5*        A  34  -4.153 -10.297   2.359
  374   2H5*    A  34          2H5*        A  34  -4.626 -11.911   2.941
  375    H4*    A  34           H4*        A  34  -4.534 -11.985   0.510
  376    H3*    A  34           H3*        A  34  -2.812 -13.648   2.103
  377    H1*    A  34           H1*        A  34  -1.561 -11.780  -1.261
  378    H8     A  34           H8         A  34  -0.255 -11.244   2.359
  379   1H6     A  34          1H6         A  34   4.311  -8.004  -0.155
  380   2H6     A  34          2H6         A  34   3.621  -8.605   1.336
  381    H2     A  34           H2         A  34   1.583  -9.363  -3.474
  382   1H2*    A  34          1H2*        A  34  -0.785 -13.276   1.162
  383   2H2*    A  34          2H2*        A  34  -1.447 -13.849  -0.366
  384   1H5*    C  35          1H5*        C  35  -3.333 -14.425  -2.208
  385   2H5*    C  35          2H5*        C  35  -3.856 -16.073  -2.621
  386    H4*    C  35           H4*        C  35  -2.410 -15.189  -4.393
  387    H3*    C  35           H3*        C  35  -1.753 -17.614  -2.962
  388    H1*    C  35           H1*        C  35   0.817 -14.871  -4.363
  389   1H4     C  35          1H4         C  35   4.906 -13.100   0.255
  390   2H4     C  35          2H4         C  35   3.924 -13.839   1.499
  391    H5     C  35           H5         C  35   1.859 -14.985   1.044
  392    H6     C  35           H6         C  35   0.293 -15.699  -0.679
  393   1H2*    C  35          1H2*        C  35   0.437 -17.244  -2.492
  394   2H2*    C  35          2H2*        C  35   0.721 -17.196  -4.255
  395   1H5*    G  36          1H5*        G  36   0.414 -16.922  -6.861
  396   2H5*    G  36          2H5*        G  36  -0.266 -18.114  -8.006
  397    H4*    G  36           H4*        G  36   1.997 -17.637  -8.695
  398    H3*    G  36           H3*        G  36   1.360 -20.280  -7.751
  399    H1*    G  36           H1*        G  36   4.798 -18.335  -7.147
  400    H8     G  36           H8         G  36   2.485 -19.072  -4.025
  401    H1     G  36           H1         G  36   8.423 -17.318  -2.558
  402   1H2     G  36          1H2         G  36   8.830 -16.845  -6.010
  403   2H2     G  36          2H2         G  36   9.541 -16.737  -4.415
  404   1H2*    G  36          1H2*        G  36   3.076 -20.568  -6.182
  405   2H2*    G  36          2H2*        G  36   4.178 -20.477  -7.584
  Start of MODEL   10
    1   1H5*    C   1          1H5*        C   1   9.703 -20.263   1.669
    2   2H5*    C   1          2H5*        C   1  10.949 -19.152   2.288
    3    H4*    C   1           H4*        C   1  10.837 -18.926  -0.145
    4    H3*    C   1           H3*        C   1  10.361 -16.701   1.602
    5    H1*    C   1           H1*        C   1   8.101 -17.401  -1.699
    6   1H4     C   1          1H4         C   1   2.044 -17.556   0.323
    7   2H4     C   1          2H4         C   1   2.519 -17.820   1.987
    8    H5     C   1           H5         C   1   4.835 -17.991   2.692
    9    H6     C   1           H6         C   1   7.185 -17.867   1.937
   10   1H2*    C   1          1H2*        C   1   8.376 -15.878   0.816
   11   2H2*    C   1          2H2*        C   1   9.192 -15.624  -0.751
   12   1H5*    G   2          1H5*        G   2  11.106 -15.505  -2.625
   13   2H5*    G   2          2H5*        G   2  12.679 -14.663  -2.755
   14    H4*    G   2           H4*        G   2  11.094 -13.783  -4.413
   15    H3*    G   2           H3*        G   2  12.204 -12.084  -2.359
   16    H1*    G   2           H1*        G   2   8.529 -11.890  -3.872
   17    H8     G   2           H8         G   2   9.054 -12.106  -0.007
   18    H1     G   2           H1         G   2   2.948 -12.272  -1.827
   19   1H2     G   2          1H2         G   2   4.241 -12.133  -5.085
   20   2H2     G   2          2H2         G   2   2.819 -12.192  -4.066
   21   1H2*    G   2          1H2*        G   2  10.314 -11.106  -1.586
   22   2H2*    G   2          2H2*        G   2  10.133 -10.369  -3.194
   23   1H5*    T   3          1H5*        T   3  10.825 -10.356  -6.437
   24   2H5*    T   3          2H5*        T   3  11.944  -9.119  -7.055
   25    H4*    T   3           H4*        T   3   9.647  -8.551  -7.688
   26    H3*    T   3           H3*        T   3  11.264  -6.759  -6.092
   27   1H2*    T   3          1H2*        T   3   9.780  -6.236  -4.463
   28   2H2*    T   3          2H2*        T   3   8.761  -5.502  -5.714
   29    H1*    T   3           H1*        T   3   7.334  -7.309  -5.883
   30    H3     T   3           H3         T   3   4.925  -8.424  -2.254
   31   1H5M    T   3          1H5M        T   3   9.472  -6.841  -0.289
   32   2H5M    T   3          2H5M        T   3   9.904  -8.553  -0.481
   33   3H5M    T   3          3H5M        T   3   8.580  -8.090   0.614
   34    H6     T   3           H6         T   3   9.611  -7.541  -2.876
   35   1H5*    G   4          1H5*        G   4   7.905  -5.463  -8.571
   36   2H5*    G   4          2H5*        G   4   8.170  -4.144  -9.747
   37    H4*    G   4           H4*        G   4   5.823  -4.246  -8.865
   38    H3*    G   4           H3*        G   4   7.435  -1.864  -8.838
   39    H1*    G   4           H1*        G   4   4.804  -2.997  -6.169
   40    H8     G   4           H8         G   4   8.445  -2.599  -4.798
   41    H1     G   4           H1         G   4   4.020  -3.578  -0.327
   42   1H2     G   4          1H2         G   4   1.776  -3.743  -3.015
   43   2H2     G   4          2H2         G   4   2.005  -3.807  -1.282
   44   1H2*    G   4          1H2*        G   4   7.411  -1.494  -6.574
   45   2H2*    G   4          2H2*        G   4   5.749  -0.976  -6.851
   46   1H5*    C   5          1H5*        C   5   2.948  -2.005  -7.973
   47   2H5*    C   5          2H5*        C   5   2.212  -1.225  -9.394
   48    H4*    C   5           H4*        C   5   0.558  -1.175  -7.639
   49    H3*    C   5           H3*        C   5   1.639   1.295  -8.658
   50    H1*    C   5           H1*        C   5   0.665   0.609  -4.807
   51   1H4     C   5          1H4         C   5   6.690   2.144  -2.348
   52   2H4     C   5          2H4         C   5   5.536   2.289  -1.041
   53    H5     C   5           H5         C   5   6.067   1.524  -4.598
   54    H6     C   5           H6         C   5   4.212   0.917  -6.073
   55   1H2*    C   5          1H2*        C   5   2.200   2.346  -6.725
   56   2H2*    C   5          2H2*        C   5   0.463   2.347  -6.339
   57   1H5*    A   6          1H5*        A   6  -1.930   1.131  -6.124
   58   2H5*    A   6          2H5*        A   6  -3.388   1.571  -7.042
   59    H4*    A   6           H4*        A   6  -3.821   1.924  -4.679
   60    H3*    A   6           H3*        A   6  -3.971   4.130  -6.534
   61    H1*    A   6           H1*        A   6  -2.808   4.226  -2.754
   62    H8     A   6           H8         A   6  -0.225   5.473  -5.464
   63   1H6     A   6          1H6         A   6   3.278   6.873  -2.488
   64   2H6     A   6          2H6         A   6   3.459   6.850  -0.748
   65    H2     A   6           H2         A   6  -0.265   5.026   0.951
   66   1H2*    A   6          1H2*        A   6  -2.650   5.631  -5.416
   67   2H2*    A   6          2H2*        A   6  -3.939   5.654  -4.187
   68   1H5*    G   7          1H5*        G   7  -5.963   4.652  -2.259
   69   2H5*    G   7          2H5*        G   7  -7.650   5.145  -2.582
   70    H4*    G   7           H4*        G   7  -6.862   6.298  -0.584
   71    H3*    G   7           H3*        G   7  -7.613   7.812  -2.903
   72    H1*    G   7           H1*        G   7  -4.793   8.661  -0.333
   73    H8     G   7           H8         G   7  -3.460   8.226  -4.014
   74    H1     G   7           H1         G   7   0.884  10.178   0.204
   75   1H2     G   7          1H2         G   7   0.013  10.222   2.265
   76   2H2     G   7          2H2         G   7  -1.646   9.769   2.586
   77   1H2*    G   7          1H2*        G   7  -5.599   8.853  -3.263
   78   2H2*    G   7          2H2*        G   7  -6.095   9.865  -1.888
   79   1H5*    C   8          1H5*        C   8  -7.638   9.908   1.528
   80   2H5*    C   8          2H5*        C   8  -9.032  11.011   1.538
   81    H4*    C   8           H4*        C   8  -7.117  11.806   2.949
   82    H3*    C   8           H3*        C   8  -8.420  13.451   0.930
   83    H1*    C   8           H1*        C   8  -4.549  13.494   1.948
   84   1H4     C   8          1H4         C   8  -2.331  12.910  -4.331
   85   2H4     C   8          2H4         C   8  -0.946  13.249  -3.317
   86    H5     C   8           H5         C   8  -4.574  12.737  -3.471
   87    H6     C   8           H6         C   8  -5.981  12.757  -1.498
   88   1H2*    C   8          1H2*        C   8  -6.619  14.504   0.050
   89   2H2*    C   8          2H2*        C   8  -6.198  15.059   1.680
   90   1H5*    G   9          1H5*        G   9  -6.444  15.349   4.318
   91   2H5*    G   9          2H5*        G   9  -7.277  16.650   5.214
   92    H4*    G   9           H4*        G   9  -4.762  16.904   4.892
   93    H3*    G   9           H3*        G   9  -6.697  19.013   4.364
   94    H1*    G   9           H1*        G   9  -3.305  18.159   2.446
   95    H8     G   9           H8         G   9  -6.640  18.593   0.350
   96    H1     G   9           H1         G   9  -1.318  17.401  -2.971
   97   1H2     G   9          1H2         G   9   0.417  17.180  -1.565
   98   2H2     G   9          2H2         G   9   0.229  17.306   0.173
   99   1H2*    G   9          1H2*        G   9  -5.918  19.718   2.360
  100   2H2*    G   9          2H2*        G   9  -4.397  20.151   3.182
  101   1H5*    G  10          1H5*        G  10  -2.283  20.730   5.463
  102   2H5*    G  10          2H5*        G  10  -2.649  22.019   6.645
  103    H4*    G  10           H4*        G  10  -0.842  22.665   5.068
  104    H3*    G  10           H3*        G  10  -3.244  24.238   5.378
  105    H1*    G  10           H1*        G  10  -1.151  23.669   2.046
  106    H8     G  10           H8         G  10  -4.895  22.481   2.125
  107    H1     G  10           H1         G  10  -2.080  22.237  -3.591
  108   1H2     G  10          1H2         G  10   0.057  22.909  -3.418
  109   2H2     G  10          2H2         G  10   0.756  23.404  -1.893
  110   1H2*    G  10          1H2*        G  10  -3.834  24.460   3.180
  111   2H2*    G  10          2H2*        G  10  -2.347  25.428   3.000
  112   1H5*    C  11          1H5*        C  11  -1.968  29.115   4.838
  113   2H5*    C  11          2H5*        C  11  -3.259  28.765   3.665
  114    H4*    C  11           H4*        C  11  -0.311  27.961   3.439
  115    H3*    C  11           H3*        C  11  -1.600  30.324   2.530
  116    H1*    C  11           H1*        C  11  -0.801  27.209   0.253
  117   1H4     C  11          1H4         C  11  -5.938  25.137  -2.971
  118   2H4     C  11          2H4         C  11  -6.943  25.262  -1.544
  119    H5     C  11           H5         C  11  -6.112  26.079   0.593
  120    H6     C  11           H6         C  11  -4.197  27.072   1.749
  121   1H2*    C  11          1H2*        C  11  -2.857  29.373   0.818
  122   2H2*    C  11          2H2*        C  11  -1.307  29.484  -0.061
  123   1H5*    T  12          1H5*        T  12   2.413  31.846  -1.109
  124   2H5*    T  12          2H5*        T  12   0.781  32.434  -1.510
  125    H4*    T  12           H4*        T  12   1.850  31.554  -3.549
  126    H3*    T  12           H3*        T  12  -0.656  30.602  -2.640
  127   1H2*    T  12          1H2*        T  12  -0.176  28.409  -2.166
  128   2H2*    T  12          2H2*        T  12  -0.095  28.223  -3.946
  129    H1*    T  12           H1*        T  12   2.212  28.126  -3.966
  130    H3     T  12           H3         T  12   2.617  24.264  -1.541
  131   1H5M    T  12          1H5M        T  12   2.017  27.907   2.202
  132   2H5M    T  12          2H5M        T  12   3.740  28.169   1.834
  133   3H5M    T  12          3H5M        T  12   3.191  26.594   2.453
  134    H6     T  12           H6         T  12   2.317  28.929  -0.359
  135   1H5*    T  13          1H5*        T  13  -1.241  28.903  -6.218
  136   2H5*    T  13          2H5*        T  13  -1.079  30.022  -7.593
  137    H4*    T  13           H4*        T  13  -2.605  28.158  -8.181
  138    H3*    T  13           H3*        T  13  -3.321  30.893  -8.473
  139   1H2*    T  13          1H2*        T  13  -4.986  31.033  -6.876
  140   2H2*    T  13          2H2*        T  13  -5.956  30.198  -8.117
  141    H1*    T  13           H1*        T  13  -5.804  28.136  -7.046
  142    H3     T  13           H3         T  13  -8.458  29.124  -3.492
  143   1H5M    T  13          1H5M        T  13  -3.659  29.943  -1.633
  144   2H5M    T  13          2H5M        T  13  -4.961  31.012  -1.063
  145   3H5M    T  13          3H5M        T  13  -3.868  31.558  -2.355
  146    H6     T  13           H6         T  13  -3.815  29.975  -4.496
  147   1H5*    G  14          1H5*        G  14  -2.448  27.646 -13.125
  148   2H5*    G  14          2H5*        G  14  -3.465  26.225 -12.791
  149    H4*    G  14           H4*        G  14  -0.686  26.917 -11.930
  150    H3*    G  14           H3*        G  14  -2.021  24.542 -12.817
  151    H1*    G  14           H1*        G  14  -0.837  25.025  -8.955
  152    H8     G  14           H8         G  14  -4.526  24.428 -10.103
  153    H1     G  14           H1         G  14  -3.745  25.439  -3.856
  154   1H2     G  14          1H2         G  14  -0.385  25.987  -4.706
  155   2H2     G  14          2H2         G  14  -1.589  25.925  -3.438
  156   1H2*    G  14          1H2*        G  14  -2.512  23.496 -10.855
  157   2H2*    G  14          2H2*        G  14  -0.766  23.400 -10.567
  158   1H5*    C  15          1H5*        C  15   1.972  24.752 -10.875
  159   2H5*    C  15          2H5*        C  15   3.280  23.783 -11.589
  160    H4*    C  15           H4*        C  15   3.685  23.966  -9.216
  161    H3*    C  15           H3*        C  15   3.200  21.351 -10.373
  162    H1*    C  15           H1*        C  15   2.225  22.617  -6.748
  163   1H4     C  15          1H4         C  15  -4.236  21.045  -6.555
  164   2H4     C  15          2H4         C  15  -3.742  21.574  -4.963
  165    H5     C  15           H5         C  15  -2.747  20.946  -8.416
  166    H6     C  15           H6         C  15  -0.448  21.408  -9.225
  167   1H2*    C  15          1H2*        C  15   1.724  20.537  -8.852
  168   2H2*    C  15          2H2*        C  15   3.029  20.675  -7.648
  169   1H5*    C  16          1H5*        C  16   4.898  21.502  -6.148
  170   2H5*    C  16          2H5*        C  16   6.613  21.218  -6.515
  171    H4*    C  16           H4*        C  16   6.406  20.404  -4.318
  172    H3*    C  16           H3*        C  16   6.734  18.440  -6.373
  173    H1*    C  16           H1*        C  16   4.324  17.956  -3.217
  174   1H4     C  16          1H4         C  16  -1.424  17.457  -6.635
  175   2H4     C  16          2H4         C  16  -1.793  17.183  -4.948
  176    H5     C  16           H5         C  16   0.803  17.824  -7.457
  177    H6     C  16           H6         C  16   3.161  18.185  -6.822
  178   1H2*    C  16          1H2*        C  16   4.961  17.058  -5.960
  179   2H2*    C  16          2H2*        C  16   5.731  16.689  -4.408
  180   1H5*    G  17          1H5*        G  17   6.901  18.371  -2.082
  181   2H5*    G  17          2H5*        G  17   8.598  18.256  -1.529
  182    H4*    G  17           H4*        G  17   7.180  17.919   0.407
  183    H3*    G  17           H3*        G  17   8.873  15.835  -0.439
  184    H1*    G  17           H1*        G  17   5.136  15.267   0.800
  185    H8     G  17           H8         G  17   5.677  14.709  -3.088
  186    H1     G  17           H1         G  17  -0.138  13.192  -1.000
  187   1H2     G  17          1H2         G  17   1.004  14.215   2.146
  188   2H2     G  17          2H2         G  17  -0.325  13.597   1.189
  189   1H2*    G  17          1H2*        G  17   7.279  14.351  -1.179
  190   2H2*    G  17          2H2*        G  17   7.142  13.962   0.564
  191   1H5*    G  18          1H5*        G  18  11.541  13.699   0.902
  192   2H5*    G  18          2H5*        G  18  10.650  12.178   1.128
  193    H4*    G  18           H4*        G  18  10.680  12.959   3.675
  194    H3*    G  18           H3*        G  18  12.753  14.769   2.490
  195    H1*    G  18           H1*        G  18  13.040  11.658   4.954
  196    H8     G  18           H8         G  18  14.959  12.005   1.558
  197    H1     G  18           H1         G  18  17.594   7.990   5.753
  198   1H2     G  18          1H2         G  18  16.423   8.025   7.672
  199   2H2     G  18          2H2         G  18  15.009   9.032   7.881
  200   1H2*    G  18          1H2*        G  18  14.516  13.839   3.568
  201   2H2*    G  18          2H2*        G  18  13.619  13.877   5.109
  202   1H5*    C  19          1H5*        C  19  11.964  14.609   6.979
  203   2H5*    C  19          2H5*        C  19  11.452  16.251   7.434
  204    H4*    C  19           H4*        C  19  12.511  15.273   9.369
  205    H3*    C  19           H3*        C  19  13.696  17.586   8.123
  206    H1*    C  19           H1*        C  19  15.762  14.545   9.676
  207   1H4     C  19          1H4         C  19  19.144  13.271   4.049
  208   2H4     C  19          2H4         C  19  19.825  12.251   5.296
  209    H5     C  19           H5         C  19  17.278  14.741   4.434
  210    H6     C  19           H6         C  19  15.694  15.602   6.041
  211   1H2*    C  19          1H2*        C  19  15.882  16.946   7.970
  212   2H2*    C  19          2H2*        C  19  15.879  16.777   9.741
  213   1H5*    A  20          1H5*        A  20  14.551  16.517  12.424
  214   2H5*    A  20          2H5*        A  20  14.357  17.857  13.579
  215    H4*    A  20           H4*        A  20  16.181  16.405  14.331
  216    H3*    A  20           H3*        A  20  16.612  19.197  13.774
  217    H1*    A  20           H1*        A  20  19.150  16.231  13.138
  218    H8     A  20           H8         A  20  18.200  18.462  10.025
  219   1H6     A  20          1H6         A  20  21.907  14.814   6.781
  220   2H6     A  20          2H6         A  20  20.864  16.219   6.739
  221    H2     A  20           H2         A  20  21.781  13.218  10.975
  222   1H2*    A  20          1H2*        A  20  18.324  19.021  12.284
  223   2H2*    A  20          2H2*        A  20  19.299  18.489  13.683
  224   1H5*    C  21          1H5*        C  21  19.915  21.047  17.094
  225   2H5*    C  21          2H5*        C  21  20.361  21.696  15.501
  226    H4*    C  21           H4*        C  21  21.146  19.012  16.735
  227    H3*    C  21           H3*        C  21  22.591  21.413  16.555
  228    H1*    C  21           H1*        C  21  23.060  18.503  13.944
  229   1H4     C  21          1H4         C  21  21.750  19.803   7.863
  230   2H4     C  21          2H4         C  21  20.485  20.929   8.302
  231    H5     C  21           H5         C  21  19.917  21.447  10.607
  232    H6     C  21           H6         C  21  20.571  21.143  12.952
  233   1H2*    C  21          1H2*        C  21  22.793  21.511  14.225
  234   2H2*    C  21          2H2*        C  21  24.185  20.448  14.573
  235   1H5*    T  22          1H5*        T  22  27.573  18.592  17.304
  236   2H5*    T  22          2H5*        T  22  27.857  20.195  16.587
  237    H4*    T  22           H4*        T  22  29.199  18.559  15.352
  238    H3*    T  22           H3*        T  22  27.356  20.206  14.039
  239   1H2*    T  22          1H2*        T  22  25.731  18.658  13.458
  240   2H2*    T  22          2H2*        T  22  26.890  18.243  12.168
  241    H1*    T  22           H1*        T  22  27.616  16.308  13.226
  242    H3     T  22           H3         T  22  23.991  13.595  13.096
  243   1H5M    T  22          1H5M        T  22  22.728  15.588  17.366
  244   2H5M    T  22          2H5M        T  22  21.739  16.506  16.207
  245   3H5M    T  22          3H5M        T  22  23.102  17.293  17.031
  246    H6     T  22           H6         T  22  25.095  17.478  15.726
  247   1H5*    T  23          1H5*        T  23  27.960  17.566  10.096
  248   2H5*    T  23          2H5*        T  23  29.480  18.423   9.778
  249    H4*    T  23           H4*        T  23  28.130  17.969   7.703
  250    H3*    T  23           H3*        T  23  29.155  20.599   8.501
  251   1H2*    T  23          1H2*        T  23  27.455  21.928   7.832
  252   2H2*    T  23          2H2*        T  23  27.497  21.158   6.225
  253    H1*    T  23           H1*        T  23  25.606  19.956   6.683
  254    H3     T  23           H3         T  23  22.893  23.360   8.091
  255   1H5M    T  23          1H5M        T  23  26.432  22.619  11.923
  256   2H5M    T  23          2H5M        T  23  25.034  21.730  12.585
  257   3H5M    T  23          3H5M        T  23  24.910  23.476  12.287
  258    H6     T  23           H6         T  23  26.163  20.593  10.315
  259   1H5*    G  24          1H5*        G  24  32.073  16.584   5.616
  260   2H5*    G  24          2H5*        G  24  31.058  16.250   4.196
  261    H4*    G  24           H4*        G  24  31.057  15.048   6.887
  262    H3*    G  24           H3*        G  24  30.351  14.164   4.267
  263    H1*    G  24           H1*        G  24  27.803  14.441   7.317
  264    H8     G  24           H8         G  24  26.934  16.523   4.100
  265    H1     G  24           H1         G  24  23.086  17.567   9.070
  266   1H2     G  24          1H2         G  24  25.334  15.524  10.831
  267   2H2     G  24          2H2         G  24  23.883  16.498  10.887
  268   1H2*    G  24          1H2*        G  24  28.080  14.556   4.297
  269   2H2*    G  24          2H2*        G  24  28.051  13.172   5.400
  270   1H5*    T  25          1H5*        T  25  29.815  11.273   8.161
  271   2H5*    T  25          2H5*        T  25  30.265   9.645   7.609
  272    H4*    T  25           H4*        T  25  28.591   9.588   9.449
  273    H3*    T  25           H3*        T  25  28.213   8.216   6.922
  274   1H2*    T  25          1H2*        T  25  26.045   8.775   6.492
  275   2H2*    T  25          2H2*        T  25  25.619   7.965   8.018
  276    H1*    T  25           H1*        T  25  25.419   9.898   9.182
  277    H3     T  25           H3         T  25  22.287  12.786   7.808
  278   1H5M    T  25          1H5M        T  25  24.107  13.264   3.550
  279   2H5M    T  25          2H5M        T  25  24.739  11.615   3.340
  280   3H5M    T  25          3H5M        T  25  25.819  12.919   3.884
  281    H6     T  25           H6         T  25  26.147  10.925   5.616
  282   1H5*    G  26          1H5*        G  26  26.075   6.651  10.865
  283   2H5*    G  26          2H5*        G  26  26.336   4.883  10.932
  284    H4*    G  26           H4*        G  26  24.152   5.453  11.887
  285    H3*    G  26           H3*        G  26  24.339   3.756   9.559
  286    H1*    G  26           H1*        G  26  21.480   6.483  10.156
  287    H8     G  26           H8         G  26  23.749   6.465   6.981
  288    H1     G  26           H1         G  26  19.535  11.239   7.174
  289   1H2     G  26          1H2         G  26  18.776  10.037  10.374
  290   2H2     G  26          2H2         G  26  18.449  11.226   9.136
  291   1H2*    G  26          1H2*        G  26  22.806   4.713   8.192
  292   2H2*    G  26          2H2*        G  26  21.605   4.369   9.442
  293   1H5*    C  27          1H5*        C  27  19.391   0.743  11.681
  294   2H5*    C  27          2H5*        C  27  19.873   1.443  10.120
  295    H4*    C  27           H4*        C  27  18.916   3.101  12.493
  296    H3*    C  27           H3*        C  27  17.262   1.587  10.596
  297    H1*    C  27           H1*        C  27  18.004   5.587  10.551
  298   1H4     C  27          1H4         C  27  20.168   5.411   4.229
  299   2H4     C  27          2H4         C  27  19.325   6.930   4.434
  300    H5     C  27           H5         C  27  20.350   3.756   5.992
  301    H6     C  27           H6         C  27  19.540   3.090   8.198
  302   1H2*    C  27          1H2*        C  27  16.776   3.271   9.114
  303   2H2*    C  27          2H2*        C  27  16.135   4.239  10.469
  304   1H5*    T  28          1H5*        T  28  12.978   3.982  13.577
  305   2H5*    T  28          2H5*        T  28  12.304   3.652  11.964
  306    H4*    T  28           H4*        T  28  11.748   5.959  12.668
  307    H3*    T  28           H3*        T  28  13.107   5.387  10.204
  308   1H2*    T  28          1H2*        T  28  15.004   6.646  10.516
  309   2H2*    T  28          2H2*        T  28  13.914   8.045  10.288
  310    H1*    T  28           H1*        T  28  13.840   8.496  12.600
  311    H3     T  28           H3         T  28  18.326   9.684  12.329
  312   1H5M    T  28          1H5M        T  28  18.235   5.804  15.665
  313   2H5M    T  28          2H5M        T  28  19.546   5.712  14.468
  314   3H5M    T  28          3H5M        T  28  18.109   4.684  14.290
  315    H6     T  28           H6         T  28  15.883   5.797  13.807
  316   1H5*    T  29          1H5*        T  29  12.687   9.834   8.018
  317   2H5*    T  29          2H5*        T  29  11.086   9.613   8.750
  318    H4*    T  29           H4*        T  29  10.936  10.647   6.462
  319    H3*    T  29           H3*        T  29   9.388   8.452   7.320
  320   1H2*    T  29          1H2*        T  29  10.246   6.776   6.010
  321   2H2*    T  29          2H2*        T  29   9.276   7.526   4.724
  322    H1*    T  29           H1*        T  29  11.134   8.516   3.724
  323    H3     T  29           H3         T  29  13.441   4.903   2.228
  324   1H5M    T  29          1H5M        T  29  14.023   4.577   7.471
  325   2H5M    T  29          2H5M        T  29  15.346   5.699   7.067
  326   3H5M    T  29          3H5M        T  29  15.343   4.050   6.401
  327    H6     T  29           H6         T  29  12.875   6.884   6.580
  328   1H5*    C  30          1H5*        C  30   7.537  13.355   5.397
  329   2H5*    C  30          2H5*        C  30   8.139  11.989   6.350
  330    H4*    C  30           H4*        C  30   5.714  12.501   6.777
  331    H3*    C  30           H3*        C  30   6.756   9.880   6.140
  332    H1*    C  30           H1*        C  30   3.231  11.369   4.995
  333   1H4     C  30          1H4         C  30   4.230  10.070  -1.497
  334   2H4     C  30          2H4         C  30   2.537   9.762  -1.179
  335    H5     C  30           H5         C  30   5.791  10.683   0.200
  336    H6     C  30           H6         C  30   6.078  11.307   2.563
  337   1H2*    C  30          1H2*        C  30   5.306   9.264   4.519
  338   2H2*    C  30          2H2*        C  30   4.034   9.340   5.756
  339   1H5*    T  31          1H5*        T  31   2.681   8.953   8.340
  340   2H5*    T  31          2H5*        T  31   3.220   7.888   9.660
  341    H4*    T  31           H4*        T  31   1.245   6.935   8.539
  342    H3*    T  31           H3*        T  31   3.760   5.498   8.722
  343   1H2*    T  31          1H2*        T  31   3.929   4.672   6.620
  344   2H2*    T  31          2H2*        T  31   2.371   3.856   6.870
  345    H1*    T  31           H1*        T  31   1.175   5.414   5.669
  346    H3     T  31           H3         T  31   2.309   6.126   1.408
  347   1H5M    T  31          1H5M        T  31   6.896   5.815   3.051
  348   2H5M    T  31          2H5M        T  31   6.769   6.960   4.397
  349   3H5M    T  31          3H5M        T  31   6.668   7.543   2.719
  350    H6     T  31           H6         T  31   4.803   6.351   5.512
  351   1H5*    G  32          1H5*        G  32   0.023   3.295   8.045
  352   2H5*    G  32          2H5*        G  32  -0.339   2.073   9.297
  353    H4*    G  32           H4*        G  32  -1.247   1.331   7.172
  354    H3*    G  32           H3*        G  32   0.849  -0.205   8.427
  355    H1*    G  32           H1*        G  32   0.233   0.310   4.555
  356    H8     G  32           H8         G  32   3.736   1.461   5.974
  357    H1     G  32           H1         G  32   3.191   1.625  -0.368
  358   1H2     G  32          1H2         G  32   1.150   0.929  -0.983
  359   2H2     G  32          2H2         G  32  -0.067   0.464   0.182
  360   1H2*    G  32          1H2*        G  32   2.286  -0.376   6.653
  361   2H2*    G  32          2H2*        G  32   1.032  -1.389   5.896
  362   1H5*    C  33          1H5*        C  33  -2.345  -1.653   5.631
  363   2H5*    C  33          2H5*        C  33  -3.250  -3.066   6.222
  364    H4*    C  33           H4*        C  33  -3.403  -2.948   3.774
  365    H3*    C  33           H3*        C  33  -2.307  -5.251   5.120
  366    H1*    C  33           H1*        C  33  -1.130  -3.722   1.611
  367   1H4     C  33          1H4         C  33   5.243  -3.034   1.566
  368   2H4     C  33          2H4         C  33   5.313  -3.006   3.314
  369    H5     C  33           H5         C  33   3.357  -3.269   4.711
  370    H6     C  33           H6         C  33   0.950  -3.577   4.756
  371   1H2*    C  33          1H2*        C  33  -0.355  -5.498   3.984
  372   2H2*    C  33          2H2*        C  33  -1.350  -5.862   2.554
  373   1H5*    A  34          1H5*        A  34  -4.209  -5.545   0.891
  374   2H5*    A  34          2H5*        A  34  -5.581  -6.663   1.082
  375    H4*    A  34           H4*        A  34  -4.895  -6.746  -1.242
  376    H3*    A  34           H3*        A  34  -4.703  -9.087   0.418
  377    H1*    A  34           H1*        A  34  -1.872  -8.054  -2.276
  378    H8     A  34           H8         A  34  -1.439  -8.395   1.570
  379   1H6     A  34          1H6         A  34   4.600  -7.885   0.548
  380   2H6     A  34          2H6         A  34   3.360  -8.090   1.765
  381    H2     A  34           H2         A  34   2.483  -7.572  -3.411
  382   1H2*    A  34          1H2*        A  34  -2.595  -9.804  -0.004
  383   2H2*    A  34          2H2*        A  34  -3.037  -9.914  -1.707
  384   1H5*    C  35          1H5*        C  35  -5.089  -9.638  -4.144
  385   2H5*    C  35          2H5*        C  35  -6.133 -10.987  -4.647
  386    H4*    C  35           H4*        C  35  -4.077 -10.752  -6.073
  387    H3*    C  35           H3*        C  35  -4.916 -13.218  -4.802
  388    H1*    C  35           H1*        C  35  -1.116 -11.962  -5.280
  389   1H4     C  35          1H4         C  35   1.882 -12.127   0.363
  390   2H4     C  35          2H4         C  35   0.392 -12.412   1.236
  391    H5     C  35           H5         C  35  -1.748 -12.639   0.149
  392    H6     C  35           H6         C  35  -2.929 -12.652  -1.980
  393   1H2*    C  35          1H2*        C  35  -2.965 -13.959  -3.931
  394   2H2*    C  35          2H2*        C  35  -2.296 -13.945  -5.584
  395   1H5*    G  36          1H5*        G  36  -2.249 -13.723  -8.509
  396   2H5*    G  36          2H5*        G  36  -3.137 -14.700  -9.717
  397    H4*    G  36           H4*        G  36  -0.706 -15.148  -9.791
  398    H3*    G  36           H3*        G  36  -2.631 -17.233  -9.312
  399    H1*    G  36           H1*        G  36   0.982 -16.941  -7.570
  400    H8     G  36           H8         G  36  -2.297 -16.492  -5.432
  401    H1     G  36           H1         G  36   2.971 -17.798  -2.086
  402   1H2     G  36          1H2         G  36   4.567 -17.829  -5.208
  403   2H2     G  36          2H2         G  36   4.725 -17.997  -3.473
  404   1H2*    G  36          1H2*        G  36  -1.688 -18.249  -7.422
  405   2H2*    G  36          2H2*        G  36  -0.287 -18.610  -8.470
  Start of MODEL   11
    1   1H5*    C   1          1H5*        C   1  16.263 -17.379   0.835
    2   2H5*    C   1          2H5*        C   1  16.910 -15.743   1.104
    3    H4*    C   1           H4*        C   1  16.141 -15.922  -1.217
    4    H3*    C   1           H3*        C   1  15.054 -13.975   0.596
    5    H1*    C   1           H1*        C   1  12.804 -16.054  -2.052
    6   1H4     C   1          1H4         C   1   7.930 -18.331   1.438
    7   2H4     C   1          2H4         C   1   8.890 -18.322   2.901
    8    H5     C   1           H5         C   1  11.192 -17.603   2.967
    9    H6     C   1           H6         C   1  13.044 -16.649   1.661
   10   1H2*    C   1          1H2*        C   1  12.815 -14.304   0.346
   11   2H2*    C   1          2H2*        C   1  13.018 -13.858  -1.370
   12   1H5*    G   2          1H5*        G   2  14.110 -13.299  -3.695
   13   2H5*    G   2          2H5*        G   2  14.979 -11.855  -4.290
   14    H4*    G   2           H4*        G   2  12.839 -12.235  -5.499
   15    H3*    G   2           H3*        G   2  13.442  -9.763  -4.142
   16    H1*    G   2           H1*        G   2   9.907 -11.496  -4.483
   17    H8     G   2           H8         G   2  11.377 -11.022  -0.869
   18    H1     G   2           H1         G   2   5.284 -12.879  -0.985
   19   1H2     G   2          1H2         G   2   5.650 -12.851  -4.475
   20   2H2     G   2          2H2         G   2   4.596 -13.138  -3.108
   21   1H2*    G   2          1H2*        G   2  11.582  -9.600  -2.837
   22   2H2*    G   2          2H2*        G   2  10.692  -9.316  -4.357
   23   1H5*    T   3          1H5*        T   3   9.901 -10.080  -6.865
   24   2H5*    T   3          2H5*        T   3  10.273  -9.113  -8.310
   25    H4*    T   3           H4*        T   3   7.926  -9.088  -8.251
   26    H3*    T   3           H3*        T   3   9.185  -6.603  -7.507
   27   1H2*    T   3          1H2*        T   3   8.118  -6.216  -5.529
   28   2H2*    T   3          2H2*        T   3   6.639  -6.002  -6.484
   29    H1*    T   3           H1*        T   3   5.827  -8.115  -6.075
   30    H3     T   3           H3         T   3   4.696  -8.910  -1.782
   31   1H5M    T   3          1H5M        T   3   9.129  -6.155  -1.468
   32   2H5M    T   3          2H5M        T   3   9.827  -7.791  -1.445
   33   3H5M    T   3          3H5M        T   3   8.737  -7.270  -0.139
   34    H6     T   3           H6         T   3   8.737  -7.285  -3.814
   35   1H5*    G   4          1H5*        G   4   4.910  -6.860  -8.749
   36   2H5*    G   4          2H5*        G   4   4.610  -5.954 -10.261
   37    H4*    G   4           H4*        G   4   2.534  -6.097  -8.982
   38    H3*    G   4           H3*        G   4   3.734  -3.536  -9.512
   39    H1*    G   4           H1*        G   4   1.766  -4.611  -6.273
   40    H8     G   4           H8         G   4   5.441  -3.363  -5.775
   41    H1     G   4           H1         G   4   2.359  -4.639  -0.347
   42   1H2     G   4          1H2         G   4  -0.259  -5.698  -2.427
   43   2H2     G   4          2H2         G   4   0.319  -5.459  -0.792
   44   1H2*    G   4          1H2*        G   4   3.905  -2.771  -7.371
   45   2H2*    G   4          2H2*        G   4   2.149  -2.643  -7.429
   46   1H5*    C   5          1H5*        C   5  -1.146  -3.700  -8.653
   47   2H5*    C   5          2H5*        C   5  -1.705  -2.795 -10.077
   48    H4*    C   5           H4*        C   5  -3.307  -2.467  -8.282
   49    H3*    C   5           H3*        C   5  -1.848  -0.195  -9.349
   50    H1*    C   5           H1*        C   5  -3.014  -0.743  -5.535
   51   1H4     C   5          1H4         C   5   3.125   0.622  -3.182
   52   2H4     C   5          2H4         C   5   1.995   0.888  -1.873
   53    H5     C   5           H5         C   5   2.449  -0.114  -5.379
   54    H6     C   5           H6         C   5   0.550  -0.761  -6.785
   55   1H2*    C   5          1H2*        C   5  -1.331   0.887  -7.437
   56   2H2*    C   5          2H2*        C   5  -3.080   1.004  -7.107
   57   1H5*    A   6          1H5*        A   6  -6.072   0.536  -7.678
   58   2H5*    A   6          2H5*        A   6  -7.048   1.567  -8.746
   59    H4*    A   6           H4*        A   6  -7.461   1.959  -6.292
   60    H3*    A   6           H3*        A   6  -6.946   4.068  -8.216
   61    H1*    A   6           H1*        A   6  -5.914   3.889  -4.405
   62    H8     A   6           H8         A   6  -3.064   4.405  -7.091
   63   1H6     A   6          1H6         A   6   0.535   5.426  -4.098
   64   2H6     A   6          2H6         A   6   0.681   5.476  -2.355
   65    H2     A   6           H2         A   6  -3.330   4.404  -0.664
   66   1H2*    A   6          1H2*        A   6  -5.345   5.207  -7.075
   67   2H2*    A   6          2H2*        A   6  -6.608   5.582  -5.876
   68   1H5*    G   7          1H5*        G   7  -8.680   5.441  -4.104
   69   2H5*    G   7          2H5*        G   7 -10.206   6.275  -4.512
   70    H4*    G   7           H4*        G   7  -9.268   7.439  -2.643
   71    H3*    G   7           H3*        G   7  -9.339   8.850  -5.150
   72    H1*    G   7           H1*        G   7  -6.712   9.135  -2.282
   73    H8     G   7           H8         G   7  -5.124   7.846  -5.648
   74    H1     G   7           H1         G   7  -0.962   9.801  -1.233
   75   1H2     G   7          1H2         G   7  -2.056  10.396   0.640
   76   2H2     G   7          2H2         G   7  -3.796  10.292   0.776
   77   1H2*    G   7          1H2*        G   7  -7.082   9.294  -5.300
   78   2H2*    G   7          2H2*        G   7  -7.437  10.509  -4.056
   79   1H5*    C   8          1H5*        C   8  -9.302  11.068  -0.870
   80   2H5*    C   8          2H5*        C   8 -10.442  12.424  -0.982
   81    H4*    C   8           H4*        C   8  -8.594  12.798   0.676
   82    H3*    C   8           H3*        C   8  -9.319  14.704  -1.395
   83    H1*    C   8           H1*        C   8  -5.657  13.965   0.032
   84   1H4     C   8          1H4         C   8  -2.920  13.135  -5.998
   85   2H4     C   8          2H4         C   8  -1.620  13.470  -4.876
   86    H5     C   8           H5         C   8  -5.236  13.002  -5.322
   87    H6     C   8           H6         C   8  -6.808  13.237  -3.485
   88   1H2*    C   8          1H2*        C   8  -7.252  15.322  -2.104
   89   2H2*    C   8          2H2*        C   8  -6.902  15.838  -0.439
   90   1H5*    G   9          1H5*        G   9  -7.163  16.074   2.158
   91   2H5*    G   9          2H5*        G   9  -7.989  17.329   3.122
   92    H4*    G   9           H4*        G   9  -5.459  17.424   3.150
   93    H3*    G   9           H3*        G   9  -7.173  19.694   2.616
   94    H1*    G   9           H1*        G   9  -3.609  18.889   1.055
   95    H8     G   9           H8         G   9  -6.622  19.487  -1.421
   96    H1     G   9           H1         G   9  -0.932  18.644  -4.167
   97   1H2     G   9          1H2         G   9   0.632  18.348  -2.581
   98   2H2     G   9          2H2         G   9   0.241  18.331  -0.875
   99   1H2*    G   9          1H2*        G   9  -6.177  20.467   0.722
  100   2H2*    G   9          2H2*        G   9  -4.759  20.825   1.738
  101   1H5*    G  10          1H5*        G  10  -2.766  20.362   4.235
  102   2H5*    G  10          2H5*        G  10  -3.013  21.263   5.757
  103    H4*    G  10           H4*        G  10  -0.829  21.835   4.810
  104    H3*    G  10           H3*        G  10  -2.837  23.838   5.191
  105    H1*    G  10           H1*        G  10  -0.380  23.699   2.039
  106    H8     G  10           H8         G  10  -4.259  23.373   1.574
  107    H1     G  10           H1         G  10  -0.954  23.599  -3.867
  108   1H2     G  10          1H2         G  10   1.232  23.807  -3.440
  109   2H2     G  10          2H2         G  10   1.862  23.859  -1.809
  110   1H2*    G  10          1H2*        G  10  -2.978  24.720   3.087
  111   2H2*    G  10          2H2*        G  10  -1.320  25.310   3.358
  112   1H5*    C  11          1H5*        C  11  -0.348  28.222   6.045
  113   2H5*    C  11          2H5*        C  11  -1.474  28.525   4.702
  114    H4*    C  11           H4*        C  11   1.206  27.048   4.585
  115    H3*    C  11           H3*        C  11   0.629  29.766   4.083
  116    H1*    C  11           H1*        C  11   0.981  27.086   1.258
  117   1H4     C  11          1H4         C  11  -4.094  26.616  -2.661
  118   2H4     C  11          2H4         C  11  -5.209  26.872  -1.338
  119    H5     C  11           H5         C  11  -4.494  27.232   0.939
  120    H6     C  11           H6         C  11  -2.569  27.616   2.401
  121   1H2*    C  11          1H2*        C  11  -0.667  29.467   2.158
  122   2H2*    C  11          2H2*        C  11   0.951  29.419   1.394
  123   1H5*    T  12          1H5*        T  12   5.188  30.882   0.964
  124   2H5*    T  12          2H5*        T  12   3.768  31.920   0.697
  125    H4*    T  12           H4*        T  12   4.706  31.278  -1.482
  126    H3*    T  12           H3*        T  12   2.003  30.715  -0.792
  127   1H2*    T  12          1H2*        T  12   1.975  28.428  -0.937
  128   2H2*    T  12          2H2*        T  12   2.114  28.704  -2.703
  129    H1*    T  12           H1*        T  12   4.359  28.147  -2.755
  130    H3     T  12           H3         T  12   3.918  23.751  -1.612
  131   1H5M    T  12          1H5M        T  12   3.570  26.181   3.046
  132   2H5M    T  12          2H5M        T  12   5.341  26.174   2.852
  133   3H5M    T  12          3H5M        T  12   4.448  24.638   2.931
  134    H6     T  12           H6         T  12   4.281  27.826   0.945
  135   1H5*    T  13          1H5*        T  13   1.448  30.138  -4.780
  136   2H5*    T  13          2H5*        T  13   1.539  31.581  -5.815
  137    H4*    T  13           H4*        T  13  -0.102  29.867  -6.669
  138    H3*    T  13           H3*        T  13  -0.639  32.656  -6.437
  139   1H2*    T  13          1H2*        T  13  -2.280  32.607  -4.818
  140   2H2*    T  13          2H2*        T  13  -3.306  32.027  -6.157
  141    H1*    T  13           H1*        T  13  -3.238  29.816  -5.431
  142    H3     T  13           H3         T  13  -5.737  30.206  -1.669
  143   1H5M    T  13          1H5M        T  13  -2.167  31.707   0.909
  144   2H5M    T  13          2H5M        T  13  -1.293  32.661  -0.311
  145   3H5M    T  13          3H5M        T  13  -0.803  30.983   0.029
  146    H6     T  13           H6         T  13  -1.137  31.248  -2.688
  147   1H5*    G  14          1H5*        G  14  -0.168  30.541 -11.718
  148   2H5*    G  14          2H5*        G  14  -1.288  29.159 -11.740
  149    H4*    G  14           H4*        G  14   1.598  29.290 -11.153
  150    H3*    G  14           H3*        G  14  -0.193  27.290 -12.153
  151    H1*    G  14           H1*        G  14   1.374  26.909  -8.380
  152    H8     G  14           H8         G  14  -2.292  27.374  -9.639
  153    H1     G  14           H1         G  14  -1.736  26.691  -3.329
  154   1H2     G  14          1H2         G  14   1.714  26.610  -3.964
  155   2H2     G  14          2H2         G  14   0.437  26.540  -2.770
  156   1H2*    G  14          1H2*        G  14  -0.505  25.905 -10.378
  157   2H2*    G  14          2H2*        G  14   1.249  25.672 -10.308
  158   1H5*    C  15          1H5*        C  15   3.962  26.583 -10.854
  159   2H5*    C  15          2H5*        C  15   4.984  25.345 -11.616
  160    H4*    C  15           H4*        C  15   5.300  25.439  -9.157
  161    H3*    C  15           H3*        C  15   4.657  22.986 -10.557
  162    H1*    C  15           H1*        C  15   3.619  24.075  -6.921
  163   1H4     C  15          1H4         C  15  -2.986  23.227  -6.930
  164   2H4     C  15          2H4         C  15  -2.482  23.621  -5.302
  165    H5     C  15           H5         C  15  -1.491  22.958  -8.700
  166    H6     C  15           H6         C  15   0.862  23.322  -9.513
  167   1H2*    C  15          1H2*        C  15   2.949  22.257  -9.223
  168   2H2*    C  15          2H2*        C  15   4.170  22.101  -7.937
  169   1H5*    C  16          1H5*        C  16   6.069  22.838  -6.303
  170   2H5*    C  16          2H5*        C  16   7.714  22.164  -6.335
  171    H4*    C  16           H4*        C  16   6.778  21.603  -4.186
  172    H3*    C  16           H3*        C  16   7.486  19.516  -6.014
  173    H1*    C  16           H1*        C  16   4.346  19.426  -3.594
  174   1H4     C  16          1H4         C  16  -0.659  19.069  -8.013
  175   2H4     C  16          2H4         C  16  -1.322  18.810  -6.415
  176    H5     C  16           H5         C  16   1.705  19.402  -8.423
  177    H6     C  16           H6         C  16   3.924  19.626  -7.370
  178   1H2*    C  16          1H2*        C  16   5.493  18.374  -6.128
  179   2H2*    C  16          2H2*        C  16   5.799  17.931  -4.435
  180   1H5*    G  17          1H5*        G  17   6.204  19.262  -1.878
  181   2H5*    G  17          2H5*        G  17   7.658  19.038  -0.868
  182    H4*    G  17           H4*        G  17   5.737  18.569   0.528
  183    H3*    G  17           H3*        G  17   7.580  16.494  -0.028
  184    H1*    G  17           H1*        G  17   3.676  16.040   0.185
  185    H8     G  17           H8         G  17   4.998  15.818  -3.529
  186    H1     G  17           H1         G  17  -0.961  13.750  -2.645
  187   1H2     G  17          1H2         G  17  -0.411  14.549   0.726
  188   2H2     G  17          2H2         G  17  -1.521  13.932  -0.478
  189   1H2*    G  17          1H2*        G  17   6.194  15.169  -1.330
  190   2H2*    G  17          2H2*        G  17   5.624  14.620   0.279
  191   1H5*    G  18          1H5*        G  18   8.994  12.766   1.607
  192   2H5*    G  18          2H5*        G  18   7.330  12.633   2.198
  193    H4*    G  18           H4*        G  18   8.020  13.152   4.410
  194    H3*    G  18           H3*        G  18  10.081  14.856   3.167
  195    H1*    G  18           H1*        G  18  10.683  11.673   5.549
  196    H8     G  18           H8         G  18  11.985  12.229   1.882
  197    H1     G  18           H1         G  18  15.046   7.751   5.215
  198   1H2     G  18          1H2         G  18  14.138   7.582   7.269
  199   2H2     G  18          2H2         G  18  12.795   8.583   7.777
  200   1H2*    G  18          1H2*        G  18  11.924  13.857   4.014
  201   2H2*    G  18          2H2*        G  18  11.211  13.896   5.647
  202   1H5*    C  19          1H5*        C  19   9.870  14.370   7.856
  203   2H5*    C  19          2H5*        C  19   9.428  16.022   8.344
  204    H4*    C  19           H4*        C  19  10.775  15.132  10.134
  205    H3*    C  19           H3*        C  19  11.745  17.352   8.593
  206    H1*    C  19           H1*        C  19  14.071  14.386   9.869
  207   1H4     C  19          1H4         C  19  16.322  12.733   3.780
  208   2H4     C  19          2H4         C  19  16.986  11.561   4.896
  209    H5     C  19           H5         C  19  14.791  14.461   4.460
  210    H6     C  19           H6         C  19  13.572  15.459   6.282
  211   1H2*    C  19          1H2*        C  19  13.833  16.661   8.036
  212   2H2*    C  19          2H2*        C  19  14.200  16.602   9.772
  213   1H5*    A  20          1H5*        A  20  14.380  17.271  12.730
  214   2H5*    A  20          2H5*        A  20  14.112  18.947  13.262
  215    H4*    A  20           H4*        A  20  16.486  18.412  13.522
  216    H3*    A  20           H3*        A  20  15.613  20.580  11.842
  217    H1*    A  20           H1*        A  20  18.676  18.141  11.091
  218    H8     A  20           H8         A  20  15.954  18.598   8.316
  219   1H6     A  20          1H6         A  20  18.685  14.024   5.322
  220   2H6     A  20          2H6         A  20  17.419  15.230   5.284
  221    H2     A  20           H2         A  20  20.755  14.459   9.298
  222   1H2*    A  20          1H2*        A  20  16.621  20.011   9.895
  223   2H2*    A  20          2H2*        A  20  18.161  20.381  10.724
  224   1H5*    C  21          1H5*        C  21  18.667  24.491  12.116
  225   2H5*    C  21          2H5*        C  21  18.229  24.250  10.410
  226    H4*    C  21           H4*        C  21  20.490  22.925  11.985
  227    H3*    C  21           H3*        C  21  20.556  25.097  10.198
  228    H1*    C  21           H1*        C  21  21.429  21.424   9.073
  229   1H4     C  21          1H4         C  21  17.769  18.950   4.461
  230   2H4     C  21          2H4         C  21  16.378  19.881   4.969
  231    H5     C  21           H5         C  21  16.440  21.446   6.830
  232    H6     C  21           H6         C  21  17.871  22.510   8.508
  233   1H2*    C  21          1H2*        C  21  19.964  23.949   8.248
  234   2H2*    C  21          2H2*        C  21  21.711  23.582   8.237
  235   1H5*    T  22          1H5*        T  22  25.948  24.413   8.870
  236   2H5*    T  22          2H5*        T  22  25.128  24.778   7.334
  237    H4*    T  22           H4*        T  22  26.692  22.859   7.071
  238    H3*    T  22           H3*        T  22  23.881  22.700   6.403
  239   1H2*    T  22          1H2*        T  22  23.379  20.919   7.710
  240   2H2*    T  22          2H2*        T  22  24.253  19.964   6.486
  241    H1*    T  22           H1*        T  22  26.257  19.915   7.730
  242    H3     T  22           H3         T  22  26.479  18.457  12.181
  243   1H5M    T  22          1H5M        T  22  22.068  17.023  11.856
  244   2H5M    T  22          2H5M        T  22  21.973  16.823  10.090
  245   3H5M    T  22          3H5M        T  22  21.358  18.311  10.855
  246    H6     T  22           H6         T  22  23.021  19.069   8.889
  247   1H5*    T  23          1H5*        T  23  23.581  18.699   4.508
  248   2H5*    T  23          2H5*        T  23  25.000  19.206   3.573
  249    H4*    T  23           H4*        T  23  23.445  17.725   2.274
  250    H3*    T  23           H3*        T  23  24.340  20.372   1.379
  251   1H2*    T  23          1H2*        T  23  22.461  21.141   0.377
  252   2H2*    T  23          2H2*        T  23  22.347  19.624  -0.553
  253    H1*    T  23           H1*        T  23  20.614  18.893   0.766
  254    H3     T  23           H3         T  23  17.889  22.605   0.824
  255   1H5M    T  23          1H5M        T  23  22.037  23.763   3.898
  256   2H5M    T  23          2H5M        T  23  20.843  23.229   5.113
  257   3H5M    T  23          3H5M        T  23  20.511  24.662   4.112
  258    H6     T  23           H6         T  23  21.735  21.252   3.380
  259   1H5*    G  24          1H5*        G  24  26.418  15.164   0.505
  260   2H5*    G  24          2H5*        G  24  24.696  14.725   0.365
  261    H4*    G  24           H4*        G  24  26.659  14.381   2.692
  262    H3*    G  24           H3*        G  24  25.656  12.553   0.890
  263    H1*    G  24           H1*        G  24  23.526  13.124   4.290
  264    H8     G  24           H8         G  24  21.476  13.578   1.203
  265    H1     G  24           H1         G  24  19.940  17.976   5.546
  266   1H2     G  24          1H2         G  24  22.958  17.064   7.085
  267   2H2     G  24          2H2         G  24  21.541  18.089   7.120
  268   1H2*    G  24          1H2*        G  24  23.386  12.560   1.355
  269   2H2*    G  24          2H2*        G  24  23.880  11.514   2.709
  270   1H5*    T  25          1H5*        T  25  26.750  10.727   5.366
  271   2H5*    T  25          2H5*        T  25  27.322   9.063   5.102
  272    H4*    T  25           H4*        T  25  26.021   9.135   7.183
  273    H3*    T  25           H3*        T  25  25.275   7.432   4.995
  274   1H2*    T  25          1H2*        T  25  23.130   8.050   4.683
  275   2H2*    T  25          2H2*        T  25  22.796   7.374   6.284
  276    H1*    T  25           H1*        T  25  22.740   9.383   7.332
  277    H3     T  25           H3         T  25  20.602  13.293   6.181
  278   1H5M    T  25          1H5M        T  25  20.818  10.602   1.647
  279   2H5M    T  25          2H5M        T  25  19.341  11.498   2.077
  280   3H5M    T  25          3H5M        T  25  19.476   9.771   2.465
  281    H6     T  25           H6         T  25  21.779   9.291   3.785
  282   1H5*    G  26          1H5*        G  26  23.614   5.830   9.522
  283   2H5*    G  26          2H5*        G  26  23.898   4.078   9.318
  284    H4*    G  26           H4*        G  26  21.824   4.526  10.590
  285    H3*    G  26           H3*        G  26  21.812   3.011   8.131
  286    H1*    G  26           H1*        G  26  18.946   5.599   9.210
  287    H8     G  26           H8         G  26  20.880   5.753   5.853
  288    H1     G  26           H1         G  26  16.749  10.524   6.721
  289   1H2     G  26          1H2         G  26  16.434   9.250   9.968
  290   2H2     G  26          2H2         G  26  15.955  10.480   8.818
  291   1H2*    G  26          1H2*        G  26  20.068   3.951   7.031
  292   2H2*    G  26          2H2*        G  26  19.044   3.508   8.408
  293   1H5*    C  27          1H5*        C  27  17.138  -0.296   9.720
  294   2H5*    C  27          2H5*        C  27  17.673   0.711   8.352
  295    H4*    C  27           H4*        C  27  16.295   1.816  10.839
  296    H3*    C  27           H3*        C  27  15.050   0.545   8.485
  297    H1*    C  27           H1*        C  27  15.340   4.518   9.290
  298   1H4     C  27          1H4         C  27  17.798   5.685   3.179
  299   2H4     C  27          2H4         C  27  16.950   7.126   3.687
  300    H5     C  27           H5         C  27  17.977   3.706   4.560
  301    H6     C  27           H6         C  27  17.152   2.592   6.580
  302   1H2*    C  27          1H2*        C  27  14.468   2.439   7.331
  303   2H2*    C  27          2H2*        C  27  13.637   3.052   8.786
  304   1H5*    T  28          1H5*        T  28  10.086   1.939  10.889
  305   2H5*    T  28          2H5*        T  28   9.843   1.829   9.132
  306    H4*    T  28           H4*        T  28   8.887   3.941  10.067
  307    H3*    T  28           H3*        T  28  10.703   3.862   7.841
  308   1H2*    T  28          1H2*        T  28  12.348   5.256   8.608
  309   2H2*    T  28          2H2*        T  28  11.133   6.552   8.451
  310    H1*    T  28           H1*        T  28  10.756   6.624  10.760
  311    H3     T  28           H3         T  28  15.248   7.912  11.183
  312   1H5M    T  28          1H5M        T  28  16.189   3.824  13.245
  313   2H5M    T  28          2H5M        T  28  14.843   2.782  12.735
  314   3H5M    T  28          3H5M        T  28  14.683   3.793  14.190
  315    H6     T  28           H6         T  28  12.681   3.906  11.982
  316   1H5*    T  29          1H5*        T  29   9.248   7.783   7.145
  317   2H5*    T  29          2H5*        T  29   7.522   7.622   6.753
  318    H4*    T  29           H4*        T  29   8.473   9.692   5.739
  319    H3*    T  29           H3*        T  29   6.968   7.796   4.290
  320   1H2*    T  29          1H2*        T  29   8.621   6.930   2.922
  321   2H2*    T  29          2H2*        T  29   8.373   8.436   2.010
  322    H1*    T  29           H1*        T  29  10.300   9.426   2.840
  323    H3     T  29           H3         T  29  13.414   6.853   0.763
  324   1H5M    T  29          1H5M        T  29  12.635   4.544   5.464
  325   2H5M    T  29          2H5M        T  29  13.340   3.621   4.119
  326   3H5M    T  29          3H5M        T  29  11.585   3.563   4.412
  327    H6     T  29           H6         T  29  10.642   6.201   4.647
  328   1H5*    C  30          1H5*        C  30   5.500  13.084   4.032
  329   2H5*    C  30          2H5*        C  30   5.885  11.557   4.851
  330    H4*    C  30           H4*        C  30   3.646  12.541   5.528
  331    H3*    C  30           H3*        C  30   4.115   9.814   4.773
  332    H1*    C  30           H1*        C  30   0.888  11.926   3.572
  333   1H4     C  30          1H4         C  30   2.416  10.867  -2.868
  334   2H4     C  30          2H4         C  30   0.707  10.529  -2.714
  335    H5     C  30           H5         C  30   3.806  11.510  -0.992
  336    H6     C  30           H6         C  30   3.883  11.816   1.439
  337   1H2*    C  30          1H2*        C  30   2.618   9.543   3.103
  338   2H2*    C  30          2H2*        C  30   1.356   9.797   4.315
  339   1H5*    T  31          1H5*        T  31  -0.289   9.005   6.167
  340   2H5*    T  31          2H5*        T  31   0.174   8.323   7.741
  341    H4*    T  31           H4*        T  31  -1.455   6.828   6.861
  342    H3*    T  31           H3*        T  31   1.279   5.873   7.028
  343   1H2*    T  31          1H2*        T  31   1.486   4.843   5.023
  344   2H2*    T  31          2H2*        T  31   0.117   3.803   5.482
  345    H1*    T  31           H1*        T  31  -1.407   4.978   4.210
  346    H3     T  31           H3         T  31  -0.684   5.262  -0.171
  347   1H5M    T  31          1H5M        T  31   3.262   7.979   1.058
  348   2H5M    T  31          2H5M        T  31   3.841   6.375   0.571
  349   3H5M    T  31          3H5M        T  31   3.878   6.845   2.282
  350    H6     T  31           H6         T  31   1.993   6.475   3.635
  351   1H5*    G  32          1H5*        G  32  -2.120   2.798   7.189
  352   2H5*    G  32          2H5*        G  32  -1.957   1.863   8.704
  353    H4*    G  32           H4*        G  32  -2.894   0.372   7.093
  354    H3*    G  32           H3*        G  32  -0.153  -0.113   7.873
  355    H1*    G  32           H1*        G  32  -1.676  -0.639   4.205
  356    H8     G  32           H8         G  32   1.496   1.606   4.851
  357    H1     G  32           H1         G  32  -0.229   1.082  -1.257
  358   1H2     G  32          1H2         G  32  -2.125  -0.099  -1.433
  359   2H2     G  32          2H2         G  32  -2.963  -0.732  -0.035
  360   1H2*    G  32          1H2*        G  32   0.809  -0.434   5.847
  361   2H2*    G  32          2H2*        G  32  -0.292  -1.811   5.611
  362   1H5*    C  33          1H5*        C  33  -3.060  -3.320   6.604
  363   2H5*    C  33          2H5*        C  33  -3.118  -4.733   7.685
  364    H4*    C  33           H4*        C  33  -3.734  -5.371   5.380
  365    H3*    C  33           H3*        C  33  -1.585  -6.637   6.831
  366    H1*    C  33           H1*        C  33  -1.724  -5.874   2.903
  367   1H4     C  33          1H4         C  33   3.737  -3.089   1.022
  368   2H4     C  33          2H4         C  33   4.140  -2.625   2.660
  369    H5     C  33           H5         C  33   2.728  -3.129   4.554
  370    H6     C  33           H6         C  33   0.672  -4.184   5.304
  371   1H2*    C  33          1H2*        C  33   0.083  -6.499   5.298
  372   2H2*    C  33          2H2*        C  33  -0.897  -7.586   4.283
  373   1H5*    A  34          1H5*        A  34  -4.040  -8.736   3.615
  374   2H5*    A  34          2H5*        A  34  -4.751 -10.247   4.233
  375    H4*    A  34           H4*        A  34  -4.478 -10.444   1.810
  376    H3*    A  34           H3*        A  34  -3.156 -12.242   3.627
  377    H1*    A  34           H1*        A  34  -1.505 -10.798   0.267
  378    H8     A  34           H8         A  34  -0.089 -10.112   3.826
  379   1H6     A  34          1H6         A  34   4.942  -8.002   0.978
  380   2H6     A  34          2H6         A  34   4.189  -8.303   2.529
  381    H2     A  34           H2         A  34   1.967  -9.242  -2.167
  382   1H2*    A  34          1H2*        A  34  -1.015 -12.120   2.889
  383   2H2*    A  34          2H2*        A  34  -1.586 -12.778   1.359
  384   1H5*    C  35          1H5*        C  35  -3.390 -12.982  -0.700
  385   2H5*    C  35          2H5*        C  35  -4.237 -14.488  -1.119
  386    H4*    C  35           H4*        C  35  -2.650 -14.001  -2.886
  387    H3*    C  35           H3*        C  35  -2.393 -16.414  -1.319
  388    H1*    C  35           H1*        C  35   0.565 -14.220  -2.869
  389   1H4     C  35          1H4         C  35   4.996 -12.827   1.555
  390   2H4     C  35          2H4         C  35   3.926 -13.269   2.867
  391    H5     C  35           H5         C  35   1.673 -14.055   2.525
  392    H6     C  35           H6         C  35  -0.008 -14.672   0.872
  393   1H2*    C  35          1H2*        C  35  -0.177 -16.347  -0.820
  394   2H2*    C  35          2H2*        C  35   0.126 -16.484  -2.575
  395   1H5*    G  36          1H5*        G  36  -0.116 -16.275  -5.187
  396   2H5*    G  36          2H5*        G  36  -0.973 -17.383  -6.297
  397    H4*    G  36           H4*        G  36   1.336 -17.314  -6.981
  398    H3*    G  36           H3*        G  36   0.284 -19.773  -5.921
  399    H1*    G  36           H1*        G  36   3.974 -18.373  -5.450
  400    H8     G  36           H8         G  36   1.717 -18.538  -2.211
  401    H1     G  36           H1         G  36   7.969 -17.933  -1.117
  402   1H2     G  36          1H2         G  36   8.255 -17.781  -4.614
  403   2H2     G  36          2H2         G  36   9.072 -17.725  -3.068
  404   1H2*    G  36          1H2*        G  36   1.925 -20.225  -4.304
  405   2H2*    G  36          2H2*        G  36   3.024 -20.429  -5.698
  Start of MODEL   12
    1   1H5*    C   1          1H5*        C   1  13.507 -16.917   3.059
    2   2H5*    C   1          2H5*        C   1  14.287 -15.359   3.416
    3    H4*    C   1           H4*        C   1  13.991 -15.483   1.012
    4    H3*    C   1           H3*        C   1  12.724 -13.424   2.532
    5    H1*    C   1           H1*        C   1  10.759 -15.416  -0.415
    6   1H4     C   1          1H4         C   1   5.422 -17.640   2.301
    7   2H4     C   1          2H4         C   1   6.084 -17.489   3.913
    8    H5     C   1           H5         C   1   8.335 -16.709   4.350
    9    H6     C   1           H6         C   1  10.390 -15.817   3.331
   10   1H2*    C   1          1H2*        C   1  10.530 -13.633   1.917
   11   2H2*    C   1          2H2*        C   1  11.047 -13.253   0.252
   12   1H5*    G   2          1H5*        G   2  12.590 -13.043  -1.868
   13   2H5*    G   2          2H5*        G   2  13.764 -11.801  -2.393
   14    H4*    G   2           H4*        G   2  11.993 -11.999  -4.067
   15    H3*    G   2           H3*        G   2  12.394  -9.542  -2.634
   16    H1*    G   2           H1*        G   2   8.867 -11.038  -3.707
   17    H8     G   2           H8         G   2   9.619 -10.385   0.087
   18    H1     G   2           H1         G   2   3.770 -12.626  -1.091
   19   1H2     G   2          1H2         G   2   4.833 -12.757  -4.435
   20   2H2     G   2          2H2         G   2   3.541 -13.039  -3.290
   21   1H2*    G   2          1H2*        G   2  10.307  -9.203  -1.820
   22   2H2*    G   2          2H2*        G   2   9.807  -8.939  -3.508
   23   1H5*    T   3          1H5*        T   3   9.992  -9.484  -6.611
   24   2H5*    T   3          2H5*        T   3  10.714  -8.262  -7.683
   25    H4*    T   3           H4*        T   3   8.351  -8.318  -8.162
   26    H3*    T   3           H3*        T   3   9.513  -5.920  -7.051
   27   1H2*    T   3          1H2*        T   3   8.057  -5.521  -5.361
   28   2H2*    T   3          2H2*        T   3   6.820  -5.261  -6.605
   29    H1*    T   3           H1*        T   3   5.877  -7.354  -6.384
   30    H3     T   3           H3         T   3   3.985  -8.384  -2.417
   31   1H5M    T   3          1H5M        T   3   7.507  -6.565   0.026
   32   2H5M    T   3          2H5M        T   3   8.066  -5.382  -1.180
   33   3H5M    T   3          3H5M        T   3   8.874  -6.957  -1.039
   34    H6     T   3           H6         T   3   8.267  -6.526  -3.575
   35   1H5*    G   4          1H5*        G   4   5.750  -5.602  -9.650
   36   2H5*    G   4          2H5*        G   4   5.797  -4.276 -10.846
   37    H4*    G   4           H4*        G   4   3.522  -4.640  -9.839
   38    H3*    G   4           H3*        G   4   4.858  -2.085  -9.887
   39    H1*    G   4           H1*        G   4   2.516  -3.523  -7.086
   40    H8     G   4           H8         G   4   6.142  -2.564  -5.949
   41    H1     G   4           H1         G   4   2.270  -4.322  -1.207
   42   1H2     G   4          1H2         G   4  -0.097  -4.863  -3.736
   43   2H2     G   4          2H2         G   4   0.260  -4.898  -2.023
   44   1H2*    G   4          1H2*        G   4   4.856  -1.666  -7.643
   45   2H2*    G   4          2H2*        G   4   3.129  -1.407  -7.853
   46   1H5*    C   5          1H5*        C   5  -0.154  -2.099  -9.636
   47   2H5*    C   5          2H5*        C   5  -0.530  -0.809 -10.800
   48    H4*    C   5           H4*        C   5  -2.203  -0.954  -8.944
   49    H3*    C   5           H3*        C   5  -0.841   1.498  -9.702
   50    H1*    C   5           H1*        C   5  -1.918   0.376  -5.993
   51   1H4     C   5          1H4         C   5   4.194   1.570  -3.503
   52   2H4     C   5          2H4         C   5   3.060   1.708  -2.178
   53    H5     C   5           H5         C   5   3.526   1.073  -5.762
   54    H6     C   5           H6         C   5   1.642   0.508  -7.218
   55   1H2*    C   5          1H2*        C   5  -0.268   2.277  -7.661
   56   2H2*    C   5          2H2*        C   5  -2.010   2.341  -7.279
   57   1H5*    A   6          1H5*        A   6  -4.814   1.833  -7.486
   58   2H5*    A   6          2H5*        A   6  -5.947   2.883  -8.365
   59    H4*    A   6           H4*        A   6  -6.200   3.002  -5.872
   60    H3*    A   6           H3*        A   6  -5.974   5.331  -7.577
   61    H1*    A   6           H1*        A   6  -4.692   4.844  -3.882
   62    H8     A   6           H8         A   6  -1.939   5.662  -6.595
   63   1H6     A   6          1H6         A   6   1.734   6.481  -3.634
   64   2H6     A   6          2H6         A   6   1.927   6.399  -1.897
   65    H2     A   6           H2         A   6  -2.031   5.180  -0.181
   66   1H2*    A   6          1H2*        A   6  -4.317   6.423  -6.437
   67   2H2*    A   6          2H2*        A   6  -5.527   6.627  -5.142
   68   1H5*    G   7          1H5*        G   7  -7.822   6.022  -3.230
   69   2H5*    G   7          2H5*        G   7  -9.343   6.923  -3.483
   70    H4*    G   7           H4*        G   7  -8.185   7.693  -1.432
   71    H3*    G   7           H3*        G   7  -8.916   9.513  -3.484
   72    H1*    G   7           H1*        G   7  -5.742   9.687  -1.338
   73    H8     G   7           H8         G   7  -4.670   9.123  -5.088
   74    H1     G   7           H1         G   7   0.119  10.001  -0.985
   75   1H2     G   7          1H2         G   7  -0.664  10.153   1.107
   76   2H2     G   7          2H2         G   7  -2.370  10.033   1.473
   77   1H2*    G   7          1H2*        G   7  -6.728   9.929  -4.226
   78   2H2*    G   7          2H2*        G   7  -6.833  11.130  -2.915
   79   1H5*    C   8          1H5*        C   8  -7.277  10.853   0.982
   80   2H5*    C   8          2H5*        C   8  -8.550  12.008   1.430
   81    H4*    C   8           H4*        C   8  -6.606  12.532   2.751
   82    H3*    C   8           H3*        C   8  -7.520  14.488   0.809
   83    H1*    C   8           H1*        C   8  -3.707  13.763   1.846
   84   1H4     C   8          1H4         C   8  -1.877  13.054  -4.545
   85   2H4     C   8          2H4         C   8  -0.415  13.345  -3.630
   86    H5     C   8           H5         C   8  -4.054  12.973  -3.541
   87    H6     C   8           H6         C   8  -5.329  13.156  -1.484
   88   1H2*    C   8          1H2*        C   8  -5.537  15.192  -0.027
   89   2H2*    C   8          2H2*        C   8  -5.048  15.623   1.625
   90   1H5*    G   9          1H5*        G   9  -5.174  16.178   4.309
   91   2H5*    G   9          2H5*        G   9  -6.105  17.452   5.144
   92    H4*    G   9           H4*        G   9  -3.599  17.813   5.050
   93    H3*    G   9           H3*        G   9  -5.561  19.815   4.277
   94    H1*    G   9           H1*        G   9  -1.962  19.139   2.655
   95    H8     G   9           H8         G   9  -5.226  19.227   0.426
   96    H1     G   9           H1         G   9   0.241  18.322  -2.739
   97   1H2     G   9          1H2         G   9   1.961  18.232  -1.285
   98   2H2     G   9          2H2         G   9   1.728  18.390   0.442
   99   1H2*    G   9          1H2*        G   9  -4.625  20.543   2.354
  100   2H2*    G   9          2H2*        G   9  -3.204  21.040   3.308
  101   1H5*    G  10          1H5*        G  10  -1.360  21.865   5.783
  102   2H5*    G  10          2H5*        G  10  -1.977  23.098   6.918
  103    H4*    G  10           H4*        G  10  -0.080  23.939   5.554
  104    H3*    G  10           H3*        G  10  -2.645  25.259   5.613
  105    H1*    G  10           H1*        G  10  -0.227  24.907   2.447
  106    H8     G  10           H8         G  10  -3.839  23.373   2.355
  107    H1     G  10           H1         G  10  -0.672  23.067  -3.168
  108   1H2     G  10          1H2         G  10   1.400  23.893  -2.916
  109   2H2     G  10          2H2         G  10   1.975  24.522  -1.389
  110   1H2*    G  10          1H2*        G  10  -3.040  25.455   3.372
  111   2H2*    G  10          2H2*        G  10  -1.632  26.545   3.324
  112   1H5*    C  11          1H5*        C  11  -2.036  30.230   5.466
  113   2H5*    C  11          2H5*        C  11  -3.227  29.757   4.232
  114    H4*    C  11           H4*        C  11  -0.181  29.488   4.062
  115    H3*    C  11           H3*        C  11  -1.888  31.585   3.167
  116    H1*    C  11           H1*        C  11  -0.470  28.698   0.841
  117   1H4     C  11          1H4         C  11  -5.072  25.824  -2.508
  118   2H4     C  11          2H4         C  11  -6.125  25.758  -1.112
  119    H5     C  11           H5         C  11  -5.516  26.704   1.050
  120    H6     C  11           H6         C  11  -3.824  27.989   2.273
  121   1H2*    C  11          1H2*        C  11  -2.872  30.485   1.384
  122   2H2*    C  11          2H2*        C  11  -1.335  30.879   0.570
  123   1H5*    T  12          1H5*        T  12   1.692  33.931  -0.406
  124   2H5*    T  12          2H5*        T  12  -0.018  34.119  -0.862
  125    H4*    T  12           H4*        T  12   1.305  33.466  -2.846
  126    H3*    T  12           H3*        T  12  -0.971  32.003  -1.994
  127   1H2*    T  12          1H2*        T  12  -0.050  29.971  -1.473
  128   2H2*    T  12          2H2*        T  12   0.154  29.791  -3.240
  129    H1*    T  12           H1*        T  12   2.427  30.188  -3.157
  130    H3     T  12           H3         T  12   3.374  26.500  -0.584
  131   1H5M    T  12          1H5M        T  12   2.057  30.261   2.930
  132   2H5M    T  12          2H5M        T  12   3.806  30.520   2.720
  133   3H5M    T  12          3H5M        T  12   3.206  28.975   3.364
  134    H6     T  12           H6         T  12   2.261  31.083   0.407
  135   1H5*    T  13          1H5*        T  13  -0.842  30.132  -5.562
  136   2H5*    T  13          2H5*        T  13  -1.070  31.177  -6.981
  137    H4*    T  13           H4*        T  13  -1.860  28.820  -7.379
  138    H3*    T  13           H3*        T  13  -3.339  31.155  -8.034
  139   1H2*    T  13          1H2*        T  13  -5.083  30.953  -6.537
  140   2H2*    T  13          2H2*        T  13  -5.656  29.719  -7.687
  141    H1*    T  13           H1*        T  13  -4.981  27.949  -6.337
  142    H3     T  13           H3         T  13  -8.030  28.520  -3.013
  143   1H5M    T  13          1H5M        T  13  -4.442  32.358  -2.144
  144   2H5M    T  13          2H5M        T  13  -3.844  30.993  -1.165
  145   3H5M    T  13          3H5M        T  13  -5.436  31.709  -0.819
  146    H6     T  13           H6         T  13  -3.800  30.607  -4.021
  147   1H5*    G  14          1H5*        G  14  -1.354  28.098 -12.351
  148   2H5*    G  14          2H5*        G  14  -2.043  26.473 -12.151
  149    H4*    G  14           H4*        G  14   0.585  27.509 -11.415
  150    H3*    G  14           H3*        G  14  -0.541  24.913 -11.860
  151    H1*    G  14           H1*        G  14   0.675  25.999  -8.099
  152    H8     G  14           H8         G  14  -2.850  24.984  -9.440
  153    H1     G  14           H1         G  14  -2.650  26.416  -3.231
  154   1H2     G  14          1H2         G  14   0.691  27.287  -3.878
  155   2H2     G  14          2H2         G  14  -0.593  27.166  -2.696
  156   1H2*    G  14          1H2*        G  14  -0.679  24.024  -9.776
  157   2H2*    G  14          2H2*        G  14   1.064  24.299  -9.595
  158   1H5*    C  15          1H5*        C  15   3.630  25.238 -10.185
  159   2H5*    C  15          2H5*        C  15   4.820  24.232 -11.043
  160    H4*    C  15           H4*        C  15   5.404  24.222  -8.699
  161    H3*    C  15           H3*        C  15   4.595  21.745  -9.971
  162    H1*    C  15           H1*        C  15   3.866  22.842  -6.207
  163   1H4     C  15          1H4         C  15  -2.683  21.689  -6.103
  164   2H4     C  15          2H4         C  15  -2.202  22.266  -4.523
  165    H5     C  15           H5         C  15  -1.158  21.402  -7.905
  166    H6     C  15           H6         C  15   1.138  21.867  -8.728
  167   1H2*    C  15          1H2*        C  15   3.202  20.913  -8.388
  168   2H2*    C  15          2H2*        C  15   4.570  20.942  -7.251
  169   1H5*    C  16          1H5*        C  16   6.872  21.378  -6.052
  170   2H5*    C  16          2H5*        C  16   8.464  20.753  -6.538
  171    H4*    C  16           H4*        C  16   8.162  19.920  -4.342
  172    H3*    C  16           H3*        C  16   8.023  17.994  -6.482
  173    H1*    C  16           H1*        C  16   5.733  17.911  -3.197
  174   1H4     C  16          1H4         C  16  -0.099  17.965  -6.512
  175   2H4     C  16          2H4         C  16  -0.455  17.768  -4.811
  176    H5     C  16           H5         C  16   2.154  18.108  -7.377
  177    H6     C  16           H6         C  16   4.522  18.358  -6.779
  178   1H2*    C  16          1H2*        C  16   6.129  16.850  -5.928
  179   2H2*    C  16          2H2*        C  16   6.914  16.434  -4.394
  180   1H5*    G  17          1H5*        G  17   8.906  17.405  -2.254
  181   2H5*    G  17          2H5*        G  17  10.412  16.545  -1.827
  182    H4*    G  17           H4*        G  17   8.806  16.415   0.022
  183    H3*    G  17           H3*        G  17   9.781  14.043  -1.260
  184    H1*    G  17           H1*        G  17   6.130  14.635   0.192
  185    H8     G  17           H8         G  17   6.362  14.270  -3.721
  186    H1     G  17           H1         G  17   0.494  13.587  -1.385
  187   1H2     G  17          1H2         G  17   1.951  14.163   1.743
  188   2H2     G  17          2H2         G  17   0.492  13.837   0.835
  189   1H2*    G  17          1H2*        G  17   7.787  13.181  -1.920
  190   2H2*    G  17          2H2*        G  17   7.562  12.746  -0.206
  191   1H5*    G  18          1H5*        G  18   6.672  14.288   3.307
  192   2H5*    G  18          2H5*        G  18   7.791  15.019   2.133
  193    H4*    G  18           H4*        G  18   7.907  14.767   5.146
  194    H3*    G  18           H3*        G  18   8.546  16.880   3.124
  195    H1*    G  18           H1*        G  18  10.883  15.216   5.901
  196    H8     G  18           H8         G  18  11.565  15.451   2.039
  197    H1     G  18           H1         G  18  16.721  14.557   5.671
  198   1H2     G  18          1H2         G  18  16.112  14.469   7.839
  199   2H2     G  18          2H2         G  18  14.446  14.633   8.343
  200   1H2*    G  18          1H2*        G  18  10.643  17.309   3.833
  201   2H2*    G  18          2H2*        G  18  10.099  17.334   5.531
  202   1H5*    C  19          1H5*        C  19   8.465  17.675   7.579
  203   2H5*    C  19          2H5*        C  19   7.441  19.089   7.920
  204    H4*    C  19           H4*        C  19   9.261  18.932   9.568
  205    H3*    C  19           H3*        C  19   8.882  21.278   7.913
  206    H1*    C  19           H1*        C  19  12.381  19.786   9.102
  207   1H4     C  19          1H4         C  19  14.874  19.267   2.919
  208   2H4     C  19          2H4         C  19  16.213  19.080   4.028
  209    H5     C  19           H5         C  19  12.607  19.651   3.652
  210    H6     C  19           H6         C  19  11.136  19.975   5.553
  211   1H2*    C  19          1H2*        C  19  11.030  21.689   7.272
  212   2H2*    C  19          2H2*        C  19  11.446  21.836   8.995
  213   1H5*    A  20          1H5*        A  20  11.305  21.511  11.613
  214   2H5*    A  20          2H5*        A  20  10.614  22.652  12.792
  215    H4*    A  20           H4*        A  20  13.026  22.622  13.087
  216    H3*    A  20           H3*        A  20  11.674  25.060  12.336
  217    H1*    A  20           H1*        A  20  15.298  23.881  11.184
  218    H8     A  20           H8         A  20  12.512  24.435   8.472
  219   1H6     A  20          1H6         A  20  16.945  23.581   4.304
  220   2H6     A  20          2H6         A  20  15.252  23.946   4.549
  221    H2     A  20           H2         A  20  18.778  23.074   8.375
  222   1H2*    A  20          1H2*        A  20  12.919  25.650  10.529
  223   2H2*    A  20          2H2*        A  20  14.252  25.901  11.683
  224   1H5*    C  21          1H5*        C  21  13.677  28.952  14.793
  225   2H5*    C  21          2H5*        C  21  13.565  29.421  13.084
  226    H4*    C  21           H4*        C  21  15.774  27.817  14.457
  227    H3*    C  21           H3*        C  21  15.665  30.547  13.817
  228    H1*    C  21           H1*        C  21  17.458  27.918  11.468
  229   1H4     C  21          1H4         C  21  15.042  27.221   5.608
  230   2H4     C  21          2H4         C  21  13.424  27.603   6.154
  231    H5     C  21           H5         C  21  12.908  28.210   8.447
  232    H6     C  21           H6         C  21  13.870  28.730  10.645
  233   1H2*    C  21          1H2*        C  21  15.656  30.365  11.487
  234   2H2*    C  21          2H2*        C  21  17.417  30.240  11.752
  235   1H5*    T  22          1H5*        T  22  21.368  31.003  14.218
  236   2H5*    T  22          2H5*        T  22  20.665  32.423  13.406
  237    H4*    T  22           H4*        T  22  22.587  31.683  12.093
  238    H3*    T  22           H3*        T  22  20.006  31.828  10.953
  239   1H2*    T  22          1H2*        T  22  19.617  29.602  10.483
  240   2H2*    T  22          2H2*        T  22  20.779  29.874   9.152
  241    H1*    T  22           H1*        T  22  22.516  28.810  10.264
  242    H3     T  22           H3         T  22  21.191  24.493  10.384
  243   1H5M    T  22          1H5M        T  22  18.723  25.134  14.299
  244   2H5M    T  22          2H5M        T  22  17.758  26.474  13.644
  245   3H5M    T  22          3H5M        T  22  19.103  26.809  14.759
  246    H6     T  22           H6         T  22  19.912  28.400  12.903
  247   1H5*    T  23          1H5*        T  23  22.251  30.280   7.232
  248   2H5*    T  23          2H5*        T  23  22.628  31.853   6.503
  249    H4*    T  23           H4*        T  23  22.013  30.057   4.831
  250    H3*    T  23           H3*        T  23  20.786  32.737   5.005
  251   1H2*    T  23          1H2*        T  23  18.664  32.265   4.426
  252   2H2*    T  23          2H2*        T  23  19.243  31.370   2.998
  253    H1*    T  23           H1*        T  23  18.816  29.357   4.013
  254    H3     T  23           H3         T  23  14.505  30.189   5.374
  255   1H5M    T  23          1H5M        T  23  17.636  32.999   8.564
  256   2H5M    T  23          2H5M        T  23  17.298  31.578   9.586
  257   3H5M    T  23          3H5M        T  23  15.965  32.634   9.069
  258    H6     T  23           H6         T  23  18.826  31.056   7.316
  259   1H5*    G  24          1H5*        G  24  24.415  29.518   1.515
  260   2H5*    G  24          2H5*        G  24  22.849  28.816   1.013
  261    H4*    G  24           H4*        G  24  24.860  27.859   3.130
  262    H3*    G  24           H3*        G  24  24.493  26.992   0.495
  263    H1*    G  24           H1*        G  24  22.662  25.156   3.562
  264    H8     G  24           H8         G  24  20.229  25.700   0.799
  265    H1     G  24           H1         G  24  17.500  27.037   6.388
  266   1H2     G  24          1H2         G  24  20.781  27.047   7.640
  267   2H2     G  24          2H2         G  24  19.076  27.248   7.982
  268   1H2*    G  24          1H2*        G  24  22.398  26.014   0.659
  269   2H2*    G  24          2H2*        G  24  23.319  24.675   1.349
  270   1H5*    T  25          1H5*        T  25  26.219  24.546   4.073
  271   2H5*    T  25          2H5*        T  25  27.337  23.232   3.645
  272    H4*    T  25           H4*        T  25  26.196  22.769   5.779
  273    H3*    T  25           H3*        T  25  26.075  20.929   3.540
  274   1H2*    T  25          1H2*        T  25  23.869  20.359   3.616
  275   2H2*    T  25          2H2*        T  25  24.142  19.786   5.274
  276    H1*    T  25           H1*        T  25  23.250  21.613   6.238
  277    H3     T  25           H3         T  25  18.967  22.635   5.422
  278   1H5M    T  25          1H5M        T  25  19.491  22.572   0.790
  279   2H5M    T  25          2H5M        T  25  20.677  21.250   0.727
  280   3H5M    T  25          3H5M        T  25  21.223  22.936   0.611
  281    H6     T  25           H6         T  25  22.733  21.965   2.497
  282   1H5*    G  26          1H5*        G  26  25.791  19.627   7.931
  283   2H5*    G  26          2H5*        G  26  26.933  18.298   8.282
  284    H4*    G  26           H4*        G  26  24.988  18.126   9.758
  285    H3*    G  26           H3*        G  26  25.585  16.024   7.879
  286    H1*    G  26           H1*        G  26  21.946  17.249   8.910
  287    H8     G  26           H8         G  26  23.071  17.418   5.158
  288    H1     G  26           H1         G  26  16.980  18.998   6.190
  289   1H2     G  26          1H2         G  26  17.737  18.502   9.579
  290   2H2     G  26          2H2         G  26  16.527  18.928   8.389
  291   1H2*    G  26          1H2*        G  26  23.559  15.799   6.858
  292   2H2*    G  26          2H2*        G  26  22.945  15.270   8.433
  293   1H5*    C  27          1H5*        C  27  23.615  11.673  11.446
  294   2H5*    C  27          2H5*        C  27  23.277  12.133   9.760
  295    H4*    C  27           H4*        C  27  21.651  13.021  12.195
  296    H3*    C  27           H3*        C  27  21.399  10.589  10.562
  297    H1*    C  27           H1*        C  27  19.101  13.943  10.304
  298   1H4     C  27          1H4         C  27  20.210  14.310   3.720
  299   2H4     C  27          2H4         C  27  18.600  14.929   4.010
  300    H5     C  27           H5         C  27  21.644  13.486   5.487
  301    H6     C  27           H6         C  27  21.745  12.848   7.850
  302   1H2*    C  27          1H2*        C  27  19.727  11.267   9.145
  303   2H2*    C  27          2H2*        C  27  18.727  11.686  10.562
  304   1H5*    T  28          1H5*        T  28  16.729   9.397  13.479
  305   2H5*    T  28          2H5*        T  28  16.666   8.580  11.901
  306    H4*    T  28           H4*        T  28  14.557   9.822  12.358
  307    H3*    T  28           H3*        T  28  16.134  10.217   9.965
  308   1H2*    T  28          1H2*        T  28  16.358  12.494  10.024
  309   2H2*    T  28          2H2*        T  28  14.594  12.548   9.756
  310    H1*    T  28           H1*        T  28  14.161  13.054  12.002
  311    H3     T  28           H3         T  28  16.458  17.064  11.328
  312   1H5M    T  28          1H5M        T  28  19.787  15.645  14.258
  313   2H5M    T  28          2H5M        T  28  19.853  13.905  13.893
  314   3H5M    T  28          3H5M        T  28  18.832  14.499  15.226
  315    H6     T  28           H6         T  28  17.413  12.844  13.462
  316   1H5*    T  29          1H5*        T  29  12.245  11.432   8.499
  317   2H5*    T  29          2H5*        T  29  11.205   9.988   8.495
  318    H4*    T  29           H4*        T  29  10.434  11.588   6.774
  319    H3*    T  29           H3*        T  29  11.070   8.877   6.179
  320   1H2*    T  29          1H2*        T  29  12.768   9.155   4.657
  321   2H2*    T  29          2H2*        T  29  11.492   9.737   3.566
  322    H1*    T  29           H1*        T  29  12.103  11.957   3.819
  323    H3     T  29           H3         T  29  16.279  12.113   2.067
  324   1H5M    T  29          1H5M        T  29  16.980   9.423   6.583
  325   2H5M    T  29          2H5M        T  29  17.121  11.110   7.140
  326   3H5M    T  29          3H5M        T  29  18.273  10.465   5.947
  327    H6     T  29           H6         T  29  14.518  10.481   6.244
  328   1H5*    C  30          1H5*        C  30   7.107  11.486   3.398
  329   2H5*    C  30          2H5*        C  30   7.667  11.167   5.048
  330    H4*    C  30           H4*        C  30   5.473  11.319   5.635
  331    H3*    C  30           H3*        C  30   5.845   8.589   4.781
  332    H1*    C  30           H1*        C  30   2.684  10.897   3.878
  333   1H4     C  30          1H4         C  30   3.404   9.791  -2.691
  334   2H4     C  30          2H4         C  30   1.686   9.751  -2.367
  335    H5     C  30           H5         C  30   5.054  10.063  -0.973
  336    H6     C  30           H6         C  30   5.446  10.439   1.425
  337   1H2*    C  30          1H2*        C  30   4.197   8.410   3.235
  338   2H2*    C  30          2H2*        C  30   3.042   8.724   4.543
  339   1H5*    T  31          1H5*        T  31   1.570   8.155   6.860
  340   2H5*    T  31          2H5*        T  31   2.100   7.167   8.241
  341    H4*    T  31           H4*        T  31   0.080   6.174   7.282
  342    H3*    T  31           H3*        T  31   2.570   4.717   7.417
  343   1H2*    T  31          1H2*        T  31   2.707   3.867   5.321
  344   2H2*    T  31          2H2*        T  31   1.175   3.030   5.636
  345    H1*    T  31           H1*        T  31  -0.075   4.494   4.434
  346    H3     T  31           H3         T  31   0.890   5.187   0.111
  347   1H5M    T  31          1H5M        T  31   5.470   5.997   2.943
  348   2H5M    T  31          2H5M        T  31   5.296   6.641   1.294
  349   3H5M    T  31          3H5M        T  31   5.540   4.902   1.551
  350    H6     T  31           H6         T  31   3.518   5.501   4.129
  351   1H5*    G  32          1H5*        G  32  -1.463   2.378   7.207
  352   2H5*    G  32          2H5*        G  32  -1.483   1.123   8.481
  353    H4*    G  32           H4*        G  32  -2.717   0.350   6.508
  354    H3*    G  32           H3*        G  32  -0.369  -1.060   7.424
  355    H1*    G  32           H1*        G  32  -1.510  -0.564   3.642
  356    H8     G  32           H8         G  32   2.016   0.767   4.799
  357    H1     G  32           H1         G  32   0.918   1.090  -1.467
  358   1H2     G  32          1H2         G  32  -1.160   0.373  -1.926
  359   2H2     G  32          2H2         G  32  -2.256  -0.167  -0.674
  360   1H2*    G  32          1H2*        G  32   0.779  -1.227   5.470
  361   2H2*    G  32          2H2*        G  32  -0.552  -2.257   4.886
  362   1H5*    C  33          1H5*        C  33  -3.790  -3.326   5.112
  363   2H5*    C  33          2H5*        C  33  -4.175  -4.821   5.994
  364    H4*    C  33           H4*        C  33  -4.536  -5.109   3.560
  365    H3*    C  33           H3*        C  33  -2.795  -6.830   5.103
  366    H1*    C  33           H1*        C  33  -2.280  -5.643   1.312
  367   1H4     C  33          1H4         C  33   3.719  -3.541   0.506
  368   2H4     C  33          2H4         C  33   3.980  -3.409   2.230
  369    H5     C  33           H5         C  33   2.292  -3.993   3.860
  370    H6     C  33           H6         C  33   0.002  -4.720   4.209
  371   1H2*    C  33          1H2*        C  33  -0.950  -6.843   3.793
  372   2H2*    C  33          2H2*        C  33  -1.955  -7.608   2.541
  373   1H5*    A  34          1H5*        A  34  -5.382  -8.733   1.449
  374   2H5*    A  34          2H5*        A  34  -5.994 -10.268   2.109
  375    H4*    A  34           H4*        A  34  -5.629 -10.435  -0.338
  376    H3*    A  34           H3*        A  34  -4.416 -12.238   1.560
  377    H1*    A  34           H1*        A  34  -2.453 -10.767  -1.666
  378    H8     A  34           H8         A  34  -1.629 -10.306   2.096
  379   1H6     A  34          1H6         A  34   3.733  -7.929   0.290
  380   2H6     A  34          2H6         A  34   2.725  -8.337   1.661
  381    H2     A  34           H2         A  34   1.390  -9.032  -3.397
  382   1H2*    A  34          1H2*        A  34  -2.264 -12.294   0.860
  383   2H2*    A  34          2H2*        A  34  -2.839 -12.801  -0.727
  384   1H5*    C  35          1H5*        C  35  -4.687 -13.572  -2.758
  385   2H5*    C  35          2H5*        C  35  -5.223 -15.253  -2.976
  386    H4*    C  35           H4*        C  35  -3.403 -14.616  -4.564
  387    H3*    C  35           H3*        C  35  -3.293 -16.946  -2.844
  388    H1*    C  35           H1*        C  35  -0.214 -14.584  -3.900
  389   1H4     C  35          1H4         C  35   3.041 -12.926   1.345
  390   2H4     C  35          2H4         C  35   1.743 -13.430   2.403
  391    H5     C  35           H5         C  35  -0.317 -14.399   1.595
  392    H6     C  35           H6         C  35  -1.590 -15.060  -0.380
  393   1H2*    C  35          1H2*        C  35  -1.182 -16.781  -2.036
  394   2H2*    C  35          2H2*        C  35  -0.606 -16.873  -3.724
  395   1H5*    G  36          1H5*        G  36  -0.424 -17.035  -6.410
  396   2H5*    G  36          2H5*        G  36  -1.045 -18.326  -7.477
  397    H4*    G  36           H4*        G  36   1.372 -18.193  -7.724
  398    H3*    G  36           H3*        G  36   0.173 -20.581  -6.656
  399    H1*    G  36           H1*        G  36   3.669 -18.992  -5.526
  400    H8     G  36           H8         G  36   0.672 -18.979  -2.961
  401    H1     G  36           H1         G  36   6.395 -18.016  -0.346
  402   1H2     G  36          1H2         G  36   7.593 -18.086  -3.639
  403   2H2     G  36          2H2         G  36   7.962 -17.878  -1.941
  404   1H2*    G  36          1H2*        G  36   1.483 -20.865  -4.733
  405   2H2*    G  36          2H2*        G  36   2.846 -21.096  -5.867