*HEADER    DNA                                     30-SEP-00   1FYI              
*TITLE     11-MER DNA DUPLEX CONTAINING A 2'-DEOXYARISTEROMYCIN 8-OXO-           
*TITLE    2 GUANINE BASE PAIR;                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-D(*CP*AP*GP*TP*GP*(2AR)P*GP*TP*CP*AP*C)-3';             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MOL_ID: 2;                                                           
*COMPND   6 MOLECULE: 5'-D(*GP*TP*GP*AP*CP*(8OG)P*CP*AP*CP*TP*G)-3';             
*COMPND   7 CHAIN: B;                                                            
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 MOL_ID: 2;                                                           
*SOURCE   4 SYNTHETIC: YES                                                       
*KEYWDS    2'-DEOXYARISTEROMYCIN, 8-OXO-GUANINE                                  
*EXPDTA    NMR, 9 STRUCTURES                                                     
*AUTHOR    S.SMIRNOV, F.JOHNSON, C.DE LOS SANTOS                                 
*REVDAT   1   18-OCT-00 1FYI    0                                                
assign (resid 1 and name H6 and segid STR1)
 (resid 1 and name H1' and segid STR1) 3.12 0.6!   2! 2

assign (resid 3 and name H8 and segid STR1)
 (resid 3 and name H1' and segid STR1) 3.27 0.6!   3! 3

assign (resid 3 and name H8 and segid STR1)
 (resid 2 and name H1' and segid STR1) 3.23 0.6!   4! 4

assign (resid 2 and name H8 and segid STR1)
 (resid 1 and name H1' and segid STR1) 4.74 0.6!   5! 5

assign (resid 2 and name H8 and segid STR1)
 (resid 2 and name H1' and segid STR1) 4.54 0.6!   6! 6

assign (resid 4 and name H6 and segid STR1)
 (resid 3 and name H1' and segid STR1) 3.37 0.6!   7! 7

assign (resid 4 and name H6 and segid STR1)
 (resid 4 and name H1' and segid STR1) 3.54 0.6!   8! 8

assign (resid 5 and name H8 and segid STR1)
 (resid 5 and name H1' and segid STR1) 3.63 0.6!   9! 9

assign (resid 5 and name H8 and segid STR1)
 (resid 4 and name H1' and segid STR1) 4.06 0.6!  10! 10

assign (resid 7 and name H8 and segid STR1)
 (resid 6 and name H1' and segid STR1) 3.48 0.6!  11! 11

assign (resid 6 and name H8 and segid STR1)
 (resid 6 and name H1' and segid STR1) 3.65 0.6!  12! 12

assign (resid 6 and name H8 and segid STR1)
 (resid 5 and name H1' and segid STR1) 3.07 0.6!  15! 15

assign (resid 7 and name H8 and segid STR1)
 (resid 7 and name H1' and segid STR1) 4.24 0.6!  16! 16

assign (resid 8 and name H6 and segid STR1)
 (resid 7 and name H1' and segid STR1) 3.61 0.6!  17! 17

assign (resid 8 and name H6 and segid STR1)
 (resid 8 and name H1' and segid STR1) 3.39 0.6!  18! 18

assign (resid 9 and name H6 and segid STR1)
 (resid 8 and name H1' and segid STR1) 3.80 0.6!  19! 19

assign (resid 9 and name H6 and segid STR1)
 (resid 9 and name H1' and segid STR1) 3.41 0.6!  21! 21

assign (resid 11 and name H6 and segid STR1)
 (resid 10 and name H1' and segid STR1) 3.66 0.6!  22! 22

assign (resid 11 and name H6 and segid STR1)
 (resid 11 and name H1' and segid STR1) 3.57 0.6!  23! 23

assign (resid 10 and name H8 and segid STR1)
 (resid 9 and name H1' and segid STR1) 3.87 0.6!  24! 24

assign (resid 10 and name H8 and segid STR1)
 (resid 10 and name H1' and segid STR1) 3.54 0.6!  25! 25

assign (resid 11 and name H8 and segid STR2)
 (resid 11 and name H1' and segid STR2) 3.47 0.6!  26! 26

assign (resid 11 and name H8 and segid STR2)
 (resid 10 and name H1' and segid STR2) 4.81 0.6!  27! 27

assign (resid 2 and name H6 and segid STR2)
 (resid 1 and name H1' and segid STR2) 3.55 0.6!  28! 28

assign (resid 2 and name H6 and segid STR2)
 (resid 2 and name H1' and segid STR2) 3.11 0.6!  29! 29

assign (resid 3 and name H8 and segid STR2)
 (resid 2 and name H1' and segid STR2) 3.53 0.8!  30! 30

assign (resid 3 and name H8 and segid STR2)
 (resid 3 and name H1' and segid STR2) 3.50 0.6!  31! 31

assign (resid 4 and name H8 and segid STR2)
 (resid 3 and name H1' and segid STR2) 2.91 0.6!  32! 32

assign (resid 4 and name H8 and segid STR2)
 (resid 4 and name H1' and segid STR2) 4.51 0.8!  33! 33

assign (resid 5 and name H6 and segid STR2)
 (resid 4 and name H1' and segid STR2) 3.62 0.8!  34! 34

assign (resid 5 and name H6 and segid STR2)
 (resid 5 and name H1' and segid STR2) 3.23 0.6!  35! 35

assign (resid 1 and name H8 and segid STR2)
 (resid 1 and name H1' and segid STR2) 3.45 0.6!  36! 36

assign (resid 7 and name H6 and segid STR2)
 (resid 6 and name H1' and segid STR2) 3.40 0.6!  38! 38

assign (resid 7 and name H6 and segid STR2)
 (resid 7 and name H1' and segid STR2) 3.90 0.6!  39! 39

assign (resid 8 and name H8 and segid STR2)
 (resid 7 and name H1' and segid STR2) 4.22 0.6!  40! 40

assign (resid 8 and name H8 and segid STR2)
 (resid 8 and name H1' and segid STR2) 3.39 0.6!  41! 41

assign (resid 9 and name H6 and segid STR2)
 (resid 8 and name H1' and segid STR2) 3.17 0.6!  42! 42

assign (resid 8 and name H6 and segid STR1)
 (resid 9 and name H5 and segid STR1) 3.85 0.8!  46! 46

assign (resid 10 and name H6 and segid STR2)
 (resid 10 and name H1' and segid STR2) 2.96 0.6!  47! 47

assign (resid 9 and name H6 and segid STR2)
 (resid 10 and name H1' and segid STR2) 4.63 0.6!  48! 48

assign (resid 10 and name H2 and segid STR1)
 (resid 10 and name H1' and segid STR1) 4.15 0.6!  49! 49

assign (resid 10 and name H2 and segid STR1)
 (resid 11 and name H1' and segid STR1) 3.65 0.6!  50! 50

assign (resid 10 and name H2 and segid STR1)
 (resid 2 and name H1' and segid STR2) 4.46 0.6!  51! 51

assign (resid 10 and name H2 and segid STR1)
 (resid 3 and name H1' and segid STR2) 4.86 0.6!  52! 52

assign (resid 4 and name H2 and segid STR2)
 (resid 4 and name H1' and segid STR2) 4.42 0.6!  53! 53

assign (resid 4 and name H2 and segid STR2)
 (resid 8 and name H1' and segid STR1) 5.04 0.8!  54! 54

assign (resid 4 and name H2 and segid STR2)
 (resid 9 and name H1' and segid STR1) 3.57 0.6!  55! 55

assign (resid 2 and name H2 and segid STR1)
 (resid 11 and name H1' and segid STR2) 4.68 0.8!  56! 56

assign (resid 2 and name H2 and segid STR1)
 (resid 2 and name H1' and segid STR1) 4.04 0.6!  57! 57

assign (resid 2 and name H2 and segid STR1)
 (resid 3 and name H1' and segid STR1) 3.74 0.6!  58! 58

assign (resid 2 and name H2 and segid STR1)
 (resid 10 and name H1' and segid STR2) 4.93 0.6!  59! 59

assign (resid 8 and name H2 and segid STR2)
 (resid 8 and name H1' and segid STR2) 4.11 0.6!  60! 60

assign (resid 8 and name H2 and segid STR2)
 (resid 9 and name H1' and segid STR2) 3.50 0.6!  61! 61

assign (resid 8 and name H2 and segid STR2)
 (resid 5 and name H1' and segid STR1) 4.17 0.6!  62! 62

assign (resid 6 and name H2 and segid STR1)
 (resid 7 and name H1' and segid STR1) 3.21 0.6!  63! 63

assign (resid 6 and name H2 and segid STR1)
 (resid 7 and name H1' and segid STR2) 3.15 0.6!  64! 64

assign (resid 8 and name H2 and segid STR2)
 (resid 4 and name H1' and segid STR1) 3.79 0.6!  65! 65

assign (resid 6 and name H2 and segid STR1)
 (resid 6 and name H1' and segid STR2) 5.32 0.8!  66! 66

assign (resid 2 and name H8 and segid STR1)
 (resid 3 and name H8 and segid STR1) 4.77 0.6!  67! 67

assign (resid 10 and name H8 and segid STR1)
 (resid 9 and name H6 and segid STR1) 4.93 0.8!  68! 68

assign (resid 8 and name H8 and segid STR2)
 (resid 7 and name H6 and segid STR2) 3.91 0.6!  69! 69

assign (resid 8 and name H8 and segid STR2)
 (resid 9 and name H6 and segid STR2) 5.06 0.8!  70! 70

assign (resid 4 and name H8 and segid STR2)
 (resid 5 and name H6 and segid STR2) 4.62 0.8!  71! 71

assign (resid 4 and name H8 and segid STR2)
 (resid 3 and name H8 and segid STR2) 4.31 0.6!  72! 72

assign (resid 3 and name H8 and segid STR2)
 (resid 2 and name H6 and segid STR2) 4.73 0.6!  73! 73

assign (resid 11 and name H8 and segid STR2)
 (resid 10 and name H6 and segid STR2) 5.53 0.8!  74! 74

assign (resid 1 and name H8 and segid STR2)
 (resid 2 and name H6 and segid STR2) 5.24 0.8!  75! 75

assign (resid 5 and name H8 and segid STR1)
 (resid 4 and name H6 and segid STR1) 4.22 0.6!  76! 76

assign (resid 3 and name H8 and segid STR1)
 (resid 4 and name H6 and segid STR1) 5.02 0.8!  77! 77

assign (resid 9 and name H6 and segid STR1)
 (resid 8 and name H6 and segid STR1) 3.76 0.6!  78! 78

assign (resid 7 and name H8 and segid STR1)
 (resid 8 and name H6 and segid STR1) 3.76 0.6!  79! 79

assign (resid 10 and name H8 and segid STR1)
 (resid 11 and name H6 and segid STR1) 5.19 0.8!  80! 80

assign (resid 7 and name H8 and segid STR1)
 (resid 6 and name H8 and segid STR1) 4.10 0.6!  81! 81

assign (resid 6 and name H8 and segid STR1)
 (resid 6 and name H3' and segid STR1) 5.59 0.8!  82! 82

assign (resid 1 and name H6 and segid STR1)
 (resid 1 and name H3' and segid STR1) 4.38 0.8!  83! 83

assign (resid 2 and name H8 and segid STR1)
 (resid 1 and name H3' and segid STR1) 4.00 0.6!  84! 84

assign (resid 3 and name H8 and segid STR1)
 (resid 2 and name H3' and segid STR1) 4.88 0.8!  85! 85

assign (resid 3 and name H8 and segid STR1)
 (resid 3 and name H3' and segid STR1) 3.99 0.6!  86! 86

assign (resid 4 and name H6 and segid STR1)
 (resid 3 and name H3' and segid STR1) 4.95 0.8!  87! 87

assign (resid 4 and name H6 and segid STR1)
 (resid 4 and name H3' and segid STR1) 4.44 0.6!  88! 88

assign (resid 5 and name H8 and segid STR1)
 (resid 4 and name H3' and segid STR1) 4.96 0.8!  89! 89

assign (resid 5 and name H8 and segid STR1)
 (resid 5 and name H3' and segid STR1) 4.35 0.8!  90! 90

assign (resid 6 and name H8 and segid STR1)
 (resid 5 and name H3' and segid STR1) 5.33 0.8!  91! 91

assign (resid 9 and name H6 and segid STR1)
 (resid 9 and name H3' and segid STR1) 3.89 0.6!  93! 93

assign (resid 8 and name H6 and segid STR1)
 (resid 9 and name H3' and segid STR1) 4.67 0.8!  94! 94

assign (resid 10 and name H8 and segid STR1)
 (resid 9 and name H3' and segid STR1) 4.92 0.6!  95! 95

assign (resid 11 and name H6 and segid STR1)
 (resid 10 and name H3' and segid STR1) 4.17 0.6!  96! 96

assign (resid 3 and name H8 and segid STR2)
 (resid 3 and name H3' and segid STR2) 4.10 0.8!  97! 97

assign (resid 3 and name H8 and segid STR2)
 (resid 2 and name H3' and segid STR2) 4.89 0.8!  98! 98

assign (resid 2 and name H6 and segid STR2)
 (resid 2 and name H3' and segid STR2) 3.82 0.8! 102! 102

assign (resid 5 and name H6 and segid STR2)
 (resid 4 and name H3' and segid STR2) 4.27 0.6! 103! 103

assign (resid 9 and name H6 and segid STR2)
 (resid 8 and name H3' and segid STR2) 4.37 0.6! 104! 104

assign (resid 4 and name H8 and segid STR2)
 (resid 5 and name H5 and segid STR2) 3.60 0.6! 105! 105

assign (resid 7 and name H6 and segid STR2)
 (resid 6 and name H3' and segid STR2) 4.08 0.6! 106! 106

assign (resid 7 and name H6 and segid STR2)
 (resid 7 and name H3' and segid STR2) 5.04 0.8! 107! 107

assign (resid 5 and name H6 and segid STR2)
 (resid 5 and name H4' and segid STR2) 4.87 0.6! 108! 108

assign (resid 9 and name H6 and segid STR2)
 (resid 9 and name H3' and segid STR2) 4.31 0.6! 109! 109

assign (resid 11 and name H8 and segid STR2)
 (resid 11 and name H3' and segid STR2) 3.91 0.8! 110! 110

assign (resid 4 and name H8 and segid STR2)
 (resid 4 and name H3' and segid STR2) 3.33 0.6! 113! 113

assign (resid 4 and name H6 and segid STR1)
 (resid 4 and name H4' and segid STR1) 3.52 0.6! 114! 114

assign (resid 3 and name H8 and segid STR1)
 (resid 3 and name H4' and segid STR1) 3.70 0.8! 115! 115

assign (resid 2 and name H8 and segid STR1)
 (resid 2 and name H4' and segid STR1) 4.33 0.8! 116! 116

assign (resid 1 and name H6 and segid STR1)
 (resid 1 and name H4' and segid STR1) 3.96 0.8! 117! 117

assign (resid 5 and name H8 and segid STR1)
 (resid 5 and name H4' and segid STR1) 4.82 0.8! 118! 118

assign (resid 7 and name H8 and segid STR1)
 (resid 7 and name H3' and segid STR1) 4.87 0.6! 119! 119

assign (resid 9 and name H6 and segid STR1)
 (resid 9 and name H4' and segid STR1) 3.17 0.6! 121! 121

assign (resid 10 and name H8 and segid STR1)
 (resid 10 and name H4' and segid STR1) 3.39 0.8! 122! 122

assign (resid 11 and name H6 and segid STR1)
 (resid 11 and name H3' and segid STR1) 3.77 0.6! 123! 123

assign (resid 1 and name H8 and segid STR2)
 (resid 1 and name H4' and segid STR2) 4.39 0.8! 124! 124

assign (resid 2 and name H6 and segid STR2)
 (resid 2 and name H4' and segid STR2) 3.81 0.6! 125! 125

assign (resid 3 and name H8 and segid STR2)
 (resid 3 and name H4' and segid STR2) 4.58 0.8! 126! 126

assign (resid 4 and name H8 and segid STR2)
 (resid 4 and name H4' and segid STR2) 5.09 0.8! 127! 127

assign (resid 7 and name H6 and segid STR2)
 (resid 7 and name H4' and segid STR2) 3.59 0.6! 128! 128

assign (resid 8 and name H8 and segid STR2)
 (resid 8 and name H4' and segid STR2) 4.74 0.8! 129! 129

assign (resid 9 and name H6 and segid STR2)
 (resid 9 and name H4' and segid STR2) 3.34 0.8! 130! 130

assign (resid 11 and name H8 and segid STR2)
 (resid 11 and name H4' and segid STR2) 4.34 0.8! 131! 131

assign (resid 1 and name H6 and segid STR1)
 (resid 1 and name H2' and segid STR1) 2.41 0.6! 132! 132

assign (resid 1 and name H6 and segid STR1)
 (resid 1 and name H2'' and segid STR1) 3.40 0.6! 133! 133

assign (resid 2 and name H1' and segid STR1)
 (resid 2 and name H2'' and segid STR1) 2.15 0.6! 135! 135

assign (resid 3 and name H8 and segid STR1)
 (resid 3 and name H2' and segid STR1) 2.43 0.6! 136! 136

assign (resid 3 and name H8 and segid STR1)
 (resid 3 and name H2'' and segid STR1) 3.61 0.8! 137! 137

assign (resid 3 and name H1' and segid STR1)
 (resid 3 and name H2' and segid STR1) 2.50 0.6! 138! 138

assign (resid 3 and name H1' and segid STR1)
 (resid 3 and name H2'' and segid STR1) 2.34 0.6! 139! 139

assign (resid 4 and name H6 and segid STR1)
 (resid 4 and name H2' and segid STR1) 2.41 0.6! 140! 140

assign (resid 4 and name H6 and segid STR1)
 (resid 3 and name H2'' and segid STR1) 2.67 0.6! 141! 141

assign (resid 4 and name H6 and segid STR1)
 (resid 4 and name H2'' and segid STR1) 2.67 0.6! 142! 142

assign (resid 5 and name H8 and segid STR1)
 (resid 4 and name H2' and segid STR1) 3.33 0.6! 144! 144

assign (resid 5 and name H8 and segid STR1)
 (resid 4 and name H2'' and segid STR1) 2.76 0.6! 145! 145

assign (resid 4 and name H6 and segid STR1)
 (resid 3 and name H2' and segid STR1) 2.84 0.6! 147! 147

assign (resid 6 and name H8 and segid STR1)
 (resid 6 and name HX'' and segid STR1) 2.85 0.6! 148! 148

assign (resid 6 and name H8 and segid STR1)
 (resid 6 and name H2'' and segid STR1) 3.37 0.6! 149! 149

assign (resid 6 and name H8 and segid STR1)
 (resid 6 and name H2' and segid STR1) 3.08 0.6! 150! 150

assign (resid 7 and name H8 and segid STR1)
 (resid 7 and name H2'' and segid STR1) 3.01 0.6! 153! 153

assign (resid 7 and name H8 and segid STR1)
 (resid 6 and name H2'' and segid STR1) 2.81 0.6! 155! 155

assign (resid 7 and name H1' and segid STR1)
 (resid 7 and name H2'' and segid STR1) 2.91 0.8! 156! 156

assign (resid 7 and name H1' and segid STR1)
 (resid 7 and name H2' and segid STR1) 1.95 0.6! 157! 157

assign (resid 8 and name H6 and segid STR1)
 (resid 8 and name H2' and segid STR1) 2.10 0.6! 160! 160

assign (resid 8 and name H6 and segid STR1)
 (resid 7 and name H2'' and segid STR1) 3.17 0.6! 161! 161

assign (resid 9 and name H6 and segid STR1)
 (resid 9 and name H2'' and segid STR1) 2.92 0.8! 164! 164

assign (resid 9 and name H6 and segid STR1)
 (resid 8 and name H2'' and segid STR1) 2.16 0.6! 165! 165

assign (resid 9 and name H1' and segid STR1)
 (resid 9 and name H2' and segid STR1) 3.30 0.6! 166! 166

assign (resid 9 and name H1' and segid STR1)
 (resid 9 and name H2'' and segid STR1) 2.37 0.8! 167! 167

assign (resid 10 and name H1' and segid STR1)
 (resid 10 and name H2' and segid STR1) 2.81 0.6! 168! 168

assign (resid 10 and name H1' and segid STR1)
 (resid 10 and name H2'' and segid STR1) 1.99 0.6! 169! 169

assign (resid 11 and name H6 and segid STR1)
 (resid 10 and name H2'' and segid STR1) 2.39 0.6! 171! 171

assign (resid 11 and name H6 and segid STR1)
 (resid 10 and name H2' and segid STR1) 3.25 0.6! 172! 172

assign (resid 1 and name H8 and segid STR2)
 (resid 1 and name H2' and segid STR2) 2.55 0.6! 175! 175

assign (resid 1 and name H8 and segid STR2)
 (resid 1 and name H2'' and segid STR2) 3.76 0.6! 176! 176

assign (resid 2 and name H6 and segid STR2)
 (resid 1 and name H2'' and segid STR2) 2.46 0.6! 177! 177

assign (resid 2 and name H6 and segid STR2)
 (resid 1 and name H2' and segid STR2) 3.45 0.6! 178! 178

assign (resid 2 and name H6 and segid STR2)
 (resid 2 and name H2'' and segid STR2) 3.30 0.6! 179! 179

assign (resid 2 and name H6 and segid STR2)
 (resid 2 and name H2' and segid STR2) 2.02 0.6! 180! 180

assign (resid 3 and name H8 and segid STR2)
 (resid 2 and name H2' and segid STR2) 3.43 0.6! 182! 182

assign (resid 3 and name H8 and segid STR2)
 (resid 2 and name H2'' and segid STR2) 2.73 0.6! 183! 183

assign (resid 3 and name H8 and segid STR2)
 (resid 3 and name H2' and segid STR2) 2.23 0.6! 184! 184

assign (resid 3 and name H8 and segid STR2)
 (resid 3 and name H2'' and segid STR2) 3.36 0.8! 185! 185

assign (resid 4 and name H1' and segid STR2)
 (resid 4 and name H2'' and segid STR2) 1.88 0.6! 186! 186

assign (resid 4 and name H1' and segid STR2)
 (resid 4 and name H2' and segid STR2) 2.54 0.6! 187! 187

assign (resid 4 and name H8 and segid STR2)
 (resid 4 and name H2'' and segid STR2) 3.66 0.6! 188! 188

assign (resid 5 and name H6 and segid STR2)
 (resid 4 and name H2'' and segid STR2) 2.50 0.6! 190! 190

assign (resid 5 and name H6 and segid STR2)
 (resid 4 and name H2' and segid STR2) 2.96 0.6! 191! 191

assign (resid 5 and name H6 and segid STR2)
 (resid 5 and name H2'' and segid STR2) 3.25 0.6! 192! 192

assign (resid 5 and name H6 and segid STR2)
 (resid 5 and name H2' and segid STR2) 2.55 0.6! 193! 193

assign (resid 7 and name H6 and segid STR2)
 (resid 7 and name H2' and segid STR2) 2.48 0.6! 194! 194

assign (resid 7 and name H6 and segid STR2)
 (resid 7 and name H2'' and segid STR2) 2.41 0.6! 195! 195

assign (resid 9 and name H6 and segid STR2)
 (resid 8 and name H2'' and segid STR2) 1.99 0.6! 197! 197

assign (resid 9 and name H6 and segid STR2)
 (resid 8 and name H2' and segid STR2) 3.11 0.6! 198! 198

assign (resid 11 and name H8 and segid STR2)
 (resid 11 and name H2' and segid STR2) 2.09 0.6! 202! 202

assign (resid 3 and name H8 and segid STR1)
 (resid 2 and name H2' and segid STR1) 3.25 0.6! 205! 205

assign (resid 3 and name H8 and segid STR1)
 (resid 2 and name H2'' and segid STR1) 2.76 0.6! 206! 206

assign (resid 2 and name H8 and segid STR1)
 (resid 1 and name H2' and segid STR1) 3.01 0.6! 207! 207

assign (resid 8 and name H8 and segid STR2)
 (resid 7 and name H2' and segid STR2) 3.15 0.6! 208! 208

assign (resid 10 and name H8 and segid STR1)
 (resid 9 and name H2' and segid STR1) 3.58 0.8! 209! 209

assign (resid 11 and name H1' and segid STR2)
 (resid 11 and name H2'' and segid STR2) 2.28 0.6! 210! 210

assign (resid 11 and name H1' and segid STR2)
 (resid 11 and name H2' and segid STR2) 2.77 0.6! 211! 211

assign (resid 1 and name H1' and segid STR1)
 (resid 1 and name H2'' and segid STR1) 1.99 0.6! 214! 214

assign (resid 4 and name H1' and segid STR1)
 (resid 4 and name H2' and segid STR1) 3.69 0.6! 215! 215

assign (resid 4 and name H1' and segid STR1)
 (resid 4 and name H2'' and segid STR1) 1.94 0.6! 216! 216

assign (resid 8 and name H1' and segid STR1)
 (resid 8 and name H2' and segid STR1) 2.57 0.6! 217! 217

assign (resid 8 and name H1' and segid STR1)
 (resid 8 and name H2'' and segid STR1) 2.17 0.6! 218! 218

assign (resid 1 and name H1' and segid STR2)
 (resid 1 and name H2' and segid STR2) 3.06 0.6! 219! 219

assign (resid 2 and name H1' and segid STR2)
 (resid 2 and name H2' and segid STR2) 2.42 0.8! 220! 220

assign (resid 7 and name H1' and segid STR2)
 (resid 7 and name H2' and segid STR2) 2.89 0.6! 222! 222

assign (resid 7 and name H1' and segid STR2)
 (resid 7 and name H2'' and segid STR2) 2.18 0.6! 223! 223

assign (resid 9 and name H1' and segid STR2)
 (resid 9 and name H2' and segid STR2) 1.79 0.6! 224! 224

assign (resid 7 and name H6 and segid STR2)
 (resid 6 and name H2'' and segid STR2) 2.44 0.6! 230! 230

assign (resid 6 and name H1' and segid STR1)
 (resid 6 and name H2'' and segid STR2) 3.58 0.8! 231! 231

assign (resid 7 and name H5 and segid STR2)
 (resid 6 and name H2'' and segid STR2) 2.77 0.6! 232! 232

assign (resid 7 and name H5 and segid STR2)
 (resid 7 and name H2' and segid STR2) 4.07 0.6! 233! 233

assign (resid 7 and name H5 and segid STR2)
 (resid 7 and name H2'' and segid STR2) 2.84 0.6! 234! 234

assign (resid 9 and name H5 and segid STR2)
 (resid 8 and name H2' and segid STR2) 3.74 0.6! 235! 235

assign (resid 9 and name H5 and segid STR2)
 (resid 8 and name H2'' and segid STR2) 2.71 0.6! 236! 236

assign (resid 5 and name H5 and segid STR2)
 (resid 4 and name H2' and segid STR2) 3.05 0.6! 237! 237

assign (resid 5 and name H5 and segid STR2)
 (resid 4 and name H2'' and segid STR2) 3.12 0.6! 238! 238

assign (resid 9 and name H5 and segid STR2)
 (resid 9 and name H2' and segid STR2) 3.23 0.6! 240! 240

assign (resid 5 and name H5 and segid STR2)
 (resid 5 and name H2' and segid STR2) 4.28 0.8! 241! 241

assign (resid 3 and name H1' and segid STR2)
 (resid 3 and name H2' and segid STR2) 2.49 0.6! 242! 242

assign (resid 3 and name H1' and segid STR2)
 (resid 3 and name H2'' and segid STR2) 2.08 0.6! 243! 243

assign (resid 9 and name H5 and segid STR1)
 (resid 9 and name H2' and segid STR1) 2.59 0.6! 244! 244

assign (resid 9 and name H5 and segid STR1)
 (resid 8 and name H2'' and segid STR1) 3.09 0.6! 245! 245

assign (resid 1 and name H1' and segid STR1)
 (resid 1 and name H3' and segid STR1) 4.61 0.8! 246! 246

assign (resid 2 and name H1' and segid STR1)
 (resid 2 and name H3' and segid STR1) 3.62 0.8! 247! 247

assign (resid 3 and name H1' and segid STR1)
 (resid 3 and name H3' and segid STR1) 3.78 0.6! 248! 248

assign (resid 5 and name H1' and segid STR1)
 (resid 5 and name H3' and segid STR1) 3.44 0.6! 250! 250

assign (resid 7 and name H1' and segid STR1)
 (resid 7 and name H3' and segid STR1) 3.50 0.6! 251! 251

assign (resid 8 and name H6 and segid STR1)
 (resid 8 and name H3' and segid STR1) 3.99 0.6! 252! 252

assign (resid 8 and name H1' and segid STR1)
 (resid 9 and name H3' and segid STR1) 4.08 0.6! 253! 253

assign (resid 9 and name H1' and segid STR1)
 (resid 9 and name H3' and segid STR1) 4.71 0.8! 254! 254

assign (resid 10 and name H1' and segid STR1)
 (resid 10 and name H3' and segid STR1) 4.53 0.6! 255! 255

assign (resid 11 and name H1' and segid STR1)
 (resid 11 and name H3' and segid STR1) 3.95 0.6! 256! 256

assign (resid 11 and name H1' and segid STR2)
 (resid 11 and name H3' and segid STR2) 4.63 0.6! 257! 257

assign (resid 9 and name H1' and segid STR2)
 (resid 9 and name H3' and segid STR2) 5.47 0.8! 258! 258

assign (resid 8 and name H1' and segid STR2)
 (resid 8 and name H3' and segid STR2) 3.17 0.6! 259! 259

assign (resid 7 and name H1' and segid STR2)
 (resid 7 and name H3' and segid STR2) 5.33 0.8! 260! 260

assign (resid 7 and name H5 and segid STR2)
 (resid 6 and name H3' and segid STR2) 5.26 0.8! 261! 261

assign (resid 5 and name H6 and segid STR2)
 (resid 5 and name H3' and segid STR2) 4.64 0.6! 262! 262

assign (resid 5 and name H1' and segid STR2)
 (resid 5 and name H3' and segid STR2) 4.75 0.6! 263! 263

assign (resid 4 and name H1' and segid STR2)
 (resid 4 and name H3' and segid STR2) 3.46 0.6! 264! 264

assign (resid 3 and name H1' and segid STR2)
 (resid 3 and name H3' and segid STR2) 3.82 0.6! 265! 265

assign (resid 11 and name H5 and segid STR1)
 (resid 10 and name H2' and segid STR1) 3.17 0.6! 267! 267

assign (resid 11 and name H5 and segid STR1)
 (resid 10 and name H2'' and segid STR1) 3.18 0.6! 268! 268

assign (resid 10 and name H1' and segid STR1)
 (resid 11 and name H5 and segid STR1) 3.89 0.6! 269! 269

assign (resid 4 and name H1' and segid STR2)
 (resid 5 and name H5 and segid STR2) 4.85 0.8! 270! 270

assign (resid 8 and name H1' and segid STR2)
 (resid 9 and name H5 and segid STR2) 3.82 0.6! 271! 271

assign (resid 4 and name H1' and segid STR2)
 (resid 5 and name H1' and segid STR2) 3.98 0.8! 272! 272

assign (resid 4 and name H1' and segid STR2)
 (resid 3 and name H1' and segid STR2) 4.31 0.8! 273! 273

assign (resid 8 and name H1' and segid STR2)
 (resid 9 and name H1' and segid STR2) 3.73 0.6! 274! 274

assign (resid 8 and name H6 and segid STR1)
 (resid 8 and name H4' and segid STR1) 3.80 0.6!  120! 120

assign (resid 10 and name H6 and segid STR2)
 (resid 10 and name H4' and segid STR2) 3.46 0.6!  120! 120

assign (resid 2 and name H1' and segid STR1)
 (resid 2 and name H2' and segid STR1) 3.39 0.6!  134! 134

assign (resid 1 and name H1' and segid STR2)
 (resid 1 and name H2'' and segid STR2) 2.22 0.6!  134! 134

assign (resid 9 and name H6 and segid STR2)
 (resid 9 and name H2' and segid STR2) 1.60 0.6!  196! 196

assign (resid 10 and name H6 and segid STR2)
 (resid 10 and name H2' and segid STR2) 2.69 0.6!  196! 196

assign (resid 4 and name H1' and segid STR1)
 (resid 4 and name H3' and segid STR1) 4.82 0.8!  249! 249

assign (resid 6 and name H1' and segid STR2)
 (resid 6 and name H3' and segid STR2) 3.15 0.6!  249! 249

assign (resid 5 and name H8 and segid STR1)
 (resid 5 and name H2' and segid STR1) 2.37 0.6!  146! 146

assign (resid 5 and name H8 and segid STR1)
 (resid 5 and name H2'' and segid STR1) 4.67 0.6!  146! 146

assign (resid 7 and name H8 and segid STR1)
 (resid 7 and name H2' and segid STR1) 2.84 0.6!  154! 154

assign (resid 7 and name H8 and segid STR1)
 (resid 6 and name H2' and segid STR1) 5.45 0.8!  154! 154

assign (resid 8 and name H6 and segid STR1)
 (resid 7 and name H2' and segid STR1) 2.14 0.6!  162! 162

assign (resid 8 and name H6 and segid STR1)
 (resid 8 and name H2'' and segid STR1) 3.18 0.6!  162! 162

assign (resid 9 and name H6 and segid STR1)
 (resid 8 and name H2' and segid STR1) 2.29 0.6!  163! 163

assign (resid 9 and name H6 and segid STR1)
 (resid 9 and name H2' and segid STR1) 1.87 0.6!  163! 163

assign (resid 11 and name H6 and segid STR1)
 (resid 11 and name H2' and segid STR1) 2.17 0.6!  173! 173

assign (resid 11 and name H6 and segid STR1)
 (resid 11 and name H2'' and segid STR1) 4.35 0.6!  173! 173

assign (resid 4 and name H8 and segid STR2)
 (resid 4 and name H2' and segid STR2) 2.16 0.6!  189! 189

assign (resid 4 and name H8 and segid STR2)
 (resid 3 and name H2' and segid STR2) 2.93 0.8!  189! 189

assign (resid 11 and name H1' and segid STR1)
 (resid 11 and name H2' and segid STR1) 2.53 0.6!  212! 212

assign (resid 11 and name H1' and segid STR1)
 (resid 11 and name H2'' and segid STR1) 2.36 0.6!  212! 212

assign (resid 11 and name H5 and segid STR1)
 (resid 11 and name H2' and segid STR1) 3.69 0.8!  266! 266

assign (resid 11 and name H5 and segid STR1)
 (resid 11 and name H2'' and segid STR1) 5.26 0.8!  266! 266

assign (resid 9 and name H6 and segid STR2)
 ((resid 10 and name H51 and segid STR2) or
 (resid 10 and name H52 and segid STR2) or
 (resid 10 and name H53 and segid STR2)) 3.65 0.6!  201! 201

assign (resid 10 and name H6 and segid STR2)
 ((resid 10 and name H51 and segid STR2) or
 (resid 10 and name H52 and segid STR2) or
 (resid 10 and name H53 and segid STR2)) 3.30 0.6!  201! 201

assign (resid 4 and name H6 and segid STR1)
 ((resid 4 and name H51 and segid STR1) or
 (resid 4 and name H52 and segid STR1) or
 (resid 4 and name H53 and segid STR1)) 2.98 0.6!  143! 143

assign (resid 7 and name H8 and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 4.15 0.6!  158! 158

assign (resid 8 and name H6 and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 2.75 0.6!  159! 159

assign (resid 3 and name H8 and segid STR1)
 ((resid 4 and name H51 and segid STR1) or
 (resid 4 and name H52 and segid STR1) or
 (resid 4 and name H53 and segid STR1)) 3.79 0.6!  170! 170

assign (resid 1 and name H8 and segid STR2)
 ((resid 2 and name H51 and segid STR2) or
 (resid 2 and name H52 and segid STR2) or
 (resid 2 and name H53 and segid STR2)) 3.97 0.6!  174! 174

assign (resid 2 and name H6 and segid STR2)
 ((resid 2 and name H51 and segid STR2) or
 (resid 2 and name H52 and segid STR2) or
 (resid 2 and name H53 and segid STR2)) 2.94 0.6!  181! 181

assign (resid 9 and name H5 and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 3.25 0.8!  225! 225

assign (resid 7 and name H1' and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 5.71 0.8!  226! 226

assign (resid 3 and name H1' and segid STR1)
 ((resid 4 and name H51 and segid STR1) or
 (resid 4 and name H52 and segid STR1) or
 (resid 4 and name H53 and segid STR1)) 4.43 0.6!  227! 227

assign (resid 1 and name H1' and segid STR2)
 ((resid 2 and name H51 and segid STR2) or
 (resid 2 and name H52 and segid STR2) or
 (resid 2 and name H53 and segid STR2)) 4.56 0.6!  228! 228

assign (resid 9 and name H1' and segid STR2)
 ((resid 10 and name H51 and segid STR2) or
 (resid 10 and name H52 and segid STR2) or
 (resid 10 and name H53 and segid STR2)) 4.78 0.6!  229! 229

assign (resid 9 and name H5 and segid STR2)
 ((resid 10 and name H51 and segid STR2) or
 (resid 10 and name H52 and segid STR2) or
 (resid 10 and name H53 and segid STR2)) 3.99 0.6!  239! 239

assign (resid 9 and name H2' and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 4.56 0.6!  275! 275

assign (resid 7 and name H2'' and segid STR1)
 ((resid 8 and name H51 and segid STR1) or
 (resid 8 and name H52 and segid STR1) or
 (resid 8 and name H53 and segid STR1)) 3.89 0.8!  276! 276


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    C   1          1H5*        C   1   2.611 -15.748   7.631
    2   2H5*    C   1          2H5*        C   1   3.806 -14.505   7.207
    3    H4*    C   1           H4*        C   1   1.524 -13.812   6.577
    4    H3*    C   1           H3*        C   1   3.375 -12.320   8.139
    5    H1*    C   1           H1*        C   1  -0.522 -12.405   8.806
    6   1H4     C   1          H41         C   1  -1.633 -13.655  14.880
    7   2H4     C   1          H42         C   1  -0.269 -14.732  14.995
    8    H5     C   1           H5         C   1   1.472 -14.798  13.237
    9    H6     C   1           H6         C   1   1.892 -14.261  10.871
   10   1H2*    C   1          1H2*        C   1   2.150 -11.946  10.004
   11   2H2*    C   1          2H2*        C   1   1.151 -10.877   8.990
   12    H5T    C   1           H5T        C   1   3.582 -13.791   9.444
   13   1H5*    A   2          1H5*        A   2  -0.325 -10.236   6.638
   14   2H5*    A   2          2H5*        A   2  -0.114  -8.538   6.160
   15    H4*    A   2           H4*        A   2  -2.156  -8.896   7.529
   16    H3*    A   2           H3*        A   2  -0.146  -6.924   7.928
   17    H1*    A   2           H1*        A   2  -2.132  -8.760  10.756
   18    H8     A   2           H8         A   2   1.769  -9.352  10.599
   19   1H6     A   2          1H6         A   2   1.070 -11.890  16.162
   20   2H6     A   2          2H6         A   2   2.217 -11.442  14.919
   21    H2     A   2           H2         A   2  -2.999 -10.697  14.679
   22   1H2*    A   2          1H2*        A   2   0.495  -7.483  10.037
   23   2H2*    A   2          2H2*        A   2  -1.045  -6.732  10.528
   24   1H5*    G   3          1H5*        G   3  -4.361  -7.649   9.791
   25   2H5*    G   3          2H5*        G   3  -5.168  -6.097   9.498
   26    H4*    G   3           H4*        G   3  -6.338  -7.326  11.229
   27    H3*    G   3           H3*        G   3  -5.383  -4.703  11.523
   28    H1*    G   3           H1*        G   3  -5.226  -7.388  14.440
   29    H8     G   3           H8         G   3  -2.113  -6.442  12.470
   30    H1     G   3           H1         G   3  -0.919  -8.975  18.191
   31   1H2     G   3          H21         G   3  -4.391  -9.077  18.499
   32   2H2     G   3          H22         G   3  -2.835  -9.410  19.227
   33   1H2*    G   3          1H2*        G   3  -3.945  -4.984  13.258
   34   2H2*    G   3          2H2*        G   3  -5.419  -5.116  14.258
   35   1H5*    T   4          1H5*        T   4  -7.943  -6.797  14.920
   36   2H5*    T   4          2H5*        T   4  -9.260  -5.647  15.226
   37    H4*    T   4           H4*        T   4  -8.679  -6.790  17.300
   38    H3*    T   4           H3*        T   4  -8.786  -3.997  16.955
   39   1H2*    T   4          1H2*        T   4  -6.562  -3.514  17.222
   40   2H2*    T   4          2H2*        T   4  -6.906  -3.689  18.943
   41    H1*    T   4           H1*        T   4  -6.005  -5.868  19.131
   42    H3     T   4           H3         T   4  -1.576  -5.945  18.528
   43   1H5M    T   4          H51         T   4  -1.755  -3.174  14.827
   44   2H5M    T   4          H52         T   4  -3.418  -3.421  14.249
   45   3H5M    T   4          H53         T   4  -3.065  -2.117  15.404
   46    H6     T   4           H6         T   4  -5.158  -3.875  16.113
   47   1H5*    G   5          1H5*        G   5  -7.768  -5.867  21.236
   48   2H5*    G   5          2H5*        G   5  -8.776  -4.967  22.386
   49    H4*    G   5           H4*        G   5  -6.658  -5.533  23.435
   50    H3*    G   5           H3*        G   5  -7.637  -2.864  23.126
   51    H1*    G   5           H1*        G   5  -3.906  -4.019  23.114
   52    H8     G   5           H8         G   5  -5.255  -2.445  19.803
   53    H1     G   5           H1         G   5   1.061  -3.189  20.098
   54   1H2     G   5          H21         G   5   0.469  -4.469  23.276
   55   2H2     G   5          H22         G   5   1.642  -4.048  22.047
   56   1H2*    G   5          1H2*        G   5  -5.809  -1.929  22.124
   57   2H2*    G   5          2H2*        G   5  -5.022  -2.104  23.724
   58   1H5*  2AR   6          1H5*      2AR   6  -4.093  -3.987  26.149
   59   2H5*  2AR   6          2H5*      2AR   6  -4.421  -3.066  27.631
   60    H4*  2AR   6           H4*      2AR   6  -2.004  -3.200  27.228
   61   1HX*  2AR   6          1HX*      2AR   6  -1.209  -3.152  25.089
   62   2HX*  2AR   6          2HX*      2AR   6  -2.807  -2.642  24.476
   63    H1*  2AR   6           H1*      2AR   6  -0.450  -0.985  25.303
   64    H2   2AR   6           H2       2AR   6   2.565  -0.118  22.145
   65   1H6   2AR   6          1H6       2AR   6   0.044   0.896  18.577
   66   2H6   2AR   6          2H6       2AR   6  -1.628   0.746  19.072
   67    H8   2AR   6           H8       2AR   6  -3.728  -0.439  23.229
   68   2H2*  2AR   6          2H2*      2AR   6  -1.733   0.706  26.312
   69   1H2*  2AR   6          1H2*      2AR   6  -3.256   0.093  25.617
   70    H3*  2AR   6           H3*      2AR   6  -3.433  -0.844  27.729
   71   1H5*    G   7          1H5*        G   7   1.587  -0.815  26.823
   72   2H5*    G   7          2H5*        G   7   1.900  -0.035  28.386
   73    H4*    G   7           H4*        G   7   3.605   0.714  26.887
   74    H3*    G   7           H3*        G   7   1.738   2.515  28.060
   75    H1*    G   7           H1*        G   7   3.443   2.802  24.614
   76    H8     G   7           H8         G   7  -0.419   2.912  24.383
   77    H1     G   7           H1         G   7   2.516   3.253  18.768
   78   1H2     G   7          H21         G   7   5.442   2.733  20.571
   79   2H2     G   7          H22         G   7   4.691   2.995  19.010
   80   1H2*    G   7          1H2*        G   7   0.866   3.352  26.079
   81   2H2*    G   7          2H2*        G   7   2.378   4.299  26.047
   82   1H5*    T   8          1H5*        T   8   5.517   3.533  25.587
   83   2H5*    T   8          2H5*        T   8   6.437   4.667  26.595
   84    H4*    T   8           H4*        T   8   7.031   5.118  24.343
   85    H3*    T   8           H3*        T   8   5.579   7.060  25.880
   86   1H2*    T   8          1H2*        T   8   4.027   7.621  24.339
   87   2H2*    T   8          2H2*        T   8   5.364   8.305  23.378
   88    H1*    T   8           H1*        T   8   5.497   6.481  21.993
   89    H3     T   8           H3         T   8   1.742   6.072  19.553
   90   1H5M    T   8          H51         T   8   0.059   5.486  24.505
   91   2H5M    T   8          H52         T   8   0.021   7.256  24.325
   92   3H5M    T   8          H53         T   8  -0.991   6.233  23.277
   93    H6     T   8           H6         T   8   2.591   6.262  24.272
   94   1H5*    C   9          1H5*        C   9   7.562   7.185  22.055
   95   2H5*    C   9          2H5*        C   9   8.811   8.440  21.938
   96    H4*    C   9           H4*        C   9   8.012   8.123  19.732
   97    H3*    C   9           H3*        C   9   7.530  10.567  21.135
   98    H1*    C   9           H1*        C   9   5.201   8.883  18.416
   99   1H4     C   9          H41         C   9  -0.228   9.462  22.167
  100   2H4     C   9          H42         C   9  -0.760   9.121  20.533
  101    H5     C   9           H5         C   9   2.133   9.641  22.770
  102    H6     C   9           H6         C   9   4.409   9.379  21.978
  103   1H2*    C   9          1H2*        C   9   5.293  10.751  20.765
  104   2H2*    C   9          2H2*        C   9   5.737  11.051  19.054
  105   1H5*    A  10          1H5*        A  10   8.017  10.133  16.254
  106   2H5*    A  10          2H5*        A  10   9.061  11.542  15.986
  107    H4*    A  10           H4*        A  10   7.845  10.956  13.956
  108    H3*    A  10           H3*        A  10   7.994  13.500  15.047
  109    H1*    A  10           H1*        A  10   4.458  12.081  13.763
  110    H8     A  10           H8         A  10   5.576  11.841  17.384
  111   1H6     A  10          1H6         A  10  -0.421  11.966  18.866
  112   2H6     A  10          2H6         A  10   1.203  11.821  19.500
  113    H2     A  10           H2         A  10  -0.049  12.427  14.413
  114   1H2*    A  10          1H2*        A  10   5.845  13.841  15.701
  115   2H2*    A  10          2H2*        A  10   5.529  14.095  13.962
  116   1H5*    C  11          1H5*        C  11   5.549  12.745  11.119
  117   2H5*    C  11          2H5*        C  11   6.041  13.983   9.944
  118    H4*    C  11           H4*        C  11   3.680  13.397   9.647
  119    H3*    C  11           H3*        C  11   4.659  16.062  10.218
  120    H1*    C  11           H1*        C  11   1.201  14.562  11.548
  121   1H4     C  11          H41         C  11   2.888  16.296  17.733
  122   2H4     C  11          H42         C  11   1.149  16.119  17.705
  123    H5     C  11           H5         C  11   4.277  15.988  15.791
  124    H6     C  11           H6         C  11   4.302  15.453  13.405
  125    H3T    C  11           H3T        C  11   2.504  15.074   8.630
  126   1H2*    C  11          1H2*        C  11   3.089  16.801  11.641
  127   2H2*    C  11          2H2*        C  11   1.836  16.418  10.427
  128   1H5*    G  12          1H5*        G  12  -7.569  18.504  19.698
  129   2H5*    G  12          2H5*        G  12  -8.164  19.614  18.446
  130    H4*    G  12           H4*        G  12  -8.514  17.722  16.915
  131    H3*    G  12           H3*        G  12  -8.077  16.194  19.381
  132    H1*    G  12           H1*        G  12  -5.568  16.286  16.278
  133    H8     G  12           H8         G  12  -5.102  17.332  19.989
  134    H1     G  12           H1         G  12   0.259  15.707  16.956
  135   1H2     G  12          H21         G  12  -0.190  15.110  14.879
  136   2H2     G  12          H22         G  12  -1.811  15.108  14.227
  137   1H2*    G  12          1H2*        G  12  -6.210  15.094  18.828
  138   2H2*    G  12          2H2*        G  12  -6.859  14.700  17.213
  139    H5T    G  12           H5T        G  12  -9.823  17.492  19.050
  140   1H5*    T  13          1H5*        T  13  -8.775  14.735  15.303
  141   2H5*    T  13          2H5*        T  13  -9.691  13.233  15.063
  142    H4*    T  13           H4*        T  13  -7.849  13.516  13.427
  143    H3*    T  13           H3*        T  13  -8.386  11.210  15.027
  144   1H2*    T  13          1H2*        T  13  -6.343  10.871  15.920
  145   2H2*    T  13          2H2*        T  13  -5.810  10.463  14.265
  146    H1*    T  13           H1*        T  13  -4.815  12.505  13.955
  147    H3     T  13           H3         T  13  -1.417  12.777  16.873
  148   1H5M    T  13          H51         T  13  -4.247  12.755  20.532
  149   2H5M    T  13          H52         T  13  -5.702  13.501  19.831
  150   3H5M    T  13          H53         T  13  -5.553  11.729  19.891
  151    H6     T  13           H6         T  13  -6.188  12.552  17.351
  152   1H5*    G  14          1H5*        G  14  -5.812  10.972  11.471
  153   2H5*    G  14          2H5*        G  14  -6.290   9.599  10.451
  154    H4*    G  14           H4*        G  14  -3.877  10.036  10.266
  155    H3*    G  14           H3*        G  14  -5.079   7.544  10.916
  156    H1*    G  14           H1*        G  14  -1.693   8.866  12.432
  157    H8     G  14           H8         G  14  -4.800   8.536  14.745
  158    H1     G  14           H1         G  14   0.784   8.992  17.767
  159   1H2     G  14          H21         G  14   2.150   9.156  14.564
  160   2H2     G  14          H22         G  14   2.433   9.150  16.290
  161   1H2*    G  14          1H2*        G  14  -4.068   7.119  12.901
  162   2H2*    G  14          2H2*        G  14  -2.600   6.823  11.929
  163   1H5*    A  15          1H5*        A  15  -0.511   8.071   9.868
  164   2H5*    A  15          2H5*        A  15  -0.187   6.836   8.637
  165    H4*    A  15           H4*        A  15   1.831   7.201   9.921
  166    H3*    A  15           H3*        A  15   0.486   4.681   9.757
  167    H1*    A  15           H1*        A  15   2.421   6.037  12.927
  168    H8     A  15           H8         A  15  -1.434   5.576  12.975
  169   1H6     A  15          1H6         A  15  -0.916   5.672  19.111
  170   2H6     A  15          2H6         A  15  -2.030   5.566  17.766
  171    H2     A  15           H2         A  15   3.203   6.076  17.356
  172   1H2*    A  15          1H2*        A  15   0.331   4.157  11.941
  173   2H2*    A  15          2H2*        A  15   2.111   4.009  11.920
  174   1H5*    C  16          1H5*        C  16   4.862   5.035  11.016
  175   2H5*    C  16          2H5*        C  16   5.892   3.740  10.373
  176    H4*    C  16           H4*        C  16   6.561   4.359  12.657
  177    H3*    C  16           H3*        C  16   5.978   1.711  11.725
  178    H1*    C  16           H1*        C  16   5.316   3.203  15.308
  179   1H4     C  16          H41         C  16  -1.184   2.238  16.223
  180   2H4     C  16          H42         C  16  -0.452   2.484  17.793
  181    H5     C  16           H5         C  16   0.077   2.244  14.170
  182    H6     C  16           H6         C  16   2.297   2.488  13.192
  183   1H2*    C  16          1H2*        C  16   4.267   1.256  13.243
  184   2H2*    C  16          2H2*        C  16   5.598   1.060  14.413
  185   1H5*  8OG  17          1H5*      8OG  17   8.655   2.166  15.823
  186   2H5*  8OG  17          2H5*      8OG  17   9.858   0.878  15.608
  187    H4*  8OG  17           H4*      8OG  17   9.255   1.094  17.970
  188    H3*  8OG  17           H3*      8OG  17   9.068  -1.308  16.446
  189   1H2*  8OG  17          1H2*      8OG  17   6.884  -1.789  16.798
  190   2H2*  8OG  17          2H2*      8OG  17   7.416  -2.255  18.441
  191    H1*  8OG  17           H1*      8OG  17   6.728  -0.223  19.355
  192    H1   8OG  17           H1       8OG  17   2.123  -1.093  14.052
  193    H7   8OG  17           H7       8OG  17   2.149  -0.134  18.957
  194   1H2   8OG  17          1H2       8OG  17   5.475  -1.299  13.114
  195   2H2   8OG  17          2H2       8OG  17   3.798  -1.392  12.628
  196   1H5*    C  18          1H5*        C  18   9.137  -1.490  21.238
  197   2H5*    C  18          2H5*        C  18  10.140  -2.893  21.663
  198    H4*    C  18           H4*        C  18   8.263  -2.694  23.227
  199    H3*    C  18           H3*        C  18   8.957  -5.002  21.804
  200    H1*    C  18           H1*        C  18   5.332  -3.920  22.490
  201   1H4     C  18          H41         C  18   2.660  -3.492  16.458
  202   2H4     C  18          H42         C  18   1.403  -3.055  17.596
  203    H5     C  18           H5         C  18   4.940  -3.991  17.142
  204    H6     C  18           H6         C  18   6.472  -4.098  18.992
  205   1H2*    C  18          1H2*        C  18   7.185  -5.044  20.393
  206   2H2*    C  18          2H2*        C  18   6.374  -5.850  21.714
  207   1H5*    A  19          1H5*        A  19   5.395  -5.685  25.416
  208   2H5*    A  19          2H5*        A  19   6.169  -7.142  26.073
  209    H4*    A  19           H4*        A  19   3.747  -7.371  26.233
  210    H3*    A  19           H3*        A  19   5.436  -9.185  24.911
  211    H1*    A  19           H1*        A  19   1.916  -8.294  23.696
  212    H8     A  19           H8         A  19   4.870  -7.397  21.376
  213   1H6     A  19          1H6         A  19   0.616  -5.685  17.276
  214   2H6     A  19          2H6         A  19   2.328  -5.886  17.569
  215    H2     A  19           H2         A  19  -1.504  -6.916  21.041
  216   1H2*    A  19          1H2*        A  19   4.646  -9.040  22.814
  217   2H2*    A  19          2H2*        A  19   3.318 -10.056  23.449
  218   1H5*    C  20          1H5*        C  20   1.209 -10.223  26.387
  219   2H5*    C  20          2H5*        C  20   0.933 -11.919  26.834
  220    H4*    C  20           H4*        C  20  -1.084 -10.920  25.837
  221    H3*    C  20           H3*        C  20   0.168 -13.343  25.026
  222    H1*    C  20           H1*        C  20  -1.624 -10.787  22.671
  223   1H4     C  20          H41         C  20   3.272  -9.879  18.292
  224   2H4     C  20          H42         C  20   1.812  -9.239  17.570
  225    H5     C  20           H5         C  20   3.317 -10.867  20.507
  226    H6     C  20           H6         C  20   2.058 -11.310  22.505
  227   1H2*    C  20          1H2*        C  20   0.619 -12.768  22.834
  228   2H2*    C  20          2H2*        C  20  -1.141 -13.050  22.608
  229   1H5*    T  21          1H5*        T  21  -4.086 -12.030  23.949
  230   2H5*    T  21          2H5*        T  21  -5.228 -13.377  24.121
  231    H4*    T  21           H4*        T  21  -5.995 -11.742  22.453
  232    H3*    T  21           H3*        T  21  -5.653 -14.559  22.002
  233   1H2*    T  21          1H2*        T  21  -4.513 -14.489  20.058
  234   2H2*    T  21          2H2*        T  21  -5.991 -13.796  19.328
  235    H1*    T  21           H1*        T  21  -5.147 -11.665  19.384
  236    H3     T  21           H3         T  21  -1.809 -12.055  16.376
  237   1H5M    T  21          H51         T  21  -0.209 -14.698  20.682
  238   2H5M    T  21          H52         T  21   0.954 -14.087  19.480
  239   3H5M    T  21          H53         T  21   0.504 -13.080  20.873
  240    H6     T  21           H6         T  21  -2.361 -13.271  20.974
  241   1H5*    G  22          1H5*        G  22  -8.727 -12.216  19.257
  242   2H5*    G  22          2H5*        G  22 -10.189 -13.224  19.281
  243    H4*    G  22           H4*        G  22  -9.935 -12.164  17.098
  244    H3*    G  22           H3*        G  22 -10.012 -15.039  17.530
  245    H1*    G  22           H1*        G  22  -7.780 -13.176  14.719
  246    H8     G  22           H8         G  22  -6.557 -15.354  17.712
  247    H1     G  22           H1         G  22  -2.403 -14.646  12.934
  248   1H2     G  22          H21         G  22  -4.858 -12.637  11.503
  249   2H2     G  22          H22         G  22  -3.236 -13.289  11.383
  250    H3T    G  22           H3T        G  22 -11.719 -13.630  16.804
  251   1H2*    G  22          1H2*        G  22  -8.482 -15.721  16.010
  252   2H2*    G  22          2H2*        G  22  -9.354 -14.823  14.737
  Start of MODEL    2
    1   1H5*    C   1          1H5*        C   1   2.016 -16.539   6.172
    2   2H5*    C   1          2H5*        C   1   3.067 -15.218   5.620
    3    H4*    C   1           H4*        C   1   0.691 -14.579   5.492
    4    H3*    C   1           H3*        C   1   2.758 -13.121   6.790
    5    H1*    C   1           H1*        C   1  -0.932 -13.447   8.198
    6   1H4     C   1          H41         C   1   0.785 -16.169  13.998
    7   2H4     C   1          H42         C   1  -0.772 -15.403  14.230
    8    H5     C   1           H5         C   1   1.982 -16.111  11.905
    9    H6     C   1           H6         C   1   1.928 -15.308   9.589
   10   1H2*    C   1          1H2*        C   1   1.906 -12.948   8.886
   11   2H2*    C   1          2H2*        C   1   0.691 -11.857   8.172
   12    H5T    C   1           H5T        C   1   3.322 -14.673   7.872
   13   1H5*    A   2          1H5*        A   2  -1.225 -11.284   6.188
   14   2H5*    A   2          2H5*        A   2  -1.276  -9.568   5.736
   15    H4*    A   2           H4*        A   2  -3.002 -10.126   7.412
   16    H3*    A   2           H3*        A   2  -1.093  -8.017   7.583
   17    H1*    A   2           H1*        A   2  -2.497 -10.105  10.575
   18    H8     A   2           H8         A   2   1.325 -10.659   9.734
   19   1H6     A   2          1H6         A   2   1.675 -12.921  15.461
   20   2H6     A   2          2H6         A   2   2.570 -12.584  13.994
   21    H2     A   2           H2         A   2  -2.557 -11.626  14.744
   22   1H2*    A   2          1H2*        A   2  -0.112  -8.586   9.555
   23   2H2*    A   2          2H2*        A   2  -1.617  -7.985  10.299
   24   1H5*    G   3          1H5*        G   3  -4.587  -9.520   9.994
   25   2H5*    G   3          2H5*        G   3  -5.751  -8.202   9.758
   26    H4*    G   3           H4*        G   3  -6.469  -9.680  11.567
   27    H3*    G   3           H3*        G   3  -6.244  -6.892  11.737
   28    H1*    G   3           H1*        G   3  -5.168  -9.286  14.693
   29    H8     G   3           H8         G   3  -2.400  -8.043  12.395
   30    H1     G   3           H1         G   3  -0.574  -9.079  18.407
   31   1H2     G   3          H21         G   3  -3.953  -9.725  18.966
   32   2H2     G   3          H22         G   3  -2.341  -9.621  19.637
   33   1H2*    G   3          1H2*        G   3  -4.617  -6.708  13.319
   34   2H2*    G   3          2H2*        G   3  -5.919  -7.137  14.464
   35   1H5*    T   4          1H5*        T   4  -7.723  -9.076  15.885
   36   2H5*    T   4          2H5*        T   4  -9.252  -8.192  16.064
   37    H4*    T   4           H4*        T   4  -8.316  -8.437  18.259
   38    H3*    T   4           H3*        T   4  -8.811  -5.906  17.063
   39   1H2*    T   4          1H2*        T   4  -6.664  -5.116  17.061
   40   2H2*    T   4          2H2*        T   4  -6.921  -4.838  18.784
   41    H1*    T   4           H1*        T   4  -5.783  -6.798  19.491
   42    H3     T   4           H3         T   4  -1.402  -6.346  18.789
   43   1H5M    T   4          H51         T   4  -3.720  -3.999  14.661
   44   2H5M    T   4          H52         T   4  -2.000  -4.451  14.619
   45   3H5M    T   4          H53         T   4  -3.229  -5.579  14.008
   46    H6     T   4           H6         T   4  -5.239  -5.615  16.012
   47   1H5*    G   5          1H5*        G   5  -7.471  -6.771  21.479
   48   2H5*    G   5          2H5*        G   5  -8.585  -5.847  22.506
   49    H4*    G   5           H4*        G   5  -6.482  -6.106  23.674
   50    H3*    G   5           H3*        G   5  -7.622  -3.574  23.010
   51    H1*    G   5           H1*        G   5  -3.798  -4.414  23.180
   52    H8     G   5           H8         G   5  -5.306  -3.553  19.698
   53    H1     G   5           H1         G   5   1.053  -3.314  20.029
   54   1H2     G   5          H21         G   5   0.605  -4.165  23.377
   55   2H2     G   5          H22         G   5   1.723  -3.776  22.089
   56   1H2*    G   5          1H2*        G   5  -5.854  -2.643  21.925
   57   2H2*    G   5          2H2*        G   5  -5.091  -2.553  23.539
   58   1H5*  2AR   6          1H5*      2AR   6  -4.242  -4.235  26.205
   59   2H5*  2AR   6          2H5*      2AR   6  -4.707  -3.308  27.647
   60    H4*  2AR   6           H4*      2AR   6  -2.267  -3.395  27.460
   61    H1*  2AR   6           H1*      2AR   6  -0.681  -1.091  25.510
   62    H2   2AR   6           H2       2AR   6   2.397  -0.381  22.378
   63   1H6   2AR   6          1H6       2AR   6  -0.044   0.273  18.673
   64   2H6   2AR   6          2H6       2AR   6  -1.724   0.102  19.129
   65    H8   2AR   6           H8       2AR   6  -3.915  -0.828  23.308
   66   2H2*  2AR   6          2H2*      2AR   6  -2.119   0.519  26.422
   67   1H2*  2AR   6          1H2*      2AR   6  -3.567  -0.216  25.685
   68    H3*  2AR   6           H3*      2AR   6  -3.763  -1.085  27.828
   69    HX*  2AR   6           HX*      2AR   6  -1.244  -3.317  25.422
   70   HX**  2AR   6          HX**      2AR   6  -2.818  -2.992  24.643
   71   1H5*    G   7          1H5*        G   7   1.284  -0.985  26.859
   72   2H5*    G   7          2H5*        G   7   1.554  -0.203  28.430
   73    H4*    G   7           H4*        G   7   3.246   0.614  26.940
   74    H3*    G   7           H3*        G   7   1.304   2.317  28.135
   75    H1*    G   7           H1*        G   7   2.957   2.726  24.648
   76    H8     G   7           H8         G   7  -0.906   2.795  24.529
   77    H1     G   7           H1         G   7   1.850   2.887  18.822
   78   1H2     G   7          H21         G   7   4.815   2.336  20.528
   79   2H2     G   7          H22         G   7   4.021   2.544  18.976
   80   1H2*    G   7          1H2*        G   7   0.407   3.190  26.183
   81   2H2*    G   7          2H2*        G   7   1.910   4.155  26.147
   82   1H5*    T   8          1H5*        T   8   5.425   4.206  26.716
   83   2H5*    T   8          2H5*        T   8   5.784   5.674  27.646
   84    H4*    T   8           H4*        T   8   6.396   5.967  25.315
   85    H3*    T   8           H3*        T   8   4.442   7.642  26.654
   86   1H2*    T   8          1H2*        T   8   3.020   7.833  24.908
   87   2H2*    T   8          2H2*        T   8   4.318   8.649  24.002
   88    H1*    T   8           H1*        T   8   4.941   6.725  22.876
   89    H3     T   8           H3         T   8   1.597   5.482  20.095
   90   1H5M    T   8          H51         T   8  -1.596   5.951  23.409
   91   2H5M    T   8          H52         T   8  -0.667   5.466  24.847
   92   3H5M    T   8          H53         T   8  -0.786   7.185  24.403
   93    H6     T   8           H6         T   8   1.815   6.425  24.778
   94   1H5*    C   9          1H5*        C   9   6.955   7.817  23.243
   95   2H5*    C   9          2H5*        C   9   8.021   9.235  23.188
   96    H4*    C   9           H4*        C   9   7.798   8.576  20.945
   97    H3*    C   9           H3*        C   9   6.518  10.981  21.846
   98    H1*    C   9           H1*        C   9   5.348   8.546  18.959
   99   1H4     C   9          H41         C   9  -0.874   7.825  19.485
  100   2H4     C   9          H42         C   9  -0.914   8.737  20.970
  101    H5     C   9           H5         C   9   1.164   9.186  22.274
  102    H6     C   9           H6         C   9   3.565   9.337  22.095
  103   1H2*    C   9          1H2*        C   9   4.487  10.672  20.889
  104   2H2*    C   9          2H2*        C   9   5.327  10.828  19.314
  105   1H5*    A  10          1H5*        A  10   6.841   9.711  17.523
  106   2H5*    A  10          2H5*        A  10   8.189  10.761  17.049
  107    H4*    A  10           H4*        A  10   6.996  10.016  15.082
  108    H3*    A  10           H3*        A  10   7.523  12.689  15.676
  109    H1*    A  10           H1*        A  10   3.940  11.565  14.260
  110    H8     A  10           H8         A  10   4.479  11.699  17.997
  111   1H6     A  10          1H6         A  10  -1.327  13.740  18.445
  112   2H6     A  10          2H6         A  10   0.082  13.228  19.348
  113    H2     A  10           H2         A  10  -0.261  13.448  14.090
  114   1H2*    A  10          1H2*        A  10   5.421  13.508  15.944
  115   2H2*    A  10          2H2*        A  10   5.318  13.394  14.165
  116   1H5*    C  11          1H5*        C  11   5.547  11.585  11.503
  117   2H5*    C  11          2H5*        C  11   6.528  12.439  10.294
  118    H4*    C  11           H4*        C  11   4.193  12.286   9.563
  119    H3*    C  11           H3*        C  11   5.663  14.752   9.908
  120    H1*    C  11           H1*        C  11   1.765  14.318  10.696
  121   1H4     C  11          H41         C  11   2.789  16.828  16.756
  122   2H4     C  11          H42         C  11   1.092  17.037  16.387
  123    H5     C  11           H5         C  11   4.357  15.839  15.221
  124    H6     C  11           H6         C  11   4.640  14.835  13.008
  125    H3T    C  11           H3T        C  11   4.643  15.155   7.884
  126   1H2*    C  11          1H2*        C  11   4.105  16.070  10.840
  127   2H2*    C  11          2H2*        C  11   3.023  15.729   9.461
  128   1H5*    G  12          1H5*        G  12  -7.759  21.587  17.801
  129   2H5*    G  12          2H5*        G  12  -8.885  20.494  18.632
  130    H4*    G  12           H4*        G  12  -8.423  19.699  16.358
  131    H3*    G  12           H3*        G  12  -7.924  18.186  18.779
  132    H1*    G  12           H1*        G  12  -5.678  18.032  15.484
  133    H8     G  12           H8         G  12  -4.552  19.419  18.931
  134    H1     G  12           H1         G  12   0.138  17.101  15.292
  135   1H2     G  12          H21         G  12  -2.410  16.339  13.039
  136   2H2     G  12          H22         G  12  -0.699  16.298  13.399
  137   1H2*    G  12          1H2*        G  12  -5.981  17.200  18.272
  138   2H2*    G  12          2H2*        G  12  -6.724  16.525  16.795
  139    H5T    G  12           H5T        G  12  -6.077  20.263  18.893
  140   1H5*    T  13          1H5*        T  13  -8.488  16.395  14.786
  141   2H5*    T  13          2H5*        T  13  -9.453  14.907  14.695
  142    H4*    T  13           H4*        T  13  -7.520  14.900  13.139
  143    H3*    T  13           H3*        T  13  -8.258  12.851  14.969
  144   1H2*    T  13          1H2*        T  13  -6.325  12.612  16.112
  145   2H2*    T  13          2H2*        T  13  -5.662  11.925  14.602
  146    H1*    T  13           H1*        T  13  -4.537  13.852  14.082
  147    H3     T  13           H3         T  13  -1.432  14.571  17.237
  148   1H5M    T  13          H51         T  13  -4.602  15.166  20.554
  149   2H5M    T  13          H52         T  13  -5.989  15.746  19.603
  150   3H5M    T  13          H53         T  13  -5.833  14.015  19.979
  151    H6     T  13           H6         T  13  -6.229  14.442  17.279
  152   1H5*    G  14          1H5*        G  14  -4.304  12.713  12.011
  153   2H5*    G  14          2H5*        G  14  -5.253  11.570  11.039
  154    H4*    G  14           H4*        G  14  -2.848  11.143  10.784
  155    H3*    G  14           H3*        G  14  -4.803   9.243  11.474
  156    H1*    G  14           H1*        G  14  -1.215   9.304  13.140
  157    H8     G  14           H8         G  14  -4.388   9.996  15.222
  158    H1     G  14           H1         G  14   1.000   9.767  18.606
  159   1H2     G  14          H21         G  14   2.524   9.168  15.530
  160   2H2     G  14          H22         G  14   2.718   9.327  17.263
  161   1H2*    G  14          1H2*        G  14  -4.093   8.638  13.546
  162   2H2*    G  14          2H2*        G  14  -2.823   7.734  12.682
  163   1H5*    A  15          1H5*        A  15  -0.073   9.269  11.268
  164   2H5*    A  15          2H5*        A  15  -0.042   8.323   9.765
  165    H4*    A  15           H4*        A  15   2.133   8.159  10.801
  166    H3*    A  15           H3*        A  15   0.490   5.950  10.226
  167    H1*    A  15           H1*        A  15   2.597   6.167  13.595
  168    H8     A  15           H8         A  15  -1.265   6.663  13.565
  169   1H6     A  15          1H6         A  15  -1.090   5.286  19.525
  170   2H6     A  15          2H6         A  15  -2.107   5.743  18.181
  171    H2     A  15           H2         A  15   3.117   5.053  17.936
  172   1H2*    A  15          1H2*        A  15   0.188   5.046  12.270
  173   2H2*    A  15          2H2*        A  15   1.898   4.545  12.152
  174   1H5*    C  16          1H5*        C  16   4.809   5.551  11.511
  175   2H5*    C  16          2H5*        C  16   5.707   4.406  10.494
  176    H4*    C  16           H4*        C  16   6.629   4.323  12.718
  177    H3*    C  16           H3*        C  16   5.436   2.047  11.407
  178    H1*    C  16           H1*        C  16   5.591   2.898  15.232
  179   1H4     C  16          H41         C  16   0.353   1.848  18.469
  180   2H4     C  16          H42         C  16  -0.699   2.514  17.268
  181    H5     C  16           H5         C  16   0.164   3.026  14.945
  182    H6     C  16           H6         C  16   2.248   3.275  13.652
  183   1H2*    C  16          1H2*        C  16   3.918   1.565  13.085
  184   2H2*    C  16          2H2*        C  16   5.325   0.942  13.963
  185   1H5*  8OG  17          1H5*      8OG  17   8.385   1.853  15.105
  186   2H5*  8OG  17          2H5*      8OG  17   9.517   0.526  14.782
  187    H4*  8OG  17           H4*      8OG  17   9.171   0.811  17.194
  188    H3*  8OG  17           H3*      8OG  17   8.791  -1.624  15.750
  189   1H2*  8OG  17          1H2*      8OG  17   6.655  -2.061  16.377
  190   2H2*  8OG  17          2H2*      8OG  17   7.375  -2.502  17.952
  191    H1*  8OG  17           H1*      8OG  17   6.855  -0.428  18.893
  192    H1   8OG  17           H1       8OG  17   1.530  -1.058  14.267
  193    H7   8OG  17           H7       8OG  17   2.269  -0.476  19.175
  194   1H2   8OG  17          1H2       8OG  17   4.706  -1.089  12.829
  195   2H2   8OG  17          2H2       8OG  17   2.977  -1.183  12.589
  196   1H5*    C  18          1H5*        C  18   9.143  -1.409  20.470
  197   2H5*    C  18          2H5*        C  18  10.176  -2.758  20.988
  198    H4*    C  18           H4*        C  18   8.395  -2.362  22.635
  199    H3*    C  18           H3*        C  18   9.040  -4.823  21.484
  200    H1*    C  18           H1*        C  18   5.422  -3.708  22.173
  201   1H4     C  18          H41         C  18   2.573  -3.949  16.210
  202   2H4     C  18          H42         C  18   1.339  -3.415  17.332
  203    H5     C  18           H5         C  18   4.870  -4.358  16.880
  204    H6     C  18           H6         C  18   6.452  -4.259  18.682
  205   1H2*    C  18          1H2*        C  18   7.220  -5.038  20.150
  206   2H2*    C  18          2H2*        C  18   6.470  -5.698  21.584
  207   1H5*    A  19          1H5*        A  19   5.787  -5.491  25.438
  208   2H5*    A  19          2H5*        A  19   6.666  -6.900  26.066
  209    H4*    A  19           H4*        A  19   4.258  -7.255  26.297
  210    H3*    A  19           H3*        A  19   6.020  -8.992  24.961
  211    H1*    A  19           H1*        A  19   2.427  -8.327  23.845
  212    H8     A  19           H8         A  19   5.213  -7.429  21.337
  213   1H6     A  19          1H6         A  19   0.684  -5.899  17.463
  214   2H6     A  19          2H6         A  19   2.413  -6.094  17.646
  215    H2     A  19           H2         A  19  -1.171  -6.975  21.411
  216   1H2*    A  19          1H2*        A  19   5.173  -8.909  22.880
  217   2H2*    A  19          2H2*        A  19   3.928 -10.004  23.553
  218   1H5*    C  20          1H5*        C  20   1.814 -10.264  26.501
  219   2H5*    C  20          2H5*        C  20   1.663 -11.987  26.899
  220    H4*    C  20           H4*        C  20  -0.425 -11.088  25.940
  221    H3*    C  20           H3*        C  20   0.961 -13.420  25.080
  222    H1*    C  20           H1*        C  20  -1.006 -10.942  22.791
  223   1H4     C  20          H41         C  20   3.733  -9.687  18.331
  224   2H4     C  20          H42         C  20   2.226  -9.107  17.659
  225    H5     C  20           H5         C  20   3.886 -10.708  20.529
  226    H6     C  20           H6         C  20   2.696 -11.261  22.544
  227   1H2*    C  20          1H2*        C  20   1.359 -12.781  22.895
  228   2H2*    C  20          2H2*        C  20  -0.380 -13.167  22.679
  229   1H5*    T  21          1H5*        T  21  -3.163 -12.130  24.030
  230   2H5*    T  21          2H5*        T  21  -4.410 -13.389  24.086
  231    H4*    T  21           H4*        T  21  -4.919 -11.538  22.492
  232    H3*    T  21           H3*        T  21  -5.048 -14.360  21.989
  233   1H2*    T  21          1H2*        T  21  -3.819 -14.443  20.089
  234   2H2*    T  21          2H2*        T  21  -5.174 -13.567  19.319
  235    H1*    T  21           H1*        T  21  -4.088 -11.548  19.437
  236    H3     T  21           H3         T  21  -1.045 -12.653  16.264
  237   1H5M    T  21          H51         T  21   1.430 -13.076  20.834
  238   2H5M    T  21          H52         T  21   0.815 -14.740  20.712
  239   3H5M    T  21          H53         T  21   1.935 -14.111  19.480
  240    H6     T  21           H6         T  21  -1.327 -13.146  21.018
  241   1H5*    G  22          1H5*        G  22  -7.602 -10.982  19.550
  242   2H5*    G  22          2H5*        G  22  -9.194 -11.740  19.755
  243    H4*    G  22           H4*        G  22  -9.191 -10.292  17.786
  244    H3*    G  22           H3*        G  22  -9.933 -13.027  17.813
  245    H1*    G  22           H1*        G  22  -7.600 -11.537  14.835
  246    H8     G  22           H8         G  22  -6.516 -13.903  17.722
  247    H1     G  22           H1         G  22  -2.674 -13.904  12.643
  248   1H2     G  22          H21         G  22  -4.930 -11.603  11.315
  249   2H2     G  22          H22         G  22  -3.461 -12.528  11.091
  250    H3T    G  22           H3T        G  22 -10.507 -10.836  16.076
  251   1H2*    G  22          1H2*        G  22  -8.618 -13.923  16.197
  252   2H2*    G  22          2H2*        G  22  -9.443 -12.854  15.028
  Start of MODEL    3
    1   1H5*    C   1          1H5*        C   1   3.048 -16.981   8.365
    2   2H5*    C   1          2H5*        C   1   2.212 -18.110   7.280
    3    H4*    C   1           H4*        C   1   0.879 -16.250   6.360
    4    H3*    C   1           H3*        C   1   2.908 -14.638   7.550
    5    H1*    C   1           H1*        C   1  -0.828 -14.860   8.847
    6   1H4     C   1          H41         C   1   0.693 -16.842  15.005
    7   2H4     C   1          H42         C   1  -0.894 -16.102  15.091
    8    H5     C   1           H5         C   1   1.981 -16.982  12.968
    9    H6     C   1           H6         C   1   2.011 -16.456  10.574
   10   1H2*    C   1          1H2*        C   1   1.973 -14.212   9.572
   11   2H2*    C   1          2H2*        C   1   0.766 -13.246   8.683
   12    H5T    C   1           H5T        C   1   3.057 -16.848   5.526
   13   1H5*    A   2          1H5*        A   2  -0.908 -12.530   6.200
   14   2H5*    A   2          2H5*        A   2  -0.694 -10.864   5.627
   15    H4*    A   2           H4*        A   2  -2.621 -11.079   7.165
   16    H3*    A   2           H3*        A   2  -0.482  -9.199   7.359
   17    H1*    A   2           H1*        A   2  -2.378 -10.857  10.367
   18    H8     A   2           H8         A   2   1.477 -11.612   9.950
   19   1H6     A   2          1H6         A   2   1.119 -13.817  15.690
   20   2H6     A   2          2H6         A   2   2.182 -13.491  14.338
   21    H2     A   2           H2         A   2  -2.996 -12.507  14.460
   22   1H2*    A   2          1H2*        A   2   0.224  -9.660   9.464
   23   2H2*    A   2          2H2*        A   2  -1.283  -8.865   9.989
   24   1H5*    G   3          1H5*        G   3  -4.213  -9.686   9.660
   25   2H5*    G   3          2H5*        G   3  -5.208  -8.280   9.234
   26    H4*    G   3           H4*        G   3  -6.072  -9.381  11.230
   27    H3*    G   3           H3*        G   3  -5.458  -6.640  11.026
   28    H1*    G   3           H1*        G   3  -4.813  -8.791  14.276
   29    H8     G   3           H8         G   3  -1.848  -8.077  12.005
   30    H1     G   3           H1         G   3  -0.357  -8.720  18.164
   31   1H2     G   3          H21         G   3  -3.800  -9.002  18.613
   32   2H2     G   3          H22         G   3  -2.214  -8.982  19.349
   33   1H2*    G   3          1H2*        G   3  -3.892  -6.465  12.661
   34   2H2*    G   3          2H2*        G   3  -5.274  -6.602  13.785
   35   1H5*    T   4          1H5*        T   4  -7.268  -8.490  15.091
   36   2H5*    T   4          2H5*        T   4  -8.787  -7.570  15.128
   37    H4*    T   4           H4*        T   4  -8.105  -7.990  17.408
   38    H3*    T   4           H3*        T   4  -8.571  -5.424  16.344
   39   1H2*    T   4          1H2*        T   4  -6.432  -4.606  16.454
   40   2H2*    T   4          2H2*        T   4  -6.800  -4.352  18.159
   41    H1*    T   4           H1*        T   4  -5.648  -6.279  18.922
   42    H3     T   4           H3         T   4  -1.237  -5.818  18.406
   43   1H5M    T   4          H51         T   4  -3.315  -3.418  14.220
   44   2H5M    T   4          H52         T   4  -1.641  -4.018  14.174
   45   3H5M    T   4          H53         T   4  -2.965  -5.028  13.553
   46    H6     T   4           H6         T   4  -4.957  -5.086  15.475
   47   1H5*    G   5          1H5*        G   5  -7.546  -6.357  20.914
   48   2H5*    G   5          2H5*        G   5  -8.744  -5.426  21.837
   49    H4*    G   5           H4*        G   5  -6.724  -5.670  23.160
   50    H3*    G   5           H3*        G   5  -7.866  -3.162  22.429
   51    H1*    G   5           H1*        G   5  -4.034  -3.908  22.838
   52    H8     G   5           H8         G   5  -5.369  -3.036  19.287
   53    H1     G   5           H1         G   5   0.969  -2.874  19.902
   54   1H2     G   5          H21         G   5   0.367  -3.704  23.231
   55   2H2     G   5          H22         G   5   1.545  -3.331  21.991
   56   1H2*    G   5          1H2*        G   5  -6.053  -2.182  21.467
   57   2H2*    G   5          2H2*        G   5  -5.398  -2.088  23.130
   58   1H5*  2AR   6          1H5*      2AR   6  -4.792  -3.759  25.899
   59   2H5*  2AR   6          2H5*      2AR   6  -5.297  -2.794  27.301
   60    H4*  2AR   6           H4*      2AR   6  -2.846  -2.934  27.187
   61    H1*  2AR   6           H1*      2AR   6  -1.143  -0.691  25.325
   62    H2   2AR   6           H2       2AR   6   2.096   0.058  22.358
   63   1H6   2AR   6          1H6       2AR   6  -0.158   0.771  18.547
   64   2H6   2AR   6          2H6       2AR   6  -1.859   0.606  18.920
   65    H8   2AR   6           H8       2AR   6  -4.257  -0.329  22.975
   66   2H2*  2AR   6          2H2*      2AR   6  -2.572   0.969  26.170
   67   1H2*  2AR   6          1H2*      2AR   6  -4.005   0.278  25.368
   68    H3*  2AR   6           H3*      2AR   6  -4.326  -0.594  27.494
   69    HX*  2AR   6           HX*      2AR   6  -1.780  -2.894  25.169
   70   HX**  2AR   6          HX**      2AR   6  -3.317  -2.498  24.353
   71   1H5*    G   7          1H5*        G   7   0.595  -0.696  26.590
   72   2H5*    G   7          2H5*        G   7   0.944  -0.010  28.189
   73    H4*    G   7           H4*        G   7   2.716   0.688  26.743
   74    H3*    G   7           H3*        G   7   0.959   2.542  27.986
   75    H1*    G   7           H1*        G   7   2.669   2.904  24.538
   76    H8     G   7           H8         G   7  -1.184   3.191  24.344
   77    H1     G   7           H1         G   7   1.736   3.690  18.735
   78   1H2     G   7          H21         G   7   4.632   2.887  20.476
   79   2H2     G   7          H22         G   7   3.896   3.251  18.926
   80   1H2*    G   7          1H2*        G   7   0.130   3.509  26.045
   81   2H2*    G   7          2H2*        G   7   1.687   4.375  26.052
   82   1H5*    T   8          1H5*        T   8   4.770   3.403  25.598
   83   2H5*    T   8          2H5*        T   8   5.783   4.416  26.645
   84    H4*    T   8           H4*        T   8   6.436   4.908  24.428
   85    H3*    T   8           H3*        T   8   5.083   6.898  25.999
   86   1H2*    T   8          1H2*        T   8   3.614   7.615  24.445
   87   2H2*    T   8          2H2*        T   8   5.017   8.224  23.529
   88    H1*    T   8           H1*        T   8   5.042   6.433  22.095
   89    H3     T   8           H3         T   8   1.314   6.394  19.585
   90   1H5M    T   8          H51         T   8  -0.423   7.491  24.372
   91   2H5M    T   8          H52         T   8  -1.473   6.572  23.268
   92   3H5M    T   8          H53         T   8  -0.491   5.717  24.482
   93    H6     T   8           H6         T   8   2.081   6.332  24.318
   94   1H5*    C   9          1H5*        C   9   7.156   6.987  22.276
   95   2H5*    C   9          2H5*        C   9   8.502   8.142  22.186
   96    H4*    C   9           H4*        C   9   7.708   7.902  19.966
   97    H3*    C   9           H3*        C   9   7.409  10.365  21.384
   98    H1*    C   9           H1*        C   9   4.981   8.898  18.627
   99   1H4     C   9          H41         C   9  -0.432   9.867  22.319
  100   2H4     C   9          H42         C   9  -0.967   9.590  20.673
  101    H5     C   9           H5         C   9   1.926   9.845  22.953
  102    H6     C   9           H6         C   9   4.183   9.403  22.188
  103   1H2*    C   9          1H2*        C   9   5.193  10.725  21.002
  104   2H2*    C   9          2H2*        C   9   5.672  11.012  19.298
  105   1H5*    A  10          1H5*        A  10   8.067   9.961  16.513
  106   2H5*    A  10          2H5*        A  10   9.192  11.314  16.294
  107    H4*    A  10           H4*        A  10   8.019  10.803  14.215
  108    H3*    A  10           H3*        A  10   8.267  13.328  15.336
  109    H1*    A  10           H1*        A  10   4.703  12.114  13.920
  110    H8     A  10           H8         A  10   5.696  11.785  17.573
  111   1H6     A  10          1H6         A  10  -0.315  12.292  18.890
  112   2H6     A  10          2H6         A  10   1.279  12.036  19.564
  113    H2     A  10           H2         A  10   0.205  12.757  14.451
  114   1H2*    A  10          1H2*        A  10   6.120  13.797  15.901
  115   2H2*    A  10          2H2*        A  10   5.883  14.062  14.150
  116   1H5*    C  11          1H5*        C  11   6.003  12.997  11.161
  117   2H5*    C  11          2H5*        C  11   6.649  14.306  10.152
  118    H4*    C  11           H4*        C  11   4.263  13.989   9.716
  119    H3*    C  11           H3*        C  11   5.426  16.472  10.699
  120    H1*    C  11           H1*        C  11   1.790  15.079  11.544
  121   1H4     C  11          H41         C  11   2.942  16.059  18.008
  122   2H4     C  11          H42         C  11   1.208  15.980  17.796
  123    H5     C  11           H5         C  11   4.501  15.886  16.183
  124    H6     C  11           H6         C  11   4.739  15.594  13.767
  125    H3T    C  11           H3T        C  11   4.176  17.254   8.943
  126   1H2*    C  11          1H2*        C  11   3.777  17.177  12.047
  127   2H2*    C  11          2H2*        C  11   2.614  17.007  10.702
  128   1H5*    G  12          1H5*        G  12  -7.601  19.848  20.604
  129   2H5*    G  12          2H5*        G  12  -8.668  18.550  21.178
  130    H4*    G  12           H4*        G  12  -8.287  18.366  18.758
  131    H3*    G  12           H3*        G  12  -7.693  16.307  20.703
  132    H1*    G  12           H1*        G  12  -5.555  17.023  17.410
  133    H8     G  12           H8         G  12  -4.303  17.572  21.045
  134    H1     G  12           H1         G  12   0.265  16.349  16.774
  135   1H2     G  12          H21         G  12  -2.366  16.065  14.504
  136   2H2     G  12          H22         G  12  -0.640  15.995  14.776
  137   1H2*    G  12          1H2*        G  12  -5.732  15.549  19.937
  138   2H2*    G  12          2H2*        G  12  -6.500  15.210  18.363
  139    H5T    G  12           H5T        G  12  -5.845  18.361  21.271
  140   1H5*    T  13          1H5*        T  13  -8.188  15.733  16.414
  141   2H5*    T  13          2H5*        T  13  -9.185  14.366  15.880
  142    H4*    T  13           H4*        T  13  -7.296  14.805  14.349
  143    H3*    T  13           H3*        T  13  -7.981  12.295  15.528
  144   1H2*    T  13          1H2*        T  13  -5.983  11.726  16.413
  145   2H2*    T  13          2H2*        T  13  -5.422  11.544  14.726
  146    H1*    T  13           H1*        T  13  -4.330  13.561  14.747
  147    H3     T  13           H3         T  13  -0.968  13.102  17.677
  148   1H5M    T  13          H51         T  13  -5.186  13.847  20.705
  149   2H5M    T  13          H52         T  13  -5.245  12.079  20.520
  150   3H5M    T  13          H53         T  13  -3.839  12.847  21.294
  151    H6     T  13           H6         T  13  -5.745  13.241  18.113
  152   1H5*    G  14          1H5*        G  14  -5.507  12.065  11.619
  153   2H5*    G  14          2H5*        G  14  -6.238  10.790  10.622
  154    H4*    G  14           H4*        G  14  -3.792  10.824  10.363
  155    H3*    G  14           H3*        G  14  -5.371   8.567  11.028
  156    H1*    G  14           H1*        G  14  -1.793   9.276  12.537
  157    H8     G  14           H8         G  14  -4.929   9.374  14.829
  158    H1     G  14           H1         G  14   0.649   9.314  17.893
  159   1H2     G  14          H21         G  14   2.049   9.294  14.700
  160   2H2     G  14          H22         G  14   2.317   9.284  16.429
  161   1H2*    G  14          1H2*        G  14  -4.443   7.991  13.017
  162   2H2*    G  14          2H2*        G  14  -3.056   7.430  12.044
  163   1H5*    A  15          1H5*        A  15  -0.747   8.585  10.120
  164   2H5*    A  15          2H5*        A  15  -0.625   7.414   8.791
  165    H4*    A  15           H4*        A  15   1.481   7.420   9.943
  166    H3*    A  15           H3*        A  15  -0.180   5.116   9.783
  167    H1*    A  15           H1*        A  15   2.043   6.056  12.931
  168    H8     A  15           H8         A  15  -1.845   6.102  13.090
  169   1H6     A  15          1H6         A  15  -1.168   6.251  19.195
  170   2H6     A  15          2H6         A  15  -2.314   6.254  17.874
  171    H2     A  15           H2         A  15   2.932   6.135  17.345
  172   1H2*    A  15          1H2*        A  15  -0.351   4.567  11.965
  173   2H2*    A  15          2H2*        A  15   1.380   4.137  11.875
  174   1H5*    C  16          1H5*        C  16   4.093   5.314  11.025
  175   2H5*    C  16          2H5*        C  16   5.096   4.136  10.152
  176    H4*    C  16           H4*        C  16   6.125   4.558  12.289
  177    H3*    C  16           H3*        C  16   5.210   1.965  11.447
  178    H1*    C  16           H1*        C  16   5.356   3.440  15.081
  179   1H4     C  16          H41         C  16   0.306   2.352  18.622
  180   2H4     C  16          H42         C  16  -0.810   2.763  17.363
  181    H5     C  16           H5         C  16  -0.043   2.932  14.982
  182    H6     C  16           H6         C  16   1.972   3.223  13.599
  183   1H2*    C  16          1H2*        C  16   3.803   1.596  13.245
  184   2H2*    C  16          2H2*        C  16   5.298   1.289  14.142
  185   1H5*  8OG  17          1H5*      8OG  17   8.239   2.394  15.181
  186   2H5*  8OG  17          2H5*      8OG  17   9.433   1.115  14.882
  187    H4*  8OG  17           H4*      8OG  17   9.065   1.387  17.285
  188    H3*  8OG  17           H3*      8OG  17   8.758  -1.060  15.853
  189   1H2*  8OG  17          1H2*      8OG  17   6.617  -1.535  16.440
  190   2H2*  8OG  17          2H2*      8OG  17   7.321  -1.969  18.025
  191    H1*  8OG  17           H1*      8OG  17   6.743   0.090  18.966
  192    H1   8OG  17           H1       8OG  17   1.532  -0.831  14.267
  193    H7   8OG  17           H7       8OG  17   2.147   0.064  19.147
  194   1H2   8OG  17          1H2       8OG  17   4.746  -0.967  12.919
  195   2H2   8OG  17          2H2       8OG  17   3.022  -1.080  12.640
  196   1H5*    C  18          1H5*        C  18   9.005  -0.898  20.585
  197   2H5*    C  18          2H5*        C  18  10.068  -2.225  21.097
  198    H4*    C  18           H4*        C  18   8.243  -1.931  22.712
  199    H3*    C  18           H3*        C  18   8.979  -4.339  21.503
  200    H1*    C  18           H1*        C  18   5.315  -3.339  22.150
  201   1H4     C  18          H41         C  18   2.625  -3.494  16.109
  202   2H4     C  18          H42         C  18   1.353  -3.007  17.208
  203    H5     C  18           H5         C  18   4.909  -3.874  16.832
  204    H6     C  18           H6         C  18   6.440  -3.787  18.673
  205   1H2*    C  18          1H2*        C  18   7.188  -4.580  20.140
  206   2H2*    C  18          2H2*        C  18   6.430  -5.285  21.546
  207   1H5*    A  19          1H5*        A  19   5.800  -5.030  25.274
  208   2H5*    A  19          2H5*        A  19   6.518  -6.469  26.026
  209    H4*    A  19           H4*        A  19   4.079  -6.623  26.093
  210    H3*    A  19           H3*        A  19   5.787  -8.557  24.950
  211    H1*    A  19           H1*        A  19   2.315  -7.670  23.640
  212    H8     A  19           H8         A  19   5.250  -7.161  21.192
  213   1H6     A  19          1H6         A  19   0.981  -5.616  17.034
  214   2H6     A  19          2H6         A  19   2.684  -5.917  17.298
  215    H2     A  19           H2         A  19  -1.085  -6.259  20.968
  216   1H2*    A  19          1H2*        A  19   5.036  -8.541  22.829
  217   2H2*    A  19          2H2*        A  19   3.674  -9.486  23.504
  218   1H5*    C  20          1H5*        C  20   1.503  -9.390  26.481
  219   2H5*    C  20          2H5*        C  20   1.164 -11.055  26.992
  220    H4*    C  20           H4*        C  20  -0.810  -9.978  25.955
  221    H3*    C  20           H3*        C  20   0.253 -12.528  25.339
  222    H1*    C  20           H1*        C  20  -1.307 -10.063  22.737
  223   1H4     C  20          H41         C  20   3.750  -9.722  18.465
  224   2H4     C  20          H42         C  20   2.359  -9.014  17.673
  225    H5     C  20           H5         C  20   3.674 -10.584  20.733
  226    H6     C  20           H6         C  20   2.335 -10.838  22.712
  227   1H2*    C  20          1H2*        C  20   0.823 -12.135  23.128
  228   2H2*    C  20          2H2*        C  20  -0.941 -12.342  22.863
  229   1H5*    T  21          1H5*        T  21  -3.399 -10.653  23.819
  230   2H5*    T  21          2H5*        T  21  -4.874 -11.612  24.047
  231    H4*    T  21           H4*        T  21  -5.053  -9.975  22.182
  232    H3*    T  21           H3*        T  21  -5.695 -12.763  22.107
  233   1H2*    T  21          1H2*        T  21  -4.468 -13.380  20.307
  234   2H2*    T  21          2H2*        T  21  -5.636 -12.425  19.347
  235    H1*    T  21           H1*        T  21  -4.210 -10.641  19.165
  236    H3     T  21           H3         T  21  -1.475 -12.977  16.368
  237   1H5M    T  21          H51         T  21   1.007 -12.616  20.951
  238   2H5M    T  21          H52         T  21   0.184 -14.174  21.200
  239   3H5M    T  21          H53         T  21   1.359 -13.988  19.876
  240    H6     T  21           H6         T  21  -1.700 -12.240  21.096
  241   1H5*    G  22          1H5*        G  22  -7.226 -10.107  18.223
  242   2H5*    G  22          2H5*        G  22  -8.945 -10.438  18.519
  243    H4*    G  22           H4*        G  22  -8.580 -10.316  16.132
  244    H3*    G  22           H3*        G  22  -9.587 -12.645  17.472
  245    H1*    G  22           H1*        G  22  -6.954 -12.865  14.392
  246    H8     G  22           H8         G  22  -6.348 -13.776  18.123
  247    H1     G  22           H1         G  22  -2.279 -16.425  14.010
  248   1H2     G  22          H21         G  22  -2.722 -15.845  12.013
  249   2H2     G  22          H22         G  22  -3.924 -14.670  11.576
  250    H3T    G  22           H3T        G  22 -10.675 -11.134  16.045
  251   1H2*    G  22          1H2*        G  22  -8.344 -14.292  16.545
  252   2H2*    G  22          2H2*        G  22  -8.954 -13.800  14.940
  Start of MODEL    4
    1   1H5*    C   1          1H5*        C   1   1.719 -15.919   6.917
    2   2H5*    C   1          2H5*        C   1   2.964 -14.742   6.448
    3    H4*    C   1           H4*        C   1   0.688 -13.820   6.176
    4    H3*    C   1           H3*        C   1   2.839 -12.631   7.653
    5    H1*    C   1           H1*        C   1  -0.985 -12.437   8.595
    6   1H4     C   1          H41         C   1  -1.802 -13.775  14.695
    7   2H4     C   1          H42         C   1  -0.510 -14.944  14.700
    8    H5     C   1           H5         C   1   1.112 -15.078  12.835
    9    H6     C   1           H6         C   1   1.420 -14.511  10.460
   10   1H2*    C   1          1H2*        C   1   1.794 -12.217   9.613
   11   2H2*    C   1          2H2*        C   1   0.805 -11.035   8.718
   12    H5T    C   1           H5T        C   1   2.108 -15.358   9.088
   13   1H5*    A   2          1H5*        A   2  -0.732 -10.250   6.446
   14   2H5*    A   2          2H5*        A   2  -0.493  -8.543   6.022
   15    H4*    A   2           H4*        A   2  -2.485  -8.913   7.470
   16    H3*    A   2           H3*        A   2  -0.421  -6.988   7.826
   17    H1*    A   2           H1*        A   2  -2.302  -8.872  10.703
   18    H8     A   2           H8         A   2   1.564  -9.557  10.285
   19   1H6     A   2          1H6         A   2   1.169 -12.148  15.854
   20   2H6     A   2          2H6         A   2   2.239 -11.723  14.536
   21    H2     A   2           H2         A   2  -2.951 -10.794  14.675
   22   1H2*    A   2          1H2*        A   2   0.297  -7.598   9.894
   23   2H2*    A   2          2H2*        A   2  -1.214  -6.849  10.470
   24   1H5*    G   3          1H5*        G   3  -4.383  -7.968   9.861
   25   2H5*    G   3          2H5*        G   3  -5.316  -6.485   9.588
   26    H4*    G   3           H4*        G   3  -6.372  -7.812  11.318
   27    H3*    G   3           H3*        G   3  -5.619  -5.129  11.626
   28    H1*    G   3           H1*        G   3  -5.204  -7.807  14.519
   29    H8     G   3           H8         G   3  -2.188  -6.686  12.483
   30    H1     G   3           H1         G   3  -0.755  -9.011  18.238
   31   1H2     G   3          H21         G   3  -4.207  -9.334  18.599
   32   2H2     G   3          H22         G   3  -2.624  -9.549  19.311
   33   1H2*    G   3          1H2*        G   3  -4.122  -5.314  13.322
   34   2H2*    G   3          2H2*        G   3  -5.560  -5.554  14.354
   35   1H5*    T   4          1H5*        T   4  -7.941  -7.389  15.113
   36   2H5*    T   4          2H5*        T   4  -9.331  -6.327  15.418
   37    H4*    T   4           H4*        T   4  -8.641  -7.360  17.510
   38    H3*    T   4           H3*        T   4  -8.906  -4.586  17.087
   39   1H2*    T   4          1H2*        T   4  -6.709  -3.978  17.310
   40   2H2*    T   4          2H2*        T   4  -7.017  -4.127  19.041
   41    H1*    T   4           H1*        T   4  -6.002  -6.252  19.266
   42    H3     T   4           H3         T   4  -1.584  -6.094  18.616
   43   1H5M    T   4          H51         T   4  -3.624  -3.753  14.313
   44   2H5M    T   4          H52         T   4  -3.290  -2.420  15.441
   45   3H5M    T   4          H53         T   4  -1.956  -3.438  14.845
   46    H6     T   4           H6         T   4  -5.300  -4.290  16.191
   47   1H5*    G   5          1H5*        G   5  -7.768  -6.321  21.388
   48   2H5*    G   5          2H5*        G   5  -8.806  -5.451  22.535
   49    H4*    G   5           H4*        G   5  -6.667  -5.910  23.583
   50    H3*    G   5           H3*        G   5  -7.738  -3.281  23.225
   51    H1*    G   5           H1*        G   5  -3.976  -4.313  23.231
   52    H8     G   5           H8         G   5  -5.367  -2.863  19.883
   53    H1     G   5           H1         G   5   0.973  -3.330  20.241
   54   1H2     G   5          H21         G   5   0.405  -4.577  23.436
   55   2H2     G   5          H22         G   5   1.571  -4.130  22.210
   56   1H2*    G   5          1H2*        G   5  -5.947  -2.309  22.198
   57   2H2*    G   5          2H2*        G   5  -5.151  -2.421  23.798
   58   1H5*  2AR   6          1H5*      2AR   6  -4.100  -4.252  26.145
   59   2H5*  2AR   6          2H5*      2AR   6  -4.448  -3.372  27.647
   60    H4*  2AR   6           H4*      2AR   6  -2.038  -3.389  27.231
   61    H1*  2AR   6           H1*      2AR   6  -0.583  -1.111  25.289
   62    H2   2AR   6           H2       2AR   6   2.342  -0.081  22.090
   63   1H6   2AR   6          1H6       2AR   6  -0.273   0.803  18.558
   64   2H6   2AR   6          2H6       2AR   6  -1.928   0.570  19.075
   65    H8   2AR   6           H8       2AR   6  -3.908  -0.723  23.261
   66   2H2*  2AR   6          2H2*      2AR   6  -1.913   0.520  26.325
   67   1H2*  2AR   6          1H2*      2AR   6  -3.422  -0.135  25.634
   68    H3*  2AR   6           H3*      2AR   6  -3.564  -1.094  27.734
   69    HX*  2AR   6           HX*      2AR   6  -1.254  -3.308  25.090
   70   HX**  2AR   6          HX**      2AR   6  -2.874  -2.866  24.483
   71   1H5*    G   7          1H5*        G   7   1.440  -0.822  26.831
   72   2H5*    G   7          2H5*        G   7   1.714  -0.046  28.404
   73    H4*    G   7           H4*        G   7   3.379   0.823  26.940
   74    H3*    G   7           H3*        G   7   1.369   2.509  28.058
   75    H1*    G   7           H1*        G   7   3.148   2.873  24.656
   76    H8     G   7           H8         G   7  -0.709   2.772  24.324
   77    H1     G   7           H1         G   7   2.355   3.240  18.786
   78   1H2     G   7          H21         G   7   5.255   2.881  20.670
   79   2H2     G   7          H22         G   7   4.534   3.094  19.088
   80   1H2*    G   7          1H2*        G   7   0.509   3.293  26.051
   81   2H2*    G   7          2H2*        G   7   1.967   4.319  26.050
   82   1H5*    T   8          1H5*        T   8   5.133   3.699  25.693
   83   2H5*    T   8          2H5*        T   8   5.983   4.872  26.719
   84    H4*    T   8           H4*        T   8   6.630   5.343  24.491
   85    H3*    T   8           H3*        T   8   5.029   7.224  25.956
   86   1H2*    T   8          1H2*        T   8   3.511   7.699  24.354
   87   2H2*    T   8          2H2*        T   8   4.850   8.437  23.435
   88    H1*    T   8           H1*        T   8   5.116   6.611  22.074
   89    H3     T   8           H3         T   8   1.471   6.002  19.509
   90   1H5M    T   8          H51         T   8  -0.352   5.367  24.404
   91   2H5M    T   8          H52         T   8  -0.474   7.132  24.207
   92   3H5M    T   8          H53         T   8  -1.394   6.051  23.134
   93    H6     T   8           H6         T   8   2.144   6.266  24.252
   94   1H5*    C   9          1H5*        C   9   7.159   7.426  22.237
   95   2H5*    C   9          2H5*        C   9   8.347   8.741  22.132
   96    H4*    C   9           H4*        C   9   7.631   8.341  19.908
   97    H3*    C   9           H3*        C   9   6.974  10.783  21.253
   98    H1*    C   9           H1*        C   9   4.838   8.924  18.489
   99   1H4     C   9          H41         C   9  -0.740   9.347  22.038
  100   2H4     C   9          H42         C   9  -1.198   8.951  20.394
  101    H5     C   9           H5         C   9   1.589   9.639  22.717
  102    H6     C   9           H6         C   9   3.900   9.460  22.007
  103   1H2*    C   9          1H2*        C   9   4.752  10.859  20.782
  104   2H2*    C   9          2H2*        C   9   5.250  11.133  19.081
  105   1H5*    A  10          1H5*        A  10   8.318  10.703  16.397
  106   2H5*    A  10          2H5*        A  10   9.218  12.230  16.461
  107    H4*    A  10           H4*        A  10   8.442  11.763  14.188
  108    H3*    A  10           H3*        A  10   8.113  14.164  15.542
  109    H1*    A  10           H1*        A  10   5.014  12.574  13.532
  110    H8     A  10           H8         A  10   5.540  11.702  17.184
  111   1H6     A  10          1H6         A  10  -0.605  11.661  17.725
  112   2H6     A  10          2H6         A  10   0.904  11.320  18.541
  113    H2     A  10           H2         A  10   0.436  13.066  13.586
  114   1H2*    A  10          1H2*        A  10   5.857  14.229  15.839
  115   2H2*    A  10          2H2*        A  10   5.804  14.645  14.104
  116   1H5*    C  11          1H5*        C  11   6.492  13.621  11.190
  117   2H5*    C  11          2H5*        C  11   7.225  14.941  10.255
  118    H4*    C  11           H4*        C  11   5.065  14.315   9.294
  119    H3*    C  11           H3*        C  11   5.741  16.953  10.248
  120    H1*    C  11           H1*        C  11   2.105  15.313  10.630
  121   1H4     C  11          H41         C  11   0.677  16.583  16.675
  122   2H4     C  11          H42         C  11   2.362  16.645  17.131
  123    H5     C  11           H5         C  11   4.166  16.395  15.533
  124    H6     C  11           H6         C  11   4.721  15.961  13.192
  125    H3T    C  11           H3T        C  11   5.630  16.213   8.057
  126   1H2*    C  11          1H2*        C  11   3.853  17.556  11.296
  127   2H2*    C  11          2H2*        C  11   2.941  17.237   9.792
  128   1H5*    G  12          1H5*        G  12  -6.253  17.645  20.695
  129   2H5*    G  12          2H5*        G  12  -6.958  19.064  19.897
  130    H4*    G  12           H4*        G  12  -7.810  17.626  18.082
  131    H3*    G  12           H3*        G  12  -7.139  15.527  19.969
  132    H1*    G  12           H1*        G  12  -5.162  16.223  16.564
  133    H8     G  12           H8         G  12  -3.807  16.633  20.180
  134    H1     G  12           H1         G  12   0.603  15.306  15.781
  135   1H2     G  12          H21         G  12  -2.078  15.274  13.547
  136   2H2     G  12          H22         G  12  -0.349  15.113  13.774
  137   1H2*    G  12          1H2*        G  12  -5.310  14.659  19.017
  138   2H2*    G  12          2H2*        G  12  -6.205  14.454  17.487
  139    H5T    G  12           H5T        G  12  -8.289  18.229  21.559
  140   1H5*    T  13          1H5*        T  13  -8.266  14.834  15.723
  141   2H5*    T  13          2H5*        T  13  -9.272  13.413  15.380
  142    H4*    T  13           H4*        T  13  -7.549  13.820  13.640
  143    H3*    T  13           H3*        T  13  -8.116  11.366  14.956
  144   1H2*    T  13          1H2*        T  13  -6.072  10.851  15.765
  145   2H2*    T  13          2H2*        T  13  -5.606  10.577  14.062
  146    H1*    T  13           H1*        T  13  -4.490  12.572  13.926
  147    H3     T  13           H3         T  13  -1.043  12.508  16.794
  148   1H5M    T  13          H51         T  13  -3.819  12.163  20.483
  149   2H5M    T  13          H52         T  13  -5.324  12.887  19.869
  150   3H5M    T  13          H53         T  13  -5.077  11.127  19.767
  151    H6     T  13           H6         T  13  -5.807  12.295  17.337
  152   1H5*    G  14          1H5*        G  14  -5.802  11.061  11.100
  153   2H5*    G  14          2H5*        G  14  -6.271   9.691  10.072
  154    H4*    G  14           H4*        G  14  -3.832  10.072  10.028
  155    H3*    G  14           H3*        G  14  -5.151   7.609  10.571
  156    H1*    G  14           H1*        G  14  -1.814   8.808  12.269
  157    H8     G  14           H8         G  14  -5.016   8.462  14.446
  158    H1     G  14           H1         G  14   0.443   8.847  17.699
  159   1H2     G  14          H21         G  14   1.935   9.081  14.557
  160   2H2     G  14          H22         G  14   2.150   9.035  16.292
  161   1H2*    G  14          1H2*        G  14  -4.263   7.130  12.603
  162   2H2*    G  14          2H2*        G  14  -2.754   6.794  11.706
  163   1H5*    A  15          1H5*        A  15  -0.518   8.118   9.790
  164   2H5*    A  15          2H5*        A  15  -0.148   6.899   8.554
  165    H4*    A  15           H4*        A  15   1.819   7.250   9.922
  166    H3*    A  15           H3*        A  15   0.489   4.728   9.667
  167    H1*    A  15           H1*        A  15   2.315   6.042  12.914
  168    H8     A  15           H8         A  15  -1.534   5.546  12.843
  169   1H6     A  15          1H6         A  15  -1.188   5.515  18.993
  170   2H6     A  15          2H6         A  15  -2.263   5.423  17.616
  171    H2     A  15           H2         A  15   2.972   6.006  17.364
  172   1H2*    A  15          1H2*        A  15   0.267   4.167  11.835
  173   2H2*    A  15          2H2*        A  15   2.047   4.026  11.869
  174   1H5*    C  16          1H5*        C  16   4.785   5.204  11.116
  175   2H5*    C  16          2H5*        C  16   5.882   3.963  10.476
  176    H4*    C  16           H4*        C  16   6.494   4.587  12.774
  177    H3*    C  16           H3*        C  16   6.045   1.929  11.812
  178    H1*    C  16           H1*        C  16   5.243   3.340  15.399
  179   1H4     C  16          H41         C  16  -1.234   2.104  16.138
  180   2H4     C  16          H42         C  16  -0.549   2.341  17.729
  181    H5     C  16           H5         C  16   0.072   2.210  14.116
  182    H6     C  16           H6         C  16   2.303   2.564  13.198
  183   1H2*    C  16          1H2*        C  16   4.311   1.393  13.278
  184   2H2*    C  16          2H2*        C  16   5.621   1.224  14.476
  185   1H5*  8OG  17          1H5*      8OG  17   8.332   2.613  16.032
  186   2H5*  8OG  17          2H5*      8OG  17   9.665   1.442  15.958
  187    H4*  8OG  17           H4*      8OG  17   8.878   1.680  18.260
  188    H3*  8OG  17           H3*      8OG  17   9.012  -0.783  16.825
  189   1H2*  8OG  17          1H2*      8OG  17   6.859  -1.448  17.063
  190   2H2*  8OG  17          2H2*      8OG  17   7.321  -1.805  18.752
  191    H1*  8OG  17           H1*      8OG  17   6.407   0.193  19.539
  192    H1   8OG  17           H1       8OG  17   2.192  -1.150  14.010
  193    H7   8OG  17           H7       8OG  17   1.876  -0.224  18.910
  194   1H2   8OG  17          1H2       8OG  17   5.590  -1.013  13.240
  195   2H2   8OG  17          2H2       8OG  17   3.957  -1.269  12.669
  196   1H5*    C  18          1H5*        C  18   8.833  -0.903  21.685
  197   2H5*    C  18          2H5*        C  18   9.947  -2.216  22.122
  198    H4*    C  18           H4*        C  18   8.002  -2.238  23.609
  199    H3*    C  18           H3*        C  18   8.958  -4.432  22.150
  200    H1*    C  18           H1*        C  18   5.233  -3.699  22.751
  201   1H4     C  18          H41         C  18   2.701  -3.402  16.652
  202   2H4     C  18          H42         C  18   1.377  -3.111  17.760
  203    H5     C  18           H5         C  18   4.997  -3.699  17.393
  204    H6     C  18           H6         C  18   6.480  -3.701  19.288
  205   1H2*    C  18          1H2*        C  18   7.236  -4.611  20.690
  206   2H2*    C  18          2H2*        C  18   6.464  -5.512  21.973
  207   1H5*    A  19          1H5*        A  19   5.358  -5.508  25.597
  208   2H5*    A  19          2H5*        A  19   6.195  -6.934  26.244
  209    H4*    A  19           H4*        A  19   3.799  -7.337  26.287
  210    H3*    A  19           H3*        A  19   5.653  -8.964  24.914
  211    H1*    A  19           H1*        A  19   2.085  -8.257  23.730
  212    H8     A  19           H8         A  19   4.967  -7.114  21.423
  213   1H6     A  19          1H6         A  19   0.586  -5.643  17.360
  214   2H6     A  19          2H6         A  19   2.309  -5.732  17.643
  215    H2     A  19           H2         A  19  -1.428  -7.070  21.114
  216   1H2*    A  19          1H2*        A  19   4.854  -8.816  22.822
  217   2H2*    A  19          2H2*        A  19   3.588  -9.928  23.420
  218   1H5*    C  20          1H5*        C  20   1.554 -10.378  26.400
  219   2H5*    C  20          2H5*        C  20   1.386 -12.103  26.778
  220    H4*    C  20           H4*        C  20  -0.699 -11.179  25.846
  221    H3*    C  20           H3*        C  20   0.669 -13.499  24.932
  222    H1*    C  20           H1*        C  20  -1.292 -10.963  22.693
  223   1H4     C  20          H41         C  20   3.499  -9.629  18.307
  224   2H4     C  20          H42         C  20   1.996  -9.063  17.612
  225    H5     C  20           H5         C  20   3.625 -10.681  20.489
  226    H6     C  20           H6         C  20   2.412 -11.257  22.481
  227   1H2*    C  20          1H2*        C  20   1.058 -12.823  22.758
  228   2H2*    C  20          2H2*        C  20  -0.687 -13.192  22.544
  229   1H5*    T  21          1H5*        T  21  -3.611 -12.302  24.038
  230   2H5*    T  21          2H5*        T  21  -4.739 -13.664  24.181
  231    H4*    T  21           H4*        T  21  -5.569 -11.923  22.640
  232    H3*    T  21           H3*        T  21  -5.294 -14.721  22.050
  233   1H2*    T  21          1H2*        T  21  -4.221 -14.584  20.071
  234   2H2*    T  21          2H2*        T  21  -5.719 -13.853  19.426
  235    H1*    T  21           H1*        T  21  -4.854 -11.730  19.532
  236    H3     T  21           H3         T  21  -1.702 -12.163  16.322
  237   1H5M    T  21          H51         T  21   1.300 -13.997  19.322
  238   2H5M    T  21          H52         T  21   0.863 -13.006  20.732
  239   3H5M    T  21          H53         T  21   0.220 -14.657  20.573
  240    H6     T  21           H6         T  21  -1.962 -13.277  20.971
  241   1H5*    G  22          1H5*        G  22  -8.404 -12.131  19.622
  242   2H5*    G  22          2H5*        G  22  -9.913 -13.060  19.723
  243    H4*    G  22           H4*        G  22  -9.805 -11.844  17.606
  244    H3*    G  22           H3*        G  22 -10.076 -14.714  17.856
  245    H1*    G  22           H1*        G  22  -7.903 -12.889  14.967
  246    H8     G  22           H8         G  22  -6.636 -15.240  17.805
  247    H1     G  22           H1         G  22  -2.763 -14.650  12.783
  248   1H2     G  22          H21         G  22  -5.162 -12.437  11.578
  249   2H2     G  22          H22         G  22  -3.601 -13.191  11.331
  250    H3T    G  22           H3T        G  22 -11.701 -13.138  17.312
  251   1H2*    G  22          1H2*        G  22  -8.685 -15.426  16.221
  252   2H2*    G  22          2H2*        G  22  -9.581 -14.425  15.045
  Start of MODEL    5
    1   1H5*    C   1          1H5*        C   1   1.473 -15.429   6.782
    2   2H5*    C   1          2H5*        C   1   2.707 -14.242   6.314
    3    H4*    C   1           H4*        C   1   0.434 -13.374   5.917
    4    H3*    C   1           H3*        C   1   2.497 -12.087   7.395
    5    H1*    C   1           H1*        C   1  -1.334 -11.973   8.370
    6   1H4     C   1          H41         C   1  -2.050 -13.473  14.445
    7   2H4     C   1          H42         C   1  -0.752 -14.635  14.400
    8    H5     C   1           H5         C   1   0.841 -14.710  12.507
    9    H6     C   1           H6         C   1   1.110 -14.077  10.143
   10   1H2*    C   1          1H2*        C   1   1.448 -11.742   9.370
   11   2H2*    C   1          2H2*        C   1   0.443 -10.560   8.493
   12    H5T    C   1           H5T        C   1   2.732 -13.637   8.589
   13   1H5*    A   2          1H5*        A   2  -1.157  -9.721   6.290
   14   2H5*    A   2          2H5*        A   2  -0.905  -8.009   5.900
   15    H4*    A   2           H4*        A   2  -2.849  -8.377   7.407
   16    H3*    A   2           H3*        A   2  -0.732  -6.505   7.750
   17    H1*    A   2           H1*        A   2  -2.571  -8.430  10.624
   18    H8     A   2           H8         A   2   1.272  -9.168  10.098
   19   1H6     A   2          1H6         A   2   0.951 -11.927  15.590
   20   2H6     A   2          2H6         A   2   2.001 -11.475  14.265
   21    H2     A   2           H2         A   2  -3.172 -10.479  14.540
   22   1H2*    A   2          1H2*        A   2   0.034  -7.191   9.777
   23   2H2*    A   2          2H2*        A   2  -1.442  -6.424  10.420
   24   1H5*    G   3          1H5*        G   3  -4.703  -7.407   9.862
   25   2H5*    G   3          2H5*        G   3  -5.578  -5.877   9.666
   26    H4*    G   3           H4*        G   3  -6.638  -7.215  11.384
   27    H3*    G   3           H3*        G   3  -5.763  -4.577  11.751
   28    H1*    G   3           H1*        G   3  -5.371  -7.363  14.548
   29    H8     G   3           H8         G   3  -2.382  -6.282  12.452
   30    H1     G   3           H1         G   3  -0.852  -8.876  18.065
   31   1H2     G   3          H21         G   3  -4.302  -9.088  18.529
   32   2H2     G   3          H22         G   3  -2.705  -9.387  19.179
   33   1H2*    G   3          1H2*        G   3  -4.227  -4.876  13.397
   34   2H2*    G   3          2H2*        G   3  -5.644  -5.094  14.463
   35   1H5*    T   4          1H5*        T   4  -8.103  -6.846  15.206
   36   2H5*    T   4          2H5*        T   4  -9.430  -5.736  15.608
   37    H4*    T   4           H4*        T   4  -8.717  -6.908  17.621
   38    H3*    T   4           H3*        T   4  -8.893  -4.110  17.347
   39   1H2*    T   4          1H2*        T   4  -6.666  -3.595  17.519
   40   2H2*    T   4          2H2*        T   4  -6.923  -3.812  19.250
   41    H1*    T   4           H1*        T   4  -5.989  -5.984  19.344
   42    H3     T   4           H3         T   4  -1.587  -5.937  18.584
   43   1H5M    T   4          H51         T   4  -1.961  -3.080  14.966
   44   2H5M    T   4          H52         T   4  -3.629  -3.378  14.423
   45   3H5M    T   4          H53         T   4  -3.295  -2.085  15.596
   46    H6     T   4           H6         T   4  -5.304  -3.909  16.342
   47   1H5*    G   5          1H5*        G   5  -7.571  -6.141  21.559
   48   2H5*    G   5          2H5*        G   5  -8.602  -5.286  22.724
   49    H4*    G   5           H4*        G   5  -6.490  -5.786  23.788
   50    H3*    G   5           H3*        G   5  -7.491  -3.133  23.443
   51    H1*    G   5           H1*        G   5  -3.751  -4.242  23.451
   52    H8     G   5           H8         G   5  -5.094  -2.814  20.079
   53    H1     G   5           H1         G   5   1.236  -3.348  20.495
   54   1H2     G   5          H21         G   5   0.633  -4.518  23.711
   55   2H2     G   5          H22         G   5   1.812  -4.106  22.486
   56   1H2*    G   5          1H2*        G   5  -5.680  -2.209  22.393
   57   2H2*    G   5          2H2*        G   5  -4.887  -2.318  23.994
   58   1H5*  2AR   6          1H5*      2AR   6  -3.848  -4.172  26.370
   59   2H5*  2AR   6          2H5*      2AR   6  -4.179  -3.266  27.861
   60    H4*  2AR   6           H4*      2AR   6  -1.766  -3.339  27.432
   61    H1*  2AR   6           H1*      2AR   6  -0.288  -1.081  25.481
   62    H2   2AR   6           H2       2AR   6   2.640  -0.076  22.272
   63   1H6   2AR   6          1H6       2AR   6   0.021   0.820  18.748
   64   2H6   2AR   6          2H6       2AR   6  -1.635   0.603  19.269
   65    H8   2AR   6           H8       2AR   6  -3.613  -0.656  23.464
   66   2H2*  2AR   6          2H2*      2AR   6  -1.596   0.572  26.516
   67   1H2*  2AR   6          1H2*      2AR   6  -3.114  -0.072  25.838
   68    H3*  2AR   6           H3*      2AR   6  -3.244  -1.017  27.949
   69    HX*  2AR   6           HX*      2AR   6  -0.992  -3.269  25.286
   70   HX**  2AR   6          HX**      2AR   6  -2.609  -2.803  24.688
   71   1H5*    G   7          1H5*        G   7   1.819  -0.776  27.071
   72   2H5*    G   7          2H5*        G   7   2.064   0.043  28.627
   73    H4*    G   7           H4*        G   7   3.726   0.893  27.137
   74    H3*    G   7           H3*        G   7   1.708   2.578  28.245
   75    H1*    G   7           H1*        G   7   3.479   2.912  24.838
   76    H8     G   7           H8         G   7  -0.378   2.803  24.512
   77    H1     G   7           H1         G   7   2.680   3.210  18.968
   78   1H2     G   7          H21         G   7   5.582   2.875  20.852
   79   2H2     G   7          H22         G   7   4.858   3.069  19.269
   80   1H2*    G   7          1H2*        G   7   0.841   3.340  26.234
   81   2H2*    G   7          2H2*        G   7   2.297   4.371  26.217
   82   1H5*    T   8          1H5*        T   8   5.466   3.757  25.861
   83   2H5*    T   8          2H5*        T   8   6.309   4.954  26.863
   84    H4*    T   8           H4*        T   8   6.942   5.383  24.619
   85    H3*    T   8           H3*        T   8   5.353   7.288  26.066
   86   1H2*    T   8          1H2*        T   8   3.822   7.735  24.467
   87   2H2*    T   8          2H2*        T   8   5.153   8.459  23.526
   88    H1*    T   8           H1*        T   8   5.412   6.610  22.195
   89    H3     T   8           H3         T   8   1.750   5.972  19.663
   90   1H5M    T   8          H51         T   8  -0.160   7.161  24.364
   91   2H5M    T   8          H52         T   8  -1.091   6.074  23.307
   92   3H5M    T   8          H53         T   8  -0.042   5.398  24.576
   93    H6     T   8           H6         T   8   2.455   6.302  24.398
   94   1H5*    C   9          1H5*        C   9   7.423   7.413  22.294
   95   2H5*    C   9          2H5*        C   9   8.625   8.716  22.187
   96    H4*    C   9           H4*        C   9   7.911   8.325  19.964
   97    H3*    C   9           H3*        C   9   7.269  10.769  21.304
   98    H1*    C   9           H1*        C   9   5.105   8.926  18.549
   99   1H4     C   9          H41         C   9  -0.445   9.304  22.147
  100   2H4     C   9          H42         C   9  -0.917   8.905  20.508
  101    H5     C   9           H5         C   9   1.886   9.616  22.804
  102    H6     C   9           H6         C   9   4.191   9.452  22.076
  103   1H2*    C   9          1H2*        C   9   5.040  10.845  20.857
  104   2H2*    C   9          2H2*        C   9   5.524  11.130  19.152
  105   1H5*    A  10          1H5*        A  10   8.360  10.429  16.487
  106   2H5*    A  10          2H5*        A  10   9.274  11.942  16.333
  107    H4*    A  10           H4*        A  10   8.369  11.239  14.175
  108    H3*    A  10           H3*        A  10   8.127  13.779  15.267
  109    H1*    A  10           H1*        A  10   4.920  12.011  13.602
  110    H8     A  10           H8         A  10   5.653  11.779  17.324
  111   1H6     A  10          1H6         A  10  -0.458  11.503  18.153
  112   2H6     A  10          2H6         A  10   1.096  11.432  18.951
  113    H2     A  10           H2         A  10   0.349  12.112  13.775
  114   1H2*    A  10          1H2*        A  10   5.893  13.910  15.656
  115   2H2*    A  10          2H2*        A  10   5.759  14.120  13.888
  116   1H5*    C  11          1H5*        C  11   6.248  12.944  11.020
  117   2H5*    C  11          2H5*        C  11   6.797  14.266   9.969
  118    H4*    C  11           H4*        C  11   4.541  13.570   9.341
  119    H3*    C  11           H3*        C  11   5.232  16.250  10.226
  120    H1*    C  11           H1*        C  11   1.762  14.403  10.912
  121   1H4     C  11          H41         C  11   2.309  15.888  17.360
  122   2H4     C  11          H42         C  11   0.616  15.587  17.039
  123    H5     C  11           H5         C  11   4.009  15.795  15.656
  124    H6     C  11           H6         C  11   4.453  15.405  13.283
  125    H3T    C  11           H3T        C  11   4.973  15.492   8.048
  126   1H2*    C  11          1H2*        C  11   3.406  16.778  11.415
  127   2H2*    C  11          2H2*        C  11   2.386  16.378  10.004
  128   1H5*    G  12          1H5*        G  12  -8.902  18.864  18.667
  129   2H5*    G  12          2H5*        G  12  -9.888  17.519  19.274
  130    H4*    G  12           H4*        G  12  -9.252  17.143  16.933
  131    H3*    G  12           H3*        G  12  -8.642  15.361  19.129
  132    H1*    G  12           H1*        G  12  -6.316  15.986  15.958
  133    H8     G  12           H8         G  12  -5.386  17.126  19.548
  134    H1     G  12           H1         G  12  -0.429  15.694  15.808
  135   1H2     G  12          H21         G  12  -2.853  14.851  13.450
  136   2H2     G  12          H22         G  12  -1.151  14.975  13.835
  137   1H2*    G  12          1H2*        G  12  -6.546  14.769  18.622
  138   2H2*    G  12          2H2*        G  12  -7.121  14.175  17.041
  139    H5T    G  12           H5T        G  12  -7.084  17.638  19.639
  140   1H5*    T  13          1H5*        T  13  -8.559  14.229  14.797
  141   2H5*    T  13          2H5*        T  13  -9.497  12.751  14.507
  142    H4*    T  13           H4*        T  13  -7.621  12.886  12.958
  143    H3*    T  13           H3*        T  13  -8.083  10.704  14.758
  144   1H2*    T  13          1H2*        T  13  -6.020  10.530  15.657
  145   2H2*    T  13          2H2*        T  13  -5.485   9.997  14.038
  146    H1*    T  13           H1*        T  13  -4.605  12.049  13.515
  147    H3     T  13           H3         T  13  -1.097  12.484  16.277
  148   1H5M    T  13          H51         T  13  -5.020  13.836  19.335
  149   2H5M    T  13          H52         T  13  -5.354  12.091  19.425
  150   3H5M    T  13          H53         T  13  -3.807  12.735  20.024
  151    H6     T  13           H6         T  13  -5.851  12.461  16.930
  152   1H5*    G  14          1H5*        G  14  -5.845  10.406  11.263
  153   2H5*    G  14          2H5*        G  14  -6.239   8.978  10.284
  154    H4*    G  14           H4*        G  14  -3.828   9.512  10.195
  155    H3*    G  14           H3*        G  14  -4.985   6.987  10.836
  156    H1*    G  14           H1*        G  14  -1.697   8.449  12.414
  157    H8     G  14           H8         G  14  -4.819   7.985  14.687
  158    H1     G  14           H1         G  14   0.693   8.740  17.782
  159   1H2     G  14          H21         G  14   2.095   8.938  14.597
  160   2H2     G  14          H22         G  14   2.354   8.962  16.326
  161   1H2*    G  14          1H2*        G  14  -4.016   6.616  12.852
  162   2H2*    G  14          2H2*        G  14  -2.511   6.361  11.926
  163   1H5*    A  15          1H5*        A  15  -0.410   7.717   9.899
  164   2H5*    A  15          2H5*        A  15   0.001   6.476   8.698
  165    H4*    A  15           H4*        A  15   1.970   6.973  10.020
  166    H3*    A  15           H3*        A  15   0.770   4.382   9.859
  167    H1*    A  15           H1*        A  15   2.559   5.878  13.049
  168    H8     A  15           H8         A  15  -1.262   5.192  13.029
  169   1H6     A  15          1H6         A  15  -0.878   5.402  19.171
  170   2H6     A  15          2H6         A  15  -1.955   5.209  17.806
  171    H2     A  15           H2         A  15   3.244   6.034  17.493
  172   1H2*    A  15          1H2*        A  15   0.593   3.877  12.045
  173   2H2*    A  15          2H2*        A  15   2.378   3.824  12.065
  174   1H5*    C  16          1H5*        C  16   5.047   5.043  11.302
  175   2H5*    C  16          2H5*        C  16   6.179   3.817  10.696
  176    H4*    C  16           H4*        C  16   6.748   4.482  12.991
  177    H3*    C  16           H3*        C  16   6.352   1.800  12.066
  178    H1*    C  16           H1*        C  16   5.492   3.263  15.618
  179   1H4     C  16          H41         C  16  -0.972   1.951  16.335
  180   2H4     C  16          H42         C  16  -0.302   2.244  17.926
  181    H5     C  16           H5         C  16   0.351   2.014  14.322
  182    H6     C  16           H6         C  16   2.584   2.374  13.412
  183   1H2*    C  16          1H2*        C  16   4.615   1.260  13.527
  184   2H2*    C  16          2H2*        C  16   5.915   1.136  14.741
  185   1H5*  8OG  17          1H5*      8OG  17   8.500   2.626  16.319
  186   2H5*  8OG  17          2H5*      8OG  17   9.872   1.498  16.302
  187    H4*  8OG  17           H4*      8OG  17   9.028   1.754  18.579
  188    H3*  8OG  17           H3*      8OG  17   9.270  -0.729  17.202
  189   1H2*  8OG  17          1H2*      8OG  17   7.121  -1.438  17.379
  190   2H2*  8OG  17          2H2*      8OG  17   7.543  -1.772  19.083
  191    H1*  8OG  17           H1*      8OG  17   6.567   0.215  19.827
  192    H1   8OG  17           H1       8OG  17   2.508  -1.312  14.230
  193    H7   8OG  17           H7       8OG  17   2.067  -0.340  19.110
  194   1H2   8OG  17          1H2       8OG  17   5.918  -1.103  13.531
  195   2H2   8OG  17          2H2       8OG  17   4.304  -1.410  12.930
  196   1H5*    C  18          1H5*        C  18   9.009  -0.900  22.207
  197   2H5*    C  18          2H5*        C  18  10.159  -2.218  22.517
  198    H4*    C  18           H4*        C  18   8.247  -2.414  24.032
  199    H3*    C  18           H3*        C  18   9.232  -4.457  22.420
  200    H1*    C  18           H1*        C  18   5.530  -3.905  22.991
  201   1H4     C  18          H41         C  18   3.007  -3.502  16.960
  202   2H4     C  18          H42         C  18   1.668  -3.212  18.051
  203    H5     C  18           H5         C  18   5.302  -3.795  17.749
  204    H6     C  18           H6         C  18   6.767  -3.633  19.604
  205   1H2*    C  18          1H2*        C  18   6.801  -5.547  21.933
  206   2H2*    C  18          2H2*        C  18   7.528  -4.359  20.904
  207   1H5*    A  19          1H5*        A  19   5.397  -5.657  25.530
  208   2H5*    A  19          2H5*        A  19   6.206  -7.100  26.174
  209    H4*    A  19           H4*        A  19   3.812  -7.492  26.147
  210    H3*    A  19           H3*        A  19   5.686  -9.091  24.743
  211    H1*    A  19           H1*        A  19   2.113  -8.340  23.613
  212    H8     A  19           H8         A  19   4.968  -7.316  21.227
  213   1H6     A  19          1H6         A  19   0.546  -5.569  17.322
  214   2H6     A  19          2H6         A  19   2.271  -5.753  17.548
  215    H2     A  19           H2         A  19  -1.419  -6.919  21.131
  216   1H2*    A  19          1H2*        A  19   4.862  -8.935  22.662
  217   2H2*    A  19          2H2*        A  19   3.586 -10.032  23.267
  218   1H5*    C  20          1H5*        C  20   1.540 -10.422  26.162
  219   2H5*    C  20          2H5*        C  20   1.347 -12.151  26.520
  220    H4*    C  20           H4*        C  20  -0.726 -11.197  25.602
  221    H3*    C  20           H3*        C  20   0.630 -13.505  24.629
  222    H1*    C  20           H1*        C  20  -1.334 -10.904  22.468
  223   1H4     C  20          H41         C  20   3.420  -9.531  18.054
  224   2H4     C  20          H42         C  20   1.913  -8.944  17.385
  225    H5     C  20           H5         C  20   3.563 -10.610  20.222
  226    H6     C  20           H6         C  20   2.366 -11.215  22.215
  227   1H2*    C  20          1H2*        C  20   0.999 -12.784  22.465
  228   2H2*    C  20          2H2*        C  20  -0.751 -13.134  22.261
  229   1H5*    T  21          1H5*        T  21  -3.683 -12.321  23.865
  230   2H5*    T  21          2H5*        T  21  -4.805 -13.692  23.964
  231    H4*    T  21           H4*        T  21  -5.653 -11.884  22.508
  232    H3*    T  21           H3*        T  21  -5.404 -14.658  21.814
  233   1H2*    T  21          1H2*        T  21  -4.359 -14.458  19.825
  234   2H2*    T  21          2H2*        T  21  -5.862 -13.695  19.228
  235    H1*    T  21           H1*        T  21  -4.985 -11.582  19.397
  236    H3     T  21           H3         T  21  -1.890 -11.921  16.121
  237   1H5M    T  21          H51         T  21   0.755 -12.922  20.442
  238   2H5M    T  21          H52         T  21   0.084 -14.561  20.266
  239   3H5M    T  21          H53         T  21   1.145 -13.890  19.003
  240    H6     T  21           H6         T  21  -2.079 -13.193  20.734
  241   1H5*    G  22          1H5*        G  22  -8.536 -11.951  19.529
  242   2H5*    G  22          2H5*        G  22 -10.048 -12.876  19.623
  243    H4*    G  22           H4*        G  22  -9.967 -11.577  17.553
  244    H3*    G  22           H3*        G  22 -10.294 -14.439  17.709
  245    H1*    G  22           H1*        G  22  -8.122 -12.577  14.842
  246    H8     G  22           H8         G  22  -6.813 -14.988  17.609
  247    H1     G  22           H1         G  22  -3.034 -14.313  12.526
  248   1H2     G  22          H21         G  22  -5.451 -12.073  11.407
  249   2H2     G  22          H22         G  22  -3.896 -12.826  11.116
  250    H3T    G  22           H3T        G  22 -11.206 -12.481  15.832
  251   1H2*    G  22          1H2*        G  22  -8.897 -15.133  16.070
  252   2H2*    G  22          2H2*        G  22  -9.798 -14.117  14.910
  Start of MODEL    6
    1   1H5*    C   1          1H5*        C   1   3.524 -16.315   6.381
    2   2H5*    C   1          2H5*        C   1   2.543 -16.796   7.781
    3    H4*    C   1           H4*        C   1   1.502 -15.446   5.260
    4    H3*    C   1           H3*        C   1   2.794 -14.334   7.529
    5    H1*    C   1           H1*        C   1  -1.127 -14.426   7.055
    6   1H4     C   1          H41         C   1  -3.904 -16.853  12.182
    7   2H4     C   1          H42         C   1  -2.409 -17.570  12.731
    8    H5     C   1           H5         C   1  -0.436 -17.719  11.298
    9    H6     C   1           H6         C   1   0.654 -16.698   9.348
   10   1H2*    C   1          1H2*        C   1   1.089 -14.329   9.024
   11   2H2*    C   1          2H2*        C   1   0.389 -13.028   8.023
   12    H5T    C   1           H5T        C   1   2.933 -18.524   6.334
   13   1H5*    A   2          1H5*        A   2  -0.518 -12.172   6.162
   14   2H5*    A   2          2H5*        A   2  -0.323 -10.452   5.764
   15    H4*    A   2           H4*        A   2  -2.424 -10.922   7.022
   16    H3*    A   2           H3*        A   2  -0.528  -8.889   7.508
   17    H1*    A   2           H1*        A   2  -2.400 -10.860  10.335
   18    H8     A   2           H8         A   2   1.350 -11.958   9.799
   19   1H6     A   2          1H6         A   2   1.198 -13.486  15.771
   20   2H6     A   2          2H6         A   2   2.170 -13.475  14.315
   21    H2     A   2           H2         A   2  -2.774 -11.685  14.705
   22   1H2*    A   2          1H2*        A   2   0.175  -9.510   9.586
   23   2H2*    A   2          2H2*        A   2  -1.376  -8.809  10.118
   24   1H5*    G   3          1H5*        G   3  -4.226  -9.935   9.946
   25   2H5*    G   3          2H5*        G   3  -5.276  -8.573   9.513
   26    H4*    G   3           H4*        G   3  -6.092  -9.629  11.537
   27    H3*    G   3           H3*        G   3  -5.463  -6.889  11.317
   28    H1*    G   3           H1*        G   3  -4.810  -9.044  14.551
   29    H8     G   3           H8         G   3  -1.807  -8.534  12.285
   30    H1     G   3           H1         G   3  -0.387  -8.758  18.485
   31   1H2     G   3          H21         G   3  -3.842  -8.905  18.926
   32   2H2     G   3          H22         G   3  -2.260  -8.885  19.672
   33   1H2*    G   3          1H2*        G   3  -3.863  -6.734  12.924
   34   2H2*    G   3          2H2*        G   3  -5.231  -6.843  14.069
   35   1H5*    T   4          1H5*        T   4  -7.167  -8.612  15.502
   36   2H5*    T   4          2H5*        T   4  -8.691  -7.700  15.497
   37    H4*    T   4           H4*        T   4  -8.011  -7.957  17.790
   38    H3*    T   4           H3*        T   4  -8.423  -5.456  16.564
   39   1H2*    T   4          1H2*        T   4  -6.258  -4.692  16.617
   40   2H2*    T   4          2H2*        T   4  -6.620  -4.308  18.298
   41    H1*    T   4           H1*        T   4  -5.526  -6.213  19.198
   42    H3     T   4           H3         T   4  -1.109  -5.802  18.692
   43   1H5M    T   4          H51         T   4  -1.476  -4.309  14.338
   44   2H5M    T   4          H52         T   4  -2.724  -5.443  13.775
   45   3H5M    T   4          H53         T   4  -3.180  -3.798  14.275
   46    H6     T   4           H6         T   4  -4.799  -5.305  15.675
   47   1H5*    G   5          1H5*        G   5  -7.474  -6.235  21.193
   48   2H5*    G   5          2H5*        G   5  -8.687  -5.250  22.034
   49    H4*    G   5           H4*        G   5  -6.729  -5.530  23.455
   50    H3*    G   5           H3*        G   5  -7.814  -3.025  22.671
   51    H1*    G   5           H1*        G   5  -3.979  -3.762  23.156
   52    H8     G   5           H8         G   5  -5.289  -3.016  19.567
   53    H1     G   5           H1         G   5   1.046  -2.846  20.210
   54   1H2     G   5          H21         G   5   0.427  -3.569  23.561
   55   2H2     G   5          H22         G   5   1.610  -3.239  22.315
   56   1H2*    G   5          1H2*        G   5  -5.979  -2.085  21.704
   57   2H2*    G   5          2H2*        G   5  -5.355  -1.943  23.375
   58   1H5*  2AR   6          1H5*      2AR   6  -4.741  -3.543  26.179
   59   2H5*  2AR   6          2H5*      2AR   6  -5.268  -2.539  27.545
   60    H4*  2AR   6           H4*      2AR   6  -2.814  -2.663  27.458
   61    H1*  2AR   6           H1*      2AR   6  -1.113  -0.459  25.544
   62    H2   2AR   6           H2       2AR   6   2.145   0.176  22.572
   63   1H6   2AR   6          1H6       2AR   6  -0.085   0.755  18.726
   64   2H6   2AR   6          2H6       2AR   6  -1.787   0.605  19.094
   65    H8   2AR   6           H8       2AR   6  -4.211  -0.181  23.161
   66   2H2*  2AR   6          2H2*      2AR   6  -2.563   1.211  26.330
   67   1H2*  2AR   6          1H2*      2AR   6  -3.983   0.486  25.537
   68    H3*  2AR   6           H3*      2AR   6  -4.314  -0.327  27.685
   69    HX*  2AR   6           HX*      2AR   6  -1.730  -2.671  25.451
   70   HX**  2AR   6          HX**      2AR   6  -3.262  -2.314  24.608
   71   1H5*    G   7          1H5*        G   7   0.621  -0.422  26.830
   72   2H5*    G   7          2H5*        G   7   0.951   0.320  28.408
   73    H4*    G   7           H4*        G   7   2.728   0.981  26.952
   74    H3*    G   7           H3*        G   7   0.954   2.862  28.127
   75    H1*    G   7           H1*        G   7   2.676   3.130  24.676
   76    H8     G   7           H8         G   7  -1.176   3.396  24.460
   77    H1     G   7           H1         G   7   1.756   3.695  18.843
   78   1H2     G   7          H21         G   7   4.651   2.964  20.620
   79   2H2     G   7          H22         G   7   3.916   3.269  19.055
   80   1H2*    G   7          1H2*        G   7   0.128   3.764  26.154
   81   2H2*    G   7          2H2*        G   7   1.680   4.639  26.142
   82   1H5*    T   8          1H5*        T   8   4.804   3.690  25.779
   83   2H5*    T   8          2H5*        T   8   5.788   4.773  26.785
   84    H4*    T   8           H4*        T   8   6.441   5.162  24.542
   85    H3*    T   8           H3*        T   8   5.068   7.207  26.027
   86   1H2*    T   8          1H2*        T   8   3.600   7.848  24.438
   87   2H2*    T   8          2H2*        T   8   5.003   8.425  23.501
   88    H1*    T   8           H1*        T   8   5.044   6.573  22.148
   89    H3     T   8           H3         T   8   1.326   6.411  19.628
   90   1H5M    T   8          H51         T   8  -1.476   6.738  23.291
   91   2H5M    T   8          H52         T   8  -0.498   5.931  24.540
   92   3H5M    T   8          H53         T   8  -0.430   7.701  24.361
   93    H6     T   8           H6         T   8   2.075   6.551  24.362
   94   1H5*    C   9          1H5*        C   9   7.151   7.146  22.297
   95   2H5*    C   9          2H5*        C   9   8.486   8.308  22.166
   96    H4*    C   9           H4*        C   9   7.703   7.971  19.954
   97    H3*    C   9           H3*        C   9   7.383  10.487  21.269
   98    H1*    C   9           H1*        C   9   4.970   8.895  18.569
   99   1H4     C   9          H41         C   9  -0.453   9.966  22.220
  100   2H4     C   9          H42         C   9  -0.985   9.620  20.588
  101    H5     C   9           H5         C   9   1.906   9.990  22.854
  102    H6     C   9           H6         C   9   4.166   9.538  22.106
  103   1H2*    C   9          1H2*        C   9   5.166  10.816  20.870
  104   2H2*    C   9          2H2*        C   9   5.647  11.038  19.156
  105   1H5*    A  10          1H5*        A  10   8.067   9.934  16.374
  106   2H5*    A  10          2H5*        A  10   9.190  11.291  16.161
  107    H4*    A  10           H4*        A  10   8.051  10.764  14.068
  108    H3*    A  10           H3*        A  10   8.260  13.296  15.177
  109    H1*    A  10           H1*        A  10   4.722  12.044  13.728
  110    H8     A  10           H8         A  10   5.676  11.736  17.394
  111   1H6     A  10          1H6         A  10  -0.358  12.161  18.634
  112   2H6     A  10          2H6         A  10   1.230  11.932  19.330
  113    H2     A  10           H2         A  10   0.213  12.614  14.201
  114   1H2*    A  10          1H2*        A  10   6.102  13.740  15.726
  115   2H2*    A  10          2H2*        A  10   5.881  14.004  13.973
  116   1H5*    C  11          1H5*        C  11   5.963  12.921  11.029
  117   2H5*    C  11          2H5*        C  11   6.603  14.224  10.007
  118    H4*    C  11           H4*        C  11   4.220  13.919   9.582
  119    H3*    C  11           H3*        C  11   5.376  16.397  10.596
  120    H1*    C  11           H1*        C  11   1.745  14.976  11.405
  121   1H4     C  11          H41         C  11   2.845  15.929  17.882
  122   2H4     C  11          H42         C  11   1.112  15.851  17.657
  123    H5     C  11           H5         C  11   4.417  15.765  16.067
  124    H6     C  11           H6         C  11   4.672  15.487  13.651
  125    H3T    C  11           H3T        C  11   4.886  15.867   8.393
  126   1H2*    C  11          1H2*        C  11   3.714  17.085  11.935
  127   2H2*    C  11          2H2*        C  11   2.560  16.918  10.582
  128   1H5*    G  12          1H5*        G  12  -7.740  19.555  20.499
  129   2H5*    G  12          2H5*        G  12  -8.783  18.231  21.056
  130    H4*    G  12           H4*        G  12  -8.393  18.074  18.638
  131    H3*    G  12           H3*        G  12  -7.738  16.014  20.566
  132    H1*    G  12           H1*        G  12  -5.631  16.816  17.273
  133    H8     G  12           H8         G  12  -4.396  17.362  20.912
  134    H1     G  12           H1         G  12   0.200  16.216  16.648
  135   1H2     G  12          H21         G  12  -2.421  15.894  14.374
  136   2H2     G  12          H22         G  12  -0.694  15.849  14.648
  137   1H2*    G  12          1H2*        G  12  -5.777  15.291  19.768
  138   2H2*    G  12          2H2*        G  12  -6.551  14.973  18.192
  139    H5T    G  12           H5T        G  12  -5.958  18.089  21.155
  140   1H5*    T  13          1H5*        T  13  -8.315  15.423  16.271
  141   2H5*    T  13          2H5*        T  13  -9.289  14.027  15.770
  142    H4*    T  13           H4*        T  13  -7.443  14.499  14.196
  143    H3*    T  13           H3*        T  13  -8.040  11.982  15.410
  144   1H2*    T  13          1H2*        T  13  -6.007  11.464  16.246
  145   2H2*    T  13          2H2*        T  13  -5.483  11.293  14.545
  146    H1*    T  13           H1*        T  13  -4.441  13.333  14.535
  147    H3     T  13           H3         T  13  -1.005  12.981  17.394
  148   1H5M    T  13          H51         T  13  -5.186  11.846  20.333
  149   2H5M    T  13          H52         T  13  -3.787  12.659  21.073
  150   3H5M    T  13          H53         T  13  -5.176  13.615  20.512
  151    H6     T  13           H6         T  13  -5.774  12.992  17.933
  152   1H5*    G  14          1H5*        G  14  -5.570  11.719  11.479
  153   2H5*    G  14          2H5*        G  14  -6.282  10.403  10.522
  154    H4*    G  14           H4*        G  14  -3.836  10.473  10.255
  155    H3*    G  14           H3*        G  14  -5.375   8.211  10.976
  156    H1*    G  14           H1*        G  14  -1.815   9.009  12.484
  157    H8     G  14           H8         G  14  -4.965   9.139  14.754
  158    H1     G  14           H1         G  14   0.597   9.260  17.846
  159   1H2     G  14          H21         G  14   2.013   9.153  14.663
  160   2H2     G  14          H22         G  14   2.273   9.205  16.392
  161   1H2*    G  14          1H2*        G  14  -4.452   7.708  12.988
  162   2H2*    G  14          2H2*        G  14  -3.053   7.136  12.036
  163   1H5*    A  15          1H5*        A  15  -0.732   8.271  10.087
  164   2H5*    A  15          2H5*        A  15  -0.596   7.061   8.794
  165    H4*    A  15           H4*        A  15   1.506   7.119   9.951
  166    H3*    A  15           H3*        A  15  -0.138   4.799   9.855
  167    H1*    A  15           H1*        A  15   2.062   5.848  12.985
  168    H8     A  15           H8         A  15  -1.827   5.869  13.122
  169   1H6     A  15          1H6         A  15  -1.182   6.251  19.221
  170   2H6     A  15          2H6         A  15  -2.321   6.199  17.894
  171    H2     A  15           H2         A  15   2.929   6.092  17.397
  172   1H2*    A  15          1H2*        A  15  -0.316   4.315  12.052
  173   2H2*    A  15          2H2*        A  15   1.418   3.894  11.982
  174   1H5*    C  16          1H5*        C  16   4.139   5.048  11.090
  175   2H5*    C  16          2H5*        C  16   5.146   3.843  10.261
  176    H4*    C  16           H4*        C  16   6.167   4.340  12.387
  177    H3*    C  16           H3*        C  16   5.261   1.717  11.630
  178    H1*    C  16           H1*        C  16   5.392   3.315  15.211
  179   1H4     C  16          H41         C  16   0.339   2.345  18.779
  180   2H4     C  16          H42         C  16  -0.776   2.704  17.502
  181    H5     C  16           H5         C  16  -0.005   2.780  15.120
  182    H6     C  16           H6         C  16   2.012   3.032  13.730
  183   1H2*    C  16          1H2*        C  16   3.851   1.405  13.435
  184   2H2*    C  16          2H2*        C  16   5.344   1.132  14.345
  185   1H5*  8OG  17          1H5*      8OG  17   8.285   2.266  15.395
  186   2H5*  8OG  17          2H5*      8OG  17   9.474   0.982  15.100
  187    H4*  8OG  17           H4*      8OG  17   9.132   1.274  17.501
  188    H3*  8OG  17           H3*      8OG  17   8.791  -1.182  16.097
  189   1H2*  8OG  17          1H2*      8OG  17   6.652  -1.638  16.698
  190   2H2*  8OG  17          2H2*      8OG  17   7.360  -2.060  18.284
  191    H1*  8OG  17           H1*      8OG  17   6.793   0.006  19.211
  192    H1   8OG  17           H1       8OG  17   1.591  -0.963  14.510
  193    H7   8OG  17           H7       8OG  17   2.194   0.076  19.364
  194   1H2   8OG  17          1H2       8OG  17   4.811  -1.187  13.188
  195   2H2   8OG  17          2H2       8OG  17   3.088  -1.284  12.901
  196   1H5*    C  18          1H5*        C  18   9.098  -0.993  20.819
  197   2H5*    C  18          2H5*        C  18  10.142  -2.333  21.339
  198    H4*    C  18           H4*        C  18   8.326  -1.987  22.958
  199    H3*    C  18           H3*        C  18   9.027  -4.421  21.779
  200    H1*    C  18           H1*        C  18   5.376  -3.363  22.418
  201   1H4     C  18          H41         C  18   2.675  -3.572  16.386
  202   2H4     C  18          H42         C  18   1.414  -3.041  17.477
  203    H5     C  18           H5         C  18   4.954  -3.977  17.111
  204    H6     C  18           H6         C  18   6.491  -3.878  18.948
  205   1H2*    C  18          1H2*        C  18   7.230  -4.657  20.425
  206   2H2*    C  18          2H2*        C  18   6.466  -5.331  21.842
  207   1H5*    A  19          1H5*        A  19   5.877  -5.032  25.576
  208   2H5*    A  19          2H5*        A  19   6.585  -6.465  26.350
  209    H4*    A  19           H4*        A  19   4.143  -6.596  26.427
  210    H3*    A  19           H3*        A  19   5.834  -8.565  25.331
  211    H1*    A  19           H1*        A  19   2.379  -7.683  23.971
  212    H8     A  19           H8         A  19   5.339  -7.257  21.539
  213   1H6     A  19          1H6         A  19   1.130  -5.693  17.329
  214   2H6     A  19          2H6         A  19   2.824  -6.030  17.609
  215    H2     A  19           H2         A  19  -0.972  -6.225  21.263
  216   1H2*    A  19          1H2*        A  19   5.104  -8.578  23.203
  217   2H2*    A  19          2H2*        A  19   3.732  -9.505  23.882
  218   1H5*    C  20          1H5*        C  20   1.487  -9.350  26.768
  219   2H5*    C  20          2H5*        C  20   1.150 -11.015  27.284
  220    H4*    C  20           H4*        C  20  -0.803  -9.976  26.176
  221    H3*    C  20           H3*        C  20   0.335 -12.509  25.583
  222    H1*    C  20           H1*        C  20  -1.237 -10.055  22.977
  223   1H4     C  20          H41         C  20   3.842  -9.714  18.732
  224   2H4     C  20          H42         C  20   2.444  -9.046  17.918
  225    H5     C  20           H5         C  20   3.766 -10.535  21.013
  226    H6     C  20           H6         C  20   2.418 -10.772  22.990
  227   1H2*    C  20          1H2*        C  20   0.903 -12.114  23.375
  228   2H2*    C  20          2H2*        C  20  -0.856 -12.332  23.097
  229   1H5*    T  21          1H5*        T  21  -3.346 -10.722  24.034
  230   2H5*    T  21          2H5*        T  21  -4.794 -11.722  24.261
  231    H4*    T  21           H4*        T  21  -5.028 -10.099  22.401
  232    H3*    T  21           H3*        T  21  -5.588 -12.894  22.314
  233   1H2*    T  21          1H2*        T  21  -4.249 -13.465  20.565
  234   2H2*    T  21          2H2*        T  21  -5.464 -12.625  19.563
  235    H1*    T  21           H1*        T  21  -4.183 -10.716  19.398
  236    H3     T  21           H3         T  21  -1.274 -12.667  16.523
  237   1H5M    T  21          H51         T  21   1.100 -12.532  21.187
  238   2H5M    T  21          H52         T  21   0.372 -14.152  21.272
  239   3H5M    T  21          H53         T  21   1.562 -13.775  20.002
  240    H6     T  21           H6         T  21  -1.612 -12.287  21.287
  241   1H5*    G  22          1H5*        G  22  -6.766 -12.500  18.104
  242   2H5*    G  22          2H5*        G  22  -6.303 -10.854  18.577
  243    H4*    G  22           H4*        G  22  -8.019  -9.941  17.048
  244    H3*    G  22           H3*        G  22  -9.125 -12.512  17.177
  245    H1*    G  22           H1*        G  22  -6.859 -11.517  13.937
  246    H8     G  22           H8         G  22  -5.834 -13.757  16.948
  247    H1     G  22           H1         G  22  -2.408 -14.603  11.650
  248   1H2     G  22          H21         G  22  -4.523 -12.223  10.252
  249   2H2     G  22          H22         G  22  -3.194 -13.338  10.006
  250    H3T    G  22           H3T        G  22  -9.485 -10.300  15.419
  251   1H2*    G  22          1H2*        G  22  -8.026 -13.655  15.551
  252   2H2*    G  22          2H2*        G  22  -8.823 -12.572  14.374
  Start of MODEL    7
    1   1H5*    C   1          1H5*        C   1   0.471 -14.814   4.864
    2   2H5*    C   1          2H5*        C   1   1.878 -13.746   4.689
    3    H4*    C   1           H4*        C   1  -0.217 -12.455   4.708
    4    H3*    C   1           H3*        C   1   2.049 -11.982   6.320
    5    H1*    C   1           H1*        C   1  -1.658 -11.702   7.731
    6   1H4     C   1          H41         C   1  -0.990 -16.500  12.263
    7   2H4     C   1          H42         C   1  -2.251 -15.430  12.836
    8    H5     C   1           H5         C   1   0.232 -16.122  10.220
    9    H6     C   1           H6         C   1   0.495 -14.629   8.290
   10   1H2*    C   1          1H2*        C   1   1.175 -12.237   8.404
   11   2H2*    C   1          2H2*        C   1   0.343 -10.693   8.097
   12    H5T    C   1           H5T        C   1   2.141 -13.894   6.971
   13   1H5*    A   2          1H5*        A   2  -1.360  -9.408   6.217
   14   2H5*    A   2          2H5*        A   2  -1.193  -7.652   6.018
   15    H4*    A   2           H4*        A   2  -3.109  -8.268   7.475
   16    H3*    A   2           H3*        A   2  -1.089  -6.354   7.997
   17    H1*    A   2           H1*        A   2  -2.693  -8.695  10.720
   18    H8     A   2           H8         A   2   1.080  -9.331   9.757
   19   1H6     A   2          1H6         A   2   1.346 -12.502  15.031
   20   2H6     A   2          2H6         A   2   2.248 -11.970  13.629
   21    H2     A   2           H2         A   2  -2.831 -10.927  14.579
   22   1H2*    A   2          1H2*        A   2  -0.197  -7.245   9.887
   23   2H2*    A   2          2H2*        A   2  -1.667  -6.624  10.679
   24   1H5*    G   3          1H5*        G   3  -4.815  -7.865  10.234
   25   2H5*    G   3          2H5*        G   3  -5.791  -6.393  10.072
   26    H4*    G   3           H4*        G   3  -6.786  -7.829  11.744
   27    H3*    G   3           H3*        G   3  -6.061  -5.168  12.194
   28    H1*    G   3           H1*        G   3  -5.448  -7.988  14.908
   29    H8     G   3           H8         G   3  -2.533  -6.858  12.724
   30    H1     G   3           H1         G   3  -0.820  -9.211  18.386
   31   1H2     G   3          H21         G   3  -4.252  -9.519  18.919
   32   2H2     G   3          H22         G   3  -2.636  -9.749  19.549
   33   1H2*    G   3          1H2*        G   3  -4.445  -5.437  13.773
   34   2H2*    G   3          2H2*        G   3  -5.816  -5.734  14.880
   35   1H5*    T   4          1H5*        T   4  -8.263  -7.468  15.808
   36   2H5*    T   4          2H5*        T   4  -9.583  -6.345  16.200
   37    H4*    T   4           H4*        T   4  -8.779  -7.356  18.253
   38    H3*    T   4           H3*        T   4  -8.915  -4.576  17.782
   39   1H2*    T   4          1H2*        T   4  -6.677  -4.097  17.869
   40   2H2*    T   4          2H2*        T   4  -6.886  -4.213  19.617
   41    H1*    T   4           H1*        T   4  -5.995  -6.401  19.801
   42    H3     T   4           H3         T   4  -1.614  -6.424  18.969
   43   1H5M    T   4          H51         T   4  -3.298  -2.691  15.861
   44   2H5M    T   4          H52         T   4  -2.031  -3.757  15.209
   45   3H5M    T   4          H53         T   4  -3.730  -4.002  14.742
   46    H6     T   4           H6         T   4  -5.354  -4.505  16.672
   47   1H5*    G   5          1H5*        G   5  -7.545  -6.430  22.049
   48   2H5*    G   5          2H5*        G   5  -8.532  -5.501  23.194
   49    H4*    G   5           H4*        G   5  -6.415  -6.034  24.244
   50    H3*    G   5           H3*        G   5  -7.368  -3.377  23.847
   51    H1*    G   5           H1*        G   5  -3.646  -4.543  23.800
   52    H8     G   5           H8         G   5  -5.039  -3.216  20.405
   53    H1     G   5           H1         G   5   1.290  -3.843  20.710
   54   1H2     G   5          H21         G   5   0.732  -4.904  23.973
   55   2H2     G   5          H22         G   5   1.893  -4.552  22.712
   56   1H2*    G   5          1H2*        G   5  -5.572  -2.524  22.707
   57   2H2*    G   5          2H2*        G   5  -4.741  -2.580  24.292
   58   1H5*  2AR   6          1H5*      2AR   6  -3.610  -4.321  26.771
   59   2H5*  2AR   6          2H5*      2AR   6  -3.949  -3.327  28.201
   60    H4*  2AR   6           H4*      2AR   6  -1.536  -3.393  27.762
   61    H1*  2AR   6           H1*      2AR   6  -0.107  -1.232  25.652
   62    H2   2AR   6           H2       2AR   6   2.760  -0.510  22.316
   63   1H6   2AR   6          1H6       2AR   6   0.077   0.095  18.778
   64   2H6   2AR   6          2H6       2AR   6  -1.569  -0.074  19.347
   65    H8   2AR   6           H8       2AR   6  -3.469  -0.961  23.666
   66   2H2*  2AR   6          2H2*      2AR   6  -1.423   0.454  26.610
   67   1H2*  2AR   6          1H2*      2AR   6  -2.941  -0.241  25.988
   68    H3*  2AR   6           H3*      2AR   6  -3.044  -1.067  28.148
   69    HX*  2AR   6           HX*      2AR   6  -0.770  -3.439  25.615
   70   HX**  2AR   6          HX**      2AR   6  -2.399  -3.047  24.998
   71   1H5*    G   7          1H5*        G   7   2.181  -0.690  27.340
   72   2H5*    G   7          2H5*        G   7   2.256   0.253  28.841
   73    H4*    G   7           H4*        G   7   3.900   1.175  27.369
   74    H3*    G   7           H3*        G   7   1.649   2.694  28.255
   75    H1*    G   7           H1*        G   7   3.553   2.982  24.890
   76    H8     G   7           H8         G   7  -0.270   2.594  24.458
   77    H1     G   7           H1         G   7   2.932   2.433  18.988
   78   1H2     G   7          H21         G   7   5.794   2.463  20.957
   79   2H2     G   7          H22         G   7   5.101   2.423  19.347
   80   1H2*    G   7          1H2*        G   7   0.839   3.282  26.165
   81   2H2*    G   7          2H2*        G   7   2.223   4.414  26.144
   82   1H5*    T   8          1H5*        T   8   5.604   4.792  26.785
   83   2H5*    T   8          2H5*        T   8   5.820   6.345  27.613
   84    H4*    T   8           H4*        T   8   6.579   6.516  25.324
   85    H3*    T   8           H3*        T   8   4.417   8.130  26.373
   86   1H2*    T   8          1H2*        T   8   3.088   8.037  24.549
   87   2H2*    T   8          2H2*        T   8   4.360   8.897  23.647
   88    H1*    T   8           H1*        T   8   5.211   6.961  22.714
   89    H3     T   8           H3         T   8   2.159   5.173  19.895
   90   1H5M    T   8          H51         T   8  -0.343   5.283  24.526
   91   2H5M    T   8          H52         T   8  -0.618   6.936  23.927
   92   3H5M    T   8          H53         T   8  -1.237   5.543  23.008
   93    H6     T   8           H6         T   8   2.028   6.493  24.493
   94   1H5*    C   9          1H5*        C   9   7.087   8.257  23.040
   95   2H5*    C   9          2H5*        C   9   8.017   9.766  22.932
   96    H4*    C   9           H4*        C   9   7.953   8.959  20.729
   97    H3*    C   9           H3*        C   9   6.411  11.272  21.432
   98    H1*    C   9           H1*        C   9   5.594   8.567  18.664
   99   1H4     C   9          H41         C   9  -0.542   7.252  19.032
  100   2H4     C   9          H42         C   9  -0.728   8.243  20.455
  101    H5     C   9           H5         C   9   1.240   8.978  21.792
  102    H6     C   9           H6         C   9   3.623   9.362  21.681
  103   1H2*    C   9          1H2*        C   9   4.455  10.705  20.432
  104   2H2*    C   9          2H2*        C   9   5.336  10.853  18.878
  105   1H5*    A  10          1H5*        A  10   6.804   9.866  17.116
  106   2H5*    A  10          2H5*        A  10   8.061  11.018  16.625
  107    H4*    A  10           H4*        A  10   6.900  10.242  14.667
  108    H3*    A  10           H3*        A  10   7.141  12.945  15.343
  109    H1*    A  10           H1*        A  10   3.708  11.450  13.904
  110    H8     A  10           H8         A  10   4.179  11.452  17.633
  111   1H6     A  10          1H6         A  10  -1.756  13.057  18.109
  112   2H6     A  10          2H6         A  10  -0.327  12.584  19.001
  113    H2     A  10           H2         A  10  -0.616  13.122  13.762
  114   1H2*    A  10          1H2*        A  10   4.961  13.523  15.623
  115   2H2*    A  10          2H2*        A  10   4.864  13.429  13.843
  116   1H5*    C  11          1H5*        C  11   5.215  11.775  11.156
  117   2H5*    C  11          2H5*        C  11   6.157  12.724   9.990
  118    H4*    C  11           H4*        C  11   3.868  12.455   9.189
  119    H3*    C  11           H3*        C  11   5.117  15.012   9.721
  120    H1*    C  11           H1*        C  11   1.249  14.205  10.337
  121   1H4     C  11          H41         C  11   1.874  16.528  16.524
  122   2H4     C  11          H42         C  11   0.183  16.649  16.094
  123    H5     C  11           H5         C  11   3.560  15.704  15.016
  124    H6     C  11           H6         C  11   3.991  14.808  12.783
  125    H3T    C  11           H3T        C  11   4.787  13.958   7.671
  126   1H2*    C  11          1H2*        C  11   3.416  16.146  10.641
  127   2H2*    C  11          2H2*        C  11   2.415  15.776   9.208
  128   1H5*    G  12          1H5*        G  12  -9.209  19.951  17.547
  129   2H5*    G  12          2H5*        G  12 -10.190  18.668  18.283
  130    H4*    G  12           H4*        G  12  -9.560  18.076  15.983
  131    H3*    G  12           H3*        G  12  -8.955  16.506  18.335
  132    H1*    G  12           H1*        G  12  -6.610  16.831  15.129
  133    H8     G  12           H8         G  12  -5.713  18.211  18.648
  134    H1     G  12           H1         G  12  -0.724  16.672  14.994
  135   1H2     G  12          H21         G  12  -3.128  15.684  12.672
  136   2H2     G  12          H22         G  12  -1.430  15.850  13.057
  137   1H2*    G  12          1H2*        G  12  -6.852  15.879  17.897
  138   2H2*    G  12          2H2*        G  12  -7.421  15.132  16.379
  139    H5T    G  12           H5T        G  12  -7.386  18.819  18.624
  140   1H5*    T  13          1H5*        T  13  -9.011  14.898  14.237
  141   2H5*    T  13          2H5*        T  13  -9.733  13.295  13.998
  142    H4*    T  13           H4*        T  13  -7.726  13.672  12.587
  143    H3*    T  13           H3*        T  13  -8.259  11.422  14.246
  144   1H2*    T  13          1H2*        T  13  -6.377  11.391  15.496
  145   2H2*    T  13          2H2*        T  13  -5.538  10.909  13.995
  146    H1*    T  13           H1*        T  13  -4.693  13.011  13.652
  147    H3     T  13           H3         T  13  -1.873  13.911  17.020
  148   1H5M    T  13          H51         T  13  -5.262  13.908  20.170
  149   2H5M    T  13          H52         T  13  -6.655  14.379  19.169
  150   3H5M    T  13          H53         T  13  -6.313  12.658  19.463
  151    H6     T  13           H6         T  13  -6.609  13.174  16.772
  152   1H5*    G  14          1H5*        G  14  -4.459  11.494  11.238
  153   2H5*    G  14          2H5*        G  14  -5.058  10.151  10.244
  154    H4*    G  14           H4*        G  14  -2.612  10.290  10.121
  155    H3*    G  14           H3*        G  14  -4.105   7.992  10.785
  156    H1*    G  14           H1*        G  14  -0.700   8.936  12.563
  157    H8     G  14           H8         G  14  -4.037   9.219  14.507
  158    H1     G  14           H1         G  14   1.196   9.335  18.130
  159   1H2     G  14          H21         G  14   2.895   8.841  15.129
  160   2H2     G  14          H22         G  14   2.998   9.009  16.869
  161   1H2*    G  14          1H2*        G  14  -3.338   7.586  12.887
  162   2H2*    G  14          2H2*        G  14  -1.856   7.021  12.071
  163   1H5*    A  15          1H5*        A  15   0.500   8.391  10.577
  164   2H5*    A  15          2H5*        A  15   0.878   7.317   9.214
  165    H4*    A  15           H4*        A  15   2.847   7.481  10.586
  166    H3*    A  15           H3*        A  15   1.459   5.034  10.131
  167    H1*    A  15           H1*        A  15   3.225   5.979  13.552
  168    H8     A  15           H8         A  15  -0.637   5.994  13.241
  169   1H6     A  15          1H6         A  15  -0.693   4.694  19.253
  170   2H6     A  15          2H6         A  15  -1.680   5.028  17.848
  171    H2     A  15           H2         A  15   3.591   4.868  17.907
  172   1H2*    A  15          1H2*        A  15   1.176   4.291  12.227
  173   2H2*    A  15          2H2*        A  15   2.951   4.106  12.291
  174   1H5*    C  16          1H5*        C  16   5.719   5.075  11.696
  175   2H5*    C  16          2H5*        C  16   6.756   3.830  10.972
  176    H4*    C  16           H4*        C  16   7.272   4.147  13.357
  177    H3*    C  16           H3*        C  16   6.690   1.651  12.069
  178    H1*    C  16           H1*        C  16   5.825   2.728  15.754
  179   1H4     C  16          H41         C  16  -0.743   1.877  16.116
  180   2H4     C  16          H42         C  16  -0.104   1.821  17.744
  181    H5     C  16           H5         C  16   0.647   2.192  14.169
  182    H6     C  16           H6         C  16   2.943   2.446  13.378
  183   1H2*    C  16          1H2*        C  16   4.863   1.083  13.401
  184   2H2*    C  16          2H2*        C  16   6.098   0.696  14.623
  185   1H5*  8OG  17          1H5*      8OG  17   8.761   2.040  16.312
  186   2H5*  8OG  17          2H5*      8OG  17  10.078   0.849  16.344
  187    H4*  8OG  17           H4*      8OG  17   9.184   1.205  18.597
  188    H3*  8OG  17           H3*      8OG  17   9.379  -1.324  17.282
  189   1H2*  8OG  17          1H2*      8OG  17   7.212  -1.974  17.470
  190   2H2*  8OG  17          2H2*      8OG  17   7.609  -2.252  19.190
  191    H1*  8OG  17           H1*      8OG  17   6.685  -0.209  19.845
  192    H1   8OG  17           H1       8OG  17   2.584  -1.618  14.243
  193    H7   8OG  17           H7       8OG  17   2.193  -0.830  19.160
  194   1H2   8OG  17          1H2       8OG  17   4.363  -1.647  12.918
  195   2H2   8OG  17          2H2       8OG  17   5.981  -1.341  13.509
  196   1H5*    C  18          1H5*        C  18   9.063  -1.352  22.334
  197   2H5*    C  18          2H5*        C  18  10.202  -2.680  22.641
  198    H4*    C  18           H4*        C  18   8.298  -2.836  24.178
  199    H3*    C  18           H3*        C  18   9.261  -4.908  22.595
  200    H1*    C  18           H1*        C  18   5.563  -4.326  23.156
  201   1H4     C  18          H41         C  18   3.043  -3.957  17.122
  202   2H4     C  18          H42         C  18   1.706  -3.644  18.210
  203    H5     C  18           H5         C  18   5.333  -4.270  17.916
  204    H6     C  18           H6         C  18   6.801  -4.097  19.767
  205   1H2*    C  18          1H2*        C  18   6.827  -5.985  22.117
  206   2H2*    C  18          2H2*        C  18   7.560  -4.810  21.075
  207   1H5*    A  19          1H5*        A  19   5.407  -6.201  25.818
  208   2H5*    A  19          2H5*        A  19   6.299  -7.632  26.374
  209    H4*    A  19           H4*        A  19   3.920  -8.128  26.383
  210    H3*    A  19           H3*        A  19   5.834  -9.592  24.898
  211    H1*    A  19           H1*        A  19   2.222  -8.958  23.832
  212    H8     A  19           H8         A  19   4.982  -7.742  21.439
  213   1H6     A  19          1H6         A  19   0.437  -5.946  17.708
  214   2H6     A  19          2H6         A  19   2.170  -6.095  17.895
  215    H2     A  19           H2         A  19  -1.416  -7.511  21.495
  216   1H2*    A  19          1H2*        A  19   4.987  -9.365  22.830
  217   2H2*    A  19          2H2*        A  19   3.773 -10.556  23.387
  218   1H5*    C  20          1H5*        C  20   1.726 -11.202  26.271
  219   2H5*    C  20          2H5*        C  20   1.630 -12.960  26.499
  220    H4*    C  20           H4*        C  20  -0.493 -12.047  25.642
  221    H3*    C  20           H3*        C  20   0.973 -14.219  24.529
  222    H1*    C  20           H1*        C  20  -1.114 -11.581  22.532
  223   1H4     C  20          H41         C  20   3.548  -9.726  18.199
  224   2H4     C  20          H42         C  20   2.014  -9.145  17.587
  225    H5     C  20           H5         C  20   3.753 -10.936  20.291
  226    H6     C  20           H6         C  20   2.596 -11.727  22.244
  227   1H2*    C  20          1H2*        C  20   1.311 -13.343  22.418
  228   2H2*    C  20          2H2*        C  20  -0.418 -13.763  22.183
  229   1H5*    T  21          1H5*        T  21  -3.171 -12.981  23.886
  230   2H5*    T  21          2H5*        T  21  -4.453 -14.201  23.762
  231    H4*    T  21           H4*        T  21  -4.949 -12.067  22.556
  232    H3*    T  21           H3*        T  21  -5.200 -14.753  21.560
  233   1H2*    T  21          1H2*        T  21  -4.107 -14.508  19.595
  234   2H2*    T  21          2H2*        T  21  -5.455 -13.447  19.098
  235    H1*    T  21           H1*        T  21  -4.260 -11.534  19.523
  236    H3     T  21           H3         T  21  -1.448 -12.200  16.012
  237   1H5M    T  21          H51         T  21   0.587 -15.018  19.955
  238   2H5M    T  21          H52         T  21   1.655 -14.224  18.772
  239   3H5M    T  21          H53         T  21   1.258 -13.406  20.301
  240    H6     T  21           H6         T  21  -1.485 -13.456  20.633
  241   1H5*    G  22          1H5*        G  22  -6.797 -10.825  20.100
  242   2H5*    G  22          2H5*        G  22  -8.554 -11.005  20.289
  243    H4*    G  22           H4*        G  22  -8.043  -9.108  18.836
  244    H3*    G  22           H3*        G  22  -9.773 -11.249  18.203
  245    H1*    G  22           H1*        G  22  -7.111  -9.865  15.462
  246    H8     G  22           H8         G  22  -6.832 -13.196  17.444
  247    H1     G  22           H1         G  22  -3.537 -13.008  11.997
  248   1H2     G  22          H21         G  22  -4.860  -9.798  11.671
  249   2H2     G  22          H22         G  22  -3.850 -11.053  10.986
  250    H3T    G  22           H3T        G  22  -9.459  -8.587  17.235
  251   1H2*    G  22          1H2*        G  22  -8.875 -12.068  16.286
  252   2H2*    G  22          2H2*        G  22  -9.295 -10.507  15.522
  Start of MODEL    8
    1   1H5*    C   1          1H5*        C   1   1.633 -17.386   7.929
    2   2H5*    C   1          2H5*        C   1   0.614 -18.332   6.825
    3    H4*    C   1           H4*        C   1  -0.320 -16.247   5.892
    4    H3*    C   1           H3*        C   1   1.952 -15.063   7.176
    5    H1*    C   1           H1*        C   1  -1.812 -14.557   8.242
    6   1H4     C   1          H41         C   1  -2.397 -15.269  14.472
    7   2H4     C   1          H42         C   1  -1.178 -16.510  14.537
    8    H5     C   1           H5         C   1   0.330 -16.934  12.616
    9    H6     C   1           H6         C   1   0.548 -16.612  10.185
   10   1H2*    C   1          1H2*        C   1   1.016 -14.422   9.131
   11   2H2*    C   1          2H2*        C   1   0.059 -13.263   8.173
   12    H5T    C   1           H5T        C   1   2.749 -18.052   6.048
   13   1H5*    A   2          1H5*        A   2  -1.449 -12.486   5.906
   14   2H5*    A   2          2H5*        A   2  -1.121 -10.809   5.428
   15    H4*    A   2           H4*        A   2  -3.029 -11.038   7.029
   16    H3*    A   2           H3*        A   2  -0.832  -9.219   7.169
   17    H1*    A   2           H1*        A   2  -2.661 -10.888  10.200
   18    H8     A   2           H8         A   2   1.122 -11.870   9.620
   19   1H6     A   2          1H6         A   2   0.919 -13.864  15.441
   20   2H6     A   2          2H6         A   2   1.929 -13.656  14.027
   21    H2     A   2           H2         A   2  -3.159 -12.314  14.377
   22   1H2*    A   2          1H2*        A   2  -0.050  -9.761   9.231
   23   2H2*    A   2          2H2*        A   2  -1.502  -8.926   9.844
   24   1H5*    G   3          1H5*        G   3  -4.520  -9.870   9.683
   25   2H5*    G   3          2H5*        G   3  -5.453  -8.399   9.353
   26    H4*    G   3           H4*        G   3  -6.326  -9.450  11.337
   27    H3*    G   3           H3*        G   3  -5.350  -6.800  11.281
   28    H1*    G   3           H1*        G   3  -4.946  -9.260  14.332
   29    H8     G   3           H8         G   3  -1.920  -9.001  12.056
   30    H1     G   3           H1         G   3  -0.512  -9.871  18.208
   31   1H2     G   3          H21         G   3  -3.916  -9.402  18.729
   32   2H2     G   3          H22         G   3  -2.340  -9.673  19.449
   33   1H2*    G   3          1H2*        G   3  -3.734  -6.959  12.871
   34   2H2*    G   3          2H2*        G   3  -5.093  -6.989  14.030
   35   1H5*    T   4          1H5*        T   4  -7.424  -8.623  15.438
   36   2H5*    T   4          2H5*        T   4  -8.775  -7.472  15.360
   37    H4*    T   4           H4*        T   4  -8.290  -7.923  17.689
   38    H3*    T   4           H3*        T   4  -8.324  -5.360  16.540
   39   1H2*    T   4          1H2*        T   4  -6.083  -4.878  16.692
   40   2H2*    T   4          2H2*        T   4  -6.464  -4.484  18.368
   41    H1*    T   4           H1*        T   4  -5.647  -6.521  19.263
   42    H3     T   4           H3         T   4  -1.198  -6.662  18.914
   43   1H5M    T   4          H51         T   4  -2.461  -6.068  13.966
   44   2H5M    T   4          H52         T   4  -2.934  -4.416  14.426
   45   3H5M    T   4          H53         T   4  -1.246  -4.946  14.618
   46    H6     T   4           H6         T   4  -4.685  -5.654  15.785
   47   1H5*    G   5          1H5*        G   5  -7.412  -6.131  21.037
   48   2H5*    G   5          2H5*        G   5  -8.550  -5.122  21.952
   49    H4*    G   5           H4*        G   5  -6.514  -5.490  23.250
   50    H3*    G   5           H3*        G   5  -7.593  -2.937  22.581
   51    H1*    G   5           H1*        G   5  -3.786  -3.803  22.922
   52    H8     G   5           H8         G   5  -5.105  -2.982  19.354
   53    H1     G   5           H1         G   5   1.210  -2.555  20.082
   54   1H2     G   5          H21         G   5   0.569  -3.365  23.411
   55   2H2     G   5          H22         G   5   1.759  -2.962  22.195
   56   1H2*    G   5          1H2*        G   5  -5.769  -2.008  21.587
   57   2H2*    G   5          2H2*        G   5  -5.085  -1.939  23.237
   58   1H5*  2AR   6          1H5*      2AR   6  -4.404  -3.632  25.974
   59   2H5*  2AR   6          2H5*      2AR   6  -4.891  -2.670  27.385
   60    H4*  2AR   6           H4*      2AR   6  -2.441  -2.816  27.240
   61    H1*  2AR   6           H1*      2AR   6  -0.751  -0.570  25.388
   62    H2   2AR   6           H2       2AR   6   2.458   0.384  22.455
   63   1H6   2AR   6          1H6       2AR   6   0.179   1.189  18.674
   64   2H6   2AR   6          2H6       2AR   6  -1.517   0.970  19.042
   65    H8   2AR   6           H8       2AR   6  -3.880  -0.223  23.057
   66   2H2*  2AR   6          2H2*      2AR   6  -2.170   1.093  26.253
   67   1H2*  2AR   6          1H2*      2AR   6  -3.611   0.408  25.455
   68    H3*  2AR   6           H3*      2AR   6  -3.912  -0.473  27.581
   69    HX*  2AR   6           HX*      2AR   6  -1.404  -2.767  25.205
   70   HX**  2AR   6          HX**      2AR   6  -2.950  -2.350  24.414
   71   1H5*    G   7          1H5*        G   7   1.134  -0.379  26.887
   72   2H5*    G   7          2H5*        G   7   1.355   0.384  28.474
   73    H4*    G   7           H4*        G   7   3.126   1.181  27.088
   74    H3*    G   7           H3*        G   7   1.162   2.939  28.157
   75    H1*    G   7           H1*        G   7   3.053   3.284  24.813
   76    H8     G   7           H8         G   7  -0.791   3.296  24.363
   77    H1     G   7           H1         G   7   2.440   3.741  18.922
   78   1H2     G   7          H21         G   7   5.277   3.313  20.882
   79   2H2     G   7          H22         G   7   4.604   3.557  19.283
   80   1H2*    G   7          1H2*        G   7   0.384   3.764  26.131
   81   2H2*    G   7          2H2*        G   7   1.872   4.746  26.191
   82   1H5*    T   8          1H5*        T   8   5.046   4.001  25.893
   83   2H5*    T   8          2H5*        T   8   5.902   5.135  26.956
   84    H4*    T   8           H4*        T   8   6.634   5.597  24.750
   85    H3*    T   8           H3*        T   8   5.072   7.525  26.195
   86   1H2*    T   8          1H2*        T   8   3.611   8.073  24.565
   87   2H2*    T   8          2H2*        T   8   4.996   8.774  23.689
   88    H1*    T   8           H1*        T   8   5.230   6.957  22.309
   89    H3     T   8           H3         T   8   1.626   6.536  19.650
   90   1H5M    T   8          H51         T   8  -1.320   6.613  23.210
   91   2H5M    T   8          H52         T   8  -0.331   5.872  24.491
   92   3H5M    T   8          H53         T   8  -0.388   7.643  24.323
   93    H6     T   8           H6         T   8   2.195   6.683  24.412
   94   1H5*    C   9          1H5*        C   9   7.272   7.683  22.484
   95   2H5*    C   9          2H5*        C   9   8.516   8.949  22.454
   96    H4*    C   9           H4*        C   9   7.850   8.651  20.200
   97    H3*    C   9           H3*        C   9   7.265  11.072  21.604
   98    H1*    C   9           H1*        C   9   5.108   9.404  18.734
   99   1H4     C   9          H41         C   9  -0.524   9.873  22.190
  100   2H4     C   9          H42         C   9  -0.963   9.549  20.526
  101    H5     C   9           H5         C   9   1.798  10.072  22.922
  102    H6     C   9           H6         C   9   4.115   9.844  22.253
  103   1H2*    C   9          1H2*        C   9   5.051  11.243  21.106
  104   2H2*    C   9          2H2*        C   9   5.588  11.569  19.426
  105   1H5*    A  10          1H5*        A  10   8.359  10.854  16.754
  106   2H5*    A  10          2H5*        A  10   9.345  12.327  16.682
  107    H4*    A  10           H4*        A  10   8.414  11.784  14.489
  108    H3*    A  10           H3*        A  10   8.298  14.271  15.709
  109    H1*    A  10           H1*        A  10   5.010  12.758  13.956
  110    H8     A  10           H8         A  10   5.718  12.305  17.661
  111   1H6     A  10          1H6         A  10  -0.403  12.236  18.464
  112   2H6     A  10          2H6         A  10   1.143  12.067  19.263
  113    H2     A  10           H2         A  10   0.446  13.022  14.123
  114   1H2*    A  10          1H2*        A  10   6.072  14.481  16.120
  115   2H2*    A  10          2H2*        A  10   5.947  14.806  14.368
  116   1H5*    C  11          1H5*        C  11   6.379  13.737  11.423
  117   2H5*    C  11          2H5*        C  11   6.973  15.091  10.441
  118    H4*    C  11           H4*        C  11   4.686  14.500   9.797
  119    H3*    C  11           H3*        C  11   5.495  17.112  10.769
  120    H1*    C  11           H1*        C  11   1.953  15.394  11.435
  121   1H4     C  11          H41         C  11   2.658  16.565  17.931
  122   2H4     C  11          H42         C  11   0.951  16.342  17.628
  123    H5     C  11           H5         C  11   4.325  16.487  16.197
  124    H6     C  11           H6         C  11   4.718  16.185  13.802
  125    H3T    C  11           H3T        C  11   3.626  16.254   8.791
  126   1H2*    C  11          1H2*        C  11   3.711  17.669  12.010
  127   2H2*    C  11          2H2*        C  11   2.655  17.374  10.600
  128   1H5*    G  12          1H5*        G  12  -8.351  19.637  19.837
  129   2H5*    G  12          2H5*        G  12  -9.317  18.261  20.411
  130    H4*    G  12           H4*        G  12  -8.811  18.032  18.020
  131    H3*    G  12           H3*        G  12  -8.072  16.111  20.065
  132    H1*    G  12           H1*        G  12  -5.916  16.941  16.811
  133    H8     G  12           H8         G  12  -4.869  17.762  20.456
  134    H1     G  12           H1         G  12  -0.035  16.634  16.460
  135   1H2     G  12          H21         G  12  -2.534  16.011  14.110
  136   2H2     G  12          H22         G  12  -0.820  16.090  14.454
  137   1H2*    G  12          1H2*        G  12  -6.048  15.490  19.347
  138   2H2*    G  12          2H2*        G  12  -6.747  15.071  17.760
  139    H5T    G  12           H5T        G  12  -6.496  18.339  20.630
  140   1H5*    T  13          1H5*        T  13  -8.462  15.277  15.773
  141   2H5*    T  13          2H5*        T  13  -9.351  13.801  15.348
  142    H4*    T  13           H4*        T  13  -7.517  14.269  13.766
  143    H3*    T  13           H3*        T  13  -7.964  11.809  15.153
  144   1H2*    T  13          1H2*        T  13  -5.907  11.479  16.022
  145   2H2*    T  13          2H2*        T  13  -5.365  11.230  14.337
  146    H1*    T  13           H1*        T  13  -4.459  13.327  14.190
  147    H3     T  13           H3         T  13  -1.015  13.367  17.062
  148   1H5M    T  13          H51         T  13  -5.179  13.991  20.157
  149   2H5M    T  13          H52         T  13  -5.175  12.216  20.054
  150   3H5M    T  13          H53         T  13  -3.780  13.070  20.753
  151    H6     T  13           H6         T  13  -5.778  13.135  17.603
  152   1H5*    G  14          1H5*        G  14  -5.620  11.605  11.297
  153   2H5*    G  14          2H5*        G  14  -6.038  10.230  10.255
  154    H4*    G  14           H4*        G  14  -3.622  10.738  10.169
  155    H3*    G  14           H3*        G  14  -4.803   8.203  10.685
  156    H1*    G  14           H1*        G  14  -1.509   9.528  12.394
  157    H8     G  14           H8         G  14  -4.717   9.116  14.552
  158    H1     G  14           H1         G  14   0.727   9.436  17.837
  159   1H2     G  14          H21         G  14   2.238   9.699  14.707
  160   2H2     G  14          H22         G  14   2.442   9.631  16.443
  161   1H2*    G  14          1H2*        G  14  -3.875   7.733  12.700
  162   2H2*    G  14          2H2*        G  14  -2.359   7.489  11.787
  163   1H5*    A  15          1H5*        A  15  -0.193   8.842   9.931
  164   2H5*    A  15          2H5*        A  15   0.222   7.659   8.675
  165    H4*    A  15           H4*        A  15   2.153   7.993  10.091
  166    H3*    A  15           H3*        A  15   0.847   5.466   9.764
  167    H1*    A  15           H1*        A  15   2.599   6.735  13.068
  168    H8     A  15           H8         A  15  -1.243   6.204  12.916
  169   1H6     A  15          1H6         A  15  -1.014   6.077  19.069
  170   2H6     A  15          2H6         A  15  -2.062   5.996  17.671
  171    H2     A  15           H2         A  15   3.171   6.631  17.528
  172   1H2*    A  15          1H2*        A  15   0.589   4.863  11.916
  173   2H2*    A  15          2H2*        A  15   2.369   4.736  11.984
  174   1H5*    C  16          1H5*        C  16   5.076   5.950  11.374
  175   2H5*    C  16          2H5*        C  16   6.204   4.740  10.733
  176    H4*    C  16           H4*        C  16   6.746   5.288  13.061
  177    H3*    C  16           H3*        C  16   6.315   2.658  12.016
  178    H1*    C  16           H1*        C  16   5.426   3.981  15.615
  179   1H4     C  16          H41         C  16  -1.073   2.761  16.157
  180   2H4     C  16          H42         C  16  -0.427   2.946  17.773
  181    H5     C  16           H5         C  16   0.285   2.916  14.174
  182    H6     C  16           H6         C  16   2.541   3.274  13.323
  183   1H2*    C  16          1H2*        C  16   4.546   2.088  13.424
  184   2H2*    C  16          2H2*        C  16   5.824   1.886  14.650
  185   1H5*  8OG  17          1H5*      8OG  17   8.768   3.064  16.337
  186   2H5*  8OG  17          2H5*      8OG  17  10.027   1.846  16.045
  187    H4*  8OG  17           H4*      8OG  17   9.410   1.848  18.405
  188    H3*  8OG  17           H3*      8OG  17   9.292  -0.431  16.702
  189   1H2*  8OG  17          1H2*      8OG  17   7.105  -0.969  16.977
  190   2H2*  8OG  17          2H2*      8OG  17   7.625  -1.576  18.575
  191    H1*  8OG  17           H1*      8OG  17   6.902   0.359  19.665
  192    H1   8OG  17           H1       8OG  17   2.339  -0.251  14.296
  193    H7   8OG  17           H7       8OG  17   2.324   0.472  19.242
  194   1H2   8OG  17          1H2       8OG  17   5.700  -0.393  13.376
  195   2H2   8OG  17          2H2       8OG  17   4.027  -0.474  12.871
  196   1H5*    C  18          1H5*        C  18   9.239  -0.929  21.437
  197   2H5*    C  18          2H5*        C  18  10.248  -2.337  21.834
  198    H4*    C  18           H4*        C  18   8.308  -2.249  23.326
  199    H3*    C  18           H3*        C  18   9.092  -4.466  21.801
  200    H1*    C  18           H1*        C  18   5.421  -3.462  22.405
  201   1H4     C  18          H41         C  18   3.011  -2.836  16.287
  202   2H4     C  18          H42         C  18   1.699  -2.457  17.382
  203    H5     C  18           H5         C  18   5.267  -3.305  17.051
  204    H6     C  18           H6         C  18   6.715  -3.471  18.960
  205   1H2*    C  18          1H2*        C  18   7.369  -4.479  20.340
  206   2H2*    C  18          2H2*        C  18   6.523  -5.343  21.598
  207   1H5*    A  19          1H5*        A  19   6.001  -5.988  25.625
  208   2H5*    A  19          2H5*        A  19   6.787  -7.562  25.871
  209    H4*    A  19           H4*        A  19   4.365  -7.802  26.068
  210    H3*    A  19           H3*        A  19   5.980  -9.236  24.220
  211    H1*    A  19           H1*        A  19   2.359  -8.134  23.653
  212    H8     A  19           H8         A  19   5.047  -6.901  21.171
  213   1H6     A  19          1H6         A  19   0.386  -4.552  17.922
  214   2H6     A  19          2H6         A  19   2.116  -4.819  17.969
  215    H2     A  19           H2         A  19  -1.299  -6.280  21.711
  216   1H2*    A  19          1H2*        A  19   4.927  -8.754  22.306
  217   2H2*    A  19          2H2*        A  19   3.646  -9.846  22.912
  218   1H5*    C  20          1H5*        C  20   2.052 -10.542  26.043
  219   2H5*    C  20          2H5*        C  20   1.752 -12.281  26.227
  220    H4*    C  20           H4*        C  20  -0.343 -11.071  25.813
  221    H3*    C  20           H3*        C  20   0.620 -13.301  24.314
  222    H1*    C  20           H1*        C  20  -1.469 -10.296  22.950
  223   1H4     C  20          H41         C  20   0.814  -7.842  17.608
  224   2H4     C  20          H42         C  20   2.261  -8.811  17.701
  225    H5     C  20           H5         C  20   2.892  -9.996  19.786
  226    H6     C  20           H6         C  20   2.055 -10.841  21.873
  227   1H2*    C  20          1H2*        C  20   0.632 -12.307  22.227
  228   2H2*    C  20          2H2*        C  20  -1.151 -12.505  22.339
  229   1H5*    T  21          1H5*        T  21  -3.536 -11.863  23.674
  230   2H5*    T  21          2H5*        T  21  -4.686 -13.143  24.114
  231    H4*    T  21           H4*        T  21  -5.576 -11.638  22.358
  232    H3*    T  21           H3*        T  21  -5.466 -14.494  22.277
  233   1H2*    T  21          1H2*        T  21  -4.433 -14.800  20.293
  234   2H2*    T  21          2H2*        T  21  -5.926 -14.157  19.547
  235    H1*    T  21           H1*        T  21  -4.986 -12.099  19.183
  236    H3     T  21           H3         T  21  -1.984 -13.437  16.070
  237   1H5M    T  21          H51         T  21   0.106 -14.741  20.762
  238   2H5M    T  21          H52         T  21   1.132 -14.464  19.333
  239   3H5M    T  21          H53         T  21   0.755 -13.116  20.431
  240    H6     T  21           H6         T  21  -2.062 -13.316  20.853
  241   1H5*    G  22          1H5*        G  22  -8.489 -12.196  19.503
  242   2H5*    G  22          2H5*        G  22 -10.056 -12.972  19.809
  243    H4*    G  22           H4*        G  22  -9.944 -12.129  17.514
  244    H3*    G  22           H3*        G  22 -10.425 -14.898  18.250
  245    H1*    G  22           H1*        G  22  -8.321 -13.705  15.008
  246    H8     G  22           H8         G  22  -7.059 -15.780  18.058
  247    H1     G  22           H1         G  22  -3.533 -16.222  12.772
  248   1H2     G  22          H21         G  22  -5.801 -13.945  11.435
  249   2H2     G  22          H22         G  22  -4.335 -14.874  11.193
  250    H3T    G  22           H3T        G  22 -11.380 -13.234  16.126
  251   1H2*    G  22          1H2*        G  22  -9.231 -15.964  16.652
  252   2H2*    G  22          2H2*        G  22 -10.114 -15.053  15.397
  Start of MODEL    9
    1   1H5*    C   1          1H5*        C   1   3.121 -14.379   5.945
    2   2H5*    C   1          2H5*        C   1   3.861 -12.814   5.549
    3    H4*    C   1           H4*        C   1   1.402 -12.702   5.412
    4    H3*    C   1           H3*        C   1   3.090 -10.961   6.898
    5    H1*    C   1           H1*        C   1  -0.455 -12.207   8.149
    6   1H4     C   1          H41         C   1   1.735 -14.982  13.761
    7   2H4     C   1          H42         C   1   0.049 -14.588  14.007
    8    H5     C   1           H5         C   1   2.919 -14.492  11.717
    9    H6     C   1           H6         C   1   2.723 -13.521   9.473
   10   1H2*    C   1          1H2*        C   1   2.196 -11.168   8.971
   11   2H2*    C   1          2H2*        C   1   0.779 -10.306   8.315
   12    H5T    C   1           H5T        C   1   3.954 -12.451   7.858
   13   1H5*    A   2          1H5*        A   2  -1.262  -9.546   6.251
   14   2H5*    A   2          2H5*        A   2  -1.333  -7.798   5.954
   15    H4*    A   2           H4*        A   2  -3.121  -8.520   7.484
   16    H3*    A   2           H3*        A   2  -1.247  -6.430   7.965
   17    H1*    A   2           H1*        A   2  -2.761  -8.826  10.662
   18    H8     A   2           H8         A   2   1.119  -9.141   9.983
   19   1H6     A   2          1H6         A   2   1.254 -12.192  15.331
   20   2H6     A   2          2H6         A   2   2.209 -11.601  13.989
   21    H2     A   2           H2         A   2  -3.002 -11.010  14.527
   22   1H2*    A   2          1H2*        A   2  -0.352  -7.191   9.911
   23   2H2*    A   2          2H2*        A   2  -1.899  -6.683  10.638
   24   1H5*    G   3          1H5*        G   3  -5.055  -7.910  10.254
   25   2H5*    G   3          2H5*        G   3  -6.033  -6.445  10.053
   26    H4*    G   3           H4*        G   3  -6.980  -7.773  11.824
   27    H3*    G   3           H3*        G   3  -6.162  -5.111  12.158
   28    H1*    G   3           H1*        G   3  -5.603  -7.881  14.938
   29    H8     G   3           H8         G   3  -2.700  -6.796  12.725
   30    H1     G   3           H1         G   3  -0.951  -9.180  18.366
   31   1H2     G   3          H21         G   3  -4.380  -9.431  18.945
   32   2H2     G   3          H22         G   3  -2.760  -9.686  19.553
   33   1H2*    G   3          1H2*        G   3  -4.556  -5.372  13.742
   34   2H2*    G   3          2H2*        G   3  -5.926  -5.618  14.863
   35   1H5*    T   4          1H5*        T   4  -8.278  -7.425  15.757
   36   2H5*    T   4          2H5*        T   4  -9.626  -6.341  16.159
   37    H4*    T   4           H4*        T   4  -8.837  -7.413  18.193
   38    H3*    T   4           H3*        T   4  -9.056  -4.627  17.817
   39   1H2*    T   4          1H2*        T   4  -6.833  -4.077  17.924
   40   2H2*    T   4          2H2*        T   4  -7.047  -4.243  19.667
   41    H1*    T   4           H1*        T   4  -6.080  -6.399  19.805
   42    H3     T   4           H3         T   4  -1.700  -6.318  18.933
   43   1H5M    T   4          H51         T   4  -3.568  -2.590  15.868
   44   2H5M    T   4          H52         T   4  -2.193  -3.547  15.268
   45   3H5M    T   4          H53         T   4  -3.846  -3.931  14.736
   46    H6     T   4           H6         T   4  -5.499  -4.416  16.720
   47   1H5*    G   5          1H5*        G   5  -7.720  -6.411  22.073
   48   2H5*    G   5          2H5*        G   5  -8.662  -5.492  23.264
   49    H4*    G   5           H4*        G   5  -6.472  -5.997  24.185
   50    H3*    G   5           H3*        G   5  -7.501  -3.345  23.854
   51    H1*    G   5           H1*        G   5  -3.774  -4.479  23.659
   52    H8     G   5           H8         G   5  -5.311  -3.016  20.380
   53    H1     G   5           H1         G   5   1.029  -3.624  20.400
   54   1H2     G   5          H21         G   5   0.603  -4.846  23.629
   55   2H2     G   5          H22         G   5   1.712  -4.432  22.341
   56   1H2*    G   5          1H2*        G   5  -5.746  -2.428  22.721
   57   2H2*    G   5          2H2*        G   5  -4.862  -2.549  24.274
   58   1H5*  2AR   6          1H5*      2AR   6  -3.763  -4.328  26.749
   59   2H5*  2AR   6          2H5*      2AR   6  -4.063  -3.354  28.203
   60    H4*  2AR   6           H4*      2AR   6  -1.659  -3.454  27.720
   61    H1*  2AR   6           H1*      2AR   6  -0.225  -1.277  25.641
   62    H2   2AR   6           H2       2AR   6   2.618  -0.507  22.302
   63   1H6   2AR   6          1H6       2AR   6  -0.090   0.244  18.809
   64   2H6   2AR   6          2H6       2AR   6  -1.732   0.084  19.389
   65    H8   2AR   6           H8       2AR   6  -3.607  -0.896  23.704
   66   2H2*  2AR   6          2H2*      2AR   6  -1.495   0.416  26.652
   67   1H2*  2AR   6          1H2*      2AR   6  -3.035  -0.240  26.037
   68    H3*  2AR   6           H3*      2AR   6  -3.124  -1.111  28.180
   69    HX*  2AR   6           HX*      2AR   6  -0.935  -3.469  25.557
   70   HX**  2AR   6          HX**      2AR   6  -2.565  -3.027  24.979
   71   1H5*    G   7          1H5*        G   7   2.043  -0.919  27.160
   72   2H5*    G   7          2H5*        G   7   2.230  -0.055  28.699
   73    H4*    G   7           H4*        G   7   3.871   0.839  27.211
   74    H3*    G   7           H3*        G   7   1.752   2.441  28.253
   75    H1*    G   7           H1*        G   7   3.531   2.785  24.825
   76    H8     G   7           H8         G   7  -0.320   2.577  24.539
   77    H1     G   7           H1         G   7   2.643   2.583  18.931
   78   1H2     G   7          H21         G   7   5.584   2.431  20.774
   79   2H2     G   7          H22         G   7   4.824   2.493  19.194
   80   1H2*    G   7          1H2*        G   7   0.888   3.155  26.223
   81   2H2*    G   7          2H2*        G   7   2.322   4.221  26.195
   82   1H5*    T   8          1H5*        T   8   5.721   4.307  26.612
   83   2H5*    T   8          2H5*        T   8   6.128   5.780  27.516
   84    H4*    T   8           H4*        T   8   6.781   6.059  25.220
   85    H3*    T   8           H3*        T   8   4.766   7.734  26.444
   86   1H2*    T   8          1H2*        T   8   3.359   7.818  24.678
   87   2H2*    T   8          2H2*        T   8   4.639   8.657  23.769
   88    H1*    T   8           H1*        T   8   5.339   6.731  22.695
   89    H3     T   8           H3         T   8   2.075   5.286  19.918
   90   1H5M    T   8          H51         T   8  -0.429   6.945  24.169
   91   2H5M    T   8          H52         T   8  -1.159   5.644  23.200
   92   3H5M    T   8          H53         T   8  -0.216   5.246  24.657
   93    H6     T   8           H6         T   8   2.211   6.338  24.584
   94   1H5*    C   9          1H5*        C   9   7.272   7.881  22.961
   95   2H5*    C   9          2H5*        C   9   8.301   9.328  22.952
   96    H4*    C   9           H4*        C   9   8.124   8.752  20.691
   97    H3*    C   9           H3*        C   9   6.722  11.050  21.659
   98    H1*    C   9           H1*        C   9   5.663   8.649  18.693
   99   1H4     C   9          H41         C   9  -0.488   7.506  19.222
  100   2H4     C   9          H42         C   9  -0.589   8.404  20.712
  101    H5     C   9           H5         C   9   1.460   8.963  22.029
  102    H6     C   9           H6         C   9   3.850   9.265  21.849
  103   1H2*    C   9          1H2*        C   9   4.699  10.661  20.697
  104   2H2*    C   9          2H2*        C   9   5.514  10.920  19.120
  105   1H5*    A  10          1H5*        A  10   7.248   9.961  17.689
  106   2H5*    A  10          2H5*        A  10   8.182  11.027  16.623
  107    H4*    A  10           H4*        A  10   6.498   9.559  15.479
  108    H3*    A  10           H3*        A  10   7.153  12.221  14.947
  109    H1*    A  10           H1*        A  10   3.317  11.011  15.047
  110    H8     A  10           H8         A  10   5.095  12.698  17.940
  111   1H6     A  10          1H6         A  10  -0.423  14.919  19.596
  112   2H6     A  10          2H6         A  10   1.271  14.839  20.024
  113    H2     A  10           H2         A  10  -0.915  12.592  15.784
  114   1H2*    A  10          1H2*        A  10   5.195  13.272  15.382
  115   2H2*    A  10          2H2*        A  10   4.604  12.502  13.884
  116   1H5*    C  11          1H5*        C  11   4.061   9.890  12.281
  117   2H5*    C  11          2H5*        C  11   4.528  10.184  10.593
  118    H4*    C  11           H4*        C  11   2.107   9.981  10.756
  119    H3*    C  11           H3*        C  11   3.459  12.370   9.811
  120    H1*    C  11           H1*        C  11   0.003  12.188  11.750
  121   1H4     C  11          H41         C  11   0.144  16.730  16.157
  122   2H4     C  11          H42         C  11   1.889  16.745  16.195
  123    H5     C  11           H5         C  11   3.247  15.296  14.797
  124    H6     C  11           H6         C  11   3.200  13.592  13.043
  125    H3T    C  11           H3T        C  11   1.157  10.865   9.082
  126   1H2*    C  11          1H2*        C  11   2.157  13.944  10.746
  127   2H2*    C  11          2H2*        C  11   0.758  13.242   9.883
  128   1H5*    G  12          1H5*        G  12  -8.340  20.522  17.302
  129   2H5*    G  12          2H5*        G  12  -6.568  20.481  17.414
  130    H4*    G  12           H4*        G  12  -8.244  19.228  15.207
  131    H3*    G  12           H3*        G  12  -7.442  18.283  17.817
  132    H1*    G  12           H1*        G  12  -5.474  17.310  14.455
  133    H8     G  12           H8         G  12  -4.291  19.473  17.455
  134    H1     G  12           H1         G  12   0.377  16.752  14.081
  135   1H2     G  12          H21         G  12  -0.477  15.452  12.511
  136   2H2     G  12          H22         G  12  -2.199  15.248  12.293
  137   1H2*    G  12          1H2*        G  12  -5.606  17.098  17.339
  138   2H2*    G  12          2H2*        G  12  -6.510  16.185  16.101
  139    H5T    G  12           H5T        G  12  -6.538  21.591  15.381
  140   1H5*    T  13          1H5*        T  13  -8.552  15.779  14.407
  141   2H5*    T  13          2H5*        T  13  -9.502  14.306  14.678
  142    H4*    T  13           H4*        T  13  -7.780  14.034  12.911
  143    H3*    T  13           H3*        T  13  -8.288  12.303  15.097
  144   1H2*    T  13          1H2*        T  13  -6.251  12.260  16.078
  145   2H2*    T  13          2H2*        T  13  -5.733  11.320  14.650
  146    H1*    T  13           H1*        T  13  -4.673  13.114  13.708
  147    H3     T  13           H3         T  13  -1.303  14.449  16.348
  148   1H5M    T  13          H51         T  13  -4.158  15.626  19.792
  149   2H5M    T  13          H52         T  13  -5.667  15.935  18.905
  150   3H5M    T  13          H53         T  13  -5.362  14.330  19.606
  151    H6     T  13           H6         T  13  -6.061  14.223  16.912
  152   1H5*    G  14          1H5*        G  14  -4.874  11.997  11.902
  153   2H5*    G  14          2H5*        G  14  -5.551  10.681  10.920
  154    H4*    G  14           H4*        G  14  -3.125  10.878  10.572
  155    H3*    G  14           H3*        G  14  -4.528   8.534  11.209
  156    H1*    G  14           H1*        G  14  -1.021   9.392  12.839
  157    H8     G  14           H8         G  14  -4.248   9.701  14.965
  158    H1     G  14           H1         G  14   1.155   9.482  18.317
  159   1H2     G  14          H21         G  14   2.684   9.027  15.224
  160   2H2     G  14          H22         G  14   2.877   9.130  16.961
  161   1H2*    G  14          1H2*        G  14  -3.648   8.047  13.253
  162   2H2*    G  14          2H2*        G  14  -2.219   7.511  12.325
  163   1H5*    A  15          1H5*        A  15   0.088   8.881  10.746
  164   2H5*    A  15          2H5*        A  15   0.375   7.841   9.335
  165    H4*    A  15           H4*        A  15   2.404   7.889  10.621
  166    H3*    A  15           H3*        A  15   0.903   5.505  10.181
  167    H1*    A  15           H1*        A  15   2.875   6.314  13.524
  168    H8     A  15           H8         A  15  -0.999   6.443  13.415
  169   1H6     A  15          1H6         A  15  -0.790   4.975  19.380
  170   2H6     A  15          2H6         A  15  -1.834   5.367  18.033
  171    H2     A  15           H2         A  15   3.431   5.102  17.833
  172   1H2*    A  15          1H2*        A  15   0.707   4.720  12.271
  173   2H2*    A  15          2H2*        A  15   2.475   4.478  12.239
  174   1H5*    C  16          1H5*        C  16   5.200   5.391  11.558
  175   2H5*    C  16          2H5*        C  16   6.183   4.156  10.744
  176    H4*    C  16           H4*        C  16   6.827   4.371  13.101
  177    H3*    C  16           H3*        C  16   6.089   1.933  11.778
  178    H1*    C  16           H1*        C  16   5.464   2.932  15.534
  179   1H4     C  16          H41         C  16  -1.100   2.264  16.226
  180   2H4     C  16          H42         C  16  -0.380   2.145  17.817
  181    H5     C  16           H5         C  16   0.194   2.588  14.219
  182    H6     C  16           H6         C  16   2.451   2.807  13.314
  183   1H2*    C  16          1H2*        C  16   4.325   1.381  13.196
  184   2H2*    C  16          2H2*        C  16   5.613   0.925  14.336
  185   1H5*  8OG  17          1H5*      8OG  17   8.569   1.996  15.882
  186   2H5*  8OG  17          2H5*      8OG  17   9.795   0.726  15.698
  187    H4*  8OG  17           H4*      8OG  17   9.149   0.944  18.044
  188    H3*  8OG  17           H3*      8OG  17   8.993  -1.474  16.526
  189   1H2*  8OG  17          1H2*      8OG  17   6.816  -1.977  16.898
  190   2H2*  8OG  17          2H2*      8OG  17   7.358  -2.412  18.546
  191    H1*  8OG  17           H1*      8OG  17   6.665  -0.367  19.431
  192    H1   8OG  17           H1       8OG  17   1.981  -1.123  14.173
  193    H7   8OG  17           H7       8OG  17   2.087  -0.504  19.129
  194   1H2   8OG  17          1H2       8OG  17   3.631  -1.259  12.695
  195   2H2   8OG  17          2H2       8OG  17   5.315  -1.129  13.151
  196   1H5*    C  18          1H5*        C  18   9.054  -1.621  21.349
  197   2H5*    C  18          2H5*        C  18  10.101  -3.000  21.746
  198    H4*    C  18           H4*        C  18   8.249  -2.877  23.340
  199    H3*    C  18           H3*        C  18   8.968  -5.143  21.865
  200    H1*    C  18           H1*        C  18   5.332  -4.156  22.630
  201   1H4     C  18          H41         C  18   2.553  -3.686  16.650
  202   2H4     C  18          H42         C  18   1.304  -3.304  17.816
  203    H5     C  18           H5         C  18   4.855  -4.142  17.290
  204    H6     C  18           H6         C  18   6.418  -4.246  19.113
  205   1H2*    C  18          1H2*        C  18   7.173  -5.203  20.484
  206   2H2*    C  18          2H2*        C  18   6.403  -6.048  21.806
  207   1H5*    A  19          1H5*        A  19   5.597  -6.198  25.579
  208   2H5*    A  19          2H5*        A  19   6.428  -7.677  26.103
  209    H4*    A  19           H4*        A  19   4.021  -8.008  26.259
  210    H3*    A  19           H3*        A  19   5.756  -9.630  24.739
  211    H1*    A  19           H1*        A  19   2.166  -8.774  23.743
  212    H8     A  19           H8         A  19   4.968  -7.646  21.336
  213   1H6     A  19          1H6         A  19   0.449  -5.795  17.590
  214   2H6     A  19          2H6         A  19   2.179  -5.980  17.771
  215    H2     A  19           H2         A  19  -1.424  -7.283  21.393
  216   1H2*    A  19          1H2*        A  19   4.880  -9.353  22.690
  217   2H2*    A  19          2H2*        A  19   3.609 -10.464  23.284
  218   1H5*    C  20          1H5*        C  20   1.637 -10.991  26.300
  219   2H5*    C  20          2H5*        C  20   1.439 -12.734  26.577
  220    H4*    C  20           H4*        C  20  -0.651 -11.699  25.770
  221    H3*    C  20           H3*        C  20   0.624 -13.998  24.682
  222    H1*    C  20           H1*        C  20  -1.335 -11.289  22.657
  223   1H4     C  20          H41         C  20   3.330  -9.845  18.173
  224   2H4     C  20          H42         C  20   1.819  -9.195  17.572
  225    H5     C  20           H5         C  20   3.506 -11.018  20.289
  226    H6     C  20           H6         C  20   2.350 -11.674  22.292
  227   1H2*    C  20          1H2*        C  20   0.964 -13.207  22.538
  228   2H2*    C  20          2H2*        C  20  -0.794 -13.518  22.358
  229   1H5*    T  21          1H5*        T  21  -3.478 -12.445  23.763
  230   2H5*    T  21          2H5*        T  21  -4.723 -13.705  23.847
  231    H4*    T  21           H4*        T  21  -5.368 -11.874  22.332
  232    H3*    T  21           H3*        T  21  -5.286 -14.668  21.653
  233   1H2*    T  21          1H2*        T  21  -4.170 -14.533  19.696
  234   2H2*    T  21          2H2*        T  21  -5.600 -13.670  19.059
  235    H1*    T  21           H1*        T  21  -4.596 -11.617  19.276
  236    H3     T  21           H3         T  21  -1.481 -12.153  16.049
  237   1H5M    T  21          H51         T  21   0.958 -13.326  20.501
  238   2H5M    T  21          H52         T  21   0.305 -14.939  20.137
  239   3H5M    T  21          H53         T  21   1.443 -14.163  19.010
  240    H6     T  21           H6         T  21  -1.817 -13.393  20.661
  241   1H5*    G  22          1H5*        G  22  -8.563 -11.981  18.945
  242   2H5*    G  22          2H5*        G  22  -9.890 -13.156  19.050
  243    H4*    G  22           H4*        G  22  -9.870 -12.168  16.835
  244    H3*    G  22           H3*        G  22  -9.467 -15.008  17.328
  245    H1*    G  22           H1*        G  22  -7.654 -12.889  14.397
  246    H8     G  22           H8         G  22  -6.050 -14.804  17.388
  247    H1     G  22           H1         G  22  -2.092 -13.453  12.580
  248   1H2     G  22          H21         G  22  -4.888 -11.992  11.096
  249   2H2     G  22          H22         G  22  -3.186 -12.374  10.977
  250    H3T    G  22           H3T        G  22 -11.019 -15.073  15.624
  251   1H2*    G  22          1H2*        G  22  -7.930 -15.484  15.739
  252   2H2*    G  22          2H2*        G  22  -8.976 -14.738  14.500