*HEADER    RNA                                     02-MAY-02   1LMV              
*TITLE     SOLUTION STRUCTURE OF THE UNMODIFIED U2 SNRNA-INTRON BRANCH           
*TITLE    2 SITE HELIX FROM S. CEREVISIAE                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-R(*GP*GP*UP*GP*UP*AP*GP*UP*A)-3';                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 OTHER_DETAILS: UNMODIFIED U2 SNRNA. REGION OF U2 SNRNA               
*COMPND   5 THAT PAIRS WITH THE INTRON BRANCH SITE DURING SPLICEOSOME            
*COMPND   6 ASSEMBLY (NUCLEOTIDES 34-39 IN YEAST U2 SNRNA).;                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: 5'-R(*UP*AP*CP*UP*AP*AP*CP*AP*CP*C)-3';                    
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 OTHER_DETAILS: INTRON BRANCH SITE SEQUENCE.  REGION OF THE           
*COMPND  11 PRE-MRNA INTRON THAT CONTAINS THE CONSERVED BRANCH SITE              
*COMPND  12 SEQUENCE, AND PAIRS WITH U2 SNRNA DURING SPLICEOSOME                 
*COMPND  13 ASSEMBLY.                                                            
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   3 ORGANISM_COMMON: YEAST;                                              
*SOURCE   4 MOL_ID: 2;                                                           
*SOURCE   5 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   6 ORGANISM_COMMON: YEAST                                               
*KEYWDS    U2 SNRNA, BRANCH SITE, NMR, SOLUTION STRUCTURE, A-FORM HELIX          
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    M.I.NEWBY, N.L.GREENBAUM                                              
*REVDAT   1   27-NOV-02 1LMV    0                                                
/* list of tables applied as constraints */

/* hbond_uBP.tbl */ 

assign (resi  10 and name  N3  and segi b)
       (resi  1 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  10 and name  H41 and segi b)
       (resi  1 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  10 and name  O2  and segi b)
       (resi  1 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  10 and name  N3  and segi b)
       (resi  1 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  10 and name  N4  and segi b)
       (resi  1 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  10 and name  O2  and segi b)
       (resi  1 and name  N2  and segi a)  2.950 0.10 0.15

assign (resi  9 and name  N3  and segi b)
       (resi  2 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  9 and name  H41 and segi b)
       (resi  2 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  9 and name  O2  and segi b)
       (resi  2 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  9 and name  N3  and segi b)
       (resi  2 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  9 and name  N4  and segi b)
       (resi  2 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  9 and name  O2  and segi b)
       (resi  2 and name  N2  and segi a)  2.950 0.10 0.15

assign (resid   3 and name  H3  and segi a)
       (resid   8 and name  N1  and segi b)  1.990 0.10 0.15
assign (resid   3 and name  O4  and segi a)
       (resid   8 and name  H61 and segi b)  1.950 0.10 0.15
assign (resid   3 and name  N3  and segi a)
       (resid   8 and name  N1  and segi b)  2.900 0.10 0.15
assign (resid   3 and name  O4  and segi a)
       (resid   8 and name  N6  and segi b)  2.950 0.10 0.15

assign (resi  3 and name  N3  and segi b)
       (resi  7 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  3 and name  H41 and segi b)
       (resi  7 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  3 and name  O2  and segi b)
       (resi  7 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  3 and name  N3  and segi b)
       (resi  7 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  3 and name  N4  and segi b)
       (resi  7 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  3 and name  O2  and segi b)
       (resi  7 and name  N2  and segi a)  2.950 0.10 0.15

assign (resid   8 and name  H3  and segi a)
       (resid   2 and name  N1  and segi b)  1.990 0.10 0.15
assign (resid   8 and name  O4  and segi a)
       (resid   2 and name  H61 and segi b)  1.950 0.10 0.15
assign (resid   8 and name  N3  and segi a)
       (resid   2 and name  N1  and segi b)  2.900 0.10 0.15
assign (resid   8 and name  O4  and segi a)
       (resid   2 and name  N6  and segi b)  2.950 0.10 0.15

assign (resid   1 and name  H3  and segi b)
       (resid   9 and name  N1  and segi a)  1.990 0.10 0.15
assign (resid   1 and name  O4  and segi b)
       (resid   9 and name  H61 and segi a)  1.950 0.10 0.15
assign (resid   1 and name  N3  and segi b)
       (resid   9 and name  N1  and segi a)  2.900 0.10 0.15
assign (resid   1 and name  O4  and segi b)
       (resid   9 and name  N6  and segi a)  2.950 0.10 0.15


assign (resi  7 and name  N3  and segi b)
       (resi  4 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  7 and name  H41 and segi b)
       (resi  4 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  7 and name  O2  and segi b)
       (resi  4 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  7 and name  N3  and segi b)
       (resi  4 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  7 and name  N4  and segi b)
       (resi  4 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  7 and name  O2  and segi b)
       (resi  4 and name  N2  and segi a)  2.950 0.10 0.15

/* d2o_uBP_intra.tbl */

assi (resi   9 and name  h1' and segi a)
     (resi   9 and name  h2' and segi a) 2.50 0.90 0.50 ! 9
assi (resi  10 and name  h1' and segi b)
     (resi  10 and name  h2' and segi b) 2.50 0.90 0.50 ! 10
assi (resi   4 and name  h1' and segi b)
     (resi   4 and name  h2' and segi b) 2.50 0.90 0.50 ! 11
assi (resi   6 and name  h1' and segi a)
     (resi   6 and name  h2' and segi a) 2.50 0.90 0.50 ! 12
assi (resi   1 and name  h1' and segi b)
     (resi   1 and name  h2' and segi b) 2.50 0.90 0.50 ! 13
assi (resi   8 and name  h1' and segi b)
     (resi   8 and name  h2' and segi b) 2.50 0.90 0.50 ! 14
assi (resi   6 and name  h1' and segi b)
     (resi   6 and name  h2' and segi b) 2.50 0.90 0.50 ! 15
assi (resi   2 and name  h1' and segi b)
     (resi   2 and name  h2' and segi b) 2.50 0.90 0.50 ! 16
assi (resi   8 and name  h1' and segi a)
     (resi   8 and name  h2' and segi a) 2.50 0.90 0.50 ! 17
assi (resi   7 and name  h1' and segi a)
     (resi   7 and name  h2' and segi a) 2.50 0.90 0.50 ! 18
assi (resi   3 and name  h1' and segi b)
     (resi   3 and name  h2' and segi b) 2.50 0.90 0.50 ! 19
assi (resi   4 and name  h1' and segi a)
     (resi   4 and name  h2' and segi a) 2.50 0.90 0.50 ! 127
assi (resi   3 and name  h1' and segi a)
     (resi   3 and name  h2' and segi a) 2.50 0.90 0.50 ! 128
assi (resi   2 and name  h1' and segi a)
     (resi   2 and name  h2' and segi a) 2.50 0.90 0.50 ! 64

assi (resi  10 and name  h1' and segi b)
     (resi  10 and name  h3' and segi b) 3.50 1.50 0.70 ! 10

assi (resi  10 and name   h6 and segi b)
     (resi  10 and name  h1' and segi b) 4.50 2.00 0.90 ! 20
assi (resi   4 and name   h6 and segi b)
     (resi   4 and name  h1' and segi b) 4.50 2.00 0.90 ! 21
assi (resi   8 and name  h1' and segi b)
     (resi   8 and name   h8 and segi b) 4.50 2.00 0.90 ! 22
assi (resi   9 and name  h1' and segi a)
     (resi   9 and name   h8 and segi a) 4.50 2.00 0.90 ! 23
assi (resi   4 and name  h1' and segi a)
     (resi   4 and name   h8 and segi a) 4.50 2.00 0.90 ! 24
assi (resi   2 and name  h1' and segi b)
     (resi   2 and name   h8 and segi b) 5.50 2.50 1.10 ! 25
assi (resi   5 and name  h1' and segi b)
     (resi   5 and name   h8 and segi b) 5.50 2.50 1.10 ! 26
assi (resi   6 and name  h1' and segi b)
     (resi   6 and name   h8 and segi b) 5.50 2.50 1.10 ! 27
assi (resi   6 and name  h1' and segi a)
     (resi   6 and name   h8 and segi a) 5.50 2.50 1.10 ! 28
assi (resi   3 and name  h1' and segi a)
     (resi   3 and name   h6 and segi a) 5.50 2.50 1.10 ! 29
assi (resi   7 and name  h1' and segi a)
     (resi   7 and name   h8 and segi a) 5.50 2.50 1.10 ! 30
assi (resi   5 and name  h1' and segi a)
     (resi   5 and name   h6 and segi a) 5.50 2.50 1.10 ! 118

assi (resi   8 and name   h5 and segi a)
     (resi   8 and name  h1' and segi a) 5.50 2.50 1.10 ! 164
assi (resi   9 and name   h5 and segi b)
     (resi   9 and name  h1' and segi b) 5.50 2.50 1.10 ! 169
assi (resi   4 and name   h5 and segi b)
     (resi   4 and name  h1' and segi b) 5.50 2.50 1.10 ! 164
assi (resi   7 and name   h5 and segi b)
     (resi   7 and name  h1' and segi b) 5.50 2.50 1.10 ! 164
assi (resi   3 and name   h5 and segi a)
     (resi   3 and name  h1' and segi a) 5.50 2.50 1.10 ! 164
assi (resi   3 and name   h5 and segi b)
     (resi   3 and name  h1' and segi b) 5.50 2.50 1.10 ! 164
assi (resi  10 and name   h5 and segi b)
     (resi  10 and name  h1' and segi b) 5.50 2.50 1.10 ! 164

assi (resi   4 and name  h2' and segi b)
     (resi   4 and name   h6 and segi b) 3.50 1.50 0.70 ! 65
assi (resi   1 and name  h2' and segi b)
     (resi   1 and name   h6 and segi b) 3.50 1.50 0.70 ! 66
assi (resi   4 and name  h2' and segi a)
     (resi   4 and name   h8 and segi a) 3.50 1.50 0.70 ! 67
assi (resi   7 and name  h2' and segi b)
     (resi   7 and name   h6 and segi b) 3.50 1.50 0.70 ! 68
assi (resi  10 and name  h2' and segi b)
     (resi  10 and name   h6 and segi b) 3.50 1.50 0.70 ! 70
assi (resi   2 and name  h2' and segi b)
     (resi   2 and name   h8 and segi b) 3.50 1.50 0.70 ! 71
assi (resi   6 and name  h2' and segi b)
     (resi   6 and name   h8 and segi b) 3.50 1.50 0.70 ! 72
assi (resi   8 and name  h2' and segi a)
     (resi   8 and name   h6 and segi a) 3.50 1.50 0.70 ! 76
assi (resi   5 and name  h2' and segi a)
     (resi   5 and name   h6 and segi a) 3.50 1.50 0.70 ! 79
assi (resi   9 and name  h2' and segi b)
     (resi   9 and name   h6 and segi b) 3.50 1.50 0.70 ! 80
assi (resi   9 and name  h2' and segi a)
     (resi   9 and name   h8 and segi a) 2.50 0.90 0.50 ! 109
assi (resi   5 and name  h2' and segi b)
     (resi   5 and name   h8 and segi b) 3.50 1.50 0.70 ! 116
assi (resi   2 and name  h2' and segi a)
     (resi   2 and name   h8 and segi a) 3.50 1.50 0.70 ! 117

assi (resi   4 and name  h2' and segi b)
     (resi   4 and name   h5 and segi b) 4.50 2.00 0.90 ! 119
assi (resi   1 and name  h2' and segi b)
     (resi   1 and name   h5 and segi b) 4.50 2.00 0.90 ! 119


assi (resi   7 and name  h3' and segi b)
     (resi   7 and name   h6 and segi b) 3.50 1.50 0.70 ! 69
assi (resi   6 and name  h3' and segi a)
     (resi   6 and name   h8 and segi a) 3.50 1.50 0.70 ! 73
assi (resi   4 and name  h3' and segi b)
     (resi   4 and name   h6 and segi b) 3.50 1.50 0.70 ! 74
assi (resi   3 and name  h3' and segi a)
     (resi   3 and name   h6 and segi a) 3.50 1.50 0.70 ! 75
assi (resi   7 and name  h3' and segi a)
     (resi   7 and name   h8 and segi a) 3.50 1.50 0.70 ! 77
assi (resi   4 and name  h3' and segi a)
     (resi   4 and name   h8 and segi a) 3.50 1.50 0.70 ! 111
assi (resi   9 and name  h3' and segi b)
     (resi   9 and name   h6 and segi b) 3.50 1.50 0.70 ! 112
assi (resi   8 and name  h3' and segi a)
     (resi   8 and name   h6 and segi a) 3.50 1.50 0.70 ! 113
assi (resi   1 and name  h3' and segi b)
     (resi   1 and name   h6 and segi b) 3.50 1.50 0.70 ! 114
assi (resi   3 and name  h3' and segi b)
     (resi   3 and name   h6 and segi b) 3.50 1.50 0.70 ! 115
assi (resi   8 and name   h8 and segi b)
     (resi   8 and name  h3' and segi b) 3.50 1.50 0.70 ! 137
assi (resi  10 and name  h3' and segi b)
     (resi  10 and name   h6 and segi b) 2.50 0.90 0.50 ! 112

! H5-H6

assi (resi   1 and name   h5 and segi b)
     (resi   1 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi   3 and name   h5 and segi b)
     (resi   3 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi   4 and name   h5 and segi b)
     (resi   4 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi   7 and name   h5 and segi b)
     (resi   7 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi   9 and name   h5 and segi b)
     (resi   9 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi  10 and name   h5 and segi b)
     (resi  10 and name   h6 and segi b) 2.50 1.00 0.50 ! 23
assi (resi   3 and name   h5 and segi a)
     (resi   3 and name   h6 and segi a) 2.50 1.00 0.50 ! 23
assi (resi   5 and name   h5 and segi a)
     (resi   5 and name   h6 and segi a) 2.50 1.00 0.50 ! 23
assi (resi   8 and name   h5 and segi a)
     (resi   8 and name   h6 and segi a) 2.50 1.00 0.50 ! 23

! H2O

assi (resi   4 and name   h1 and segi a)
     (resi   4 and name  h22 and segi a) 5.50 2.50 1.10 ! 23
assi (resi   4 and name   h1 and segi a)
     (resi   4 and name  h21 and segi a) 4.50 2.00 0.90 ! 23
assi (resi   2 and name   h1 and segi a)
     (resi   2 and name  h22 and segi a) 5.50 2.50 1.10 ! 23
assi (resi   2 and name   h1 and segi a)
     (resi   2 and name  h21 and segi a) 4.50 2.00 0.90 ! 23
assi (resi   7 and name   h1 and segi a)
     (resi   7 and name  h22 and segi a) 5.50 2.50 1.10 ! 23
assi (resi   7 and name   h1 and segi a)
     (resi   7 and name  h21 and segi a) 4.50 2.00 0.90 ! 23


/* d2o_uBP_inter.tbl */

assi (resi   2 and name   h8 and segi b)
     (resi   3 and name   h6 and segi b) 5.50 2.50 1.10 ! 61
assi (resi   6 and name   h8 and segi a)
     (resi   5 and name   h6 and segi a) 4.50 2.00 0.90 ! 62
assi (resi   5 and name   h8 and segi b)
     (resi   4 and name   h6 and segi b) 5.50 2.50 1.10 ! 63
assi (resi   7 and name   h6 and segi b)
     (resi   6 and name   h8 and segi b) 4.50 2.00 0.90 ! 148
assi (resi   7 and name   h6 and segi b)
     (resi   8 and name   h8 and segi b) 4.50 2.00 0.90 ! 148
assi (resi   8 and name   h6 and segi a)
     (resi   9 and name   h8 and segi a) 4.50 2.00 0.90 ! 149
assi (resi   1 and name   h6 and segi b)
     (resi   2 and name   h8 and segi b) 4.50 2.00 0.90 ! 151
assi (resi   9 and name   h6 and segi b)
     (resi   8 and name   h8 and segi b) 4.50 2.00 0.90 ! 152
assi (resi   7 and name   h8 and segi a)
     (resi   6 and name   h8 and segi a) 4.50 2.00 0.90 ! 153
assi (resi   9 and name   h6 and segi b)
     (resi  10 and name   h6 and segi b) 4.50 2.00 0.90 ! 154
assi (resi   8 and name   h6 and segi a)
     (resi   7 and name   h8 and segi a) 4.50 2.00 0.90 ! 156
assi (resi   4 and name   h8 and segi a)
     (resi   5 and name   h6 and segi a) 4.50 2.00 0.90 ! 157

assi (resi   9 and name   h5 and segi b)
     (resi  10 and name   h5 and segi b) 4.50 2.00 0.90 ! 154

assi (resi   2 and name   h8 and segi b)
     (resi   3 and name   h5 and segi b) 5.50 2.50 1.10 ! 61
assi (resi   7 and name   h5 and segi b)
     (resi   6 and name   h8 and segi b) 5.50 2.50 1.10 ! 148
assi (resi   8 and name   h5 and segi a)
     (resi   7 and name   h8 and segi a) 5.50 2.50 1.10 ! 156
assi (resi   9 and name   h5 and segi b)
     (resi   8 and name   h8 and segi b) 5.50 2.50 1.10 ! 152
assi (resi   2 and name   h8 and segi a)
     (resi   3 and name   h5 and segi a) 5.50 2.50 1.10 ! 61
assi (resi   4 and name   h5 and segi b)
     (resi   3 and name   h6 and segi b) 5.50 2.50 1.10 ! 61
assi (resi   9 and name   h6 and segi b)
     (resi  10 and name   h5 and segi b) 5.50 2.50 1.10 ! 152
assi (resi   5 and name   h5 and segi a)
     (resi   4 and name   h8 and segi a) 5.50 2.50 1.10 ! 156

assi (resi   1 and name  h1' and segi b)
     (resi   2 and name   h8 and segi b) 4.50 2.00 0.90 ! 31
assi (resi   2 and name  h1' and segi b)
     (resi   3 and name   h6 and segi b) 4.50 2.00 0.90 ! 36
assi (resi   3 and name  h1' and segi b)
     (resi   4 and name   h6 and segi b) 4.50 2.00 0.90 ! 33
assi (resi   4 and name  h1' and segi b)
     (resi   5 and name   h8 and segi b) 4.50 2.00 0.90 ! 39
assi (resi   5 and name  h1' and segi b)
     (resi   6 and name   h8 and segi b) 4.50 2.00 0.90 ! 40
assi (resi   6 and name  h1' and segi b)
     (resi   7 and name   h6 and segi b) 4.50 2.00 0.90 ! 43
assi (resi   7 and name  h1' and segi b)
     (resi   8 and name   h8 and segi b) 4.50 2.00 0.90 ! 34
assi (resi   8 and name  h1' and segi b)
     (resi   9 and name   h6 and segi b) 4.50 2.00 0.90 ! 44
assi (resi   9 and name  h1' and segi b)
     (resi  10 and name   h6 and segi b) 4.50 2.00 0.90 ! 44
assi (resi   1 and name  h1' and segi a)
     (resi   2 and name   h8 and segi a) 4.50 2.00 0.90 ! 38
assi (resi   2 and name  h1' and segi a)
     (resi   3 and name   h6 and segi a) 4.50 2.00 0.90 ! 42
assi (resi   3 and name  h1' and segi a)
     (resi   4 and name   h8 and segi a) 4.50 2.00 0.90 ! 35
assi (resi   4 and name  h1' and segi a)
     (resi   5 and name   h6 and segi a) 4.50 2.00 0.90 ! 45
assi (resi   5 and name  h1' and segi a)
     (resi   6 and name   h8 and segi a) 4.50 2.00 0.90 ! 40
assi (resi   6 and name  h1' and segi a)
     (resi   7 and name   h8 and segi a) 4.50 2.00 0.90 ! 37
assi (resi   7 and name  h1' and segi a)
     (resi   8 and name   h6 and segi a) 4.50 2.00 0.90 ! 34
assi (resi   8 and name  h1' and segi a)
     (resi   9 and name   h8 and segi a) 4.50 2.00 0.90 ! 32


assi (resi   7 and name   h5 and segi b)
     (resi   6 and name  h1' and segi b) 4.50 2.00 0.90 ! 60
assi (resi   8 and name   h5 and segi a)
     (resi   7 and name  h1' and segi a) 4.50 2.00 0.90 ! 165
assi (resi   3 and name   h5 and segi a)
     (resi   2 and name  h1' and segi a) 4.50 2.00 0.90 ! 167
assi (resi   9 and name   h5 and segi b)
     (resi   8 and name  h1' and segi b) 4.50 2.00 0.90 ! 168
assi (resi   3 and name  h5  and segi b)
     (resi   2 and name  h1' and segi b) 4.50 2.00 0.90 ! 172
assi (resi   5 and name   h5 and segi a)
     (resi   4 and name  h1' and segi a) 4.50 2.00 0.90 ! 165

assi (resi   1 and name  h2' and segi b)
     (resi   2 and name   h8 and segi b) 2.50 0.90 0.50 ! 81
assi (resi   8 and name  h2' and segi a)
     (resi   9 and name   h8 and segi a) 2.50 0.90 0.50 ! 82
assi (resi   7 and name  h2' and segi b)
     (resi   8 and name   h8 and segi b) 2.50 0.90 0.50 ! 83
assi (resi   3 and name  h2' and segi b)
     (resi   4 and name   h6 and segi b) 2.50 0.90 0.50 ! 86
assi (resi   4 and name  h2' and segi a)
     (resi   5 and name   h6 and segi a) 2.50 0.90 0.50 ! 87
assi (resi   5 and name  h2' and segi a)
     (resi   6 and name   h8 and segi a) 2.50 0.90 0.50 ! 88
assi (resi   7 and name  h2' and segi a)
     (resi   8 and name   h6 and segi a) 2.50 0.90 0.50 ! 89
assi (resi   9 and name  h2' and segi b)
     (resi  10 and name   h6 and segi b) 2.50 0.90 0.50 ! 90
assi (resi   2 and name  h2' and segi b)
     (resi   3 and name   h6 and segi b) 2.50 0.90 0.50 ! 93
assi (resi   6 and name  h2' and segi b)
     (resi   7 and name   h6 and segi b) 2.50 0.90 0.50 ! 94
assi (resi   6 and name  h2' and segi a)
     (resi   7 and name   h8 and segi a) 2.50 0.90 0.50 ! 95
assi (resi   8 and name  h2' and segi b)
     (resi   9 and name   h6 and segi b) 2.50 0.90 0.50 ! 92
assi (resi   2 and name  h2' and segi a)
     (resi   3 and name   h6 and segi a) 2.50 0.90 0.50 ! 98
assi (resi   4 and name  h2' and segi b)
     (resi   5 and name   h8 and segi b) 2.50 0.90 0.50 ! 102
assi (resi   5 and name  h2' and segi b)
     (resi   6 and name   h8 and segi b) 2.50 0.90 0.50 ! 103
assi (resi   3 and name  h2' and segi a)
     (resi   4 and name   h8 and segi a) 2.50 0.90 0.50 ! 86

assi (resi   9 and name   h5 and segi b)
     (resi   8 and name  h2' and segi b) 3.50 1.50 0.70 ! 140
assi (resi   8 and name   h5 and segi a)
     (resi   7 and name  h2' and segi a) 3.50 1.50 0.70 ! 143
assi (resi   7 and name   h5 and segi b)
     (resi   6 and name  h2' and segi b) 3.50 1.50 0.70 ! 162
assi (resi   5 and name   h5 and segi a)
     (resi   4 and name  h2' and segi a) 3.50 1.50 0.70 ! 143

assi (resi   7 and name  h3' and segi b)
     (resi   8 and name   h8 and segi b) 3.50 1.50 0.70 ! 84
assi (resi   8 and name  h3' and segi a)
     (resi   9 and name   h8 and segi a) 3.50 1.50 0.70 ! 85
assi (resi   7 and name  h3' and segi a)
     (resi   8 and name   h6 and segi a) 3.50 1.50 0.70 ! 91
assi (resi   9 and name  h3' and segi b)
     (resi  10 and name   h6 and segi b) 3.50 1.50 0.70 ! 96
assi (resi   3 and name  h3' and segi a)
     (resi   4 and name   h8 and segi a) 3.50 1.50 0.70 ! 97
assi (resi   3 and name  h3' and segi b)
     (resi   4 and name   h6 and segi b) 3.50 1.50 0.70 ! 99
assi (resi   6 and name  h3' and segi a)
     (resi   7 and name   h8 and segi a) 3.50 1.50 0.70 ! 100
assi (resi   4 and name  h3' and segi a)
     (resi   5 and name   h6 and segi a) 3.50 1.50 0.70 ! 101
assi (resi   9 and name   h6 and segi b)
     (resi   8 and name  h3' and segi b) 3.50 1.50 0.70 ! 133
assi (resi   5 and name  h3' and segi a)
     (resi   6 and name   h8 and segi a) 3.50 1.50 0.70 ! 101
assi (resi   4 and name  h3' and segi b)
     (resi   5 and name   h8 and segi b) 3.50 1.50 0.70 ! 101
assi (resi   5 and name  h3' and segi b)
     (resi   6 and name   h8 and segi b) 3.50 1.50 0.70 ! 101
assi (resi   6 and name  h3' and segi b)
     (resi   7 and name   h6 and segi b) 3.50 1.50 0.70 ! 100

assi (resi   7 and name   h5 and segi b)
     (resi   6 and name  h3' and segi b) 3.50 1.50 0.70 ! 138
assi (resi   9 and name   h5 and segi b)
     (resi   8 and name  h3' and segi b) 3.50 1.50 0.70 ! 139
assi (resi   5 and name   h5 and segi a)
     (resi   4 and name  h3' and segi a) 3.50 1.50 0.70 ! 143


assi (resi   8 and name  h2' and segi a)
     (resi   9 and name  h1' and segi a) 3.50 1.50 0.70 ! 104
assi (resi   1 and name  h2' and segi a)
     (resi   2 and name  h1' and segi a) 3.50 1.50 0.70 ! 105
assi (resi   5 and name  h2' and segi a)
     (resi   6 and name  h1' and segi a) 3.50 1.50 0.70 ! 106
assi (resi   9 and name  h2' and segi b)
     (resi  10 and name  h1' and segi b) 3.50 1.50 0.70 ! 107
assi (resi   7 and name  h2' and segi b)
     (resi   8 and name  h1' and segi b) 3.50 1.50 0.70 ! 108
assi (resi   7 and name  h1' and segi a)
     (resi   6 and name  h2' and segi a) 3.50 1.50 0.70 ! 134
assi (resi   6 and name  h1' and segi a)
     (resi   5 and name  h2' and segi a) 3.50 1.50 0.70 ! 135
assi (resi   2 and name  h1' and segi b)
     (resi   1 and name  h2' and segi b) 3.50 1.50 0.70 ! 136
assi (resi   6 and name  h1' and segi b)
     (resi   5 and name  h2' and segi b) 3.50 1.50 0.70 ! 141
assi (resi   7 and name  h1' and segi b)
     (resi   6 and name  h2' and segi b) 3.50 1.50 0.70 ! 142
assi (resi   3 and name  h2' and segi a)
     (resi   4 and name  h1' and segi a) 3.50 1.50 0.70 ! 155
assi (resi   4 and name  h1' and segi b)
     (resi   3 and name  h2' and segi b) 3.50 1.50 0.70 ! 179
assi (resi   4 and name  h2' and segi a)
     (resi   5 and name  h1' and segi a) 3.50 1.50 0.70 ! 155


assi (resi   6 and name  h1' and segi b)
     (resi   7 and name  h1' and segi b) 4.50 2.00 0.90 ! 170
assi (resi   6 and name  h1' and segi b)
     (resi   5 and name  h1' and segi b) 4.50 2.00 0.90 ! 126
assi (resi   8 and name  h1' and segi b)
     (resi   7 and name  h1' and segi b) 4.50 2.00 0.90 ! 170
assi (resi   3 and name  h1' and segi b)
     (resi   2 and name  h1' and segi b) 4.50 2.00 0.90 ! 171
assi (resi   8 and name  h1' and segi b)
     (resi   9 and name  h1' and segi b) 4.50 2.00 0.90 ! 170
assi (resi   3 and name  h1' and segi a)
     (resi   2 and name  h1' and segi a) 4.50 2.00 0.90 ! 171

assi (resi   9 and name  h1' and segi b)
     (resi   8 and name  h2' and segi b) 5.50 2.50 1.10 ! 180
assi (resi   9 and name  h1' and segi b)
     (resi  10 and name  h2' and segi b) 5.50 2.50 1.10 ! 181

! H2O

assi (resi   3 and name   h3 and segi a)
     (resi   8 and name   h2 and segi b) 2.50 1.00 0.50 ! 149
assi (resi   3 and name   h3 and segi a)
     (resi   8 and name  h62 and segi b) 5.50 2.50 1.10 ! 149
assi (resi   3 and name   h3 and segi a)
     (resi   8 and name  h61 and segi b) 5.50 2.50 1.10 ! 149
assi (resi   4 and name   h1 and segi a)
     (resi   8 and name  h1' and segi b) 5.50 2.50 1.10 ! 149
assi (resi   4 and name   h1 and segi a)
     (resi   7 and name  h41 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   4 and name   h1 and segi a)
     (resi   7 and name  h42 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   2 and name   h1 and segi a)
     (resi   9 and name  h41 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   2 and name   h1 and segi a)
     (resi   9 and name  h42 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   7 and name   h1 and segi a)
     (resi   3 and name  h42 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   7 and name   h1 and segi a)
     (resi   3 and name  h41 and segi b) 4.50 2.00 0.90 ! 149
assi (resi   2 and name  h61 and segi b)
     (resi   3 and name   h5 and segi b) 4.50 2.00 0.90 ! 149

assi (resi   3 and name   h3 and segi a)
     (resi   4 and name   h1 and segi a) 4.50 2.00 0.90 ! 149

/* d2o_uBP_lr.tbl */

assi (resi   5 and name   h2 and segi b)
     (resi   6 and name  h1' and segi a) 4.50 2.00 0.90 ! 46
assi (resi   5 and name   h2 and segi b)
     (resi   6 and name  h1' and segi b) 3.50 1.50 0.70 ! 46

assi (resi   6 and name   h2 and segi b)
     (resi   6 and name  h1' and segi a) 5.50 2.50 1.10 ! 46
assi (resi   6 and name   h2 and segi b)
     (resi   5 and name  h1' and segi a) 5.50 2.50 1.10 ! 46
assi (resi   6 and name   h2 and segi b)
     (resi   7 and name  h1' and segi b) 3.50 1.50 0.70 ! 46
assi (resi   6 and name   h2 and segi b)
     (resi   5 and name   h5 and segi a) 5.50 2.50 1.10 ! 46

assi (resi   6 and name   h2 and segi a)
     (resi   5 and name  h1' and segi b) 4.50 2.00 0.90 ! 46
assi (resi   6 and name   h2 and segi a)
     (resi   7 and name  h1' and segi a) 3.50 1.50 0.70 ! 46
assi (resi   6 and name   h2 and segi a)
     (resi   5 and name   h2 and segi b) 4.50 2.00 0.90 ! 46
assi (resi   6 and name   h2 and segi a)
     (resi   6 and name  h1' and segi b) 5.50 2.50 1.10 ! 46

assi (resi   5 and name   h2 and segi b)
     (resi   6 and name  h1' and segi b) 3.50 1.50 0.70 ! 46
assi (resi   5 and name   h2 and segi b)
     (resi   6 and name  h1' and segi a) 4.50 2.00 0.90 ! 46

assi (resi   9 and name   h2 and segi a)
     (resi   2 and name  h1' and segi b) 5.50 2.50 1.10 ! 53
assi (resi   9 and name   h2 and segi a)
     (resi   1 and name  h1' and segi b) 5.50 2.50 1.10 ! 53

assi (resi   8 and name   h2 and segi b)
     (resi   4 and name  h1' and segi a) 4.50 2.00 0.90 ! 48
assi (resi   8 and name   h2 and segi b)
     (resi   9 and name  h1' and segi b) 3.50 1.50 0.70 ! 48

assi (resi   2 and name   h2 and segi b)
     (resi   3 and name  h1' and segi b) 3.50 1.50 0.70 ! 49
assi (resi   2 and name   h2 and segi b)
     (resi   9 and name  h1' and segi a) 5.50 2.50 1.10 ! 50

/* u2_chiral.tbl */

 
assi (resi 1 and name H1' and segi A) (resi 1 and name C2' and segi A)
     (resi 1 and name O4' and segi A) (resi 1 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 1 and name H3' and segi A) (resi 1 and name C4' and segi A)
     (resi 1 and name C2' and segi A) (resi 1 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 1 and name H4' and segi A) (resi 1 and name C5' and segi A)
     (resi 1 and name C3' and segi A) (resi 1 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 1 and name H2' and segi A) (resi 1 and name C1' and segi A)
     (resi 1 and name C3' and segi A) (resi 1 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 2 and name H1' and segi A) (resi 2 and name C2' and segi A)
     (resi 2 and name O4' and segi A) (resi 2 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 2 and name H3' and segi A) (resi 2 and name C4' and segi A)
     (resi 2 and name C2' and segi A) (resi 2 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 2 and name H4' and segi A) (resi 2 and name C5' and segi A)
     (resi 2 and name C3' and segi A) (resi 2 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 2 and name H2' and segi A) (resi 2 and name C1' and segi A)
     (resi 2 and name C3' and segi A) (resi 2 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 3 and name H1' and segi A) (resi 3 and name C2' and segi A)
     (resi 3 and name O4' and segi A) (resi 3 and name N1  and segi A)  500. -65. 20. 2 !1'
assi (resi 3 and name H3' and segi A) (resi 3 and name C4' and segi A)
     (resi 3 and name C2' and segi A) (resi 3 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 3 and name H4' and segi A) (resi 3 and name C5' and segi A)
     (resi 3 and name C3' and segi A) (resi 3 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 3 and name H2' and segi A) (resi 3 and name C1' and segi A)
     (resi 3 and name C3' and segi A) (resi 3 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 4 and name H1' and segi A) (resi 4 and name C2' and segi A)
     (resi 4 and name O4' and segi A) (resi 4 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 4 and name H3' and segi A) (resi 4 and name C4' and segi A)
     (resi 4 and name C2' and segi A) (resi 4 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 4 and name H4' and segi A) (resi 4 and name C5' and segi A)
     (resi 4 and name C3' and segi A) (resi 4 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 4 and name H2' and segi A) (resi 4 and name C1' and segi A)
     (resi 4 and name C3' and segi A) (resi 4 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 5 and name H1' and segi A) (resi 5 and name C2' and segi A)
     (resi 5 and name O4' and segi A) (resi 5 and name N1  and segi A)  500. -65. 20. 2 !1'
assi (resi 5 and name H3' and segi A) (resi 5 and name C4' and segi A)
     (resi 5 and name C2' and segi A) (resi 5 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 5 and name H4' and segi A) (resi 5 and name C5' and segi A)
     (resi 5 and name C3' and segi A) (resi 5 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 5 and name H2' and segi A) (resi 5 and name C1' and segi A)
     (resi 5 and name C3' and segi A) (resi 5 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 6 and name H1' and segi A) (resi 6 and name C2' and segi A)
     (resi 6 and name O4' and segi A) (resi 6 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 6 and name H3' and segi A) (resi 6 and name C4' and segi A)
     (resi 6 and name C2' and segi A) (resi 6 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 6 and name H4' and segi A) (resi 6 and name C5' and segi A)
     (resi 6 and name C3' and segi A) (resi 6 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 6 and name H2' and segi A) (resi 6 and name C1' and segi A)
     (resi 6 and name C3' and segi A) (resi 6 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 7 and name H1' and segi A) (resi 7 and name C2' and segi A)
     (resi 7 and name O4' and segi A) (resi 7 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 7 and name H3' and segi A) (resi 7 and name C4' and segi A)
     (resi 7 and name C2' and segi A) (resi 7 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 7 and name H4' and segi A) (resi 7 and name C5' and segi A)
     (resi 7 and name C3' and segi A) (resi 7 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 7 and name H2' and segi A) (resi 7 and name C1' and segi A)
     (resi 7 and name C3' and segi A) (resi 7 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 8 and name H1' and segi A) (resi 8 and name C2' and segi A)
     (resi 8 and name O4' and segi A) (resi 8 and name N1  and segi A)  500. -65. 20. 2 !1'
assi (resi 8 and name H3' and segi A) (resi 8 and name C4' and segi A)
     (resi 8 and name C2' and segi A) (resi 8 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 8 and name H4' and segi A) (resi 8 and name C5' and segi A)
     (resi 8 and name C3' and segi A) (resi 8 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 8 and name H2' and segi A) (resi 8 and name C1' and segi A)
     (resi 8 and name C3' and segi A) (resi 8 and name O2' and segi A)  500. -65. 20. 2 !2'
 
assi (resi 9 and name H1' and segi A) (resi 9 and name C2' and segi A)
     (resi 9 and name O4' and segi A) (resi 9 and name N9  and segi A)  500. -65. 20. 2 !1'
assi (resi 9 and name H3' and segi A) (resi 9 and name C4' and segi A)
     (resi 9 and name C2' and segi A) (resi 9 and name O3' and segi A)  500.  65. 20. 2 !3'
assi (resi 9 and name H4' and segi A) (resi 9 and name C5' and segi A)
     (resi 9 and name C3' and segi A) (resi 9 and name O4' and segi A)  500.  65. 20. 2 !4'
assi (resi 9 and name H2' and segi A) (resi 9 and name C1' and segi A)
     (resi 9 and name C3' and segi A) (resi 9 and name O2' and segi A)  500. -65. 20. 2 !2'


assi (resi 1 and name H1' and segi B) (resi 1 and name C2' and segi B)
     (resi 1 and name O4' and segi B) (resi 1 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 1 and name H3' and segi B) (resi 1 and name C4' and segi B)
     (resi 1 and name C2' and segi B) (resi 1 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 1 and name H4' and segi B) (resi 1 and name C5' and segi B)
     (resi 1 and name C3' and segi B) (resi 1 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 1 and name H2' and segi B) (resi 1 and name C1' and segi B)
     (resi 1 and name C3' and segi B) (resi 1 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 2 and name H1' and segi B) (resi 2 and name C2' and segi B)
     (resi 2 and name O4' and segi B) (resi 2 and name N9  and segi B)  500. -65. 20. 2 !1'
assi (resi 2 and name H3' and segi B) (resi 2 and name C4' and segi B)
     (resi 2 and name C2' and segi B) (resi 2 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 2 and name H4' and segi B) (resi 2 and name C5' and segi B)
     (resi 2 and name C3' and segi B) (resi 2 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 2 and name H2' and segi B) (resi 2 and name C1' and segi B)
     (resi 2 and name C3' and segi B) (resi 2 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 3 and name H1' and segi B) (resi 3 and name C2' and segi B)
     (resi 3 and name O4' and segi B) (resi 3 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 3 and name H3' and segi B) (resi 3 and name C4' and segi B)
     (resi 3 and name C2' and segi B) (resi 3 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 3 and name H4' and segi B) (resi 3 and name C5' and segi B)
     (resi 3 and name C3' and segi B) (resi 3 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 3 and name H2' and segi B) (resi 3 and name C1' and segi B)
     (resi 3 and name C3' and segi B) (resi 3 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 4 and name H1' and segi B) (resi 4 and name C2' and segi B)
     (resi 4 and name O4' and segi B) (resi 4 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 4 and name H3' and segi B) (resi 4 and name C4' and segi B)
     (resi 4 and name C2' and segi B) (resi 4 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 4 and name H4' and segi B) (resi 4 and name C5' and segi B)
     (resi 4 and name C3' and segi B) (resi 4 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 4 and name H2' and segi B) (resi 4 and name C1' and segi B)
     (resi 4 and name C3' and segi B) (resi 4 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 5 and name H1' and segi B) (resi 5 and name C2' and segi B)
     (resi 5 and name O4' and segi B) (resi 5 and name N9  and segi B)  500. -65. 20. 2 !1'
assi (resi 5 and name H3' and segi B) (resi 5 and name C4' and segi B)
     (resi 5 and name C2' and segi B) (resi 5 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 5 and name H4' and segi B) (resi 5 and name C5' and segi B)
     (resi 5 and name C3' and segi B) (resi 5 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 5 and name H2' and segi B) (resi 5 and name C1' and segi B)
     (resi 5 and name C3' and segi B) (resi 5 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 6 and name H1' and segi B) (resi 6 and name C2' and segi B)
     (resi 6 and name O4' and segi B) (resi 6 and name N9  and segi B)  500. -65. 20. 2 !1'
assi (resi 6 and name H3' and segi B) (resi 6 and name C4' and segi B)
     (resi 6 and name C2' and segi B) (resi 6 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 6 and name H4' and segi B) (resi 6 and name C5' and segi B)
     (resi 6 and name C3' and segi B) (resi 6 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 6 and name H2' and segi B) (resi 6 and name C1' and segi B)
     (resi 6 and name C3' and segi B) (resi 6 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 7 and name H1' and segi B) (resi 7 and name C2' and segi B)
     (resi 7 and name O4' and segi B) (resi 7 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 7 and name H3' and segi B) (resi 7 and name C4' and segi B)
     (resi 7 and name C2' and segi B) (resi 7 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 7 and name H4' and segi B) (resi 7 and name C5' and segi B)
     (resi 7 and name C3' and segi B) (resi 7 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 7 and name H2' and segi B) (resi 7 and name C1' and segi B)
     (resi 7 and name C3' and segi B) (resi 7 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 8 and name H1' and segi B) (resi 8 and name C2' and segi B)
     (resi 8 and name O4' and segi B) (resi 8 and name N9  and segi B)  500. -65. 20. 2 !1'
assi (resi 8 and name H3' and segi B) (resi 8 and name C4' and segi B)
     (resi 8 and name C2' and segi B) (resi 8 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 8 and name H4' and segi B) (resi 8 and name C5' and segi B)
     (resi 8 and name C3' and segi B) (resi 8 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 8 and name H2' and segi B) (resi 8 and name C1' and segi B)
     (resi 8 and name C3' and segi B) (resi 8 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 9 and name H1' and segi B) (resi 9 and name C2' and segi B)
     (resi 9 and name O4' and segi B) (resi 9 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 9 and name H3' and segi B) (resi 9 and name C4' and segi B)
     (resi 9 and name C2' and segi B) (resi 9 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 9 and name H4' and segi B) (resi 9 and name C5' and segi B)
     (resi 9 and name C3' and segi B) (resi 9 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 9 and name H2' and segi B) (resi 9 and name C1' and segi B)
     (resi 9 and name C3' and segi B) (resi 9 and name O2' and segi B)  500. -65. 20. 2 !2'

assi (resi 10 and name H1' and segi B) (resi 10 and name C2' and segi B)
     (resi 10 and name O4' and segi B) (resi 10 and name N1  and segi B)  500. -65. 20. 2 !1'
assi (resi 10 and name H3' and segi B) (resi 10 and name C4' and segi B)
     (resi 10 and name C2' and segi B) (resi 10 and name O3' and segi B)  500.  65. 20. 2 !3'
assi (resi 10 and name H4' and segi B) (resi 10 and name C5' and segi B)
     (resi 10 and name C3' and segi B) (resi 10 and name O4' and segi B)  500.  65. 20. 2 !4'
assi (resi 10 and name H2' and segi B) (resi 10 and name C1' and segi B)
     (resi 10 and name C3' and segi B) (resi 10 and name O2' and segi B)  500. -65. 20. 2 !2'


/* aform_uBP.tbl */

assi (resi 9 and name C3' and segi a) (resi 9 and name C4' and segi a)
     (resi 9 and name C5' and segi a) (resi 9 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 9 and name C4' and segi a) (resi 9 and name C5' and segi a)
     (resi 9 and name O5' and segi a) (resi 9 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 9 and name C5' and segi a) (resi 9 and name O5' and segi a)
     (resi 9 and name P   and segi a) (resi 8 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 9 and name O5' and segi a) (resi 9 and name P   and segi a)
     (resi 8 and name O3' and segi a) (resi 8 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 9 and name P   and segi a) (resi 8 and name O3' and segi a)
     (resi 8 and name C3' and segi a) (resi 8 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 8 and name C3' and segi a) (resi 8 and name C4' and segi a)
     (resi 8 and name C5' and segi a) (resi 8 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 8 and name C4' and segi a) (resi 8 and name C5' and segi a)
     (resi 8 and name O5' and segi a) (resi 8 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 8 and name C5' and segi a) (resi 8 and name O5' and segi a)
     (resi 8 and name P   and segi a) (resi 7 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 8 and name O5' and segi a) (resi 8 and name P   and segi a)
     (resi 7 and name O3' and segi a) (resi 7 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 8 and name P   and segi a) (resi 7 and name O3' and segi a)
     (resi 7 and name C3' and segi a) (resi 7 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 7 and name C3' and segi a) (resi 7 and name C4' and segi a)
     (resi 7 and name C5' and segi a) (resi 7 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 7 and name C4' and segi a) (resi 7 and name C5' and segi a)
     (resi 7 and name O5' and segi a) (resi 7 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 7 and name C5' and segi a) (resi 7 and name O5' and segi a)
     (resi 7 and name P   and segi a) (resi 6 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 7 and name O5' and segi a) (resi 7 and name P   and segi a)
     (resi 6 and name O3' and segi a) (resi 6 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 7 and name P   and segi a) (resi 6 and name O3' and segi a)
     (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a)
     (resi 6 and name C5' and segi a) (resi 6 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 6 and name C4' and segi a) (resi 6 and name C5' and segi a)
     (resi 6 and name O5' and segi a) (resi 6 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 6 and name C5' and segi a) (resi 6 and name O5' and segi a)
     (resi 6 and name P   and segi a) (resi 5 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 6 and name O5' and segi a) (resi 6 and name P   and segi a)
     (resi 5 and name O3' and segi a) (resi 5 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 6 and name P   and segi a) (resi 5 and name O3' and segi a)
     (resi 5 and name C3' and segi a) (resi 5 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 5 and name C3' and segi b) (resi 5 and name C4' and segi a)
     (resi 5 and name C5' and segi b) (resi 5 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 5 and name C4' and segi b) (resi 5 and name C5' and segi a)
     (resi 5 and name O5' and segi b) (resi 5 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 5 and name C5' and segi b) (resi 5 and name O5' and segi a)
     (resi 5 and name P   and segi b) (resi 4 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 5 and name O5' and segi b) (resi 5 and name P   and segi a)
     (resi 4 and name O3' and segi b) (resi 4 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 5 and name P   and segi b) (resi 4 and name O3' and segi a)
     (resi 4 and name C3' and segi b) (resi 4 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 4 and name C3' and segi a) (resi 4 and name C4' and segi a)
     (resi 4 and name C5' and segi a) (resi 4 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 4 and name C4' and segi a) (resi 4 and name C5' and segi a)
     (resi 4 and name O5' and segi a) (resi 4 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 4 and name C5' and segi a) (resi 4 and name O5' and segi a)
     (resi 4 and name P   and segi a) (resi 3 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 4 and name O5' and segi a) (resi 4 and name P   and segi a)
     (resi 3 and name O3' and segi a) (resi 3 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 4 and name P   and segi a) (resi 3 and name O3' and segi a)
     (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a)
     (resi 3 and name C5' and segi a) (resi 3 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 3 and name C4' and segi a) (resi 3 and name C5' and segi a)
     (resi 3 and name O5' and segi a) (resi 3 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 3 and name C5' and segi a) (resi 3 and name O5' and segi a)
     (resi 3 and name P   and segi a) (resi 2 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 3 and name O5' and segi a) (resi 3 and name P   and segi a)
     (resi 2 and name O3' and segi a) (resi 2 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 3 and name P   and segi a) (resi 2 and name O3' and segi a)
     (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a)
     (resi 2 and name C5' and segi a) (resi 2 and name O5' and segi a) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 2 and name C4' and segi a) (resi 2 and name C5' and segi a)
     (resi 2 and name O5' and segi a) (resi 2 and name P   and segi a) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 2 and name C5' and segi a) (resi 2 and name O5' and segi a)
     (resi 2 and name P   and segi a) (resi 1 and name O3' and segi a) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 2 and name O5' and segi a) (resi 2 and name P   and segi a)
     (resi 1 and name O3' and segi a) (resi 1 and name C3' and segi a) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 2 and name P   and segi a) (resi 1 and name O3' and segi a)
     (resi 1 and name C3' and segi a) (resi 1 and name C4' and segi a) 5.0 201.4 28.1 2    ! 5  a-form

assi (resi 10 and name C3' and segi b) (resi 10 and name C4' and segi b)
     (resi 10 and name C5' and segi b) (resi 10 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 10 and name C4' and segi b) (resi 10 and name C5' and segi b)
     (resi 10 and name O5' and segi b) (resi 10 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 10 and name C5' and segi b) (resi 10 and name O5' and segi b)
     (resi 10 and name P   and segi b) (resi 9 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 10 and name O5' and segi b) (resi 10 and name P   and segi b)
     (resi 9 and name O3' and segi b) (resi 9 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 10 and name P   and segi b) (resi 9 and name O3' and segi b)
     (resi 9 and name C3' and segi b) (resi 9 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 9 and name C3' and segi b) (resi 9 and name C4' and segi b)
     (resi 9 and name C5' and segi b) (resi 9 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 9 and name C4' and segi b) (resi 9 and name C5' and segi b)
     (resi 9 and name O5' and segi b) (resi 9 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 9 and name C5' and segi b) (resi 9 and name O5' and segi b)
     (resi 9 and name P   and segi b) (resi 8 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 9 and name O5' and segi b) (resi 9 and name P   and segi b)
     (resi 8 and name O3' and segi b) (resi 8 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 9 and name P   and segi b) (resi 8 and name O3' and segi b)
     (resi 8 and name C3' and segi b) (resi 8 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 8 and name C3' and segi b) (resi 8 and name C4' and segi b)
     (resi 8 and name C5' and segi b) (resi 8 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 8 and name C4' and segi b) (resi 8 and name C5' and segi b)
     (resi 8 and name O5' and segi b) (resi 8 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 8 and name C5' and segi b) (resi 8 and name O5' and segi b)
     (resi 8 and name P   and segi b) (resi 7 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 8 and name O5' and segi b) (resi 8 and name P   and segi b)
     (resi 7 and name O3' and segi b) (resi 7 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 8 and name P   and segi b) (resi 7 and name O3' and segi b)
     (resi 7 and name C3' and segi b) (resi 7 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 7 and name C3' and segi b) (resi 7 and name C4' and segi b)
     (resi 7 and name C5' and segi b) (resi 7 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 7 and name C4' and segi b) (resi 7 and name C5' and segi b)
     (resi 7 and name O5' and segi b) (resi 7 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 7 and name C5' and segi b) (resi 7 and name O5' and segi b)
     (resi 7 and name P   and segi b) (resi 6 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 7 and name O5' and segi b) (resi 7 and name P   and segi b)
     (resi 6 and name O3' and segi b) (resi 6 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 7 and name P   and segi b) (resi 6 and name O3' and segi b)
     (resi 6 and name C3' and segi b) (resi 6 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 6 and name C3' and segi b) (resi 6 and name C4' and segi b)
     (resi 6 and name C5' and segi b) (resi 6 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 6 and name C4' and segi b) (resi 6 and name C5' and segi b)
     (resi 6 and name O5' and segi b) (resi 6 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 6 and name C5' and segi b) (resi 6 and name O5' and segi b)
     (resi 6 and name P   and segi b) (resi 5 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 6 and name O5' and segi b) (resi 6 and name P   and segi b)
     (resi 5 and name O3' and segi b) (resi 5 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 6 and name P   and segi b) (resi 5 and name O3' and segi b)                                  
     (resi 5 and name C3' and segi b) (resi 5 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 5 and name C3' and segi b) (resi 5 and name C4' and segi b)
     (resi 5 and name C5' and segi b) (resi 5 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 5 and name C4' and segi b) (resi 5 and name C5' and segi b)
     (resi 5 and name O5' and segi b) (resi 5 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 5 and name C5' and segi b) (resi 5 and name O5' and segi b)
     (resi 5 and name P   and segi b) (resi 4 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 5 and name O5' and segi b) (resi 5 and name P   and segi b)
     (resi 4 and name O3' and segi b) (resi 4 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 5 and name P   and segi b) (resi 4 and name O3' and segi b)
     (resi 4 and name C3' and segi b) (resi 4 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 4 and name C3' and segi b) (resi 4 and name C4' and segi b)
     (resi 4 and name C5' and segi b) (resi 4 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 4 and name C4' and segi b) (resi 4 and name C5' and segi b)
     (resi 4 and name O5' and segi b) (resi 4 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 4 and name C5' and segi b) (resi 4 and name O5' and segi b)
     (resi 4 and name P   and segi b) (resi 3 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 4 and name O5' and segi b) (resi 4 and name P   and segi b)
     (resi 3 and name O3' and segi b) (resi 3 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 4 and name P   and segi b) (resi 3 and name O3' and segi b)
     (resi 3 and name C3' and segi b) (resi 3 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 3 and name C3' and segi b) (resi 3 and name C4' and segi b)
     (resi 3 and name C5' and segi b) (resi 3 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 3 and name C4' and segi b) (resi 3 and name C5' and segi b)
     (resi 3 and name O5' and segi b) (resi 3 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 3 and name C5' and segi b) (resi 3 and name O5' and segi b)
     (resi 3 and name P   and segi b) (resi 2 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 3 and name O5' and segi b) (resi 3 and name P   and segi b)
     (resi 2 and name O3' and segi b) (resi 2 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 3 and name P   and segi b) (resi 2 and name O3' and segi b)
     (resi 2 and name C3' and segi b) (resi 2 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form
assi (resi 2 and name C3' and segi b) (resi 2 and name C4' and segi b)
     (resi 2 and name C5' and segi b) (resi 2 and name O5' and segi b) 5.0  54.7 24.6 2    ! 1  a-form
assi (resi 2 and name C4' and segi b) (resi 2 and name C5' and segi b)
     (resi 2 and name O5' and segi b) (resi 2 and name P   and segi b) 5.0 175.1 26.6 2    ! 2  a-form
assi (resi 2 and name C5' and segi b) (resi 2 and name O5' and segi b)
     (resi 2 and name P   and segi b) (resi 1 and name O3' and segi b) 5.0 292.0 31.5 2    ! 3  a-form
assi (resi 2 and name O5' and segi b) (resi 2 and name P   and segi b)
     (resi 1 and name O3' and segi b) (resi 1 and name C3' and segi b) 5.0 290.2 26.9 2    ! 4  a-form
assi (resi 2 and name P   and segi b) (resi 1 and name O3' and segi b)
     (resi 1 and name C3' and segi b) (resi 1 and name C4' and segi b) 5.0 201.4 28.1 2    ! 5  a-form


/* c3endo_uBP.tbl */

assi (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a)
     (resi 1 and name C3' and segi a) (resi 1 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a)
     (resi 1 and name C3' and segi a) (resi 1 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 1 and name C2' and segi a) (resi 1 and name C3' and segi a)
     (resi 1 and name C4' and segi a) (resi 1 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 1 and name C3' and segi a) (resi 1 and name C4' and segi a)
     (resi 1 and name O4' and segi a) (resi 1 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 1 and name C4' and segi a) (resi 1 and name O4' and segi a)
     (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 1 and name O4' and segi a) (resi 1 and name C1' and segi a)
     (resi 1 and name C2' and segi a) (resi 1 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 1 and name O3' and segi a) (resi 1 and name C3' and segi a)
     (resi 1 and name C4' and segi a) (resi 1 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3
assi (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a)
     (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a)
     (resi 2 and name C3' and segi a) (resi 2 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 2 and name C2' and segi a) (resi 2 and name C3' and segi a)
     (resi 2 and name C4' and segi a) (resi 2 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a)
     (resi 2 and name O4' and segi a) (resi 2 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 2 and name C4' and segi a) (resi 2 and name O4' and segi a)
     (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 2 and name O4' and segi a) (resi 2 and name C1' and segi a)
     (resi 2 and name C2' and segi a) (resi 2 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 2 and name O3' and segi a) (resi 2 and name C3' and segi a)
     (resi 2 and name C4' and segi a) (resi 2 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3
assi (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a)
     (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a)
     (resi 3 and name C3' and segi a) (resi 3 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 3 and name C2' and segi a) (resi 3 and name C3' and segi a)
     (resi 3 and name C4' and segi a) (resi 3 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a)
     (resi 3 and name O4' and segi a) (resi 3 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 3 and name C4' and segi a) (resi 3 and name O4' and segi a)
     (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 3 and name O4' and segi a) (resi 3 and name C1' and segi a)
     (resi 3 and name C2' and segi a) (resi 3 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 3 and name O3' and segi a) (resi 3 and name C3' and segi a)
     (resi 3 and name C4' and segi a) (resi 3 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3
assi (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a)
     (resi 4 and name C3' and segi a) (resi 4 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a)
     (resi 4 and name C3' and segi a) (resi 4 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 4 and name C2' and segi a) (resi 4 and name C3' and segi a)
     (resi 4 and name C4' and segi a) (resi 4 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 4 and name C3' and segi a) (resi 4 and name C4' and segi a)
     (resi 4 and name O4' and segi a) (resi 4 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 4 and name C4' and segi a) (resi 4 and name O4' and segi a)
     (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 4 and name O4' and segi a) (resi 4 and name C1' and segi a)
     (resi 4 and name C2' and segi a) (resi 4 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 4 and name O3' and segi a) (resi 4 and name C3' and segi a)
     (resi 4 and name C4' and segi a) (resi 4 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3
assi (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a)
     (resi 5 and name C3' and segi a) (resi 5 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a)
     (resi 5 and name C3' and segi a) (resi 5 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 5 and name C2' and segi a) (resi 5 and name C3' and segi a)
     (resi 5 and name C4' and segi a) (resi 5 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 5 and name C3' and segi a) (resi 5 and name C4' and segi a)
     (resi 5 and name O4' and segi a) (resi 5 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 5 and name C4' and segi a) (resi 5 and name O4' and segi a)
     (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 5 and name O4' and segi a) (resi 5 and name C1' and segi a)
     (resi 5 and name C2' and segi a) (resi 5 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 5 and name O3' and segi a) (resi 5 and name C3' and segi a)
     (resi 5 and name C4' and segi a) (resi 5 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3
assi (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a)
     (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a)
     (resi 6 and name C3' and segi a) (resi 6 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 6 and name C2' and segi a) (resi 6 and name C3' and segi a)
     (resi 6 and name C4' and segi a) (resi 6 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a)
     (resi 6 and name O4' and segi a) (resi 6 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 6 and name C4' and segi a) (resi 6 and name O4' and segi a)
     (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 6 and name O4' and segi a) (resi 6 and name C1' and segi a)
     (resi 6 and name C2' and segi a) (resi 6 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 6 and name O3' and segi a) (resi 6 and name C3' and segi a)
     (resi 6 and name C4' and segi a) (resi 6 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3
assi (resi 7 and name C1' and segi a) (resi 7 and name C2' and segi a)
     (resi 7 and name C3' and segi a) (resi 7 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 7 and name C1' and segi a) (resi 7 and name C2' and segi a)
     (resi 7 and name C3' and segi a) (resi 7 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 7 and name C2' and segi a) (resi 7 and name C3' and segi a)
     (resi 7 and name C4' and segi a) (resi 7 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 7 and name C3' and segi a) (resi 7 and name C4' and segi a)
     (resi 7 and name O4' and segi a) (resi 7 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 7 and name C4' and segi a) (resi 7 and name O4' and segi a)
     (resi 7 and name C1' and segi a) (resi 7 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 7 and name O4' and segi a) (resi 7 and name C1' and segi a)
     (resi 7 and name C2' and segi a) (resi 7 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 7 and name O3' and segi a) (resi 7 and name C3' and segi a)
     (resi 7 and name C4' and segi a) (resi 7 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3
assi (resi 8 and name C1' and segi a) (resi 8 and name C2' and segi a)
     (resi 8 and name C3' and segi a) (resi 8 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 8 and name C1' and segi a) (resi 8 and name C2' and segi a)
     (resi 8 and name C3' and segi a) (resi 8 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 8 and name C2' and segi a) (resi 8 and name C3' and segi a)
     (resi 8 and name C4' and segi a) (resi 8 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 8 and name C3' and segi a) (resi 8 and name C4' and segi a)
     (resi 8 and name O4' and segi a) (resi 8 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 8 and name C4' and segi a) (resi 8 and name O4' and segi a)
     (resi 8 and name C1' and segi a) (resi 8 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 8 and name O4' and segi a) (resi 8 and name C1' and segi a)
     (resi 8 and name C2' and segi a) (resi 8 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 8 and name O3' and segi a) (resi 8 and name C3' and segi a)
     (resi 8 and name C4' and segi a) (resi 8 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 1 and name C1' and segi b) (resi 1 and name C2' and segi b)
     (resi 1 and name C3' and segi b) (resi 1 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 1 and name C1' and segi b) (resi 1 and name C2' and segi b)
     (resi 1 and name C3' and segi b) (resi 1 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 1 and name C2' and segi b) (resi 1 and name C3' and segi b)
     (resi 1 and name C4' and segi b) (resi 1 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 1 and name C3' and segi b) (resi 1 and name C4' and segi b)
     (resi 1 and name O4' and segi b) (resi 1 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 1 and name C4' and segi b) (resi 1 and name O4' and segi b)
     (resi 1 and name C1' and segi b) (resi 1 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 1 and name O4' and segi b) (resi 1 and name C1' and segi b)
     (resi 1 and name C2' and segi b) (resi 1 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 1 and name O3' and segi b) (resi 1 and name C3' and segi b)
     (resi 1 and name C4' and segi b) (resi 1 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 2 and name C1' and segi b) (resi 2 and name C2' and segi b)
     (resi 2 and name C3' and segi b) (resi 2 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 2 and name C1' and segi b) (resi 2 and name C2' and segi b)
     (resi 2 and name C3' and segi b) (resi 2 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 2 and name C2' and segi b) (resi 2 and name C3' and segi b)
     (resi 2 and name C4' and segi b) (resi 2 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 2 and name C3' and segi b) (resi 2 and name C4' and segi b)
     (resi 2 and name O4' and segi b) (resi 2 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 2 and name C4' and segi b) (resi 2 and name O4' and segi b)
     (resi 2 and name C1' and segi b) (resi 2 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 2 and name O4' and segi b) (resi 2 and name C1' and segi b)
     (resi 2 and name C2' and segi b) (resi 2 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 2 and name O3' and segi b) (resi 2 and name C3' and segi b)
     (resi 2 and name C4' and segi b) (resi 2 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 3 and name C1' and segi b) (resi 3 and name C2' and segi b)
     (resi 3 and name C3' and segi b) (resi 3 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 3 and name C1' and segi b) (resi 3 and name C2' and segi b)
     (resi 3 and name C3' and segi b) (resi 3 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 3 and name C2' and segi b) (resi 3 and name C3' and segi b)
     (resi 3 and name C4' and segi b) (resi 3 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 3 and name C3' and segi b) (resi 3 and name C4' and segi b)
     (resi 3 and name O4' and segi b) (resi 3 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 3 and name C4' and segi b) (resi 3 and name O4' and segi b)
     (resi 3 and name C1' and segi b) (resi 3 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 3 and name O4' and segi b) (resi 3 and name C1' and segi b)
     (resi 3 and name C2' and segi b) (resi 3 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 3 and name O3' and segi b) (resi 3 and name C3' and segi b)
     (resi 3 and name C4' and segi b) (resi 3 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 4 and name C1' and segi b) (resi 4 and name C2' and segi b)
     (resi 4 and name C3' and segi b) (resi 4 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 4 and name C1' and segi b) (resi 4 and name C2' and segi b)
     (resi 4 and name C3' and segi b) (resi 4 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 4 and name C2' and segi b) (resi 4 and name C3' and segi b)
     (resi 4 and name C4' and segi b) (resi 4 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 4 and name C3' and segi b) (resi 4 and name C4' and segi b)
     (resi 4 and name O4' and segi b) (resi 4 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 4 and name C4' and segi b) (resi 4 and name O4' and segi b)
     (resi 4 and name C1' and segi b) (resi 4 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 4 and name O4' and segi b) (resi 4 and name C1' and segi b)
     (resi 4 and name C2' and segi b) (resi 4 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 4 and name O3' and segi b) (resi 4 and name C3' and segi b)
     (resi 4 and name C4' and segi b) (resi 4 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 5 and name C1' and segi b) (resi 5 and name C2' and segi b)
     (resi 5 and name C3' and segi b) (resi 5 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 5 and name C1' and segi b) (resi 5 and name C2' and segi b)
     (resi 5 and name C3' and segi b) (resi 5 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 5 and name C2' and segi b) (resi 5 and name C3' and segi b)
     (resi 5 and name C4' and segi b) (resi 5 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 5 and name C3' and segi b) (resi 5 and name C4' and segi b)
     (resi 5 and name O4' and segi b) (resi 5 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 5 and name C4' and segi b) (resi 5 and name O4' and segi b)
     (resi 5 and name C1' and segi b) (resi 5 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 5 and name O4' and segi b) (resi 5 and name C1' and segi b)
     (resi 5 and name C2' and segi b) (resi 5 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 5 and name O3' and segi b) (resi 5 and name C3' and segi b)
     (resi 5 and name C4' and segi b) (resi 5 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 6 and name C1' and segi b) (resi 6 and name C2' and segi b)
     (resi 6 and name C3' and segi b) (resi 6 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 6 and name C1' and segi b) (resi 6 and name C2' and segi b)
     (resi 6 and name C3' and segi b) (resi 6 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 6 and name C2' and segi b) (resi 6 and name C3' and segi b)
     (resi 6 and name C4' and segi b) (resi 6 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 6 and name C3' and segi b) (resi 6 and name C4' and segi b)
     (resi 6 and name O4' and segi b) (resi 6 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 6 and name C4' and segi b) (resi 6 and name O4' and segi b)
     (resi 6 and name C1' and segi b) (resi 6 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 6 and name O4' and segi b) (resi 6 and name C1' and segi b)
     (resi 6 and name C2' and segi b) (resi 6 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 6 and name O3' and segi b) (resi 6 and name C3' and segi b)
     (resi 6 and name C4' and segi b) (resi 6 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 7 and name C1' and segi b) (resi 7 and name C2' and segi b)
     (resi 7 and name C3' and segi b) (resi 7 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 7 and name C1' and segi b) (resi 7 and name C2' and segi b)
     (resi 7 and name C3' and segi b) (resi 7 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 7 and name C2' and segi b) (resi 7 and name C3' and segi b)
     (resi 7 and name C4' and segi b) (resi 7 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 7 and name C3' and segi b) (resi 7 and name C4' and segi b)
     (resi 7 and name O4' and segi b) (resi 7 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 7 and name C4' and segi b) (resi 7 and name O4' and segi b)
     (resi 7 and name C1' and segi b) (resi 7 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 7 and name O4' and segi b) (resi 7 and name C1' and segi b)
     (resi 7 and name C2' and segi b) (resi 7 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 7 and name O3' and segi b) (resi 7 and name C3' and segi b)
     (resi 7 and name C4' and segi b) (resi 7 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 8 and name C1' and segi b) (resi 8 and name C2' and segi b)
     (resi 8 and name C3' and segi b) (resi 8 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 8 and name C1' and segi b) (resi 8 and name C2' and segi b)
     (resi 8 and name C3' and segi b) (resi 8 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 8 and name C2' and segi b) (resi 8 and name C3' and segi b)
     (resi 8 and name C4' and segi b) (resi 8 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 8 and name C3' and segi b) (resi 8 and name C4' and segi b)
     (resi 8 and name O4' and segi b) (resi 8 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 8 and name C4' and segi b) (resi 8 and name O4' and segi b)
     (resi 8 and name C1' and segi b) (resi 8 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 8 and name O4' and segi b) (resi 8 and name C1' and segi b)
     (resi 8 and name C2' and segi b) (resi 8 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 8 and name O3' and segi b) (resi 8 and name C3' and segi b)
     (resi 8 and name C4' and segi b) (resi 8 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3
assi (resi 9 and name C1' and segi b) (resi 9 and name C2' and segi b)
     (resi 9 and name C3' and segi b) (resi 9 and name C4' and segi b) 25.0  39.5 15.1 2 ! C3
assi (resi 9 and name C1' and segi b) (resi 9 and name C2' and segi b)
     (resi 9 and name C3' and segi b) (resi 9 and name O3' and segi b) 25.0 159.2 15.6 2 ! C3
assi (resi 9 and name C2' and segi b) (resi 9 and name C3' and segi b)
     (resi 9 and name C4' and segi b) (resi 9 and name O4' and segi b) 25.0 320.3 17.8 2 ! C3
assi (resi 9 and name C3' and segi b) (resi 9 and name C4' and segi b)
     (resi 9 and name O4' and segi b) (resi 9 and name C1' and segi b) 25.0  24.2 20.8 2 ! C3
assi (resi 9 and name C4' and segi b) (resi 9 and name O4' and segi b)
     (resi 9 and name C1' and segi b) (resi 9 and name C2' and segi b) 25.0   1.4 20.1 2 ! C3
assi (resi 9 and name O4' and segi b) (resi 9 and name C1' and segi b)
     (resi 9 and name C2' and segi b) (resi 9 and name C3' and segi b) 25.0 -26.1 16.4 2 ! C3
assi (resi 9 and name O3' and segi b) (resi 9 and name C3' and segi b)
     (resi 9 and name C4' and segi b) (resi 9 and name C5' and segi b) 25.0  80.4 20.7 2 ! C3


/* uBP_chi.tbl */

assi (resi 1 and name  O4' and segi a)(resi 1 and name  C1' and segi a)
     (resi 1 and name  N9  and segi a)(resi 1 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 2 and name  O4' and segi a)(resi 2 and name  C1' and segi a)
     (resi 2 and name  N9  and segi a)(resi 2 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 3 and name  O4' and segi a)(resi 3 and name  C1' and segi a)  
     (resi 3 and name  N1  and segi a)(resi 3 and name  C2  and segi a)  25.0  -120.0  40.0  2
assi (resi 4 and name  O4' and segi a)(resi 4 and name  C1' and segi a)
     (resi 4 and name  N9  and segi a)(resi 4 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 5 and name  O4' and segi a)(resi 5 and name  C1' and segi a)
     (resi 5 and name  N1  and segi a)(resi 5 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 6 and name  O4' and segi a)(resi 6 and name  C1' and segi a)
     (resi 6 and name  N9  and segi a)(resi 6 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 7 and name  O4' and segi a)(resi 7 and name  C1' and segi a)
     (resi 7 and name  N9  and segi a)(resi 7 and name  C4  and segi a)  25.0  -120.0  40.0  2
assi (resi 8 and name  O4' and segi a)(resi 8 and name  C1' and segi a)
     (resi 8 and name  N1  and segi a)(resi 8 and name  C2  and segi a)  25.0  -120.0  40.0  2
assi (resi 9 and name  O4' and segi a)(resi 9 and name  C1' and segi a)
     (resi 9 and name  N9  and segi a)(resi 9 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 1 and name  O4' and segi b)(resi 1 and name  C1' and segi b)
     (resi 1 and name  N1  and segi b)(resi 1 and name  C2  and segi b)  25.0  -120.0  40.0  2
assi (resi 2 and name  O4' and segi b)(resi 2 and name  C1' and segi b)
     (resi 2 and name  N9  and segi b)(resi 2 and name  C4  and segi b)  25.0  -120.0  40.0  2
assi (resi 3 and name  O4' and segi b)(resi 3 and name  C1' and segi b)
     (resi 3 and name  N1  and segi b)(resi 3 and name  C2  and segi b)  25.0  -120.0  40.0  2
assi (resi 4 and name  O4' and segi b)(resi 4 and name  C1' and segi b)
     (resi 4 and name  N1  and segi b)(resi 4 and name  C2  and segi b)  25.0  -120.0  40.0  2
assi (resi 5 and name  O4' and segi b)(resi 5 and name  C1' and segi b)
     (resi 5 and name  N9  and segi b)(resi 5 and name  C4  and segi b)  25.0  -120.0  40.0  2
assi (resi 6 and name  O4' and segi b)(resi 6 and name  C1' and segi b)
     (resi 6 and name  N9  and segi b)(resi 6 and name  C4  and segi b)  25.0  -120.0  40.0  2
assi (resi 7 and name  O4' and segi b)(resi 7 and name  C1' and segi b)
     (resi 7 and name  N1  and segi b)(resi 7 and name  C2  and segi b)  25.0  -120.0  40.0  2
assi (resi 8 and name  O4' and segi b)(resi 8 and name  C1' and segi b)
     (resi 8 and name  N9  and segi b)(resi 8 and name  C4  and segi b)  25.0  -120.0  40.0  2
assi (resi 9 and name  O4' and segi b)(resi 9 and name  C1' and segi b)
     (resi 9 and name  N1  and segi b)(resi 9 and name  C2  and segi b)  25.0  -120.0  40.0  2
assi (resi 10 and name  O4' and segi b)(resi 10 and name  C1' and segi b)
     (resi 10 and name  N1  and segi b)(resi 10 and name  C2  and segi b)  25.0  -120.0  40.0  2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          H5*         G   1  17.455  -6.851   2.018
    2   2H5*    G   1          H5**        G   1  17.549  -6.691   0.249
    3    H4*    G   1           H4*        G   1  15.314  -5.718   0.178
    4    H3*    G   1           H3*        G   1  15.239  -6.146   3.212
    5    H2*    G   1           H2*        G   1  12.805  -6.075   2.776
    6   2HO*    G   1          H2**        G   1  12.075  -5.145   1.218
    7    H1*    G   1           H1*        G   1  13.086  -7.909   0.832
    8    H8     G   1           H8         G   1  15.694  -8.755   3.458
    9    H1     G   1           H1         G   1   9.754 -10.583   5.018
   10   1H2     G   1          H21         G   1   8.296  -9.683   3.614
   11   2H2     G   1          H22         G   1   8.760  -8.645   2.276
   12    H5T    G   1           H5T        G   1  16.867  -4.481   1.727
   13   1H5*    G   2          H5*         G   2  12.448  -3.290   1.488
   14   2H5*    G   2          H5**        G   2  12.153  -1.905   2.562
   15    H4*    G   2           H4*        G   2  10.033  -2.945   1.824
   16    H3*    G   2           H3*        G   2  10.666  -3.348   4.789
   17    H2*    G   2           H2*        G   2   8.356  -4.170   4.895
   18   2HO*    G   2          H2**        G   2   7.013  -3.576   3.580
   19    H1*    G   2           H1*        G   2   8.806  -5.894   2.947
   20    H8     G   2           H8         G   2  12.188  -5.529   4.629
   21    H1     G   2           H1         G   2   8.182  -9.414   7.757
   22   1H2     G   2          H21         G   2   6.002  -9.179   6.818
   23   2H2     G   2          H22         G   2   5.731  -8.044   5.522
   24   1H5*    U   3          H5*         U   3   6.748  -1.649   3.736
   25   2H5*    U   3          H5**        U   3   6.274  -0.369   4.877
   26    H4*    U   3           H4*        U   3   4.482  -2.041   4.638
   27    H3*    U   3           H3*        U   3   5.900  -2.104   7.348
   28    H2*    U   3           H2*        U   3   4.018  -3.579   7.990
   29   2HO*    U   3          H2**        U   3   3.157  -3.279   5.315
   30    H1*    U   3           H1*        U   3   4.629  -5.210   5.994
   31    H3     U   3           H3         U   3   7.001  -7.111   9.411
   32    H5     U   3           H5         U   3   9.469  -4.052   7.988
   33    H6     U   3           H6         U   3   7.678  -3.297   6.607
   34   1H5*    G   4          H5*         G   4   1.914  -1.864   8.332
   35   2H5*    G   4          H5**        G   4   1.662  -0.653   9.611
   36    H4*    G   4           H4*        G   4   0.861  -2.865  10.331
   37    H3*    G   4           H3*        G   4   3.400  -1.940  11.768
   38    H2*    G   4           H2*        G   4   2.913  -3.862  13.243
   39   2HO*    G   4          H2**        G   4   0.569  -3.647  12.960
   40    H1*    G   4           H1*        G   4   2.869  -5.479  11.183
   41    H8     G   4           H8         G   4   5.174  -2.888   9.811
   42    H1     G   4           H1         G   4   8.021  -6.905  13.896
   43   1H2     G   4          H21         G   4   6.330  -8.094  15.091
   44   2H2     G   4          H22         G   4   4.657  -7.871  14.663
   45   1H5*    U   5          H5*         U   5   0.662  -3.281  14.681
   46   2H5*    U   5          H5**        U   5   0.592  -2.122  16.028
   47    H4*    U   5           H4*        U   5   1.238  -4.352  16.846
   48    H3*    U   5           H3*        U   5   3.476  -2.275  16.875
   49    H2*    U   5           H2*        U   5   4.687  -3.947  18.246
   50   2HO*    U   5          H2**        U   5   3.705  -5.898  18.667
   51    H1*    U   5           H1*        U   5   4.340  -5.751  16.307
   52    H3     U   5           H3         U   5   8.455  -4.019  15.373
   53    H5     U   5           H5         U   5   5.750  -1.457  13.455
   54    H6     U   5           H6         U   5   3.972  -2.591  14.551
   55   1H5*    A   6          H5*         A   6   3.725  -3.528  20.601
   56   2H5*    A   6          H5**        A   6   3.469  -2.184  21.737
   57    H4*    A   6           H4*        A   6   5.630  -3.273  22.175
   58    H3*    A   6           H3*        A   6   5.811  -0.488  20.924
   59    H2*    A   6           H2*        A   6   8.195  -0.658  21.447
   60   2HO*    A   6          H2**        A   6   8.773  -1.756  22.973
   61    H1*    A   6           H1*        A   6   8.343  -2.954  20.117
   62    H8     A   6           H8         A   6   5.579  -1.501  18.168
   63   1H6     A   6          H61         A   6   9.791   2.079  15.341
   64   2H6     A   6          H62         A   6   8.139   1.500  15.289
   65    H2     A   6           H2         A   6  11.731   0.247  18.928
   66   1H5*    G   7          H5*         G   7   7.996  -1.050  24.632
   67   2H5*    G   7          H5**        G   7   7.784   0.339  25.723
   68    H4*    G   7           H4*        G   7  10.166  -0.257  25.475
   69    H3*    G   7           H3*        G   7   9.387   2.400  24.173
   70    H2*    G   7           H2*        G   7  11.850   2.690  23.985
   71   2HO*    G   7          H2**        G   7  13.176   1.031  24.653
   72    H1*    G   7           H1*        G   7  11.984   0.455  22.601
   73    H8     G   7           H8         G   7   8.397   1.234  21.888
   74    H1     G   7           H1         G   7  12.368   4.824  18.415
   75   1H2     G   7          H21         G   7  14.567   4.676  19.353
   76   2H2     G   7          H22         G   7  14.862   3.577  20.671
   77   1H5*    U   8          H5*         U   8  12.733   3.100  26.681
   78   2H5*    U   8          H5**        U   8  12.511   4.590  27.626
   79    H4*    U   8           H4*        U   8  14.590   4.671  26.303
   80    H3*    U   8           H3*        U   8  12.421   6.581  25.307
   81    H2*    U   8           H2*        U   8  14.304   7.494  23.928
   82   2HO*    U   8          H2**        U   8  15.941   6.909  25.525
   83    H1*    U   8           H1*        U   8  14.638   5.102  22.865
   84    H3     U   8           H3         U   8  11.653   7.118  20.004
   85    H5     U   8           H5         U   8   9.314   5.113  22.831
   86    H6     U   8           H6         U   8  11.283   4.702  24.112
   87   1H5*    A   9          H5*         A   9  15.726   8.628  25.718
   88   2H5*    A   9          H5**        A   9  15.739  10.108  26.692
   89    H4*    A   9           H4*        A   9  16.713  10.315  24.387
   90    H3*    A   9           H3*        A   9  15.476  12.432  25.432
   91    H2*    A   9           H2*        A   9  13.280  11.308  25.011
   92   2HO*    A   9          H2**        A   9  12.690  12.687  22.930
   93    H1*    A   9           H1*        A   9  14.284  11.307  22.150
   94    H8     A   9           H8         A   9  12.496   8.531  24.184
   95   1H6     A   9          H61         A   9   7.846   9.301  20.147
   96   2H6     A   9          H62         A   9   8.404   8.371  21.522
   97    H2     A   9           H2         A   9  10.918  12.440  19.325
   98    H3T    A   9           H3T        A   9  15.678  13.483  23.439
   99   1H5*    U   1          H5*         U   1   5.483  14.901  11.607
  100   2H5*    U   1          H5**        U   1   4.815  14.102  13.043
  101    H4*    U   1           H4*        U   1   7.315  15.829  13.007
  102    H3*    U   1           H3*        U   1   7.042  12.788  13.286
  103    H2*    U   1           H2*        U   1   9.265  13.056  14.331
  104   2HO*    U   1          H2**        U   1  10.427  14.548  13.883
  105    H1*    U   1           H1*        U   1   8.316  15.000  15.920
  106    H3     U   1           H3         U   1   8.725  11.298  18.540
  107    H5     U   1           H5         U   1   5.074  10.767  16.558
  108    H6     U   1           H6         U   1   5.574  12.690  15.214
  109    H5T    U   1           H5T        U   1   4.566  16.163  13.981
  110   1H5*    A   2          H5*         A   2  11.015  14.226  12.004
  111   2H5*    A   2          H5**        A   2  11.773  13.044  10.914
  112    H4*    A   2           H4*        A   2  13.248  13.577  12.822
  113    H3*    A   2           H3*        A   2  12.089  10.748  12.900
  114    H2*    A   2           H2*        A   2  13.719  10.420  14.707
  115   2HO*    A   2          H2**        A   2  15.339  11.495  14.828
  116    H1*    A   2           H1*        A   2  12.782  12.507  16.012
  117    H8     A   2           H8         A   2   9.798  11.174  14.053
  118   1H6     A   2          H61         A   2   9.116   7.157  18.712
  119   2H6     A   2          H62         A   2   8.420   7.728  17.209
  120    H2     A   2           H2         A   2  13.050   9.189  19.244
  121   1H5*    C   3          H5*         C   3  16.377  10.800  13.376
  122   2H5*    C   3          H5**        C   3  17.123   9.469  12.467
  123    H4*    C   3           H4*        C   3  17.814   9.423  14.832
  124    H3*    C   3           H3*        C   3  15.946   7.133  14.047
  125    H2*    C   3           H2*        C   3  16.631   6.220  16.252
  126   2HO*    C   3          H2**        C   3  17.972   7.452  17.549
  127    H1*    C   3           H1*        C   3  15.760   8.428  17.416
  128   1H4     C   3          H41         C   3  10.272   5.360  16.524
  129   2H4     C   3          H42         C   3  10.067   6.111  14.953
  130    H5     C   3           H5         C   3  11.745   7.587  14.000
  131    H6     C   3           H6         C   3  13.955   8.514  14.281
  132   1H5*    U   4          H5*         U   4  19.143   5.493  16.079
  133   2H5*    U   4          H5**        U   4  19.809   4.103  15.192
  134    H4*    U   4           H4*        U   4  19.194   3.463  17.494
  135    H3*    U   4           H3*        U   4  17.378   2.290  15.329
  136    H2*    U   4           H2*        U   4  16.506   0.920  17.147
  137   2HO*    U   4          H2**        U   4  17.616   0.524  18.744
  138    H1*    U   4           H1*        U   4  16.103   3.054  18.672
  139    H3     U   4           H3         U   4  12.063   1.798  16.896
  140    H5     U   4           H5         U   4  13.724   4.474  14.133
  141    H6     U   4           H6         U   4  15.771   4.406  15.352
  142   1H5*    A   5          H5*         A   5  19.174  -0.397  18.212
  143   2H5*    A   5          H5**        A   5  19.727  -1.927  17.498
  144    H4*    A   5           H4*        A   5  18.301  -2.311  19.487
  145    H3*    A   5           H3*        A   5  17.064  -3.161  16.823
  146    H2*    A   5           H2*        A   5  15.342  -4.190  18.232
  147   2HO*    A   5          H2**        A   5  15.812  -4.777  20.045
  148    H1*    A   5           H1*        A   5  14.893  -1.909  19.499
  149    H8     A   5           H8         A   5  16.133  -0.834  16.071
  150   1H6     A   5          H61         A   5  11.853  -0.914  13.736
  151   2H6     A   5          H62         A   5  10.281  -1.564  14.148
  152    H2     A   5           H2         A   5  10.584  -3.237  18.283
  153   1H5*    A   6          H5*         A   6  17.258  -6.334  19.949
  154   2H5*    A   6          H5**        A   6  17.528  -7.937  19.226
  155    H4*    A   6           H4*        A   6  15.472  -7.896  20.619
  156    H3*    A   6           H3*        A   6  15.014  -8.193  17.611
  157    H2*    A   6           H2*        A   6  12.677  -8.535  18.186
  158   2HO*    A   6          H2**        A   6  12.115  -9.169  19.946
  159    H1*    A   6           H1*        A   6  12.571  -6.272  19.512
  160    H8     A   6           H8         A   6  15.315  -5.890  16.858
  161   1H6     A   6          H61         A   6  12.422  -4.211  13.281
  162   2H6     A   6          H62         A   6  10.690  -4.357  13.045
  163    H2     A   6           H2         A   6   8.893  -5.688  16.894
  164   1H5*    C   7          H5*         C   7  12.711 -11.005  20.036
  165   2H5*    C   7          H5**        C   7  12.668 -12.599  19.252
  166    H4*    C   7           H4*        C   7  10.384 -11.790  19.734
  167    H3*    C   7           H3*        C   7  11.106 -11.833  16.764
  168    H2*    C   7           H2*        C   7   8.719 -11.421  16.427
  169   2HO*    C   7          H2**        C   7   7.390 -11.954  17.743
  170    H1*    C   7           H1*        C   7   8.783  -9.330  18.063
  171   1H4     C   7          H41         C   7  10.502  -6.831  12.483
  172   2H4     C   7          H42         C   7  12.156  -7.358  12.701
  173    H5     C   7           H5         C   7  12.879  -8.649  14.648
  174    H6     C   7           H6         C   7  12.146  -9.770  16.659
  175   1H5*    A   8          H5*         A   8   7.361 -13.870  17.666
  176   2H5*    A   8          H5**        A   8   7.274 -15.355  16.692
  177    H4*    A   8           H4*        A   8   5.262 -14.006  16.345
  178    H3*    A   8           H3*        A   8   7.164 -14.030  13.953
  179    H2*    A   8           H2*        A   8   5.249 -13.024  12.761
  180   2HO*    A   8          H2**        A   8   3.904 -13.194  15.243
  181    H1*    A   8           H1*        A   8   5.120 -11.096  14.538
  182    H8     A   8           H8         A   8   8.766 -12.264  14.599
  183   1H6     A   8          H61         A   8   9.714  -7.881  10.354
  184   2H6     A   8          H62         A   8  10.465  -9.164  11.278
  185    H2     A   8           H2         A   8   5.287  -8.294  10.909
  186   1H5*    C   9          H5*         C   9   3.313 -14.921  12.557
  187   2H5*    C   9          H5**        C   9   3.403 -16.310  11.450
  188    H4*    C   9           H4*        C   9   2.392 -14.401  10.296
  189    H3*    C   9           H3*        C   9   5.244 -15.046   9.396
  190    H2*    C   9           H2*        C   9   4.750 -13.471   7.598
  191   2HO*    C   9          H2**        C   9   2.897 -13.210   7.025
  192    H1*    C   9           H1*        C   9   4.045 -11.607   9.239
  193   1H4     C   9          H41         C   9  10.297 -10.719   9.318
  194   2H4     C   9          H42         C   9  10.542 -12.027  10.458
  195    H5     C   9           H5         C   9   8.699 -13.447  11.221
  196    H6     C   9           H6         C   9   6.331 -13.886  11.028
  197   1H5*    C  10          H5*         C  10   2.432 -15.247   6.011
  198   2H5*    C  10          H5**        C  10   3.034 -16.309   4.719
  199    H4*    C  10           H4*        C  10   2.754 -13.969   3.966
  200    H3*    C  10           H3*        C  10   5.678 -14.841   4.088
  201    H2*    C  10           H2*        C  10   6.069 -12.684   2.938
  202   2HO*    C  10          H2**        C  10   4.006 -12.711   1.786
  203    H1*    C  10           H1*        C  10   4.900 -11.412   4.874
  204   1H4     C  10          H41         C  10  10.745 -12.430   7.131
  205   2H4     C  10          H42         C  10  10.233 -13.915   7.910
  206    H5     C  10           H5         C  10   8.056 -14.923   7.449
  207    H6     C  10           H6         C  10   5.924 -14.614   6.348
  208    H3T    C  10           H3T        C  10   3.838 -14.713   1.956
  Start of MODEL    2
    1   1H5*    G   1          H5*         G   1  16.065  -7.559  -0.452
    2   2H5*    G   1          H5**        G   1  15.701  -7.509  -2.193
    3    H4*    G   1           H4*        G   1  13.575  -6.401  -1.758
    4    H3*    G   1           H3*        G   1  14.257  -6.658   1.220
    5    H2*    G   1           H2*        G   1  11.805  -6.421   1.402
    6   2HO*    G   1          H2**        G   1  10.750  -5.526   0.014
    7    H1*    G   1           H1*        G   1  11.471  -8.327  -0.493
    8    H8     G   1           H8         G   1  14.490  -9.302   1.612
    9    H1     G   1           H1         G   1   8.847 -10.606   4.357
   10   1H2     G   1          H21         G   1   7.212  -9.643   3.211
   11   2H2     G   1          H22         G   1   7.485  -8.691   1.763
   12    H5T    G   1           H5T        G   1  15.538  -5.178  -0.753
   13   1H5*    G   2          H5*         G   2  11.296  -3.689   0.064
   14   2H5*    G   2          H5**        G   2  11.342  -2.255   1.112
   15    H4*    G   2           H4*        G   2   9.062  -3.183   0.954
   16    H3*    G   2           H3*        G   2  10.341  -3.579   3.704
   17    H2*    G   2           H2*        G   2   8.029  -4.156   4.338
   18   2HO*    G   2          H2**        G   2   6.505  -3.454   3.323
   19    H1*    G   2           H1*        G   2   7.886  -5.940   2.401
   20    H8     G   2           H8         G   2  11.550  -5.898   3.411
   21    H1     G   2           H1         G   2   7.819  -9.283   7.358
   22   1H2     G   2          H21         G   2   5.536  -8.863   6.803
   23   2H2     G   2          H22         G   2   5.150  -7.723   5.543
   24   1H5*    U   3          H5*         U   3   6.504  -1.483   3.559
   25   2H5*    U   3          H5**        U   3   6.407  -0.197   4.783
   26    H4*    U   3           H4*        U   3   4.476  -1.724   4.930
   27    H3*    U   3           H3*        U   3   6.417  -1.940   7.285
   28    H2*    U   3           H2*        U   3   4.618  -3.292   8.281
   29   2HO*    U   3          H2**        U   3   3.224  -2.857   5.859
   30    H1*    U   3           H1*        U   3   4.659  -4.922   6.207
   31    H3     U   3           H3         U   3   7.468  -6.973   9.196
   32    H5     U   3           H5         U   3   9.875  -4.234   7.150
   33    H6     U   3           H6         U   3   7.924  -3.325   6.137
   34   1H5*    G   4          H5*         G   4   2.538  -1.594   8.607
   35   2H5*    G   4          H5**        G   4   2.344  -0.492   9.987
   36    H4*    G   4           H4*        G   4   1.460  -2.749  10.484
   37    H3*    G   4           H3*        G   4   3.978  -2.008  12.057
   38    H2*    G   4           H2*        G   4   3.464  -4.069  13.308
   39   2HO*    G   4          H2**        G   4   1.102  -3.793  12.955
   40    H1*    G   4           H1*        G   4   3.471  -5.471  11.116
   41    H8     G   4           H8         G   4   5.767  -2.779   9.989
   42    H1     G   4           H1         G   4   8.581  -7.017  13.870
   43   1H2     G   4          H21         G   4   6.871  -8.282  14.963
   44   2H2     G   4          H22         G   4   5.209  -8.062  14.489
   45   1H5*    U   5          H5*         U   5   1.284  -3.795  14.697
   46   2H5*    U   5          H5**        U   5   1.101  -2.822  16.171
   47    H4*    U   5           H4*        U   5   1.873  -5.088  16.735
   48    H3*    U   5           H3*        U   5   3.936  -2.870  17.101
   49    H2*    U   5           H2*        U   5   5.282  -4.569  18.268
   50   2HO*    U   5          H2**        U   5   3.088  -6.288  17.733
   51    H1*    U   5           H1*        U   5   5.097  -6.184  16.154
   52    H3     U   5           H3         U   5   9.077  -4.069  15.496
   53    H5     U   5           H5         U   5   6.211  -1.563  13.734
   54    H6     U   5           H6         U   5   4.514  -2.919  14.686
   55   1H5*    A   6          H5*         A   6   4.320  -4.371  20.598
   56   2H5*    A   6          H5**        A   6   3.918  -3.190  21.867
   57    H4*    A   6           H4*        A   6   6.238  -3.945  22.142
   58    H3*    A   6           H3*        A   6   5.945  -1.097  21.062
   59    H2*    A   6           H2*        A   6   8.329  -0.915  21.572
   60   2HO*    A   6          H2**        A   6   9.021  -1.936  23.099
   61    H1*    A   6           H1*        A   6   8.791  -3.208  20.205
   62    H8     A   6           H8         A   6   6.034  -1.930  18.127
   63   1H6     A   6          H61         A   6   8.535   1.322  15.450
   64   2H6     A   6          H62         A   6  10.148   1.988  15.602
   65    H2     A   6           H2         A   6  11.985   0.251  19.280
   66   1H5*    G   7          H5*         G   7   8.180  -1.308  24.819
   67   2H5*    G   7          H5**        G   7   7.653   0.026  25.873
   68    H4*    G   7           H4*        G   7  10.104   0.014  25.661
   69    H3*    G   7           H3*        G   7   8.737   2.312  24.171
   70    H2*    G   7           H2*        G   7  11.015   3.191  23.992
   71   2HO*    G   7          H2**        G   7  12.320   2.765  25.396
   72    H1*    G   7           H1*        G   7  11.869   0.884  22.969
   73    H8     G   7           H8         G   7   8.299   1.089  21.752
   74    H1     G   7           H1         G   7  12.293   4.909  18.537
   75   1H2     G   7          H21         G   7  14.340   5.057  19.759
   76   2H2     G   7          H22         G   7  14.582   4.070  21.177
   77   1H5*    U   8          H5*         U   8  11.663   3.607  27.206
   78   2H5*    U   8          H5**        U   8  11.109   5.093  28.009
   79    H4*    U   8           H4*        U   8  13.389   5.355  27.118
   80    H3*    U   8           H3*        U   8  11.289   6.995  25.614
   81    H2*    U   8           H2*        U   8  13.321   8.053  24.596
   82   2HO*    U   8          H2**        U   8  15.319   7.240  25.148
   83    H1*    U   8           H1*        U   8  14.105   5.678  23.757
   84    H3     U   8           H3         U   8  11.666   7.181  20.171
   85    H5     U   8           H5         U   8   8.874   5.344  22.680
   86    H6     U   8           H6         U   8  10.559   5.155  24.359
   87   1H5*    A   9          H5*         A   9  14.289   9.303  26.562
   88   2H5*    A   9          H5**        A   9  14.000  10.809  27.453
   89    H4*    A   9           H4*        A   9  15.433  11.026  25.404
   90    H3*    A   9           H3*        A   9  13.860  13.074  26.069
   91    H2*    A   9           H2*        A   9  11.888  11.782  25.232
   92   2HO*    A   9          H2**        A   9  11.683  13.061  23.014
   93    H1*    A   9           H1*        A   9  13.493  11.780  22.658
   94    H8     A   9           H8         A   9  11.469   8.945  24.378
   95   1H6     A   9          H61         A   9   7.812   9.228  19.385
   96   2H6     A   9          H62         A   9   8.117   8.391  20.891
   97    H2     A   9           H2         A   9  10.796  12.549  19.089
   98    H3T    A   9           H3T        A   9  15.633  13.167  24.568
   99   1H5*    U   1          H5*         U   1   5.428  12.981  11.949
  100   2H5*    U   1          H5**        U   1   5.142  14.678  11.503
  101    H4*    U   1           H4*        U   1   7.499  15.203  11.830
  102    H3*    U   1           H3*        U   1   7.831  12.271  12.649
  103    H2*    U   1           H2*        U   1   9.811  13.210  13.828
  104   2HO*    U   1          H2**        U   1   8.963  15.709  12.814
  105    H1*    U   1           H1*        U   1   8.210  14.922  15.084
  106    H3     U   1           H3         U   1   8.764  11.385  17.952
  107    H5     U   1           H5         U   1   5.569  10.284  15.487
  108    H6     U   1           H6         U   1   6.002  12.201  14.128
  109    H5T    U   1           H5T        U   1   7.148  13.314  10.221
  110   1H5*    A   2          H5*         A   2  11.570  13.991  11.839
  111   2H5*    A   2          H5**        A   2  12.609  12.861  10.940
  112    H4*    A   2           H4*        A   2  13.721  13.651  12.984
  113    H3*    A   2           H3*        A   2  12.883  10.712  13.116
  114    H2*    A   2           H2*        A   2  14.348  10.706  15.120
  115   2HO*    A   2          H2**        A   2  14.739  13.450  14.572
  116    H1*    A   2           H1*        A   2  12.927  12.662  16.161
  117    H8     A   2           H8         A   2  10.337  11.139  13.909
  118   1H6     A   2          H61         A   2   9.312   7.097  18.491
  119   2H6     A   2          H62         A   2   8.777   7.619  16.905
  120    H2     A   2           H2         A   2  13.073   9.300  19.440
  121   1H5*    C   3          H5*         C   3  16.965  10.914  14.191
  122   2H5*    C   3          H5**        C   3  17.864   9.622  13.360
  123    H4*    C   3           H4*        C   3  18.143   9.446  15.807
  124    H3*    C   3           H3*        C   3  16.414   7.253  14.564
  125    H2*    C   3           H2*        C   3  16.602   6.190  16.760
  126   2HO*    C   3          H2**        C   3  18.107   6.575  17.955
  127    H1*    C   3           H1*        C   3  15.716   8.394  17.952
  128   1H4     C   3          H41         C   3  10.437   5.337  16.260
  129   2H4     C   3          H42         C   3  10.386   6.165  14.714
  130    H5     C   3           H5         C   3  12.164   7.728  14.028
  131    H6     C   3           H6         C   3  14.307   8.657  14.629
  132   1H5*    U   4          H5*         U   4  19.455   5.608  17.046
  133   2H5*    U   4          H5**        U   4  20.207   4.202  16.262
  134    H4*    U   4           H4*        U   4  19.384   3.617  18.513
  135    H3*    U   4           H3*        U   4  17.782   2.368  16.225
  136    H2*    U   4           H2*        U   4  16.782   1.023  18.007
  137   2HO*    U   4          H2**        U   4  17.764   0.677  19.679
  138    H1*    U   4           H1*        U   4  16.192   3.205  19.409
  139    H3     U   4           H3         U   4  12.349   1.838  17.336
  140    H5     U   4           H5         U   4  14.249   4.354  14.577
  141    H6     U   4           H6         U   4  16.179   4.373  15.984
  142   1H5*    A   5          H5*         A   5  19.352  -0.247  19.280
  143   2H5*    A   5          H5**        A   5  20.011  -1.762  18.626
  144    H4*    A   5           H4*        A   5  18.425  -2.191  20.476
  145    H3*    A   5           H3*        A   5  17.459  -3.059  17.707
  146    H2*    A   5           H2*        A   5  15.641  -4.138  18.944
  147   2HO*    A   5          H2**        A   5  15.976  -4.746  20.779
  148    H1*    A   5           H1*        A   5  15.031  -1.884  20.192
  149    H8     A   5           H8         A   5  16.486  -0.679  16.908
  150   1H6     A   5          H61         A   5  12.421  -0.897  14.220
  151   2H6     A   5          H62         A   5  10.830  -1.564  14.516
  152    H2     A   5           H2         A   5  10.898  -3.402  18.589
  153   1H5*    A   6          H5*         A   6  17.471  -6.314  20.771
  154   2H5*    A   6          H5**        A   6  17.832  -7.893  20.035
  155    H4*    A   6           H4*        A   6  15.648  -7.903  21.225
  156    H3*    A   6           H3*        A   6  15.485  -8.142  18.181
  157    H2*    A   6           H2*        A   6  13.104  -8.509  18.520
  158   2HO*    A   6          H2**        A   6  12.374  -9.165  20.215
  159    H1*    A   6           H1*        A   6  12.859  -6.269  19.861
  160    H8     A   6           H8         A   6  15.829  -5.758  17.498
  161   1H6     A   6          H61         A   6  13.207  -4.146  13.663
  162   2H6     A   6          H62         A   6  11.501  -4.328  13.290
  163    H2     A   6           H2         A   6   9.434  -5.823  16.925
  164   1H5*    C   7          H5*         C   7  12.974 -10.997  20.359
  165   2H5*    C   7          H5**        C   7  12.996 -12.585  19.562
  166    H4*    C   7           H4*        C   7  10.679 -11.768  19.890
  167    H3*    C   7           H3*        C   7  11.596 -11.823  16.973
  168    H2*    C   7           H2*        C   7   9.235 -11.409  16.486
  169   2HO*    C   7          H2**        C   7   7.806 -11.860  17.736
  170    H1*    C   7           H1*        C   7   9.202  -9.317  18.136
  171   1H4     C   7          H41         C   7  11.119  -6.774  12.680
  172   2H4     C   7          H42         C   7  12.767  -7.331  12.905
  173    H5     C   7           H5         C   7  13.447  -8.532  14.958
  174    H6     C   7           H6         C   7  12.637  -9.666  16.929
  175   1H5*    A   8          H5*         A   8   7.757 -13.721  17.622
  176   2H5*    A   8          H5**        A   8   7.644 -15.202  16.647
  177    H4*    A   8           H4*        A   8   5.734 -13.718  16.183
  178    H3*    A   8           H3*        A   8   7.760 -13.912  13.900
  179    H2*    A   8           H2*        A   8   6.036 -12.778  12.598
  180   2HO*    A   8          H2**        A   8   4.137 -12.944  13.056
  181    H1*    A   8           H1*        A   8   5.762 -10.884  14.438
  182    H8     A   8           H8         A   8   9.427 -11.940  14.522
  183   1H6     A   8          H61         A   8  10.226  -7.787  10.000
  184   2H6     A   8          H62         A   8  11.038  -8.934  11.047
  185    H2     A   8           H2         A   8   5.829  -8.287  10.622
  186   1H5*    C   9          H5*         C   9   3.590 -14.732  12.854
  187   2H5*    C   9          H5**        C   9   3.509 -16.116  11.740
  188    H4*    C   9           H4*        C   9   2.302 -14.205  10.789
  189    H3*    C   9           H3*        C   9   4.946 -14.873   9.403
  190    H2*    C   9           H2*        C   9   4.186 -13.284   7.721
  191   2HO*    C   9          H2**        C   9   2.275 -12.958   7.466
  192    H1*    C   9           H1*        C   9   3.780 -11.416   9.435
  193   1H4     C   9          H41         C   9  10.006 -10.590   8.602
  194   2H4     C   9          H42         C   9  10.386 -11.919   9.678
  195    H5     C   9           H5         C   9   8.669 -13.376  10.604
  196    H6     C   9           H6         C   9   6.296 -13.789  10.762
  197   1H5*    C  10          H5*         C  10   1.589 -14.893   6.571
  198   2H5*    C  10          H5**        C  10   1.905 -15.971   5.193
  199    H4*    C  10           H4*        C  10   1.601 -13.627   4.487
  200    H3*    C  10           H3*        C  10   4.463 -14.622   4.121
  201    H2*    C  10           H2*        C  10   4.758 -12.495   2.902
  202   2HO*    C  10          H2**        C  10   2.046 -12.003   3.563
  203    H1*    C  10           H1*        C  10   3.975 -11.158   4.991
  204   1H4     C  10          H41         C  10  10.051 -12.406   6.349
  205   2H4     C  10          H42         C  10   9.600 -13.871   7.198
  206    H5     C  10           H5         C  10   7.357 -14.811   7.035
  207    H6     C  10           H6         C  10   5.097 -14.420   6.269
  208    H3T    C  10           H3T        C  10   3.752 -14.955   2.030
  Start of MODEL    3
    1   1H5*    G   1          H5*         G   1  16.816  -5.706   0.854
    2   2H5*    G   1          H5**        G   1  16.585  -5.449  -0.891
    3    H4*    G   1           H4*        G   1  14.349  -4.564  -0.509
    4    H3*    G   1           H3*        G   1  14.803  -5.176   2.461
    5    H2*    G   1           H2*        G   1  12.336  -5.134   2.441
    6   2HO*    G   1          H2**        G   1  11.336  -4.115   1.099
    7    H1*    G   1           H1*        G   1  12.314  -6.751   0.262
    8    H8     G   1           H8         G   1  15.157  -7.953   2.467
    9    H1     G   1           H1         G   1   9.348  -9.753   4.493
   10   1H2     G   1          H21         G   1   7.786  -8.646   3.375
   11   2H2     G   1          H22         G   1   8.149  -7.488   2.106
   12    H5T    G   1           H5T        G   1  16.117  -3.350   0.814
   13   1H5*    G   2          H5*         G   2  11.730  -2.279   1.430
   14   2H5*    G   2          H5**        G   2  11.569  -0.991   2.644
   15    H4*    G   2           H4*        G   2   9.394  -2.053   2.149
   16    H3*    G   2           H3*        G   2  10.441  -2.689   4.953
   17    H2*    G   2           H2*        G   2   8.144  -3.525   5.275
   18   2HO*    G   2          H2**        G   2   6.653  -2.836   4.178
   19    H1*    G   2           H1*        G   2   8.333  -5.043   3.122
   20    H8     G   2           H8         G   2  11.882  -4.965   4.431
   21    H1     G   2           H1         G   2   8.040  -8.923   7.675
   22   1H2     G   2          H21         G   2   5.783  -8.504   7.024
   23   2H2     G   2          H22         G   2   5.440  -7.257   5.856
   24   1H5*    U   3          H5*         U   3   6.427  -0.939   4.509
   25   2H5*    U   3          H5**        U   3   6.068   0.224   5.805
   26    H4*    U   3           H4*        U   3   4.257  -1.436   5.572
   27    H3*    U   3           H3*        U   3   5.898  -1.726   8.136
   28    H2*    U   3           H2*        U   3   4.060  -3.271   8.792
   29   2HO*    U   3          H2**        U   3   2.444  -3.691   7.311
   30    H1*    U   3           H1*        U   3   4.526  -4.715   6.628
   31    H3     U   3           H3         U   3   7.188  -6.837   9.698
   32    H5     U   3           H5         U   3   9.527  -3.699   8.232
   33    H6     U   3           H6         U   3   7.618  -2.852   7.091
   34   1H5*    G   4          H5*         G   4   1.897  -1.837   9.269
   35   2H5*    G   4          H5**        G   4   1.649  -0.661  10.581
   36    H4*    G   4           H4*        G   4   0.881  -2.876  11.287
   37    H3*    G   4           H3*        G   4   3.468  -1.947  12.625
   38    H2*    G   4           H2*        G   4   3.097  -3.868  14.128
   39   2HO*    G   4          H2**        G   4   0.758  -4.303  12.599
   40    H1*    G   4           H1*        G   4   2.913  -5.499  12.043
   41    H8     G   4           H8         G   4   5.133  -2.801  10.616
   42    H1     G   4           H1         G   4   8.293  -7.193  14.031
   43   1H2     G   4          H21         G   4   6.706  -8.503  15.240
   44   2H2     G   4          H22         G   4   5.002  -8.180  15.062
   45   1H5*    U   5          H5*         U   5   0.848  -2.982  15.798
   46   2H5*    U   5          H5**        U   5   0.914  -1.689  17.019
   47    H4*    U   5           H4*        U   5   1.584  -3.808  18.037
   48    H3*    U   5           H3*        U   5   3.885  -1.841  17.595
   49    H2*    U   5           H2*        U   5   5.169  -3.389  19.052
   50   2HO*    U   5          H2**        U   5   4.176  -5.158  19.889
   51    H1*    U   5           H1*        U   5   4.533  -5.420  17.428
   52    H3     U   5           H3         U   5   8.515  -4.372  15.557
   53    H5     U   5           H5         U   5   5.904  -1.453  14.051
   54    H6     U   5           H6         U   5   4.207  -2.296  15.495
   55   1H5*    A   6          H5*         A   6   3.888  -2.964  21.467
   56   2H5*    A   6          H5**        A   6   3.738  -1.569  22.559
   57    H4*    A   6           H4*        A   6   5.607  -3.015  23.240
   58    H3*    A   6           H3*        A   6   6.462  -0.336  22.031
   59    H2*    A   6           H2*        A   6   8.665  -0.950  22.992
   60   2HO*    A   6          H2**        A   6   8.543  -2.132  24.651
   61    H1*    A   6           H1*        A   6   8.559  -3.229  21.576
   62    H8     A   6           H8         A   6   6.425  -1.258  19.310
   63   1H6     A   6          H61         A   6   9.880   1.134  16.860
   64   2H6     A   6          H62         A   6  11.599   1.350  17.112
   65    H2     A   6           H2         A   6  12.653  -0.794  20.892
   66   1H5*    G   7          H5*         G   7   8.338  -0.524  25.814
   67   2H5*    G   7          H5**        G   7   7.984   0.996  26.667
   68    H4*    G   7           H4*        G   7  10.398   0.606  26.623
   69    H3*    G   7           H3*        G   7   9.477   2.862  24.776
   70    H2*    G   7           H2*        G   7  11.908   3.376  24.676
   71   2HO*    G   7          H2**        G   7  12.359   2.637  26.828
   72    H1*    G   7           H1*        G   7  12.347   0.921  23.789
   73    H8     G   7           H8         G   7   8.784   1.164  22.715
   74    H1     G   7           H1         G   7  12.710   4.380  18.831
   75   1H2     G   7          H21         G   7  14.870   4.532  19.865
   76   2H2     G   7          H22         G   7  15.064   3.955  21.493
   77   1H5*    U   8          H5*         U   8  12.364   4.567  27.336
   78   2H5*    U   8          H5**        U   8  11.793   6.143  27.931
   79    H4*    U   8           H4*        U   8  13.960   6.368  26.808
   80    H3*    U   8           H3*        U   8  11.636   7.587  25.236
   81    H2*    U   8           H2*        U   8  13.484   8.583  23.885
   82   2HO*    U   8          H2**        U   8  15.203   7.141  25.598
   83    H1*    U   8           H1*        U   8  14.401   6.152  23.399
   84    H3     U   8           H3         U   8  11.579   7.078  19.889
   85    H5     U   8           H5         U   8   9.222   5.121  22.740
   86    H6     U   8           H6         U   8  11.020   5.306  24.298
   87   1H5*    A   9          H5*         A   9  14.479  10.204  25.538
   88   2H5*    A   9          H5**        A   9  14.150  11.812  26.209
   89    H4*    A   9           H4*        A   9  15.381  11.794  24.026
   90    H3*    A   9           H3*        A   9  13.697  13.803  24.521
   91    H2*    A   9           H2*        A   9  11.780  12.255  24.065
   92   2HO*    A   9          H2**        A   9  11.307  13.161  21.705
   93    H1*    A   9           H1*        A   9  13.191  11.969  21.396
   94    H8     A   9           H8         A   9  11.527   9.289  23.652
   95   1H6     A   9          H61         A   9   7.518   8.596  18.970
   96   2H6     A   9          H62         A   9   7.980   8.010  20.554
   97    H2     A   9           H2         A   9  10.182  12.050  17.995
   98    H3T    A   9           H3T        A   9  14.014  14.536  22.405
   99   1H5*    U   1          H5*         U   1   6.093  11.012   8.962
  100   2H5*    U   1          H5**        U   1   5.280  10.652  10.497
  101    H4*    U   1           H4*        U   1   7.534  12.654  10.138
  102    H3*    U   1           H3*        U   1   7.582   9.896  11.474
  103    H2*    U   1           H2*        U   1   9.555  10.909  12.585
  104   2HO*    U   1          H2**        U   1  10.541  12.370  11.755
  105    H1*    U   1           H1*        U   1   8.091  13.018  13.303
  106    H3     U   1           H3         U   1   8.494  10.329  16.992
  107    H5     U   1           H5         U   1   5.255   8.747  14.864
  108    H6     U   1           H6         U   1   5.764  10.234  13.055
  109    H5T    U   1           H5T        U   1   4.667  12.858  10.581
  110   1H5*    A   2          H5*         A   2  11.456  11.436  10.149
  111   2H5*    A   2          H5**        A   2  12.597  10.142   9.723
  112    H4*    A   2           H4*        A   2  13.521  11.693  11.418
  113    H3*    A   2           H3*        A   2  12.973   8.887  12.508
  114    H2*    A   2           H2*        A   2  14.263   9.762  14.458
  115   2HO*    A   2          H2**        A   2  14.922  11.886  14.441
  116    H1*    A   2           H1*        A   2  12.505  11.671  14.746
  117    H8     A   2           H8         A   2  10.415   9.140  12.880
  118   1H6     A   2          H61         A   2   9.452   6.419  18.349
  119   2H6     A   2          H62         A   2   9.024   6.419  16.652
  120    H2     A   2           H2         A   2  12.721   9.428  18.883
  121   1H5*    C   3          H5*         C   3  16.666  10.139  13.799
  122   2H5*    C   3          H5**        C   3  17.928   8.907  13.572
  123    H4*    C   3           H4*        C   3  17.806   9.634  15.933
  124    H3*    C   3           H3*        C   3  16.850   6.788  15.394
  125    H2*    C   3           H2*        C   3  16.870   6.570  17.863
  126   2HO*    C   3          H2**        C   3  17.366   8.371  19.085
  127    H1*    C   3           H1*        C   3  15.226   8.611  18.037
  128   1H4     C   3          H41         C   3  11.016   4.145  16.545
  129   2H4     C   3          H42         C   3  11.114   4.562  14.843
  130    H5     C   3           H5         C   3  12.646   6.305  14.039
  131    H6     C   3           H6         C   3  14.450   7.775  14.656
  132   1H5*    U   4          H5*         U   4  18.776   5.552  18.177
  133   2H5*    U   4          H5**        U   4  19.779   4.146  17.768
  134    H4*    U   4           H4*        U   4  17.929   3.457  19.220
  135    H3*    U   4           H3*        U   4  17.641   2.536  16.322
  136    H2*    U   4           H2*        U   4  15.891   1.079  17.234
  137   2HO*    U   4          H2**        U   4  16.223   0.552  19.267
  138    H1*    U   4           H1*        U   4  14.634   3.202  18.197
  139    H3     U   4           H3         U   4  12.741   2.528  14.083
  140    H5     U   4           H5         U   4  16.144   4.876  13.353
  141    H6     U   4           H6         U   4  16.785   4.575  15.622
  142   1H5*    A   5          H5*         A   5  18.465  -0.447  19.678
  143   2H5*    A   5          H5**        A   5  19.319  -1.854  19.001
  144    H4*    A   5           H4*        A   5  17.518  -2.566  20.501
  145    H3*    A   5           H3*        A   5  16.886  -3.109  17.553
  146    H2*    A   5           H2*        A   5  15.118  -4.519  18.559
  147   2HO*    A   5          H2**        A   5  15.457  -5.291  20.346
  148    H1*    A   5           H1*        A   5  14.287  -2.471  20.052
  149    H8     A   5           H8         A   5  15.749  -1.022  16.832
  150   1H6     A   5          H61         A   5  11.676  -1.038  14.179
  151   2H6     A   5          H62         A   5  10.117  -1.808  14.383
  152    H2     A   5           H2         A   5  10.142  -3.757  18.423
  153   1H5*    A   6          H5*         A   6  17.196  -6.715  20.201
  154   2H5*    A   6          H5**        A   6  17.685  -8.155  19.281
  155    H4*    A   6           H4*        A   6  15.552  -8.516  20.499
  156    H3*    A   6           H3*        A   6  15.294  -8.415  17.452
  157    H2*    A   6           H2*        A   6  12.982  -9.103  17.853
  158   2HO*    A   6          H2**        A   6  12.454 -10.024  19.505
  159    H1*    A   6           H1*        A   6  12.562  -7.049  19.437
  160    H8     A   6           H8         A   6  15.368  -6.101  16.984
  161   1H6     A   6          H61         A   6  12.475  -4.200  13.533
  162   2H6     A   6          H62         A   6  10.745  -4.311  13.271
  163    H2     A   6           H2         A   6   8.944  -6.327  16.806
  164   1H5*    C   7          H5*         C   7  13.331 -11.827  19.412
  165   2H5*    C   7          H5**        C   7  13.427 -13.292  18.409
  166    H4*    C   7           H4*        C   7  11.086 -12.767  19.030
  167    H3*    C   7           H3*        C   7  11.733 -12.387  16.066
  168    H2*    C   7           H2*        C   7   9.321 -12.099  15.815
  169   2HO*    C   7          H2**        C   7   8.046 -12.827  17.096
  170    H1*    C   7           H1*        C   7   9.269 -10.225  17.689
  171   1H4     C   7          H41         C   7  10.766  -6.850  12.536
  172   2H4     C   7          H42         C   7  12.447  -7.329  12.639
  173    H5     C   7           H5         C   7  13.271  -8.851  14.369
  174    H6     C   7           H6         C   7  12.636 -10.287  16.203
  175   1H5*    A   8          H5*         A   8   8.126 -14.743  16.838
  176   2H5*    A   8          H5**        A   8   8.001 -16.065  15.656
  177    H4*    A   8           H4*        A   8   5.959 -14.677  15.626
  178    H3*    A   8           H3*        A   8   7.742 -14.420  13.160
  179    H2*    A   8           H2*        A   8   5.903 -13.156  12.196
  180   2HO*    A   8          H2**        A   8   4.056 -13.405  12.777
  181    H1*    A   8           H1*        A   8   5.765 -11.551  14.300
  182    H8     A   8           H8         A   8   9.408 -12.696  13.858
  183   1H6     A   8          H61         A   8   9.987  -7.684  10.279
  184   2H6     A   8          H62         A   8  10.826  -9.080  10.923
  185    H2     A   8           H2         A   8   5.646  -8.192  11.208
  186   1H5*    C   9          H5*         C   9   3.582 -15.065  12.103
  187   2H5*    C   9          H5**        C   9   3.511 -16.261  10.789
  188    H4*    C   9           H4*        C   9   2.363 -14.207  10.097
  189    H3*    C   9           H3*        C   9   5.049 -14.713   8.726
  190    H2*    C   9           H2*        C   9   4.406 -12.876   7.278
  191   2HO*    C   9          H2**        C   9   2.526 -12.432   6.987
  192    H1*    C   9           H1*        C   9   3.942 -11.276   9.222
  193   1H4     C   9          H41         C   9  10.197 -10.430   8.790
  194   2H4     C   9          H42         C   9  10.528 -11.945   9.605
  195    H5     C   9           H5         C   9   8.761 -13.499  10.235
  196    H6     C   9           H6         C   9   6.376 -13.888  10.249
  197   1H5*    C  10          H5*         C  10   1.882 -14.144   5.798
  198   2H5*    C  10          H5**        C  10   2.222 -15.017   4.285
  199    H4*    C  10           H4*        C  10   2.034 -12.587   3.929
  200    H3*    C  10           H3*        C  10   4.881 -13.616   3.547
  201    H2*    C  10           H2*        C  10   5.279 -11.346   2.657
  202   2HO*    C  10          H2**        C  10   2.552 -10.878   3.270
  203    H1*    C  10           H1*        C  10   4.438 -10.305   4.886
  204   1H4     C  10          H41         C  10  10.436 -11.879   6.231
  205   2H4     C  10          H42         C  10   9.926 -13.427   6.874
  206    H5     C  10           H5         C  10   7.652 -14.262   6.574
  207    H6     C  10           H6         C  10   5.431 -13.719   5.795
  208    H3T    C  10           H3T        C  10   2.802 -13.092   1.714
  Start of MODEL    4
    1   1H5*    G   1          H5*         G   1  16.718  -8.626   1.198
    2   2H5*    G   1          H5**        G   1  17.077  -8.696  -0.542
    3    H4*    G   1           H4*        G   1  14.971  -7.579  -1.060
    4    H3*    G   1           H3*        G   1  14.458  -7.589   1.960
    5    H2*    G   1           H2*        G   1  12.087  -7.415   1.159
    6   2HO*    G   1          H2**        G   1  12.699  -6.244  -0.808
    7    H1*    G   1           H1*        G   1  12.448  -9.666  -0.194
    8    H8     G   1           H8         G   1  15.105 -10.012   2.459
    9    H1     G   1           H1         G   1   9.229 -11.398   4.588
   10   1H2     G   1          H21         G   1   7.714 -10.735   3.121
   11   2H2     G   1          H22         G   1   8.116 -10.002   1.577
   12    H5T    G   1           H5T        G   1  16.382  -6.275   0.545
   13   1H5*    G   2          H5*         G   2  11.931  -4.854  -0.057
   14   2H5*    G   2          H5**        G   2  11.714  -3.354   0.867
   15    H4*    G   2           H4*        G   2   9.558  -4.388   0.272
   16    H3*    G   2           H3*        G   2  10.185  -4.492   3.266
   17    H2*    G   2           H2*        G   2   7.790  -5.149   3.411
   18   2HO*    G   2          H2**        G   2   7.800  -4.970   0.591
   19    H1*    G   2           H1*        G   2   8.258  -7.177   1.815
   20    H8     G   2           H8         G   2  11.711  -6.669   3.195
   21    H1     G   2           H1         G   2   7.828  -9.726   7.249
   22   1H2     G   2          H21         G   2   5.583  -9.537   6.454
   23   2H2     G   2          H22         G   2   5.257  -8.662   4.983
   24   1H5*    U   3          H5*         U   3   6.339  -2.945   2.560
   25   2H5*    U   3          H5**        U   3   6.015  -1.522   3.578
   26    H4*    U   3           H4*        U   3   4.269  -3.227   3.876
   27    H3*    U   3           H3*        U   3   6.107  -2.929   6.300
   28    H2*    U   3           H2*        U   3   4.346  -4.296   7.407
   29   2HO*    U   3          H2**        U   3   2.648  -5.050   6.165
   30    H1*    U   3           H1*        U   3   4.711  -6.182   5.586
   31    H3     U   3           H3         U   3   7.533  -7.352   9.022
   32    H5     U   3           H5         U   3   9.801  -4.907   6.496
   33    H6     U   3           H6         U   3   7.823  -4.374   5.295
   34   1H5*    G   4          H5*         G   4   2.136  -2.674   7.498
   35   2H5*    G   4          H5**        G   4   1.890  -1.331   8.638
   36    H4*    G   4           H4*        G   4   1.068  -3.443   9.588
   37    H3*    G   4           H3*        G   4   3.606  -2.388  10.930
   38    H2*    G   4           H2*        G   4   3.076  -4.119  12.614
   39   2HO*    G   4          H2**        G   4   0.762  -3.929  12.345
   40    H1*    G   4           H1*        G   4   3.042  -5.967  10.743
   41    H8     G   4           H8         G   4   5.364  -3.542   9.115
   42    H1     G   4           H1         G   4   8.197  -7.007  13.684
   43   1H2     G   4          H21         G   4   6.506  -8.055  15.000
   44   2H2     G   4          H22         G   4   4.838  -7.937  14.511
   45   1H5*    U   5          H5*         U   5   0.802  -3.172  13.969
   46   2H5*    U   5          H5**        U   5   0.762  -1.839  15.145
   47    H4*    U   5           H4*        U   5   1.328  -3.966  16.255
   48    H3*    U   5           H3*        U   5   3.625  -1.954  16.077
   49    H2*    U   5           H2*        U   5   4.779  -3.510  17.626
   50   2HO*    U   5          H2**        U   5   2.758  -4.176  18.644
   51    H1*    U   5           H1*        U   5   4.386  -5.518  15.921
   52    H3     U   5           H3         U   5   8.560  -4.085  14.800
   53    H5     U   5           H5         U   5   5.952  -1.740  12.495
   54    H6     U   5           H6         U   5   4.129  -2.636  13.737
   55   1H5*    A   6          H5*         A   6   3.592  -3.255  19.883
   56   2H5*    A   6          H5**        A   6   3.296  -1.957  21.061
   57    H4*    A   6           H4*        A   6   5.302  -3.296  21.639
   58    H3*    A   6           H3*        A   6   5.836  -0.413  20.771
   59    H2*    A   6           H2*        A   6   8.134  -0.870  21.577
   60   2HO*    A   6          H2**        A   6   8.630  -2.913  22.315
   61    H1*    A   6           H1*        A   6   8.297  -2.881  19.862
   62    H8     A   6           H8         A   6   5.650  -1.098  18.016
   63   1H6     A   6          H61         A   6   8.336   2.194  15.689
   64   2H6     A   6          H62         A   6  10.008   2.695  15.808
   65    H2     A   6           H2         A   6  11.802   0.379  19.210
   66   1H5*    G   7          H5*         G   7   7.959  -1.271  24.257
   67   2H5*    G   7          H5**        G   7   7.693  -0.022  25.494
   68    H4*    G   7           H4*        G   7  10.105  -0.372  25.103
   69    H3*    G   7           H3*        G   7   9.004   2.294  24.086
   70    H2*    G   7           H2*        G   7  11.354   2.874  23.747
   71   2HO*    G   7          H2**        G   7  12.728   2.076  24.892
   72    H1*    G   7           H1*        G   7  11.765   0.700  22.316
   73    H8     G   7           H8         G   7   8.131   1.321  21.592
   74    H1     G   7           H1         G   7  12.020   5.357  18.511
   75   1H2     G   7          H21         G   7  14.195   5.202  19.487
   76   2H2     G   7          H22         G   7  14.516   4.006  20.713
   77   1H5*    U   8          H5*         U   8  12.442   2.710  26.805
   78   2H5*    U   8          H5**        U   8  12.199   4.089  27.903
   79    H4*    U   8           H4*        U   8  14.358   4.257  26.727
   80    H3*    U   8           H3*        U   8  12.295   6.335  25.841
   81    H2*    U   8           H2*        U   8  14.263   7.346  24.681
   82   2HO*    U   8          H2**        U   8  16.213   6.271  24.772
   83    H1*    U   8           H1*        U   8  14.632   5.085  23.376
   84    H3     U   8           H3         U   8  11.899   7.434  20.523
   85    H5     U   8           H5         U   8   9.312   5.355  23.064
   86    H6     U   8           H6         U   8  11.182   4.746  24.412
   87   1H5*    A   9          H5*         A   9  15.627   8.183  26.539
   88   2H5*    A   9          H5**        A   9  15.662   9.548  27.671
   89    H4*    A   9           H4*        A   9  16.713   9.979  25.435
   90    H3*    A   9           H3*        A   9  15.498  12.006  26.672
   91    H2*    A   9           H2*        A   9  13.289  11.009  26.053
   92   2HO*    A   9          H2**        A   9  12.816  12.629  24.121
   93    H1*    A   9           H1*        A   9  14.395  11.293  23.243
   94    H8     A   9           H8         A   9  12.451   8.377  24.911
   95   1H6     A   9          H61         A   9   7.986   9.689  20.809
   96   2H6     A   9          H62         A   9   8.467   8.611  22.102
   97    H2     A   9           H2         A   9  11.175  12.797  20.414
   98    H3T    A   9           H3T        A   9  15.802  13.263  24.814
   99   1H5*    U   1          H5*         U   1   5.313  16.986  14.294
  100   2H5*    U   1          H5**        U   1   5.879  16.077  12.880
  101    H4*    U   1           H4*        U   1   7.750  16.858  14.300
  102    H3*    U   1           H3*        U   1   7.395  13.817  14.400
  103    H2*    U   1           H2*        U   1   9.641  13.961  15.428
  104   2HO*    U   1          H2**        U   1  10.825  15.472  15.086
  105    H1*    U   1           H1*        U   1   8.745  15.769  17.181
  106    H3     U   1           H3         U   1   8.981  11.812  19.432
  107    H5     U   1           H5         U   1   5.314  11.645  17.412
  108    H6     U   1           H6         U   1   5.906  13.663  16.260
  109    H5T    U   1           H5T        U   1   4.117  15.075  13.928
  110   1H5*    A   2          H5*         A   2  11.328  15.267  13.158
  111   2H5*    A   2          H5**        A   2  12.084  14.169  11.983
  112    H4*    A   2           H4*        A   2  13.574  14.616  13.897
  113    H3*    A   2           H3*        A   2  12.510  11.748  13.827
  114    H2*    A   2           H2*        A   2  14.273  11.409  15.561
  115   2HO*    A   2          H2**        A   2  15.695  13.051  14.684
  116    H1*    A   2           H1*        A   2  13.152  13.278  17.034
  117    H8     A   2           H8         A   2  10.219  12.129  14.921
  118   1H6     A   2          H61         A   2   9.376   7.769  19.226
  119   2H6     A   2          H62         A   2   8.725   8.478  17.761
  120    H2     A   2           H2         A   2  13.336   9.683  19.998
  121   1H5*    C   3          H5*         C   3  16.686  11.507  14.342
  122   2H5*    C   3          H5**        C   3  17.348  10.264  13.256
  123    H4*    C   3           H4*        C   3  17.910   9.760  15.604
  124    H3*    C   3           H3*        C   3  15.845   7.877  14.364
  125    H2*    C   3           H2*        C   3  16.197   6.544  16.382
  126   2HO*    C   3          H2**        C   3  17.892   6.623  17.346
  127    H1*    C   3           H1*        C   3  15.683   8.630  17.928
  128   1H4     C   3          H41         C   3   9.977   6.226  16.564
  129   2H4     C   3          H42         C   3   9.817   7.269  15.164
  130    H5     C   3           H5         C   3  11.640   8.756  14.445
  131    H6     C   3           H6         C   3  13.915   9.433  14.873
  132   1H5*    U   4          H5*         U   4  19.230   5.908  16.167
  133   2H5*    U   4          H5**        U   4  19.796   4.543  15.178
  134    H4*    U   4           H4*        U   4  19.384   3.851  17.518
  135    H3*    U   4           H3*        U   4  17.402   2.716  15.484
  136    H2*    U   4           H2*        U   4  16.664   1.319  17.346
  137   2HO*    U   4          H2**        U   4  17.863   0.928  18.873
  138    H1*    U   4           H1*        U   4  16.313   3.438  18.894
  139    H3     U   4           H3         U   4  12.200   2.254  17.271
  140    H5     U   4           H5         U   4  13.802   4.879  14.427
  141    H6     U   4           H6         U   4  15.894   4.776  15.566
  142   1H5*    A   5          H5*         A   5  19.356   0.028  18.214
  143   2H5*    A   5          H5**        A   5  19.865  -1.508  17.481
  144    H4*    A   5           H4*        A   5  18.565  -1.866  19.567
  145    H3*    A   5           H3*        A   5  17.185  -2.762  16.988
  146    H2*    A   5           H2*        A   5  15.553  -3.779  18.488
  147   2HO*    A   5          H2**        A   5  16.042  -4.318  20.299
  148    H1*    A   5           H1*        A   5  15.178  -1.500  19.790
  149    H8     A   5           H8         A   5  16.084  -0.359  16.298
  150   1H6     A   5          H61         A   5  10.179  -1.488  14.786
  151   2H6     A   5          H62         A   5  11.676  -0.744  14.273
  152    H2     A   5           H2         A   5  10.900  -3.184  18.869
  153   1H5*    A   6          H5*         A   6  17.322  -5.791  20.112
  154   2H5*    A   6          H5**        A   6  17.575  -7.424  19.456
  155    H4*    A   6           H4*        A   6  15.493  -7.296  20.799
  156    H3*    A   6           H3*        A   6  15.096  -7.689  17.795
  157    H2*    A   6           H2*        A   6  12.741  -8.000  18.344
  158   2HO*    A   6          H2**        A   6  12.162  -8.579  20.125
  159    H1*    A   6           H1*        A   6  12.632  -5.682  19.564
  160    H8     A   6           H8         A   6  15.442  -5.314  17.006
  161   1H6     A   6          H61         A   6  12.667  -3.977  13.214
  162   2H6     A   6          H62         A   6  10.940  -4.062  12.934
  163    H2     A   6           H2         A   6   9.017  -5.427  16.717
  164   1H5*    C   7          H5*         C   7  12.824 -10.400  20.324
  165   2H5*    C   7          H5**        C   7  12.784 -12.041  19.641
  166    H4*    C   7           H4*        C   7  10.509 -11.225  20.123
  167    H3*    C   7           H3*        C   7  11.136 -11.446  17.139
  168    H2*    C   7           H2*        C   7   8.690 -11.114  16.903
  169   2HO*    C   7          H2**        C   7   7.480 -10.743  18.752
  170    H1*    C   7           H1*        C   7   8.868  -8.854  18.258
  171   1H4     C   7          H41         C   7  10.786  -6.795  12.582
  172   2H4     C   7          H42         C   7  12.424  -7.345  12.868
  173    H5     C   7           H5         C   7  13.066  -8.473  14.942
  174    H6     C   7           H6         C   7  12.252  -9.438  16.998
  175   1H5*    A   8          H5*         A   8   7.447 -13.320  17.856
  176   2H5*    A   8          H5**        A   8   7.404 -14.873  16.990
  177    H4*    A   8           H4*        A   8   5.507 -13.474  16.305
  178    H3*    A   8           H3*        A   8   7.676 -13.740  14.168
  179    H2*    A   8           H2*        A   8   5.987 -12.754  12.700
  180   2HO*    A   8          H2**        A   8   4.074 -12.985  13.074
  181    H1*    A   8           H1*        A   8   5.577 -10.745  14.401
  182    H8     A   8           H8         A   8   9.237 -11.677  14.832
  183   1H6     A   8          H61         A   8  10.284  -7.940   9.998
  184   2H6     A   8          H62         A   8  11.040  -8.932  11.228
  185    H2     A   8           H2         A   8   5.864  -8.516  10.348
  186   1H5*    C   9          H5*         C   9   3.631 -14.841  12.978
  187   2H5*    C   9          H5**        C   9   3.662 -16.294  11.954
  188    H4*    C   9           H4*        C   9   2.402 -14.511  10.843
  189    H3*    C   9           H3*        C   9   5.122 -15.132   9.582
  190    H2*    C   9           H2*        C   9   4.343 -13.656   7.796
  191   2HO*    C   9          H2**        C   9   2.209 -14.307   7.846
  192    H1*    C   9           H1*        C   9   3.817 -11.729   9.376
  193   1H4     C   9          H41         C   9  10.037 -10.743   8.746
  194   2H4     C   9          H42         C   9  10.415 -11.977   9.931
  195    H5     C   9           H5         C   9   8.707 -13.422  10.892
  196    H6     C   9           H6         C   9   6.342 -13.910  10.975
  197   1H5*    C  10          H5*         C  10   2.003 -15.829   6.561
  198   2H5*    C  10          H5**        C  10   2.539 -16.975   5.312
  199    H4*    C  10           H4*        C  10   2.195 -14.692   4.422
  200    H3*    C  10           H3*        C  10   5.130 -15.531   4.431
  201    H2*    C  10           H2*        C  10   5.420 -13.457   3.101
  202   2HO*    C  10          H2**        C  10   2.631 -13.116   3.464
  203    H1*    C  10           H1*        C  10   4.370 -12.068   5.025
  204   1H4     C  10          H41         C  10  10.371 -12.957   6.901
  205   2H4     C  10          H42         C  10   9.895 -14.325   7.891
  206    H5     C  10           H5         C  10   7.663 -15.307   7.734
  207    H6     C  10           H6         C  10   5.463 -15.076   6.758
  208    H3T    C  10           H3T        C  10   3.174 -15.570   2.400
  Start of MODEL    5
    1   1H5*    G   1          H5*         G   1  16.545  -6.468  -0.828
    2   2H5*    G   1          H5**        G   1  16.888  -5.147   0.307
    3    H4*    G   1           H4*        G   1  14.547  -5.106  -0.508
    4    H3*    G   1           H3*        G   1  14.753  -5.848   2.458
    5    H2*    G   1           H2*        G   1  12.328  -5.403   2.377
    6   2HO*    G   1          H2**        G   1  11.536  -4.250   1.006
    7    H1*    G   1           H1*        G   1  12.064  -7.063   0.292
    8    H8     G   1           H8         G   1  14.925  -8.408   2.418
    9    H1     G   1           H1         G   1   9.097  -9.818   4.675
   10   1H2     G   1          H21         G   1   7.561  -8.664   3.571
   11   2H2     G   1          H22         G   1   7.943  -7.551   2.269
   12    H5T    G   1           H5T        G   1  16.593  -6.646   2.008
   13   1H5*    G   2          H5*         G   2  12.208  -2.507   1.418
   14   2H5*    G   2          H5**        G   2  12.215  -1.222   2.645
   15    H4*    G   2           H4*        G   2   9.915  -1.955   2.094
   16    H3*    G   2           H3*        G   2  10.828  -2.716   4.913
   17    H2*    G   2           H2*        G   2   8.457  -3.302   5.213
   18   2HO*    G   2          H2**        G   2   7.058  -2.484   4.103
   19    H1*    G   2           H1*        G   2   8.504  -4.878   3.122
   20    H8     G   2           H8         G   2  12.079  -4.970   4.399
   21    H1     G   2           H1         G   2   8.069  -8.736   7.665
   22   1H2     G   2          H21         G   2   5.831  -8.230   7.007
   23   2H2     G   2          H22         G   2   5.540  -6.969   5.842
   24   1H5*    U   3          H5*         U   3   7.042  -0.565   4.523
   25   2H5*    U   3          H5**        U   3   6.768   0.586   5.849
   26    H4*    U   3           H4*        U   3   4.856  -0.953   5.582
   27    H3*    U   3           H3*        U   3   6.461  -1.395   8.147
   28    H2*    U   3           H2*        U   3   4.524  -2.837   8.748
   29   2HO*    U   3          H2**        U   3   3.009  -1.533   7.473
   30    H1*    U   3           H1*        U   3   4.939  -4.275   6.578
   31    H3     U   3           H3         U   3   7.477  -6.547   9.662
   32    H5     U   3           H5         U   3   9.986  -3.555   8.175
   33    H6     U   3           H6         U   3   8.127  -2.600   7.047
   34   1H5*    G   4          H5*         G   4   2.453  -1.150   9.198
   35   2H5*    G   4          H5**        G   4   2.220  -0.116  10.624
   36    H4*    G   4           H4*        G   4   1.319  -2.378  11.019
   37    H3*    G   4           H3*        G   4   3.834  -1.691  12.620
   38    H2*    G   4           H2*        G   4   3.355  -3.783  13.816
   39   2HO*    G   4          H2**        G   4   1.573  -4.994  13.240
   40    H1*    G   4           H1*        G   4   3.279  -5.137  11.570
   41    H8     G   4           H8         G   4   5.620  -2.427  10.517
   42    H1     G   4           H1         G   4   8.437  -6.978  14.015
   43   1H2     G   4          H21         G   4   6.738  -8.272  15.084
   44   2H2     G   4          H22         G   4   5.064  -7.984  14.694
   45   1H5*    U   5          H5*         U   5   1.045  -3.419  15.232
   46   2H5*    U   5          H5**        U   5   0.920  -2.443  16.716
   47    H4*    U   5           H4*        U   5   1.609  -4.727  17.286
   48    H3*    U   5           H3*        U   5   3.801  -2.619  17.552
   49    H2*    U   5           H2*        U   5   5.050  -4.379  18.746
   50   2HO*    U   5          H2**        U   5   3.117  -5.381  19.619
   51    H1*    U   5           H1*        U   5   4.756  -5.985  16.635
   52    H3     U   5           H3         U   5   8.796  -4.203  15.638
   53    H5     U   5           H5         U   5   6.044  -1.334  14.296
   54    H6     U   5           H6         U   5   4.310  -2.592  15.324
   55   1H5*    A   6          H5*         A   6   3.853  -3.878  21.303
   56   2H5*    A   6          H5**        A   6   3.601  -2.531  22.433
   57    H4*    A   6           H4*        A   6   5.724  -3.640  22.902
   58    H3*    A   6           H3*        A   6   6.078  -0.890  21.609
   59    H2*    A   6           H2*        A   6   8.431  -1.202  22.397
   60   2HO*    A   6          H2**        A   6   7.823  -2.495  24.247
   61    H1*    A   6           H1*        A   6   8.515  -3.437  20.952
   62    H8     A   6           H8         A   6   5.841  -1.924  18.923
   63   1H6     A   6          H61         A   6   8.527   0.989  16.093
   64   2H6     A   6          H62         A   6  10.212   1.459  16.119
   65    H2     A   6           H2         A   6  12.021  -0.325  19.805
   66   1H5*    G   7          H5*         G   7   8.235  -1.012  25.274
   67   2H5*    G   7          H5**        G   7   7.848   0.448  26.212
   68    H4*    G   7           H4*        G   7  10.272   0.147  26.033
   69    H3*    G   7           H3*        G   7   9.203   2.494  24.386
   70    H2*    G   7           H2*        G   7  11.614   3.085  24.233
   71   2HO*    G   7          H2**        G   7  12.050   0.732  25.736
   72    H1*    G   7           H1*        G   7  12.098   0.701  23.192
   73    H8     G   7           H8         G   7   8.530   0.893  22.155
   74    H1     G   7           H1         G   7  12.309   4.539  18.514
   75   1H2     G   7          H21         G   7  14.400   4.827  19.634
   76   2H2     G   7          H22         G   7  14.736   3.916  21.082
   77   1H5*    U   8          H5*         U   8  12.284   3.931  26.943
   78   2H5*    U   8          H5**        U   8  11.797   5.473  27.684
   79    H4*    U   8           H4*        U   8  13.932   5.711  26.480
   80    H3*    U   8           H3*        U   8  11.584   7.134  25.132
   81    H2*    U   8           H2*        U   8  13.387   8.151  23.751
   82   2HO*    U   8          H2**        U   8  15.251   8.222  24.457
   83    H1*    U   8           H1*        U   8  14.219   5.744  23.058
   84    H3     U   8           H3         U   8  11.330   7.004  19.720
   85    H5     U   8           H5         U   8   8.958   5.036  22.551
   86    H6     U   8           H6         U   8  10.819   5.025  24.044
   87   1H5*    A   9          H5*         A   9  14.635   9.576  25.553
   88   2H5*    A   9          H5**        A   9  14.417  11.162  26.315
   89    H4*    A   9           H4*        A   9  15.623  11.179  24.114
   90    H3*    A   9           H3*        A   9  14.102  13.275  24.741
   91    H2*    A   9           H2*        A   9  12.071  11.901  24.257
   92   2HO*    A   9          H2**        A   9  11.615  12.955  21.955
   93    H1*    A   9           H1*        A   9  13.378  11.655  21.533
   94    H8     A   9           H8         A   9  11.552   9.031  23.759
   95   1H6     A   9          H61         A   9   7.424   8.778  19.139
   96   2H6     A   9          H62         A   9   7.888   8.092  20.681
   97    H2     A   9           H2         A   9  10.372  11.996  18.171
   98    H3T    A   9           H3T        A   9  14.428  14.087  22.649
   99   1H5*    U   1          H5*         U   1   4.768  13.836  10.760
  100   2H5*    U   1          H5**        U   1   5.518  12.620   9.708
  101    H4*    U   1           H4*        U   1   7.197  13.949  10.951
  102    H3*    U   1           H3*        U   1   7.063  11.043  11.912
  103    H2*    U   1           H2*        U   1   9.197  11.695  12.986
  104   2HO*    U   1          H2**        U   1  10.279  13.161  12.297
  105    H1*    U   1           H1*        U   1   8.009  13.811  14.097
  106    H3     U   1           H3         U   1   8.360  10.605  17.334
  107    H5     U   1           H5         U   1   4.852   9.635  15.261
  108    H6     U   1           H6         U   1   5.396  11.315  13.640
  109    H5T    U   1           H5T        U   1   5.084  11.070  11.329
  110   1H5*    A   2          H5*         A   2  10.942  12.460  10.551
  111   2H5*    A   2          H5**        A   2  11.901  11.170   9.796
  112    H4*    A   2           H4*        A   2  13.155  12.307  11.591
  113    H3*    A   2           H3*        A   2  12.380   9.430  12.283
  114    H2*    A   2           H2*        A   2  13.979   9.803  14.161
  115   2HO*    A   2          H2**        A   2  14.896  11.823  14.393
  116    H1*    A   2           H1*        A   2  12.533  11.844  14.959
  117    H8     A   2           H8         A   2   9.953   9.856  13.027
  118   1H6     A   2          H61         A   2   9.112   6.618  18.230
  119   2H6     A   2          H62         A   2   8.557   6.867  16.589
  120    H2     A   2           H2         A   2  12.787   9.120  18.762
  121   1H5*    C   3          H5*         C   3  16.446  10.001  13.106
  122   2H5*    C   3          H5**        C   3  17.408   8.634  12.500
  123    H4*    C   3           H4*        C   3  17.799   8.971  14.902
  124    H3*    C   3           H3*        C   3  16.183   6.457  14.265
  125    H2*    C   3           H2*        C   3  16.683   5.906  16.640
  126   2HO*    C   3          H2**        C   3  18.732   7.054  16.651
  127    H1*    C   3           H1*        C   3  15.525   8.178  17.366
  128   1H4     C   3          H41         C   3  10.415   4.558  16.336
  129   2H4     C   3          H42         C   3  10.319   5.094  14.670
  130    H5     C   3           H5         C   3  11.990   6.601  13.700
  131    H6     C   3           H6         C   3  14.075   7.740  14.087
  132   1H5*    U   4          H5*         U   4  19.308   5.301  16.728
  133   2H5*    U   4          H5**        U   4  20.107   3.865  16.052
  134    H4*    U   4           H4*        U   4  19.402   3.452  18.362
  135    H3*    U   4           H3*        U   4  17.718   1.943  16.301
  136    H2*    U   4           H2*        U   4  16.962   0.700  18.285
  137   2HO*    U   4          H2**        U   4  18.712   2.379  19.750
  138    H1*    U   4           H1*        U   4  16.303   2.976  19.487
  139    H3     U   4           H3         U   4  12.441   1.223  17.726
  140    H5     U   4           H5         U   4  14.086   3.583  14.685
  141    H6     U   4           H6         U   4  16.063   3.832  15.990
  142   1H5*    A   5          H5*         A   5  19.266  -0.564  19.217
  143   2H5*    A   5          H5**        A   5  19.906  -2.084  18.552
  144    H4*    A   5           H4*        A   5  18.246  -2.525  20.319
  145    H3*    A   5           H3*        A   5  17.296  -3.235  17.499
  146    H2*    A   5           H2*        A   5  15.454  -4.339  18.698
  147   2HO*    A   5          H2**        A   5  15.831  -5.054  20.501
  148    H1*    A   5           H1*        A   5  14.927  -2.124  20.078
  149    H8     A   5           H8         A   5  16.275  -0.730  16.839
  150   1H6     A   5          H61         A   5  12.112  -0.777  14.262
  151   2H6     A   5          H62         A   5  10.548  -1.508  14.571
  152    H2     A   5           H2         A   5  10.744  -3.585  18.497
  153   1H5*    A   6          H5*         A   6  17.398  -6.613  20.469
  154   2H5*    A   6          H5**        A   6  17.771  -8.158  19.671
  155    H4*    A   6           H4*        A   6  15.633  -8.275  20.932
  156    H3*    A   6           H3*        A   6  15.378  -8.390  17.888
  157    H2*    A   6           H2*        A   6  13.025  -8.843  18.280
  158   2HO*    A   6          H2**        A   6  12.372  -9.604  19.961
  159    H1*    A   6           H1*        A   6  12.753  -6.683  19.748
  160    H8     A   6           H8         A   6  15.625  -6.042  17.279
  161   1H6     A   6          H61         A   6  12.860  -4.161  13.690
  162   2H6     A   6          H62         A   6  11.138  -4.304  13.380
  163    H2     A   6           H2         A   6   9.208  -5.972  17.020
  164   1H5*    C   7          H5*         C   7  13.042 -11.431  19.984
  165   2H5*    C   7          H5**        C   7  13.077 -12.969  19.096
  166    H4*    C   7           H4*        C   7  10.752 -12.235  19.520
  167    H3*    C   7           H3*        C   7  11.607 -12.076  16.588
  168    H2*    C   7           H2*        C   7   9.232 -11.691  16.175
  169   2HO*    C   7          H2**        C   7   7.848 -12.293  17.405
  170    H1*    C   7           H1*        C   7   9.164  -9.723  17.970
  171   1H4     C   7          H41         C   7  10.934  -6.734  12.668
  172   2H4     C   7          H42         C   7  12.596  -7.255  12.855
  173    H5     C   7           H5         C   7  13.318  -8.662  14.730
  174    H6     C   7           H6         C   7  12.574  -9.956  16.628
  175   1H5*    A   8          H5*         A   8   7.861 -14.207  17.196
  176   2H5*    A   8          H5**        A   8   7.760 -15.585  16.078
  177    H4*    A   8           H4*        A   8   5.801 -14.110  15.815
  178    H3*    A   8           H3*        A   8   7.768 -14.034  13.475
  179    H2*    A   8           H2*        A   8   6.016 -12.782  12.335
  180   2HO*    A   8          H2**        A   8   4.131 -12.976  12.810
  181    H1*    A   8           H1*        A   8   5.786 -11.080  14.359
  182    H8     A   8           H8         A   8   9.437 -12.234  14.214
  183   1H6     A   8          H61         A   8  10.233  -7.518  10.291
  184   2H6     A   8          H62         A   8  11.029  -8.866  11.079
  185    H2     A   8           H2         A   8   5.841  -7.995  10.960
  186   1H5*    C   9          H5*         C   9   3.604 -14.706  12.358
  187   2H5*    C   9          H5**        C   9   3.517 -15.956  11.098
  188    H4*    C   9           H4*        C   9   2.344 -13.932  10.354
  189    H3*    C   9           H3*        C   9   4.988 -14.501   8.923
  190    H2*    C   9           H2*        C   9   4.302 -12.711   7.427
  191   2HO*    C   9          H2**        C   9   2.406 -12.306   7.177
  192    H1*    C   9           H1*        C   9   3.902 -11.035   9.329
  193   1H4     C   9          H41         C   9  10.168 -10.242   8.784
  194   2H4     C   9          H42         C   9  10.491 -11.731   9.647
  195    H5     C   9           H5         C   9   8.723 -13.241  10.353
  196    H6     C   9           H6         C   9   6.339 -13.615  10.406
  197   1H5*    C  10          H5*         C  10   1.668 -14.097   6.050
  198   2H5*    C  10          H5**        C  10   1.983 -15.028   4.567
  199    H4*    C  10           H4*        C  10   1.770 -12.610   4.119
  200    H3*    C  10           H3*        C  10   4.604 -13.663   3.701
  201    H2*    C  10           H2*        C  10   5.021 -11.428   2.748
  202   2HO*    C  10          H2**        C  10   2.314 -10.893   3.397
  203    H1*    C  10           H1*        C  10   4.224 -10.305   4.959
  204   1H4     C  10          H41         C  10  10.177 -11.945   6.420
  205   2H4     C  10          H42         C  10   9.648 -13.503   7.024
  206    H5     C  10           H5         C  10   7.387 -14.330   6.634
  207    H6     C  10           H6         C  10   5.180 -13.756   5.835
  208    H3T    C  10           H3T        C  10   2.949 -14.590   2.434
  Start of MODEL    6
    1   1H5*    G   1          H5*         G   1  17.108  -4.751   1.423
    2   2H5*    G   1          H5**        G   1  16.964  -6.417   2.017
    3    H4*    G   1           H4*        G   1  14.862  -4.949   0.388
    4    H3*    G   1           H3*        G   1  14.855  -5.700   3.358
    5    H2*    G   1           H2*        G   1  12.412  -5.487   3.028
    6   2HO*    G   1          H2**        G   1  11.669  -4.379   1.592
    7    H1*    G   1           H1*        G   1  12.531  -7.136   0.922
    8    H8     G   1           H8         G   1  15.261  -8.262   3.321
    9    H1     G   1           H1         G   1   9.379 -10.214   4.948
   10   1H2     G   1          H21         G   1   7.869  -9.175   3.705
   11   2H2     G   1          H22         G   1   8.283  -8.005   2.464
   12    H5T    G   1           H5T        G   1  16.788  -7.089  -0.155
   13   1H5*    G   2          H5*         G   2  12.141  -2.561   2.018
   14   2H5*    G   2          H5**        G   2  11.929  -1.285   3.237
   15    H4*    G   2           H4*        G   2   9.753  -2.157   2.443
   16    H3*    G   2           H3*        G   2  10.424  -2.867   5.341
   17    H2*    G   2           H2*        G   2   8.095  -3.636   5.418
   18   2HO*    G   2          H2**        G   2   6.745  -2.902   4.189
   19    H1*    G   2           H1*        G   2   8.456  -5.190   3.329
   20    H8     G   2           H8         G   2  11.891  -4.981   4.938
   21    H1     G   2           H1         G   2   7.994  -9.202   7.748
   22   1H2     G   2          H21         G   2   5.784  -8.888   6.902
   23   2H2     G   2          H22         G   2   5.476  -7.641   5.725
   24   1H5*    U   3          H5*         U   3   6.531  -0.986   4.562
   25   2H5*    U   3          H5**        U   3   6.087   0.158   5.851
   26    H4*    U   3           H4*        U   3   4.289  -1.483   5.466
   27    H3*    U   3           H3*        U   3   5.756  -1.815   8.128
   28    H2*    U   3           H2*        U   3   3.905  -3.373   8.649
   29   2HO*    U   3          H2**        U   3   2.978  -2.781   6.045
   30    H1*    U   3           H1*        U   3   4.482  -4.787   6.491
   31    H3     U   3           H3         U   3   6.975  -6.997   9.628
   32    H5     U   3           H5         U   3   9.358  -3.764   8.470
   33    H6     U   3           H6         U   3   7.522  -2.900   7.225
   34   1H5*    G   4          H5*         G   4   1.753  -1.753   9.133
   35   2H5*    G   4          H5**        G   4   1.476  -0.703  10.540
   36    H4*    G   4           H4*        G   4   0.733  -3.000  11.008
   37    H3*    G   4           H3*        G   4   3.251  -2.158  12.530
   38    H2*    G   4           H2*        G   4   2.880  -4.254  13.773
   39   2HO*    G   4          H2**        G   4   1.150  -5.542  13.274
   40    H1*    G   4           H1*        G   4   2.852  -5.633  11.546
   41    H8     G   4           H8         G   4   5.026  -2.814  10.431
   42    H1     G   4           H1         G   4   8.112  -7.124  14.006
   43   1H2     G   4          H21         G   4   6.493  -8.512  15.084
   44   2H2     G   4          H22         G   4   4.803  -8.307  14.716
   45   1H5*    U   5          H5*         U   5   0.748  -3.992  15.263
   46   2H5*    U   5          H5**        U   5   0.595  -2.996  16.729
   47    H4*    U   5           H4*        U   5   1.450  -5.217  17.314
   48    H3*    U   5           H3*        U   5   3.510  -2.970  17.506
   49    H2*    U   5           H2*        U   5   4.905  -4.627  18.673
   50   2HO*    U   5          H2**        U   5   2.725  -6.389  18.249
   51    H1*    U   5           H1*        U   5   4.650  -6.288  16.594
   52    H3     U   5           H3         U   5   8.572  -4.159  15.693
   53    H5     U   5           H5         U   5   5.609  -1.676  14.071
   54    H6     U   5           H6         U   5   3.966  -3.034  15.118
   55   1H5*    A   6          H5*         A   6   3.940  -4.161  21.150
   56   2H5*    A   6          H5**        A   6   3.617  -2.858  22.321
   57    H4*    A   6           H4*        A   6   5.919  -3.679  22.573
   58    H3*    A   6           H3*        A   6   5.729  -0.905  21.294
   59    H2*    A   6           H2*        A   6   8.137  -0.833  21.770
   60   2HO*    A   6          H2**        A   6   8.852  -1.842  23.285
   61    H1*    A   6           H1*        A   6   8.440  -3.216  20.520
   62    H8     A   6           H8         A   6   5.661  -1.816  18.504
   63   1H6     A   6          H61         A   6   8.258   1.121  15.586
   64   2H6     A   6          H62         A   6   9.900   1.723  15.659
   65    H2     A   6           H2         A   6  11.816  -0.086  19.278
   66   1H5*    G   7          H5*         G   7   8.163  -1.019  24.866
   67   2H5*    G   7          H5**        G   7   7.785   0.389  25.884
   68    H4*    G   7           H4*        G   7  10.211   0.214  25.527
   69    H3*    G   7           H3*        G   7   8.898   2.536  24.029
   70    H2*    G   7           H2*        G   7  11.209   3.268  23.689
   71   2HO*    G   7          H2**        G   7  12.581   2.801  25.017
   72    H1*    G   7           H1*        G   7  11.865   0.882  22.709
   73    H8     G   7           H8         G   7   8.283   1.178  21.621
   74    H1     G   7           H1         G   7  12.237   4.890  18.233
   75   1H2     G   7          H21         G   7  14.318   5.037  19.397
   76   2H2     G   7          H22         G   7  14.603   4.018  20.782
   77   1H5*    U   8          H5*         U   8  12.129   3.706  26.764
   78   2H5*    U   8          H5**        U   8  11.718   5.222  27.599
   79    H4*    U   8           H4*        U   8  13.938   5.362  26.543
   80    H3*    U   8           H3*        U   8  11.816   7.103  25.191
   81    H2*    U   8           H2*        U   8  13.811   8.066  24.024
   82   2HO*    U   8          H2**        U   8  15.808   7.174  24.434
   83    H1*    U   8           H1*        U   8  14.432   5.654  23.147
   84    H3     U   8           H3         U   8  11.839   7.321  19.744
   85    H5     U   8           H5         U   8   9.145   5.530  22.389
   86    H6     U   8           H6         U   8  10.923   5.257  23.960
   87   1H5*    A   9          H5*         A   9  14.938   9.292  25.879
   88   2H5*    A   9          H5**        A   9  14.783  10.804  26.793
   89    H4*    A   9           H4*        A   9  16.023  10.983  24.621
   90    H3*    A   9           H3*        A   9  14.572  13.073  25.426
   91    H2*    A   9           H2*        A   9  12.499  11.839  24.762
   92   2HO*    A   9          H2**        A   9  12.133  13.127  22.575
   93    H1*    A   9           H1*        A   9  13.874  11.791  22.059
   94    H8     A   9           H8         A   9  11.945   9.003  23.940
   95   1H6     A   9          H61         A   9   7.827   9.444  19.323
   96   2H6     A   9          H62         A   9   8.256   8.566  20.775
   97    H2     A   9           H2         A   9  10.853  12.687  18.779
   98    H3T    A   9           H3T        A   9  16.210  13.123  23.781
   99   1H5*    U   1          H5*         U   1   5.417  13.690  11.690
  100   2H5*    U   1          H5**        U   1   5.493  15.440  11.384
  101    H4*    U   1           H4*        U   1   7.911  15.430  11.700
  102    H3*    U   1           H3*        U   1   7.628  12.439  12.305
  103    H2*    U   1           H2*        U   1   9.771  12.875  13.470
  104   2HO*    U   1          H2**        U   1  10.928  14.349  12.941
  105    H1*    U   1           H1*        U   1   8.653  14.925  14.777
  106    H3     U   1           H3         U   1   8.851  11.445  17.730
  107    H5     U   1           H5         U   1   5.389  10.720  15.490
  108    H6     U   1           H6         U   1   5.996  12.530  14.041
  109    H5T    U   1           H5T        U   1   7.150  13.788   9.947
  110   1H5*    A   2          H5*         A   2  11.613  13.791  11.123
  111   2H5*    A   2          H5**        A   2  12.502  12.521  10.254
  112    H4*    A   2           H4*        A   2  13.793  13.387  12.167
  113    H3*    A   2           H3*        A   2  12.807  10.521  12.581
  114    H2*    A   2           H2*        A   2  14.413  10.606  14.490
  115   2HO*    A   2          H2**        A   2  15.464  12.530  14.909
  116    H1*    A   2           H1*        A   2  13.098  12.663  15.462
  117    H8     A   2           H8         A   2  10.414  11.009  13.360
  118   1H6     A   2          H61         A   2   9.385   7.379  18.261
  119   2H6     A   2          H62         A   2   8.819   7.823  16.663
  120    H2     A   2           H2         A   2  13.174   9.622  19.011
  121   1H5*    C   3          H5*         C   3  16.867  10.645  13.516
  122   2H5*    C   3          H5**        C   3  17.714   9.268  12.778
  123    H4*    C   3           H4*        C   3  18.083   9.313  15.205
  124    H3*    C   3           H3*        C   3  16.265   7.036  14.282
  125    H2*    C   3           H2*        C   3  16.650   6.187  16.580
  126   2HO*    C   3          H2**        C   3  18.177   8.539  16.946
  127    H1*    C   3           H1*        C   3  15.698   8.467  17.544
  128   1H4     C   3          H41         C   3  10.356   5.365  16.081
  129   2H4     C   3          H42         C   3  10.290   6.149  14.515
  130    H5     C   3           H5         C   3  12.089   7.620  13.722
  131    H6     C   3           H6         C   3  14.251   8.540  14.242
  132   1H5*    U   4          H5*         U   4  19.188   5.398  16.735
  133   2H5*    U   4          H5**        U   4  19.933   4.008  15.915
  134    H4*    U   4           H4*        U   4  19.141   3.362  18.150
  135    H3*    U   4           H3*        U   4  17.454   2.206  15.874
  136    H2*    U   4           H2*        U   4  16.540   0.791  17.648
  137   2HO*    U   4          H2**        U   4  17.601   0.380  19.255
  138    H1*    U   4           H1*        U   4  16.046   2.931  19.167
  139    H3     U   4           H3         U   4  12.095   1.569  17.285
  140    H5     U   4           H5         U   4  13.774   4.238  14.527
  141    H6     U   4           H6         U   4  15.791   4.236  15.814
  142   1H5*    A   5          H5*         A   5  19.167  -0.543  18.710
  143   2H5*    A   5          H5**        A   5  19.765  -2.033  17.947
  144    H4*    A   5           H4*        A   5  18.291  -2.536  19.862
  145    H3*    A   5           H3*        A   5  17.120  -3.248  17.128
  146    H2*    A   5           H2*        A   5  15.407  -4.400  18.459
  147   2HO*    A   5          H2**        A   5  15.888  -5.091  20.232
  148    H1*    A   5           H1*        A   5  14.910  -2.207  19.861
  149    H8     A   5           H8         A   5  16.084  -0.864  16.516
  150   1H6     A   5          H61         A   5  11.807  -0.970  14.177
  151   2H6     A   5          H62         A   5  10.249  -1.664  14.569
  152    H2     A   5           H2         A   5  10.645  -3.651  18.553
  153   1H5*    A   6          H5*         A   6  17.385  -6.621  20.027
  154   2H5*    A   6          H5**        A   6  17.701  -8.162  19.199
  155    H4*    A   6           H4*        A   6  15.628  -8.272  20.558
  156    H3*    A   6           H3*        A   6  15.221  -8.346  17.530
  157    H2*    A   6           H2*        A   6  12.887  -8.804  18.036
  158   2HO*    A   6          H2**        A   6  12.352  -9.644  19.722
  159    H1*    A   6           H1*        A   6  12.706  -6.637  19.540
  160    H8     A   6           H8         A   6  15.449  -5.950  16.959
  161   1H6     A   6          H61         A   6  10.770  -4.345  13.226
  162   2H6     A   6          H62         A   6  12.500  -4.154  13.467
  163    H2     A   6           H2         A   6   9.027  -6.077  16.921
  164   1H5*    C   7          H5*         C   7  13.055 -11.510  19.690
  165   2H5*    C   7          H5**        C   7  13.128 -13.026  18.762
  166    H4*    C   7           H4*        C   7  10.791 -12.429  19.300
  167    H3*    C   7           H3*        C   7  11.520 -12.145  16.345
  168    H2*    C   7           H2*        C   7   9.114 -11.862  16.025
  169   2HO*    C   7          H2**        C   7   7.824 -12.629  17.276
  170    H1*    C   7           H1*        C   7   9.030  -9.939  17.862
  171   1H4     C   7          H41         C   7  10.554  -6.807  12.555
  172   2H4     C   7          H42         C   7  12.239  -7.250  12.714
  173    H5     C   7           H5         C   7  13.056  -8.667  14.531
  174    H6     C   7           H6         C   7  12.410 -10.018  16.431
  175   1H5*    A   8          H5*         A   8   7.945 -14.578  17.097
  176   2H5*    A   8          H5**        A   8   7.935 -15.961  15.979
  177    H4*    A   8           H4*        A   8   5.815 -14.736  15.846
  178    H3*    A   8           H3*        A   8   7.596 -14.410  13.382
  179    H2*    A   8           H2*        A   8   5.574 -13.400  12.381
  180   2HO*    A   8          H2**        A   8   4.358 -13.881  14.886
  181    H1*    A   8           H1*        A   8   5.429 -11.661  14.351
  182    H8     A   8           H8         A   8   9.117 -12.679  14.132
  183   1H6     A   8          H61         A   8   9.736  -7.804  10.398
  184   2H6     A   8          H62         A   8  10.566  -9.162  11.128
  185    H2     A   8           H2         A   8   5.354  -8.438  11.079
  186   1H5*    C   9          H5*         C   9   3.668 -15.374  12.168
  187   2H5*    C   9          H5**        C   9   3.727 -16.652  10.931
  188    H4*    C   9           H4*        C   9   2.518 -14.707  10.058
  189    H3*    C   9           H3*        C   9   5.292 -15.139   8.842
  190    H2*    C   9           H2*        C   9   4.618 -13.407   7.272
  191   2HO*    C   9          H2**        C   9   2.724 -13.145   6.866
  192    H1*    C   9           H1*        C   9   3.978 -11.739   9.130
  193   1H4     C   9          H41         C   9  10.190 -10.566   9.032
  194   2H4     C   9          H42         C   9  10.550 -12.017   9.946
  195    H5     C   9           H5         C   9   8.817 -13.604  10.599
  196    H6     C   9           H6         C   9   6.463 -14.126  10.477
  197   1H5*    C  10          H5*         C  10   2.188 -15.039   5.675
  198   2H5*    C  10          H5**        C  10   2.713 -15.959   4.245
  199    H4*    C  10           H4*        C  10   2.361 -13.564   3.740
  200    H3*    C  10           H3*        C  10   5.293 -14.404   3.591
  201    H2*    C  10           H2*        C  10   5.615 -12.142   2.652
  202   2HO*    C  10          H2**        C  10   3.839 -10.788   2.483
  203    H1*    C  10           H1*        C  10   4.559 -11.078   4.776
  204   1H4     C  10          H41         C  10  10.462 -12.315   6.750
  205   2H4     C  10          H42         C  10   9.998 -13.915   7.294
  206    H5     C  10           H5         C  10   7.834 -14.887   6.727
  207    H6     C  10           H6         C  10   5.667 -14.458   5.746
  208    H3T    C  10           H3T        C  10   3.314 -14.092   1.612
  Start of MODEL    7
    1   1H5*    G   1          H5*         G   1  16.609  -7.471   0.765
    2   2H5*    G   1          H5**        G   1  16.705  -7.254  -0.998
    3    H4*    G   1           H4*        G   1  14.694  -5.881  -0.973
    4    H3*    G   1           H3*        G   1  14.593  -6.412   2.043
    5    H2*    G   1           H2*        G   1  12.192  -5.896   1.674
    6   2HO*    G   1          H2**        G   1  12.904  -5.582  -1.046
    7    H1*    G   1           H1*        G   1  12.092  -7.806  -0.177
    8    H8     G   1           H8         G   1  14.894  -8.952   2.102
    9    H1     G   1           H1         G   1   9.039 -10.176   4.399
   10   1H2     G   1          H21         G   1   7.514  -9.104   3.205
   11   2H2     G   1          H22         G   1   7.911  -8.094   1.825
   12    H5T    G   1           H5T        G   1  16.454  -5.020   0.575
   13   1H5*    G   2          H5*         G   2  12.112  -3.293   0.857
   14   2H5*    G   2          H5**        G   2  12.146  -1.906   1.969
   15    H4*    G   2           H4*        G   2   9.839  -2.715   1.588
   16    H3*    G   2           H3*        G   2  10.898  -3.266   4.405
   17    H2*    G   2           H2*        G   2   8.556  -3.869   4.859
   18   2HO*    G   2          H2**        G   2   7.095  -3.091   3.789
   19    H1*    G   2           H1*        G   2   8.514  -5.543   2.821
   20    H8     G   2           H8         G   2  12.122  -5.644   3.947
   21    H1     G   2           H1         G   2   8.169  -9.122   7.592
   22   1H2     G   2          H21         G   2   5.918  -8.598   6.979
   23   2H2     G   2          H22         G   2   5.619  -7.369   5.780
   24   1H5*    U   3          H5*         U   3   7.061  -1.131   4.020
   25   2H5*    U   3          H5**        U   3   6.876   0.126   5.264
   26    H4*    U   3           H4*        U   3   4.924  -1.397   5.219
   27    H3*    U   3           H3*        U   3   6.667  -1.660   7.721
   28    H2*    U   3           H2*        U   3   4.784  -3.043   8.535
   29   2HO*    U   3          H2**        U   3   3.042  -3.407   7.189
   30    H1*    U   3           H1*        U   3   4.997  -4.617   6.436
   31    H3     U   3           H3         U   3   7.626  -6.812   9.483
   32    H5     U   3           H5         U   3  10.142  -3.959   7.751
   33    H6     U   3           H6         U   3   8.258  -3.006   6.659
   34   1H5*    G   4          H5*         G   4   2.672  -1.268   8.795
   35   2H5*    G   4          H5**        G   4   2.429  -0.157  10.159
   36    H4*    G   4           H4*        G   4   1.477  -2.399  10.618
   37    H3*    G   4           H3*        G   4   3.915  -1.643  12.303
   38    H2*    G   4           H2*        G   4   3.478  -3.716  13.528
   39   2HO*    G   4          H2**        G   4   1.753  -5.007  12.916
   40    H1*    G   4           H1*        G   4   3.456  -5.138  11.320
   41    H8     G   4           H8         G   4   5.808  -2.438  10.246
   42    H1     G   4           H1         G   4   8.546  -6.959  13.860
   43   1H2     G   4          H21         G   4   6.817  -8.202  14.947
   44   2H2     G   4          H22         G   4   5.164  -7.961  14.453
   45   1H5*    U   5          H5*         U   5   1.123  -3.442  14.940
   46   2H5*    U   5          H5**        U   5   0.933  -2.420  16.378
   47    H4*    U   5           H4*        U   5   1.747  -4.675  17.049
   48    H3*    U   5           H3*        U   5   3.840  -2.458  17.286
   49    H2*    U   5           H2*        U   5   5.148  -4.170  18.510
   50   2HO*    U   5          H2**        U   5   4.298  -6.176  18.786
   51    H1*    U   5           H1*        U   5   4.892  -5.838  16.432
   52    H3     U   5           H3         U   5   8.910  -4.073  15.337
   53    H5     U   5           H5         U   5   6.143  -1.223  13.981
   54    H6     U   5           H6         U   5   4.421  -2.459  15.046
   55   1H5*    A   6          H5*         A   6   3.920  -3.865  21.141
   56   2H5*    A   6          H5**        A   6   3.570  -2.527  22.263
   57    H4*    A   6           H4*        A   6   5.739  -3.560  22.813
   58    H3*    A   6           H3*        A   6   5.944  -0.784  21.551
   59    H2*    A   6           H2*        A   6   8.317  -0.938  22.153
   60   2HO*    A   6          H2**        A   6   8.842  -2.022  23.699
   61    H1*    A   6           H1*        A   6   8.531  -3.233  20.838
   62    H8     A   6           H8         A   6   5.770  -1.812  18.821
   63   1H6     A   6          H61         A   6   8.362   1.146  15.947
   64   2H6     A   6          H62         A   6  10.022   1.692  15.977
   65    H2     A   6           H2         A   6  11.922  -0.079  19.631
   66   1H5*    G   7          H5*         G   7   8.168  -1.098  25.202
   67   2H5*    G   7          H5**        G   7   7.873   0.323  26.231
   68    H4*    G   7           H4*        G   7  10.277  -0.083  25.959
   69    H3*    G   7           H3*        G   7   9.272   2.406  24.493
   70    H2*    G   7           H2*        G   7  11.701   2.895  24.274
   71   2HO*    G   7          H2**        G   7  12.075   0.428  25.607
   72    H1*    G   7           H1*        G   7  12.023   0.573  23.064
   73    H8     G   7           H8         G   7   8.416   1.017  22.205
   74    H1     G   7           H1         G   7  12.237   4.645  18.601
   75   1H2     G   7          H21         G   7  14.391   4.756  19.638
   76   2H2     G   7          H22         G   7  14.727   3.762  21.031
   77   1H5*    U   8          H5*         U   8  12.694   3.485  26.700
   78   2H5*    U   8          H5**        U   8  12.323   4.946  27.643
   79    H4*    U   8           H4*        U   8  14.330   5.300  26.290
   80    H3*    U   8           H3*        U   8  11.894   6.849  25.276
   81    H2*    U   8           H2*        U   8  13.625   8.042  23.933
   82   2HO*    U   8          H2**        U   8  15.739   7.369  24.087
   83    H1*    U   8           H1*        U   8  14.387   5.720  22.906
   84    H3     U   8           H3         U   8  11.317   7.216  19.852
   85    H5     U   8           H5         U   8   9.095   5.061  22.667
   86    H6     U   8           H6         U   8  11.042   4.928  24.045
   87   1H5*    A   9          H5*         A   9  14.904   9.287  25.904
   88   2H5*    A   9          H5**        A   9  14.685  10.748  26.886
   89    H4*    A   9           H4*        A   9  15.768  11.121  24.664
   90    H3*    A   9           H3*        A   9  14.176  13.031  25.639
   91    H2*    A   9           H2*        A   9  12.191  11.634  25.018
   92   2HO*    A   9          H2**        A   9  11.651  13.006  22.892
   93    H1*    A   9           H1*        A   9  13.445  11.845  22.264
   94    H8     A   9           H8         A   9  11.692   8.929  24.179
   95   1H6     A   9          H61         A   9   7.650   9.011  19.475
   96   2H6     A   9          H62         A   9   8.113   8.195  20.952
   97    H2     A   9           H2         A   9  10.535  12.375  18.867
   98    H3T    A   9           H3T        A   9  15.715  13.304  23.925
   99   1H5*    U   1          H5*         U   1   4.675  12.778  12.010
  100   2H5*    U   1          H5**        U   1   4.618  14.503  11.581
  101    H4*    U   1           H4*        U   1   7.053  14.647  11.686
  102    H3*    U   1           H3*        U   1   6.989  11.688  12.478
  103    H2*    U   1           H2*        U   1   9.177  12.286  13.469
  104   2HO*    U   1          H2**        U   1  10.217  13.789  12.804
  105    H1*    U   1           H1*        U   1   8.049  14.328  14.768
  106    H3     U   1           H3         U   1   8.557  10.947  17.807
  107    H5     U   1           H5         U   1   4.982  10.050  15.818
  108    H6     U   1           H6         U   1   5.435  11.830  14.284
  109    H5T    U   1           H5T        U   1   6.247  12.851  10.118
  110   1H5*    A   2          H5*         A   2  10.822  13.119  10.987
  111   2H5*    A   2          H5**        A   2  11.735  11.845  10.149
  112    H4*    A   2           H4*        A   2  13.043  12.879  11.976
  113    H3*    A   2           H3*        A   2  12.252   9.972  12.522
  114    H2*    A   2           H2*        A   2  13.866  10.223  14.407
  115   2HO*    A   2          H2**        A   2  14.820  12.207  14.742
  116    H1*    A   2           H1*        A   2  12.460  12.234  15.333
  117    H8     A   2           H8         A   2   9.819  10.384  13.330
  118   1H6     A   2          H61         A   2   9.017   6.910  18.396
  119   2H6     A   2          H62         A   2   8.422   7.245  16.783
  120    H2     A   2           H2         A   2  12.722   9.340  18.980
  121   1H5*    C   3          H5*         C   3  16.302  10.497  13.498
  122   2H5*    C   3          H5**        C   3  17.266   9.192  12.766
  123    H4*    C   3           H4*        C   3  17.650   9.295  15.203
  124    H3*    C   3           H3*        C   3  16.045   6.863  14.275
  125    H2*    C   3           H2*        C   3  16.447   6.046  16.552
  126   2HO*    C   3          H2**        C   3  17.987   6.738  17.628
  127    H1*    C   3           H1*        C   3  15.424   8.296  17.564
  128   1H4     C   3          H41         C   3  10.219   4.863  16.454
  129   2H4     C   3          H42         C   3  10.077   5.508  14.830
  130    H5     C   3           H5         C   3  11.742   7.058  13.912
  131    H6     C   3           H6         C   3  13.863   8.138  14.311
  132   1H5*    U   4          H5*         U   4  19.223   5.469  16.653
  133   2H5*    U   4          H5**        U   4  19.999   4.068  15.882
  134    H4*    U   4           H4*        U   4  19.229   3.522  18.163
  135    H3*    U   4           H3*        U   4  17.610   2.159  15.951
  136    H2*    U   4           H2*        U   4  16.685   0.854  17.801
  137   2HO*    U   4          H2**        U   4  17.668   0.586  19.469
  138    H1*    U   4           H1*        U   4  16.142   3.069  19.185
  139    H3     U   4           H3         U   4  12.221   1.483  17.444
  140    H5     U   4           H5         U   4  13.790   4.012  14.498
  141    H6     U   4           H6         U   4  15.827   4.148  15.758
  142   1H5*    A   5          H5*         A   5  19.183  -0.356  19.065
  143   2H5*    A   5          H5**        A   5  19.834  -1.889  18.448
  144    H4*    A   5           H4*        A   5  18.222  -2.271  20.288
  145    H3*    A   5           H3*        A   5  17.279  -3.172  17.522
  146    H2*    A   5           H2*        A   5  15.427  -4.207  18.741
  147   2HO*    A   5          H2**        A   5  15.736  -4.819  20.577
  148    H1*    A   5           H1*        A   5  14.839  -1.943  19.982
  149    H8     A   5           H8         A   5  16.341  -0.822  16.681
  150   1H6     A   5          H61         A   5  12.265  -0.870  14.002
  151   2H6     A   5          H62         A   5  10.662  -1.517  14.294
  152    H2     A   5           H2         A   5  10.633  -3.279  18.389
  153   1H5*    A   6          H5*         A   6  17.258  -6.406  20.650
  154   2H5*    A   6          H5**        A   6  17.640  -7.988  19.933
  155    H4*    A   6           H4*        A   6  15.442  -8.021  21.085
  156    H3*    A   6           H3*        A   6  15.315  -8.248  18.039
  157    H2*    A   6           H2*        A   6  12.933  -8.638  18.357
  158   2HO*    A   6          H2**        A   6  12.215  -9.329  20.045
  159    H1*    A   6           H1*        A   6  12.653  -6.411  19.719
  160    H8     A   6           H8         A   6  15.650  -5.929  17.366
  161   1H6     A   6          H61         A   6  11.405  -4.300  13.160
  162   2H6     A   6          H62         A   6  13.108  -4.152  13.559
  163    H2     A   6           H2         A   6   9.260  -5.761  16.766
  164   1H5*    C   7          H5*         C   7  12.872 -11.160  20.227
  165   2H5*    C   7          H5**        C   7  12.902 -12.746  19.426
  166    H4*    C   7           H4*        C   7  10.580 -11.957  19.786
  167    H3*    C   7           H3*        C   7  11.469 -12.007  16.859
  168    H2*    C   7           H2*        C   7   9.123 -11.569  16.378
  169   2HO*    C   7          H2**        C   7   7.692 -12.037  17.618
  170    H1*    C   7           H1*        C   7   9.073  -9.501  18.051
  171   1H4     C   7          H41         C   7  11.014  -6.800  12.672
  172   2H4     C   7          H42         C   7  12.657  -7.368  12.894
  173    H5     C   7           H5         C   7  13.316  -8.702  14.853
  174    H6     C   7           H6         C   7  12.502  -9.891  16.797
  175   1H5*    A   8          H5*         A   8   7.611 -13.925  17.525
  176   2H5*    A   8          H5**        A   8   7.474 -15.374  16.508
  177    H4*    A   8           H4*        A   8   5.598 -13.827  16.077
  178    H3*    A   8           H3*        A   8   7.628 -14.019  13.800
  179    H2*    A   8           H2*        A   8   5.971 -12.770  12.521
  180   2HO*    A   8          H2**        A   8   4.062 -12.830  12.957
  181    H1*    A   8           H1*        A   8   5.751 -10.928  14.420
  182    H8     A   8           H8         A   8   9.371 -12.171  14.455
  183   1H6     A   8          H61         A   8  10.360  -7.811  10.173
  184   2H6     A   8          H62         A   8  11.116  -9.089  11.104
  185    H2     A   8           H2         A   8   5.947  -8.142  10.777
  186   1H5*    C   9          H5*         C   9   3.449 -14.547  12.651
  187   2H5*    C   9          H5**        C   9   3.320 -15.882  11.485
  188    H4*    C   9           H4*        C   9   2.246 -13.873  10.578
  189    H3*    C   9           H3*        C   9   4.882 -14.640   9.232
  190    H2*    C   9           H2*        C   9   4.259 -12.951   7.589
  191   2HO*    C   9          H2**        C   9   2.384 -12.471   7.315
  192    H1*    C   9           H1*        C   9   3.923 -11.125   9.347
  193   1H4     C   9          H41         C   9  10.222 -10.653   8.781
  194   2H4     C   9          H42         C   9  10.475 -12.074   9.772
  195    H5     C   9           H5         C   9   8.641 -13.448  10.586
  196    H6     C   9           H6         C   9   6.244 -13.712  10.655
  197   1H5*    C  10          H5*         C  10   1.538 -14.291   6.380
  198   2H5*    C  10          H5**        C  10   1.793 -15.331   4.960
  199    H4*    C  10           H4*        C  10   1.604 -12.951   4.333
  200    H3*    C  10           H3*        C  10   4.413 -14.075   3.927
  201    H2*    C  10           H2*        C  10   4.790 -11.933   2.752
  202   2HO*    C  10          H2**        C  10   3.110 -10.454   2.658
  203    H1*    C  10           H1*        C  10   4.068 -10.611   4.870
  204   1H4     C  10          H41         C  10  10.091 -12.100   6.267
  205   2H4     C  10          H42         C  10   9.575 -13.587   7.034
  206    H5     C  10           H5         C  10   7.321 -14.448   6.791
  207    H6     C  10           H6         C  10   5.084 -13.959   6.019
  208    H3T    C  10           H3T        C  10   2.234 -13.756   2.170
  Start of MODEL    8
    1   1H5*    G   1          H5*         G   1  17.469  -6.494   0.516
    2   2H5*    G   1          H5**        G   1  17.391  -5.059   1.558
    3    H4*    G   1           H4*        G   1  15.265  -5.456   0.351
    4    H3*    G   1           H3*        G   1  15.020  -5.967   3.362
    5    H2*    G   1           H2*        G   1  12.611  -5.915   2.813
    6   2HO*    G   1          H2**        G   1  11.942  -4.962   1.236
    7    H1*    G   1           H1*        G   1  12.991  -7.722   0.879
    8    H8     G   1           H8         G   1  15.568  -8.563   3.529
    9    H1     G   1           H1         G   1   9.629 -10.474   4.993
   10   1H2     G   1          H21         G   1   8.177  -9.564   3.593
   11   2H2     G   1          H22         G   1   8.646  -8.509   2.270
   12    H5T    G   1           H5T        G   1  17.009  -6.464   3.321
   13   1H5*    G   2          H5*         G   2  12.312  -3.134   1.531
   14   2H5*    G   2          H5**        G   2  11.978  -1.743   2.584
   15    H4*    G   2           H4*        G   2   9.899  -2.734   1.722
   16    H3*    G   2           H3*        G   2  10.324  -3.179   4.718
   17    H2*    G   2           H2*        G   2   7.944  -3.892   4.632
   18   2HO*    G   2          H2**        G   2   8.117  -3.391   1.859
   19    H1*    G   2           H1*        G   2   8.548  -5.695   2.817
   20    H8     G   2           H8         G   2  11.872  -5.250   4.565
   21    H1     G   2           H1         G   2   7.920  -9.224   7.637
   22   1H2     G   2          H21         G   2   5.739  -9.031   6.691
   23   2H2     G   2          H22         G   2   5.459  -7.924   5.375
   24   1H5*    U   3          H5*         U   3   6.519  -1.493   3.893
   25   2H5*    U   3          H5**        U   3   6.094  -0.238   5.080
   26    H4*    U   3           H4*        U   3   4.367  -1.986   5.008
   27    H3*    U   3           H3*        U   3   6.045  -2.013   7.564
   28    H2*    U   3           H2*        U   3   4.269  -3.563   8.353
   29   2HO*    U   3          H2**        U   3   2.581  -2.572   7.081
   30    H1*    U   3           H1*        U   3   4.756  -5.148   6.289
   31    H3     U   3           H3         U   3   7.449  -6.954   9.516
   32    H5     U   3           H5         U   3   9.740  -3.911   7.792
   33    H6     U   3           H6         U   3   7.818  -3.198   6.582
   34   1H5*    G   4          H5*         G   4   2.026  -1.787   8.676
   35   2H5*    G   4          H5**        G   4   1.778  -0.649  10.020
   36    H4*    G   4           H4*        G   4   0.972  -2.909  10.600
   37    H3*    G   4           H3*        G   4   3.480  -2.030  12.117
   38    H2*    G   4           H2*        G   4   3.030  -4.046  13.469
   39   2HO*    G   4          H2**        G   4   0.704  -3.871  13.249
   40    H1*    G   4           H1*        G   4   2.984  -5.549  11.315
   41    H8     G   4           H8         G   4   5.305  -2.879  10.114
   42    H1     G   4           H1         G   4   8.138  -7.191  13.899
   43   1H2     G   4          H21         G   4   6.438  -8.446  15.017
   44   2H2     G   4          H22         G   4   4.768  -8.197  14.589
   45   1H5*    U   5          H5*         U   5   0.632  -3.428  14.964
   46   2H5*    U   5          H5**        U   5   0.584  -2.328  16.360
   47    H4*    U   5           H4*        U   5   1.209  -4.595  17.079
   48    H3*    U   5           H3*        U   5   3.478  -2.549  17.183
   49    H2*    U   5           H2*        U   5   4.673  -4.291  18.461
   50   2HO*    U   5          H2**        U   5   2.759  -5.165  19.448
   51    H1*    U   5           H1*        U   5   4.281  -6.017  16.461
   52    H3     U   5           H3         U   5   8.403  -4.396  15.453
   53    H5     U   5           H5         U   5   5.743  -1.589  13.825
   54    H6     U   5           H6         U   5   3.958  -2.731  14.905
   55   1H5*    A   6          H5*         A   6   3.710  -3.780  20.827
   56   2H5*    A   6          H5**        A   6   3.492  -2.482  22.023
   57    H4*    A   6           H4*        A   6   5.639  -3.620  22.348
   58    H3*    A   6           H3*        A   6   5.891  -0.779  21.244
   59    H2*    A   6           H2*        A   6   8.286  -1.084  21.833
   60   2HO*    A   6          H2**        A   6   7.518  -3.683  22.640
   61    H1*    A   6           H1*        A   6   8.340  -3.211  20.242
   62    H8     A   6           H8         A   6   5.488  -1.604  18.537
   63   1H6     A   6          H61         A   6   7.910   1.610  15.785
   64   2H6     A   6          H62         A   6   9.587   2.110  15.734
   65    H2     A   6           H2         A   6  11.686   0.055  19.104
   66   1H5*    G   7          H5*         G   7   8.349  -1.323  24.526
   67   2H5*    G   7          H5**        G   7   8.145  -0.018  25.715
   68    H4*    G   7           H4*        G   7  10.517  -0.356  25.182
   69    H3*    G   7           H3*        G   7   9.374   2.254  24.065
   70    H2*    G   7           H2*        G   7  11.790   2.780  23.723
   71   2HO*    G   7          H2**        G   7  12.508   1.554  25.564
   72    H1*    G   7           H1*        G   7  12.023   0.582  22.274
   73    H8     G   7           H8         G   7   8.377   1.084  21.693
   74    H1     G   7           H1         G   7  11.975   5.107  18.267
   75   1H2     G   7          H21         G   7  14.192   5.090  19.155
   76   2H2     G   7          H22         G   7  14.604   3.983  20.439
   77   1H5*    U   8          H5*         U   8  12.860   3.113  26.415
   78   2H5*    U   8          H5**        U   8  12.538   4.513  27.463
   79    H4*    U   8           H4*        U   8  14.548   4.884  26.087
   80    H3*    U   8           H3*        U   8  12.149   6.612  25.299
   81    H2*    U   8           H2*        U   8  13.829   7.798  23.911
   82   2HO*    U   8          H2**        U   8  15.702   7.782  24.492
   83    H1*    U   8           H1*        U   8  14.510   5.533  22.738
   84    H3     U   8           H3         U   8  11.430   7.458  19.934
   85    H5     U   8           H5         U   8   9.184   5.167  22.621
   86    H6     U   8           H6         U   8  11.161   4.807  23.909
   87   1H5*    A   9          H5*         A   9  15.477   8.711  26.023
   88   2H5*    A   9          H5**        A   9  15.442  10.140  27.072
   89    H4*    A   9           H4*        A   9  16.567  10.464  24.856
   90    H3*    A   9           H3*        A   9  15.267  12.521  25.936
   91    H2*    A   9           H2*        A   9  13.106  11.455  25.307
   92   2HO*    A   9          H2**        A   9  12.684  12.956  23.257
   93    H1*    A   9           H1*        A   9  14.272  11.593  22.513
   94    H8     A   9           H8         A   9  12.211   8.889  24.437
   95   1H6     A   9          H61         A   9   8.065   9.604  19.891
   96   2H6     A   9          H62         A   9   8.472   8.700  21.331
   97    H2     A   9           H2         A   9  11.356  12.569  19.228
   98    H3T    A   9           H3T        A   9  15.762  12.353  23.143
   99   1H5*    U   1          H5*         U   1   5.154  14.651  12.901
  100   2H5*    U   1          H5**        U   1   5.355  16.416  12.812
  101    H4*    U   1           H4*        U   1   7.782  16.182  12.866
  102    H3*    U   1           H3*        U   1   7.291  13.166  13.116
  103    H2*    U   1           H2*        U   1   9.558  13.267  14.089
  104   2HO*    U   1          H2**        U   1  10.805  14.692  13.630
  105    H1*    U   1           H1*        U   1   8.794  15.271  15.715
  106    H3     U   1           H3         U   1   9.047  11.562  18.347
  107    H5     U   1           H5         U   1   5.335  11.220  16.437
  108    H6     U   1           H6         U   1   5.909  13.113  15.079
  109    H5T    U   1           H5T        U   1   6.713  14.852  11.013
  110   1H5*    A   2          H5*         A   2  11.285  14.349  11.732
  111   2H5*    A   2          H5**        A   2  11.958  13.133  10.623
  112    H4*    A   2           H4*        A   2  13.493  13.571  12.509
  113    H3*    A   2           H3*        A   2  12.176  10.811  12.583
  114    H2*    A   2           H2*        A   2  13.807  10.373  14.362
  115   2HO*    A   2          H2**        A   2  15.481  11.369  14.500
  116    H1*    A   2           H1*        A   2  13.028  12.499  15.697
  117    H8     A   2           H8         A   2   9.950  11.316  13.770
  118   1H6     A   2          H61         A   2   9.040   7.479  18.549
  119   2H6     A   2          H62         A   2   8.367   8.083  17.051
  120    H2     A   2           H2         A   2  13.080   9.328  19.036
  121   1H5*    C   3          H5*         C   3  16.448  10.580  13.060
  122   2H5*    C   3          H5**        C   3  17.099   9.192  12.160
  123    H4*    C   3           H4*        C   3  17.727   9.062  14.543
  124    H3*    C   3           H3*        C   3  15.673   6.982  13.652
  125    H2*    C   3           H2*        C   3  16.094   5.971  15.840
  126   2HO*    C   3          H2**        C   3  17.786   6.243  16.777
  127    H1*    C   3           H1*        C   3  15.584   8.262  17.067
  128   1H4     C   3          H41         C   3   9.862   5.637  16.321
  129   2H4     C   3          H42         C   3   9.663   6.396  14.753
  130    H5     C   3           H5         C   3  11.456   7.693  13.708
  131    H6     C   3           H6         C   3  13.736   8.449  13.932
  132   1H5*    U   4          H5*         U   4  18.985   5.296  15.755
  133   2H5*    U   4          H5**        U   4  19.583   3.839  14.933
  134    H4*    U   4           H4*        U   4  19.115   3.379  17.316
  135    H3*    U   4           H3*        U   4  17.190   2.063  15.335
  136    H2*    U   4           H2*        U   4  16.386   0.833  17.273
  137   2HO*    U   4          H2**        U   4  17.567   0.505  18.822
  138    H1*    U   4           H1*        U   4  16.056   3.067  18.672
  139    H3     U   4           H3         U   4  11.921   1.778  17.185
  140    H5     U   4           H5         U   4  13.498   4.178  14.138
  141    H6     U   4           H6         U   4  15.603   4.152  15.258
  142   1H5*    A   5          H5*         A   5  19.075  -0.453  18.285
  143   2H5*    A   5          H5**        A   5  19.628  -2.007  17.627
  144    H4*    A   5           H4*        A   5  18.246  -2.329  19.653
  145    H3*    A   5           H3*        A   5  16.968  -3.268  17.041
  146    H2*    A   5           H2*        A   5  15.268  -4.257  18.503
  147   2HO*    A   5          H2**        A   5  15.780  -4.802  20.315
  148    H1*    A   5           H1*        A   5  14.816  -1.939  19.684
  149    H8     A   5           H8         A   5  16.054  -0.938  16.241
  150   1H6     A   5          H61         A   5  11.787  -1.104  13.886
  151   2H6     A   5          H62         A   5  10.224  -1.771  14.304
  152    H2     A   5           H2         A   5  10.518  -3.357  18.468
  153   1H5*    A   6          H5*         A   6  17.273  -6.398  20.187
  154   2H5*    A   6          H5**        A   6  17.533  -8.009  19.477
  155    H4*    A   6           H4*        A   6  15.520  -7.954  20.913
  156    H3*    A   6           H3*        A   6  14.932  -8.274  17.929
  157    H2*    A   6           H2*        A   6  12.619  -8.698  18.695
  158   2HO*    A   6          H2**        A   6  13.625  -8.231  21.295
  159    H1*    A   6           H1*        A   6  12.565  -6.351  19.864
  160    H8     A   6           H8         A   6  15.287  -5.986  17.213
  161   1H6     A   6          H61         A   6  10.705  -4.569  13.321
  162   2H6     A   6          H62         A   6  12.427  -4.398  13.596
  163    H2     A   6           H2         A   6   8.861  -5.910  17.158
  164   1H5*    C   7          H5*         C   7  12.760 -11.127  20.194
  165   2H5*    C   7          H5**        C   7  12.746 -12.712  19.389
  166    H4*    C   7           H4*        C   7  10.457 -11.926  19.856
  167    H3*    C   7           H3*        C   7  11.161 -11.917  16.879
  168    H2*    C   7           H2*        C   7   8.711 -11.599  16.625
  169   2HO*    C   7          H2**        C   7   7.438 -11.468  18.423
  170    H1*    C   7           H1*        C   7   8.834  -9.460  18.180
  171   1H4     C   7          H41         C   7  10.655  -6.984  12.642
  172   2H4     C   7          H42         C   7  12.327  -7.422  12.935
  173    H5     C   7           H5         C   7  13.023  -8.626  14.959
  174    H6     C   7           H6         C   7  12.245  -9.760  16.940
  175   1H5*    A   8          H5*         A   8   7.455 -13.949  17.480
  176   2H5*    A   8          H5**        A   8   7.449 -15.426  16.491
  177    H4*    A   8           H4*        A   8   5.500 -14.024  15.940
  178    H3*    A   8           H3*        A   8   7.657 -14.109  13.773
  179    H2*    A   8           H2*        A   8   5.985 -13.013  12.384
  180   2HO*    A   8          H2**        A   8   4.076 -13.305  12.699
  181    H1*    A   8           H1*        A   8   5.523 -11.152  14.241
  182    H8     A   8           H8         A   8   9.197 -12.183  14.501
  183   1H6     A   8          H61         A   8  10.209  -7.749  10.296
  184   2H6     A   8          H62         A   8  10.967  -8.994  11.264
  185    H2     A   8           H2         A   8   5.784  -8.319  10.640
  186   1H5*    C   9          H5*         C   9   3.615 -15.165  12.390
  187   2H5*    C   9          H5**        C   9   3.729 -16.529  11.254
  188    H4*    C   9           H4*        C   9   2.511 -14.668  10.212
  189    H3*    C   9           H3*        C   9   5.317 -15.172   9.098
  190    H2*    C   9           H2*        C   9   4.693 -13.573   7.390
  191   2HO*    C   9          H2**        C   9   2.814 -13.298   6.908
  192    H1*    C   9           H1*        C   9   3.964 -11.772   9.092
  193   1H4     C   9          H41         C   9  10.141 -10.457   9.042
  194   2H4     C   9          H42         C   9  10.532 -11.879   9.989
  195    H5     C   9           H5         C   9   8.837 -13.492  10.664
  196    H6     C   9           H6         C   9   6.493 -14.070  10.549
  197   1H5*    C  10          H5*         C  10   2.341 -15.181   5.877
  198   2H5*    C  10          H5**        C  10   2.868 -16.203   4.520
  199    H4*    C  10           H4*        C  10   2.587 -13.846   3.847
  200    H3*    C  10           H3*        C  10   5.503 -14.749   3.837
  201    H2*    C  10           H2*        C  10   5.890 -12.574   2.735
  202   2HO*    C  10          H2**        C  10   4.141 -11.203   2.427
  203    H1*    C  10           H1*        C  10   4.791 -11.330   4.740
  204   1H4     C  10          H41         C  10  10.634 -12.424   6.958
  205   2H4     C  10          H42         C  10  10.151 -13.979   7.607
  206    H5     C  10           H5         C  10   7.988 -14.978   7.085
  207    H6     C  10           H6         C  10   5.848 -14.623   6.018
  208    H3T    C  10           H3T        C  10   3.574 -14.550   1.792
  Start of MODEL    9
    1   1H5*    G   1          H5*         G   1  16.955  -5.289   1.300
    2   2H5*    G   1          H5**        G   1  16.795  -4.853  -0.416
    3    H4*    G   1           H4*        G   1  14.581  -3.918  -0.013
    4    H3*    G   1           H3*        G   1  14.928  -4.822   2.896
    5    H2*    G   1           H2*        G   1  12.461  -4.693   2.820
    6   2HO*    G   1          H2**        G   1  11.531  -3.546   1.534
    7    H1*    G   1           H1*        G   1  12.445  -6.166   0.558
    8    H8     G   1           H8         G   1  15.311  -7.455   2.697
    9    H1     G   1           H1         G   1   9.533  -9.497   4.575
   10   1H2     G   1          H21         G   1   7.951  -8.371   3.506
   11   2H2     G   1          H22         G   1   8.293  -7.124   2.321
   12    H5T    G   1           H5T        G   1  16.350  -2.913   1.474
   13   1H5*    G   2          H5*         G   2  11.990  -1.784   2.039
   14   2H5*    G   2          H5**        G   2  11.827  -0.581   3.336
   15    H4*    G   2           H4*        G   2   9.638  -1.534   2.701
   16    H3*    G   2           H3*        G   2  10.594  -2.385   5.480
   17    H2*    G   2           H2*        G   2   8.279  -3.200   5.697
   18   2HO*    G   2          H2**        G   2   6.825  -2.410   4.612
   19    H1*    G   2           H1*        G   2   8.498  -4.597   3.464
   20    H8     G   2           H8         G   2  12.031  -4.543   4.840
   21    H1     G   2           H1         G   2   8.241  -8.838   7.693
   22   1H2     G   2          H21         G   2   5.990  -8.450   7.003
   23   2H2     G   2          H22         G   2   5.622  -7.092   5.975
   24   1H5*    U   3          H5*         U   3   6.644  -0.539   5.026
   25   2H5*    U   3          H5**        U   3   6.273   0.574   6.361
   26    H4*    U   3           H4*        U   3   4.431  -1.025   6.017
   27    H3*    U   3           H3*        U   3   6.022  -1.467   8.589
   28    H2*    U   3           H2*        U   3   4.170  -3.003   9.153
   29   2HO*    U   3          H2**        U   3   2.538  -1.801   8.045
   30    H1*    U   3           H1*        U   3   4.582  -4.346   6.912
   31    H3     U   3           H3         U   3   7.173  -6.793   9.778
   32    H5     U   3           H5         U   3   9.589  -3.571   8.661
   33    H6     U   3           H6         U   3   7.715  -2.587   7.566
   34   1H5*    G   4          H5*         G   4   2.063  -1.115   9.832
   35   2H5*    G   4          H5**        G   4   1.946  -0.118  11.300
   36    H4*    G   4           H4*        G   4   1.095  -2.398  11.705
   37    H3*    G   4           H3*        G   4   3.750  -1.782  13.076
   38    H2*    G   4           H2*        G   4   3.396  -3.901  14.262
   39   2HO*    G   4          H2**        G   4   1.105  -3.708  14.332
   40    H1*    G   4           H1*        G   4   3.096  -5.153  11.991
   41    H8     G   4           H8         G   4   5.416  -2.416  10.883
   42    H1     G   4           H1         G   4   8.324  -7.213  13.964
   43   1H2     G   4          H21         G   4   6.653  -8.554  15.021
   44   2H2     G   4          H22         G   4   4.970  -8.150  14.826
   45   1H5*    U   5          H5*         U   5   0.845  -1.629  17.500
   46   2H5*    U   5          H5**        U   5   2.243  -1.549  16.417
   47    H4*    U   5           H4*        U   5   1.267  -4.008  17.906
   48    H3*    U   5           H3*        U   5   3.711  -2.191  18.156
   49    H2*    U   5           H2*        U   5   4.842  -4.138  19.140
   50   2HO*    U   5          H2**        U   5   2.922  -4.956  20.158
   51    H1*    U   5           H1*        U   5   4.141  -5.645  17.028
   52    H3     U   5           H3         U   5   8.340  -4.482  15.732
   53    H5     U   5           H5         U   5   5.928  -1.261  14.556
   54    H6     U   5           H6         U   5   4.119  -2.234  15.736
   55   1H5*    A   6          H5*         A   6   3.766  -3.655  21.932
   56   2H5*    A   6          H5**        A   6   3.639  -2.325  23.109
   57    H4*    A   6           H4*        A   6   5.712  -3.576  23.476
   58    H3*    A   6           H3*        A   6   6.114  -0.809  22.237
   59    H2*    A   6           H2*        A   6   8.495  -1.204  22.814
   60   2HO*    A   6          H2**        A   6   9.056  -3.174  23.711
   61    H1*    A   6           H1*        A   6   8.388  -3.456  21.347
   62    H8     A   6           H8         A   6   5.677  -1.847  19.498
   63   1H6     A   6          H61         A   6   9.997   1.315  16.375
   64   2H6     A   6          H62         A   6   8.294   0.918  16.459
   65    H2     A   6           H2         A   6  11.952  -0.476  19.978
   66   1H5*    G   7          H5*         G   7   8.545  -0.775  25.695
   67   2H5*    G   7          H5**        G   7   8.179   0.707  26.610
   68    H4*    G   7           H4*        G   7  10.585   0.574  26.121
   69    H3*    G   7           H3*        G   7   9.111   2.704  24.489
   70    H2*    G   7           H2*        G   7  11.372   3.455  23.931
   71   2HO*    G   7          H2**        G   7  12.831   3.176  25.207
   72    H1*    G   7           H1*        G   7  12.060   0.996  23.186
   73    H8     G   7           H8         G   7   8.440   1.027  22.224
   74    H1     G   7           H1         G   7  12.120   4.513  18.317
   75   1H2     G   7          H21         G   7  14.232   4.852  19.388
   76   2H2     G   7          H22         G   7  14.581   4.028  20.884
   77   1H5*    U   8          H5*         U   8  12.470   4.243  26.854
   78   2H5*    U   8          H5**        U   8  12.066   5.832  27.543
   79    H4*    U   8           H4*        U   8  14.205   5.901  26.324
   80    H3*    U   8           H3*        U   8  11.955   7.440  24.932
   81    H2*    U   8           H2*        U   8  13.848   8.296  23.537
   82   2HO*    U   8          H2**        U   8  15.888   7.480  23.910
   83    H1*    U   8           H1*        U   8  14.464   5.815  22.894
   84    H3     U   8           H3         U   8  11.622   7.057  19.513
   85    H5     U   8           H5         U   8   9.150   5.492  22.499
   86    H6     U   8           H6         U   8  11.027   5.434  23.971
   87   1H5*    A   9          H5*         A   9  15.154   9.679  25.137
   88   2H5*    A   9          H5**        A   9  15.049  11.292  25.867
   89    H4*    A   9           H4*        A   9  16.175  11.198  23.628
   90    H3*    A   9           H3*        A   9  14.776  13.381  24.253
   91    H2*    A   9           H2*        A   9  12.665  12.097  23.845
   92   2HO*    A   9          H2**        A   9  12.214  13.129  21.529
   93    H1*    A   9           H1*        A   9  13.910  11.727  21.104
   94    H8     A   9           H8         A   9  12.005   9.233  23.397
   95   1H6     A   9          H61         A   9   7.802   9.080  18.847
   96   2H6     A   9          H62         A   9   8.224   8.452  20.425
   97    H2     A   9           H2         A   9  10.844  12.187  17.798
   98    H3T    A   9           H3T        A   9  15.091  14.135  22.143
   99   1H5*    U   1          H5*         U   1   4.966  11.656  10.997
  100   2H5*    U   1          H5**        U   1   4.692  13.286  10.341
  101    H4*    U   1           H4*        U   1   7.082  13.767  10.433
  102    H3*    U   1           H3*        U   1   7.399  10.968  11.637
  103    H2*    U   1           H2*        U   1   9.493  12.016  12.507
  104   2HO*    U   1          H2**        U   1   9.747  13.434  10.648
  105    H1*    U   1           H1*        U   1   8.023  13.943  13.606
  106    H3     U   1           H3         U   1   8.716  10.914  16.975
  107    H5     U   1           H5         U   1   5.358   9.490  14.926
  108    H6     U   1           H6         U   1   5.720  11.149  13.247
  109    H5T    U   1           H5T        U   1   6.564  11.690   9.126
  110   1H5*    A   2          H5*         A   2  11.144  12.349  10.200
  111   2H5*    A   2          H5**        A   2  12.060  11.016   9.463
  112    H4*    A   2           H4*        A   2  13.343  12.108  11.252
  113    H3*    A   2           H3*        A   2  12.413   9.286  11.985
  114    H2*    A   2           H2*        A   2  14.030   9.593  13.850
  115   2HO*    A   2          H2**        A   2  14.455  12.166  12.761
  116    H1*    A   2           H1*        A   2  12.733  11.746  14.604
  117    H8     A   2           H8         A   2   9.963   9.936  12.822
  118   1H6     A   2          H61         A   2   9.181   6.775  18.094
  119   2H6     A   2          H62         A   2   8.547   7.040  16.483
  120    H2     A   2           H2         A   2  13.034   9.008  18.405
  121   1H5*    C   3          H5*         C   3  16.545   9.570  12.697
  122   2H5*    C   3          H5**        C   3  17.388   8.110  12.131
  123    H4*    C   3           H4*        C   3  17.830   8.517  14.517
  124    H3*    C   3           H3*        C   3  16.046   6.087  14.007
  125    H2*    C   3           H2*        C   3  16.537   5.622  16.407
  126   2HO*    C   3          H2**        C   3  18.653   6.664  16.330
  127    H1*    C   3           H1*        C   3  15.514   7.983  17.020
  128   1H4     C   3          H41         C   3  10.233   4.568  16.142
  129   2H4     C   3          H42         C   3  10.123   5.109  14.479
  130    H5     C   3           H5         C   3  11.859   6.505  13.448
  131    H6     C   3           H6         C   3  14.003   7.539  13.779
  132   1H5*    U   4          H5*         U   4  19.163   4.962  16.578
  133   2H5*    U   4          H5**        U   4  19.894   3.447  16.007
  134    H4*    U   4           H4*        U   4  19.232   3.274  18.368
  135    H3*    U   4           H3*        U   4  17.493   1.611  16.478
  136    H2*    U   4           H2*        U   4  16.705   0.590  18.565
  137   2HO*    U   4          H2**        U   4  18.492   2.360  19.875
  138    H1*    U   4           H1*        U   4  16.104   2.972  19.543
  139    H3     U   4           H3         U   4  12.245   1.098  17.899
  140    H5     U   4           H5         U   4  13.909   3.254  14.718
  141    H6     U   4           H6         U   4  15.881   3.571  16.007
  142   1H5*    A   5          H5*         A   5  18.700  -0.673  19.722
  143   2H5*    A   5          H5**        A   5  19.395  -2.213  19.171
  144    H4*    A   5           H4*        A   5  17.614  -2.624  20.816
  145    H3*    A   5           H3*        A   5  16.868  -3.372  17.945
  146    H2*    A   5           H2*        A   5  14.967  -4.493  19.008
  147   2HO*    A   5          H2**        A   5  15.218  -5.229  20.815
  148    H1*    A   5           H1*        A   5  14.341  -2.287  20.383
  149    H8     A   5           H8         A   5  15.809  -0.894  17.201
  150   1H6     A   5          H61         A   5  11.777  -1.016  14.440
  151   2H6     A   5          H62         A   5  10.214  -1.778  14.672
  152    H2     A   5           H2         A   5  10.249  -3.828  18.618
  153   1H5*    A   6          H5*         A   6  16.755  -6.735  20.864
  154   2H5*    A   6          H5**        A   6  17.258  -8.249  20.076
  155    H4*    A   6           H4*        A   6  15.030  -8.494  21.119
  156    H3*    A   6           H3*        A   6  15.034  -8.466  18.061
  157    H2*    A   6           H2*        A   6  12.690  -9.101  18.262
  158   2HO*    A   6          H2**        A   6  12.012 -10.017  19.852
  159    H1*    A   6           H1*        A   6  12.180  -7.036  19.808
  160    H8     A   6           H8         A   6  15.147  -6.086  17.569
  161   1H6     A   6          H61         A   6  10.833  -4.410  13.458
  162   2H6     A   6          H62         A   6  12.524  -4.237  13.891
  163    H2     A   6           H2         A   6   8.763  -6.421  16.859
  164   1H5*    C   7          H5*         C   7  12.874 -11.829  19.803
  165   2H5*    C   7          H5**        C   7  13.085 -13.296  18.820
  166    H4*    C   7           H4*        C   7  10.693 -12.774  19.148
  167    H3*    C   7           H3*        C   7  11.672 -12.330  16.283
  168    H2*    C   7           H2*        C   7   9.275 -12.134  15.795
  169   2HO*    C   7          H2**        C   7   7.918 -12.931  16.960
  170    H1*    C   7           H1*        C   7   9.000 -10.273  17.672
  171   1H4     C   7          H41         C   7  10.821  -6.894  12.620
  172   2H4     C   7          H42         C   7  12.505  -7.278  12.902
  173    H5     C   7           H5         C   7  13.232  -8.719  14.751
  174    H6     C   7           H6         C   7  12.488 -10.168  16.533
  175   1H5*    A   8          H5*         A   8   8.165 -14.899  16.727
  176   2H5*    A   8          H5**        A   8   8.169 -16.191  15.506
  177    H4*    A   8           H4*        A   8   6.054 -14.937  15.449
  178    H3*    A   8           H3*        A   8   7.846 -14.451  13.018
  179    H2*    A   8           H2*        A   8   5.814 -13.368  12.100
  180   2HO*    A   8          H2**        A   8   3.989 -13.246  13.380
  181    H1*    A   8           H1*        A   8   5.698 -11.767  14.187
  182    H8     A   8           H8         A   8   9.378 -12.799  13.821
  183   1H6     A   8          H61         A   8   9.947  -7.688  10.401
  184   2H6     A   8          H62         A   8  10.787  -9.092  11.027
  185    H2     A   8           H2         A   8   5.580  -8.325  11.165
  186   1H5*    C   9          H5*         C   9   3.908 -15.299  11.765
  187   2H5*    C   9          H5**        C   9   3.947 -16.477  10.433
  188    H4*    C   9           H4*        C   9   2.747 -14.462   9.722
  189    H3*    C   9           H3*        C   9   5.511 -14.808   8.456
  190    H2*    C   9           H2*        C   9   4.807 -12.971   7.017
  191   2HO*    C   9          H2**        C   9   2.909 -12.621   6.694
  192    H1*    C   9           H1*        C   9   4.213 -11.440   8.996
  193   1H4     C   9          H41         C   9  10.443 -10.340   8.804
  194   2H4     C   9          H42         C   9  10.800 -11.826   9.660
  195    H5     C   9           H5         C   9   9.059 -13.427  10.269
  196    H6     C   9           H6         C   9   6.697 -13.914  10.169
  197   1H5*    C  10          H5*         C  10   2.332 -14.332   5.462
  198   2H5*    C  10          H5**        C  10   2.744 -15.137   3.931
  199    H4*    C  10           H4*        C  10   2.408 -12.710   3.638
  200    H3*    C  10           H3*        C  10   5.314 -13.565   3.256
  201    H2*    C  10           H2*        C  10   5.598 -11.247   2.450
  202   2HO*    C  10          H2**        C  10   3.821  -9.874   2.498
  203    H1*    C  10           H1*        C  10   4.670 -10.321   4.696
  204   1H4     C  10          H41         C  10  10.689 -11.643   6.219
  205   2H4     C  10          H42         C  10  10.246 -13.257   6.740
  206    H5     C  10           H5         C  10   8.054 -14.207   6.254
  207    H6     C  10           H6         C  10   5.834 -13.739   5.423
  208    H3T    C  10           H3T        C  10   3.747 -14.513   1.883
  Start of MODEL   10
    1   1H5*    G   1          H5*         G   1  17.834  -4.223   3.653
    2   2H5*    G   1          H5**        G   1  18.184  -3.582   2.033
    3    H4*    G   1           H4*        G   1  16.005  -2.487   1.957
    4    H3*    G   1           H3*        G   1  15.481  -3.776   4.687
    5    H2*    G   1           H2*        G   1  13.117  -3.430   3.961
    6   2HO*    G   1          H2**        G   1  14.211  -2.376   1.582
    7    H1*    G   1           H1*        G   1  13.649  -4.786   1.725
    8    H8     G   1           H8         G   1  16.128  -6.279   4.139
    9    H1     G   1           H1         G   1  10.174  -8.506   4.926
   10   1H2     G   1          H21         G   1   8.743  -7.259   3.799
   11   2H2     G   1          H22         G   1   9.224  -5.902   2.794
   12    H5T    G   1           H5T        G   1  17.328  -1.836   3.968
   13   1H5*    G   2          H5*         G   2  12.812  -0.609   3.772
   14   2H5*    G   2          H5**        G   2  12.510   0.433   5.180
   15    H4*    G   2           H4*        G   2  10.395  -0.367   4.160
   16    H3*    G   2           H3*        G   2  11.001  -1.530   6.927
   17    H2*    G   2           H2*        G   2   8.718  -2.408   6.787
   18   2HO*    G   2          H2**        G   2   7.364  -1.438   5.695
   19    H1*    G   2           H1*        G   2   9.185  -3.502   4.420
   20    H8     G   2           H8         G   2  12.589  -3.659   6.055
   21    H1     G   2           H1         G   2   8.607  -8.290   7.961
   22   1H2     G   2          H21         G   2   6.416  -7.776   7.177
   23   2H2     G   2          H22         G   2   6.120  -6.274   6.341
   24   1H5*    U   3          H5*         U   3   7.036   0.483   6.294
   25   2H5*    U   3          H5**        U   3   6.572   1.419   7.734
   26    H4*    U   3           H4*        U   3   4.750  -0.098   7.044
   27    H3*    U   3           H3*        U   3   6.122  -0.871   9.669
   28    H2*    U   3           H2*        U   3   4.289  -2.510   9.861
   29   2HO*    U   3          H2**        U   3   2.706  -1.226   8.891
   30    H1*    U   3           H1*        U   3   4.877  -3.527   7.496
   31    H3     U   3           H3         U   3   7.352  -6.326  10.103
   32    H5     U   3           H5         U   3   9.708  -2.892   9.764
   33    H6     U   3           H6         U   3   7.892  -1.800   8.673
   34   1H5*    G   4          H5*         G   4   1.958  -0.778  10.547
   35   2H5*    G   4          H5**        G   4   1.659   0.025  12.106
   36    H4*    G   4           H4*        G   4   0.863  -2.341  12.124
   37    H3*    G   4           H3*        G   4   3.235  -1.662  13.941
   38    H2*    G   4           H2*        G   4   3.072  -3.930  14.761
   39   2HO*    G   4          H2**        G   4   1.340  -4.957  14.697
   40    H1*    G   4           H1*        G   4   2.913  -4.993  12.306
   41    H8     G   4           H8         G   4   5.296  -2.158  11.677
   42    H1     G   4           H1         G   4   8.057  -7.296  14.303
   43   1H2     G   4          H21         G   4   6.340  -8.715  15.173
   44   2H2     G   4          H22         G   4   4.673  -8.356  14.816
   45   1H5*    U   5          H5*         U   5   0.631  -4.295  16.378
   46   2H5*    U   5          H5**        U   5   0.440  -3.410  17.909
   47    H4*    U   5           H4*        U   5   1.565  -5.546  18.352
   48    H3*    U   5           H3*        U   5   3.385  -3.087  18.516
   49    H2*    U   5           H2*        U   5   5.005  -4.592  19.520
   50   2HO*    U   5          H2**        U   5   3.976  -5.941  20.731
   51    H1*    U   5           H1*        U   5   4.658  -6.381  17.544
   52    H3     U   5           H3         U   5   8.509  -4.601  16.080
   53    H5     U   5           H5         U   5   5.717  -1.530  15.400
   54    H6     U   5           H6         U   5   4.065  -2.868  16.501
   55   1H5*    A   6          H5*         A   6   3.891  -4.345  22.415
   56   2H5*    A   6          H5**        A   6   3.624  -2.946  23.483
   57    H4*    A   6           H4*        A   6   5.890  -3.802  23.778
   58    H3*    A   6           H3*        A   6   5.834  -1.135  22.282
   59    H2*    A   6           H2*        A   6   8.257  -1.156  22.818
   60   2HO*    A   6          H2**        A   6   7.768  -3.659  24.027
   61    H1*    A   6           H1*        A   6   8.461  -3.551  21.673
   62    H8     A   6           H8         A   6   5.609  -2.269  19.653
   63   1H6     A   6          H61         A   6   8.095   0.431  16.461
   64   2H6     A   6          H62         A   6   9.802   0.764  16.261
   65    H2     A   6           H2         A   6  11.830  -0.644  20.011
   66   1H5*    G   7          H5*         G   7   8.478  -0.736  25.509
   67   2H5*    G   7          H5**        G   7   8.173   0.788  26.374
   68    H4*    G   7           H4*        G   7  10.533   0.612  25.669
   69    H3*    G   7           H3*        G   7   8.956   2.719  24.104
   70    H2*    G   7           H2*        G   7  11.195   3.394  23.353
   71   2HO*    G   7          H2**        G   7  12.745   3.104  24.535
   72    H1*    G   7           H1*        G   7  11.776   0.901  22.641
   73    H8     G   7           H8         G   7   8.079   1.086  21.970
   74    H1     G   7           H1         G   7  11.608   4.123  17.580
   75   1H2     G   7          H21         G   7  13.830   4.340  18.426
   76   2H2     G   7          H22         G   7  14.238   3.669  19.983
   77   1H5*    U   8          H5*         U   8  12.556   4.249  26.295
   78   2H5*    U   8          H5**        U   8  12.232   5.884  26.913
   79    H4*    U   8           H4*        U   8  14.328   5.802  25.616
   80    H3*    U   8           H3*        U   8  12.110   7.376  24.216
   81    H2*    U   8           H2*        U   8  14.007   8.055  22.720
   82   2HO*    U   8          H2**        U   8  15.601   7.866  24.458
   83    H1*    U   8           H1*        U   8  14.450   5.518  22.180
   84    H3     U   8           H3         U   8  11.502   6.692  18.861
   85    H5     U   8           H5         U   8   9.113   5.440  22.052
   86    H6     U   8           H6         U   8  11.047   5.378  23.434
   87   1H5*    A   9          H5*         A   9  15.411   9.573  24.289
   88   2H5*    A   9          H5**        A   9  15.347  11.245  24.873
   89    H4*    A   9           H4*        A   9  16.434  10.899  22.629
   90    H3*    A   9           H3*        A   9  15.144  13.188  23.073
   91    H2*    A   9           H2*        A   9  12.975  11.976  22.843
   92   2HO*    A   9          H2**        A   9  12.473  12.785  20.464
   93    H1*    A   9           H1*        A   9  14.088  11.274  20.111
   94    H8     A   9           H8         A   9  12.218   9.121  22.754
   95   1H6     A   9          H61         A   9   7.693   8.769  18.529
   96   2H6     A   9          H62         A   9   8.226   8.229  20.105
   97    H2     A   9           H2         A   9  10.831  11.546  16.961
   98    H3T    A   9           H3T        A   9  16.642  12.791  21.341
   99   1H5*    U   1          H5*         U   1   4.404  12.206  10.726
  100   2H5*    U   1          H5**        U   1   4.538  13.927  10.306
  101    H4*    U   1           H4*        U   1   6.970  13.805  10.388
  102    H3*    U   1           H3*        U   1   6.603  10.877  11.225
  103    H2*    U   1           H2*        U   1   8.867  11.258  12.140
  104   2HO*    U   1          H2**        U   1  10.056  12.589  11.354
  105    H1*    U   1           H1*        U   1   8.009  13.502  13.354
  106    H3     U   1           H3         U   1   8.469  10.349  16.595
  107    H5     U   1           H5         U   1   4.734   9.525  14.880
  108    H6     U   1           H6         U   1   5.207  11.156  13.185
  109    H5T    U   1           H5T        U   1   5.958  12.101   8.828
  110   1H5*    A   2          H5*         A   2  10.556  11.840   9.476
  111   2H5*    A   2          H5**        A   2  11.206  10.422   8.625
  112    H4*    A   2           H4*        A   2  12.812  11.312  10.263
  113    H3*    A   2           H3*        A   2  11.666   8.597  11.096
  114    H2*    A   2           H2*        A   2  13.547   8.718  12.740
  115   2HO*    A   2          H2**        A   2  14.953   9.932  11.350
  116    H1*    A   2           H1*        A   2  12.574  10.993  13.644
  117    H8     A   2           H8         A   2   9.476   9.365  12.186
  118   1H6     A   2          H61         A   2   8.941   6.473  17.626
  119   2H6     A   2          H62         A   2   8.185   6.746  16.070
  120    H2     A   2           H2         A   2  12.965   8.415  17.514
  121   1H5*    C   3          H5*         C   3  15.938   8.320  11.234
  122   2H5*    C   3          H5**        C   3  16.473   6.754  10.590
  123    H4*    C   3           H4*        C   3  17.278   7.122  12.911
  124    H3*    C   3           H3*        C   3  15.192   4.906  12.605
  125    H2*    C   3           H2*        C   3  15.669   4.419  14.947
  126   2HO*    C   3          H2**        C   3  17.400   4.889  15.755
  127    H1*    C   3           H1*        C   3  15.212   6.924  15.660
  128   1H4     C   3          H41         C   3   9.455   4.276  15.581
  129   2H4     C   3          H42         C   3   9.189   4.809  13.932
  130    H5     C   3           H5         C   3  10.948   5.911  12.631
  131    H6     C   3           H6         C   3  13.246   6.651  12.644
  132   1H5*    U   4          H5*         U   4  18.805   3.944  14.889
  133   2H5*    U   4          H5**        U   4  19.421   2.321  14.502
  134    H4*    U   4           H4*        U   4  19.183   2.654  16.947
  135    H3*    U   4           H3*        U   4  17.212   0.647  15.745
  136    H2*    U   4           H2*        U   4  16.721   0.126  18.101
  137   2HO*    U   4          H2**        U   4  18.920   0.597  18.840
  138    H1*    U   4           H1*        U   4  16.148   2.653  18.573
  139    H3     U   4           H3         U   4  12.127   0.630  17.657
  140    H5     U   4           H5         U   4  13.635   1.867  13.955
  141    H6     U   4           H6         U   4  15.693   2.400  15.003
  142   1H5*    A   5          H5*         A   5  18.815  -1.162  19.315
  143   2H5*    A   5          H5**        A   5  19.472  -2.727  18.780
  144    H4*    A   5           H4*        A   5  17.922  -3.072  20.646
  145    H3*    A   5           H3*        A   5  16.860  -3.979  17.925
  146    H2*    A   5           H2*        A   5  15.063  -5.002  19.230
  147   2HO*    A   5          H2**        A   5  15.630  -5.710  20.974
  148    H1*    A   5           H1*        A   5  14.552  -2.734  20.500
  149    H8     A   5           H8         A   5  15.921  -1.602  17.151
  150   1H6     A   5          H61         A   5  11.741  -1.580  14.648
  151   2H6     A   5          H62         A   5  10.115  -2.087  15.063
  152    H2     A   5           H2         A   5  10.262  -3.980  19.094
  153   1H5*    A   6          H5*         A   6  17.354  -7.537  20.590
  154   2H5*    A   6          H5**        A   6  17.599  -9.019  19.638
  155    H4*    A   6           H4*        A   6  15.486  -9.095  20.941
  156    H3*    A   6           H3*        A   6  15.136  -8.902  17.911
  157    H2*    A   6           H2*        A   6  12.772  -9.290  18.384
  158   2HO*    A   6          H2**        A   6  12.183 -10.197  20.009
  159    H1*    A   6           H1*        A   6  12.697  -7.212  20.018
  160    H8     A   6           H8         A   6  15.483  -6.464  17.514
  161   1H6     A   6          H61         A   6  12.632  -4.459  14.059
  162   2H6     A   6          H62         A   6  10.904  -4.617  13.774
  163    H2     A   6           H2         A   6   9.055  -6.470  17.354
  164   1H5*    C   7          H5*         C   7  12.818 -12.058  19.777
  165   2H5*    C   7          H5**        C   7  12.780 -13.509  18.752
  166    H4*    C   7           H4*        C   7  10.507 -12.796  19.372
  167    H3*    C   7           H3*        C   7  11.144 -12.322  16.417
  168    H2*    C   7           H2*        C   7   8.690 -11.991  16.274
  169   2HO*    C   7          H2**        C   7   8.689 -12.453  19.063
  170    H1*    C   7           H1*        C   7   8.867 -10.102  18.132
  171   1H4     C   7          H41         C   7  10.490  -6.929  12.874
  172   2H4     C   7          H42         C   7  12.164  -7.400  13.065
  173    H5     C   7           H5         C   7  12.923  -8.875  14.857
  174    H6     C   7           H6         C   7  12.220 -10.258  16.705
  175   1H5*    A   8          H5*         A   8   7.539 -14.505  16.776
  176   2H5*    A   8          H5**        A   8   7.471 -15.779  15.537
  177    H4*    A   8           H4*        A   8   5.495 -14.329  15.404
  178    H3*    A   8           H3*        A   8   7.431 -13.943  13.070
  179    H2*    A   8           H2*        A   8   5.513 -12.706  12.094
  180   2HO*    A   8          H2**        A   8   3.659 -12.472  13.325
  181    H1*    A   8           H1*        A   8   5.450 -11.139  14.209
  182    H8     A   8           H8         A   8   9.061 -12.341  14.090
  183   1H6     A   8          H61         A   8  10.082  -7.455  10.441
  184   2H6     A   8          H62         A   8  10.806  -8.833  11.236
  185    H2     A   8           H2         A   8   5.641  -7.868  10.962
  186   1H5*    C   9          H5*         C   9   3.602 -14.546  11.432
  187   2H5*    C   9          H5**        C   9   3.724 -15.669  10.061
  188    H4*    C   9           H4*        C   9   2.732 -13.543   9.333
  189    H3*    C   9           H3*        C   9   5.583 -14.001   8.320
  190    H2*    C   9           H2*        C   9   5.102 -12.065   6.906
  191   2HO*    C   9          H2**        C   9   3.261 -11.529   6.485
  192    H1*    C   9           H1*        C   9   4.458 -10.595   8.918
  193   1H4     C   9          H41         C   9  10.746 -10.024   9.049
  194   2H4     C   9          H42         C   9  10.947 -11.528   9.931
  195    H5     C   9           H5         C   9   9.014 -12.951  10.521
  196    H6     C   9           H6         C   9   6.633 -13.232  10.278
  197   1H5*    C  10          H5*         C  10   2.688 -13.082   5.174
  198   2H5*    C  10          H5**        C  10   3.130 -13.808   3.615
  199    H4*    C  10           H4*        C  10   2.917 -11.353   3.476
  200    H3*    C  10           H3*        C  10   5.792 -12.314   3.128
  201    H2*    C  10           H2*        C  10   6.211  -9.971   2.485
  202   2HO*    C  10          H2**        C  10   3.452  -9.569   2.999
  203    H1*    C  10           H1*        C  10   5.249  -9.143   4.756
  204   1H4     C  10          H41         C  10  11.143 -10.858   6.368
  205   2H4     C  10          H42         C  10  10.617 -12.492   6.725
  206    H5     C  10           H5         C  10   8.373 -13.275   6.193
  207    H6     C  10           H6         C  10   6.206 -12.640   5.335
  208    H3T    C  10           H3T        C  10   3.782 -11.638   1.272