*HEADER    RNA                                     29-MAR-06   2GIO              
*TITLE     SOLUTION STRUCTURE OF A PORTION OF THE 5'UTR OF HSPA MRNA             
*TITLE    2 OF BRADYRHIZOBIUM JAPONICUM                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 29-MER;                                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 OTHER_DETAILS: WT MICROROSE RNA                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE SEQUENCE FOR THIS RNA NATURALLY OCCURS            
*SOURCE   4 IN BRADYRHIZOBIUM JAPONICUM.                                         
*KEYWDS    G-G NON CANNONICAL PAIR                                               
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    S.CHOWDHURY, C.MARIS, F.H.ALLAIN, F.NARBERHAUS                        
*REVDAT   1   20-JUN-06 2GIO    0                                                


1  RGUA H8 1  RGUA H1' 3.7
1  RGUA H8 1  RGUA    H2' 4.5
1  RGUA H8 1  RGUA H3' 3.7
1  RGUA H8 1  RGUA H4' 5.0
1  RGUA H8 1  RGUA    Q5' 4.5
1  RGUA H1' 1  RGUA H8 3.7
#
2  RGUA H8 1  RGUA H8 5.0
2  RGUA H8 1  RGUA H1' 4.5
2  RGUA H8 1  RGUA    H2' 2.5
2  RGUA H8 1  RGUA H3' 3.0
2  RGUA H1' 1  RGUA    H2' 4.5
2  RGUA H8 2  RGUA H1' 3.7
2  RGUA H8 2  RGUA    H2' 4.5
2  RGUA H8 2  RGUA H3' 3.7
2  RGUA H8 2  RGUA H4' 5.0
2  RGUA H8 2  RGUA    Q5' 4.5
# 
3  RCYT H6 2  RGUA H1' 4.5
3  RCYT H6 2  RGUA    H2' 2.5
3  RCYT H6 2  RGUA H3' 3.0
3  RCYT H1' 2  RGUA    H2' 3.7
3  RCYT H5 2  RGUA    H2' 4.5
3  RCYT H5 2  RGUA H3' 3.7
3  RCYT H6 3  RCYT H1' 3.7
3  RCYT H6 3  RCYT    H2' 4.5
3  RCYT H6 3  RCYT H3' 3.7
3  RCYT H6 3  RCYT H4' 4.5
3  RCYT H6 3  RCYT    Q5' 4.5
# 
4  RCYT H6 3  RCYT H1' 5.0
4  RCYT H1' 3  RCYT    H2' 3.7
4  RCYT H6 3  RCYT    H2' 2.5
4  RCYT H6 3  RCYT H3' 3.0
4  RCYT H5 3  RCYT    H2' 4.5
4  RCYT H5 3  RCYT H3' 3.7
4  RCYT H6 4  RCYT H1' 3.7
4  RCYT H6 4  RCYT    H2' 4.5
4  RCYT H6 4  RCYT H3' 3.7
4  RCYT H6 4  RCYT H4' 4.5
4  RCYT H6 4  RCYT    H5' 4.5
4  RCYT H6 4  RCYT    Q5' 4.5
#
5  RADE H8 4  RCYT H6 5.0
5  RADE H8 4  RCYT H1' 4.5
5  RADE H8 4  RCYT    H2' 2.5
5  RADE H8 4  RCYT H3' 3.0
5  RADE H1' 4  RCYT H1' 5.0
5  RADE H1' 4  RCYT    H2' 4.5
5  RADE H8 5  RADE H1' 3.7
5  RADE H8 5  RADE    H2' 4.5
5  RADE H8 5  RADE H3' 3.7
5  RADE H8 5  RADE H4' 4.5
5  RADE H8 5  RADE Q5' 4.5
5  RADE H2 5  RADE H1' 5.0
5  RADE H2 5  RADE    H2' 6.0
5  RADE H8 6  RURA H6 5.0
5  RADE H2 6  RURA H1' 3.7
5  RADE H2 26 RGUA H1' 4.5
5  RADE H2 26 RGUA H8 6.0
#
6 RURA H6 5 RADE H1'     5.0
6 RURA H6 5 RADE H2'     3.0
6 RURA H6 5 RADE H3'     3.7
6 RURA H5 5 RADE H1'     6.0
6 RURA H5 5 RADE H2'     5.0
6 RURA H5 5 RADE H3'     6.0
6 RURA H5 5 RADE H8      4.5
6 RURA H1' 5 RADE H1'     6.0
6 RURA H1' 5 RADE H2'     5.0
6 RURA H6 6 RURA H1'     3.7
6 RURA H6 6 RURA H2'     4.5
6 RURA H6 6 RURA H3'     3.0
6 RURA H6 6 RURA H4'     4.5
6 RURA H6 6 RURA Q5'     4.5
6 RURA H1' 7 RCYT H5      6.0
6 RURA H5 7 RCYT H5      5.0
6 RURA H6 7 RCYT H5      4.5
#
7 RCYT H6 6 RURA H6 6.0
7 RCYT H6 6 RURA H1'     4.5
7 RCYT H6 6 RURA H2'     3.0
7 RCYT H6 6 RURA H3'     4.5
7 RCYT H1' 6 RURA H2'     6.0
7 RCYT H5 6 RURA H2'     4.5
7 RCYT H5 6 RURA H3'     4.5
7 RCYT H6 7 RCYT H1' 3.7
7 RCYT H6 7 RCYT H2' 4.5
7 RCYT H6 7 RCYT H3' 2.5
7 RCYT H6 7 RCYT H4'     5.0
7 RCYT H6 7 RCYT Q5'     5.0
7 RCYT H5 7 RCYT H2'     6.0
7 RCYT H5 7 RCYT H3'     5.0
7 RCYT H5 8 RURA H5      5.0
7 RCYT H6 8 RURA H6 5.0
#
8 RURA H6 7 RCYT H1'     4.5
8 RURA H6 7 RCYT H2'     2.5
8 RURA H6 7 RCYT H3'     3.7
8 RURA H1' 7 RCYT H2'     5.0
8 RURA H5 7 RCYT H6      4.5
8 RURA H5 7 RCYT H5      5.0
8 RURA H5 7 RCYT H2' 4.5
8 RURA H5 7 RCYT H3' 4.5
8 RURA H6 8 RURA H1'     3.7
8 RURA H6 8 RURA H2'     4.5
8 RURA H6 8 RURA H3' 3.7
8 RURA H6 8 RURA H4' 5.0
8 RURA H6 8 RURA Q5' 5.0
8 RURA H6 9 RURA H5      4.5
8 RURA H6 9 RURA H6 5.0
8 RURA H5 9 RURA H5      5.0
#
9 RURA H6 8 RURA H1'     4.5
9 RURA H6 8 RURA H2' 2.5
9 RURA H6 8 RURA H3' 3.7
9 RURA H1' 8 RURA H1' 6.0
9 RURA H1' 8 RURA H2' 5.0
9 RURA H5 8 RURA H2' 3.7
9 RURA H5 8 RURA H3' 4.5
9 RURA H6 9 RURA H1'     3.7
9 RURA H6 9 RURA H2' 4.5
9 RURA H6 9 RURA H3' 3.0
9 RURA H6 9 RURA H4' 5.0
9 RURA H6 9 RURA Q5' 5.0
9 RURA H5 9 RURA H3' 4.5
#
10 RGUA H1' 9 RURA H2'     5.0
10 RGUA H8 10 RGUA H1' 3.0
10 RGUA H8 10 RGUA H2' 3.0
10 RGUA H8 10 RGUA H3' 4.5
10 RGUA H8 10 RGUA Q5' 6.0
10 RGUA H1' 22 RADE H2 6.0
#
11 RCYT H6 10 RGUA H1'     4.5
11 RCYT H6 10 RGUA H2'     3.7
11 RCYT H6 10 RGUA H3'     4.5
11 RCYT H6 10 RGUA H4'     6.0
11 RCYT H1' 10 RGUA H2'     5.0
11 RCYT H6 11 RCYT H1'     3.7
11 RCYT H6 11 RCYT H2'     4.5
11 RCYT H6 11 RCYT H3'     3.7
11 RCYT H6 11 RCYT H4'     4.5
11 RCYT H6 11 RCYT Q5'     4.5
11 RCYT H6 12 RURA H5      4.5
11 RCYT H5 12 RURA H5      5.0
#
12 RURA H6 11 RCYT H1' 4.5
12 RURA H5 11 RCYT H2' 4.5
12 RURA H5 11 RCYT H3' 3.7
12 RURA H6 11 RCYT H2' 2.5
12 RURA H5 11 RCYT H5 5.0
12 RURA H5 11 RCYT H6 4.5
12 RURA H6 12 RURA H1' 3.7
12 RURA H6 12 RURA H2' 4.5
12 RURA H6 12 RURA H3' 3.7
12 RURA H6 12 RURA H4' 4.5
12 RURA H6 12 RURA Q5' 4.5
12 RURA H5 13 RCYT H5 5.0
12 RURA H6 13 RCYT H5 4.5
12 RURA H6 13 RCYT H6 5.0
#  
13 RCYT H6 12 RURA H1' 4.5
13 RCYT H6 12 RURA H2' 2.5
13 RCYT H6 12 RURA H3' 3.0
13 RCYT H6 13 RCYT H1' 3.7
13 RCYT H6 13 RCYT H2' 4.5
13 RCYT H6 13 RCYT H3' 3.7
13 RCYT H6 13 RCYT H4' 5.0
13 RCYT H6 13 RCYT Q5' 4.5
13 RCYT H5 14 RURA H5 5.0
13 RCYT H5 12 RURA H6 4.5
#  
14 RURA H5 14 RURA H3' 4.5
14 RURA H5 13 RURA H6 4.5
14 RURA H6 13 RCYT H6 5.0
14 RURA H6 13 RCYT H2' 2.5
14 RURA H6 13 RCYT H3' 3.7
14 RURA H6 13 RCYT H4' 6.0
14 RURA H6 13 RCYT H1' 5.0
14 RURA H6 14 RURA H1' 3.7
14 RURA H6 14 RURA H2' 3.7
14 RURA H6 14 RURA H3' 2.5
14 RURA H6 14 RURA H4' 4.5
14 RURA H6 14 RURA Q5' 5.0
#   
15 RURA H6 14 RURA H2' 4.5
15 RURA H6 14 RURA H3' 4.5
15 RURA H6 14 RURA H4' 3.0
15 RURA H6 14 RURA Q5' 4.5
15 RURA H5 14 RURA H1' 5.0
15 RURA H5 14 RURA H4' 2.5
15 RURA H5 14 RURA Q5' 3.7
15 RURA H6 15 RURA H1' 3.7
15 RURA H6 15 RURA H2' 2.5
15 RURA H6 15 RURA H3' 4.5
15 RURA H6 15 RURA H4' 4.5
15 RURA H6 15 RURA Q5' 4.5
15 RURA H6 16 RCYT H6 6.0
15 RURA H6 16 RCYT H5 5.0
15 RURA H1' 16 RCYT Q5' 4.5
#  
16 RCYT H5 15 RURA H1' 6.0
16 RCYT H5 15 RURA H2' 6.0
16 RCYT H5 15 RURA H3' 3.7
16 RCYT H5 15 RURA H6 6.0
16 RCYT H6 15 RURA H1' 6.0
16 RCYT H6 15 RURA H2' 3.7
16 RCYT H6 15 RURA H3' 2.5
16 RCYT H6 15 RURA H4' 4.5
16 RCYT H6 15 RURA Q5' 5.0
16 RCYT H6 16 RCYT H1' 3.7
16 RCYT H6 16 RCYT H2' 2.5
16 RCYT H6 16 RCYT H3' 4.5
16 RCYT H6 16 RCYT H4' 4.5
16 RCYT H6 16 RCYT Q5' 3.0
#   
17 RGUA H8 15 RURA H1' 6.0
17 RGUA H8 16 RCYT H4' 5.0
17 RGUA H8 16 RCYT Q5' 4.5
17 RGUA H8 16 RCYT Q5' 4.5
17 RGUA H8 17 RGUA H1' 2.5
17 RGUA H8 17 RGUA H2' 3.7
17 RGUA H8 17 RGUA H3' 6.0
17 RGUA H8 17 RGUA H4' 6.0
17 RGUA H8 17 RGUA Q5' 6.0
17 RGUA H8 18 RGUA H1' 3.7
17 RGUA H8 18 RGUA H4' 6.0
#   
18 RGUA H8 17 RGUA H1' 5.0
18 RGUA H8 17 RGUA H2' 2.5
18 RGUA H8 17 RGUA H3' 3.0
18 RGUA H8 17 RGUA H4' 5.0
18 RGUA H8 17 RGUA Q5' 6.0
18 RGUA H1' 17 RGUA H2' 4.5
18 RGUA H8 18 RGUA H1' 3.7
18 RGUA H8 18 RGUA H2' 4.5
18 RGUA H8 18 RGUA H3' 3.7
18 RGUA H8 18 RGUA H4' 4.5
18 RGUA H8 18 RGUA Q5' 4.5
#   
19 RADE H8 18 RGUA H1' 4.5
19 RADE H8 18 RGUA H2' 2.5
19 RADE H8 18 RGUA H3' 3.0
19 RADE H1' 18 RGUA H2' 4.5
19 RADE H8 18 RGUA H8 5.0
19 RADE H8 19 RADE H1' 3.7
19 RADE H8 19 RADE H2' 4.5
19 RADE H8 19 RADE H3' 3.7
19 RADE H8 19 RADE H4' 4.5
19 RADE H8 19 RADE Q5' 4.5
19 RADE H1' 20 RGUA H1' 5.0
19 RADE H1' 20 RGUA Q5' 5.0
19 RADE H8 20 RGUA H8 5.0
19 RADE H2 20 RGUA H1' 3.7
19 RADE H2 20 RGUA H8 6.0
19 RADE H2 13 RCYT H1' 4.5
19 RADE H2 13 RCYT H5 6.0
19 RADE H2 13 RCYT H6 6.0
#
20 RGUA H8 19 RADE H1' 4.5
20 RGUA H8 19 RADE H2' 2.5
20 RGUA H8 19 RADE H3' 3.0
20 RGUA H1' 19 RADE H2' 4.5
20 RGUA H1' 19 RADE H3' 6.0
20 RGUA H8 20 RGUA H1' 3.7
20 RGUA H8 20 RGUA H2' 4.5 
20 RGUA H8 20 RGUA H3' 3.7
20 RGUA H8 20 RGUA H4' 4.5
20 RGUA H8 20 RGUA Q5' 4.5
20 RGUA H8 21 RGUA H8 6.0
#
21 RGUA H8 20 RGUA H1' 5.0
21 RGUA H8 20 RGUA H2' 3.0
21 RGUA H8 20 RGUA H3' 3.7
21 RGUA H8 20 RGUA H4' 6.0
21 RGUA H8 20 RGUA Q5' 4.5
21 RGUA H1' 20 RGUA H2' 4.5
21 RGUA H8 21 RGUA H1' 3.7
21 RGUA H8 21 RGUA H2' 3.7
21 RGUA H8 21 RGUA H3' 3.7
21 RGUA H8 21 RGUA H4' 4.5
21 RGUA H8 21 RGUA Q5' 4.5
#
22 RADE H8 21 RGUA H8 5.0
22 RADE H8 21 RGUA H1'     5.0
22 RADE H8 21 RGUA H2' 2.5
22 RADE H8 21 RGUA H3'     3.7
22 RADE H8 21 RGUA H4'     6.0
22 RADE H1' 21 RGUA H2'     4.5
22 RADE H8 22 RADE H1'     3.7
22 RADE H8 22 RADE H2'     4.5
22 RADE H8 22 RADE H3' 3.7
22 RADE H8 22 RADE H4' 4.5
22 RADE H8 22 RADE Q5' 4.5
22 RADE H2 22 RADE H1' 6.0
22 RADE H1' 23 RURA H1' 6.0
22 RADE H8 23 RURA H6 6.0
22 RADE H2 23 RURA H6 6.0
22 RADE H2 23 RURA H1' 3.7
22 RADE H2 23 RURA H2' 6.0
#
23 RURA H6 22 RADE H8      5.0
23 RURA H6 22 RADE H1'     4.5
23 RURA H6 22 RADE H2' 2.5
23 RURA H6 22 RADE H3' 3.0
23 RURA H1' 22 RADE H2' 4.5
23 RURA H1' 22 RADE H3' 6.0
23 RURA H5 22 RADE H8      4.5
23 RURA H5 22 RADE H2' 4.5
23 RURA H5 22 RADE H3' 4.5
23 RURA H6 23 RURA H1' 3.7
23 RURA H6 23 RURA H2' 4.5
23 RURA H6 23 RURA H3' 3.7
23 RURA H6 23 RURA H4' 4.5
23 RURA H6 23 RURA Q5' 4.5
23 RURA H5 23 RURA H2' 6.0
23 RURA H1' 24 RURA H1' 6.0
23 RURA H6 24 RURA H6 5.0
23 RURA H5 24 RURA H5      5.0
#
24 RURA H6 23 RURA H1'     5.0
24 RURA H6 23 RURA H2'     2.5
24 RURA H5 23 RURA H2' 4.5
24 RURA H5 23 RURA H3' 4.5
24 RURA H5 23 RURA H6      5.0
24 RURA H6 24 RURA H1' 3.7
24 RURA H6 24 RURA H2' 4.5
24 RURA H6 24 RURA H3' 3.7
24 RURA H6 24 RURA H4' 4.5
24 RURA H6 24 RURA H5' 4.5
24 RURA H6 25 RURA H6 5.0
24 RURA H6 25 RURA H5 4.5
#
25 RURA H6 24 RURA H1' 5.0
25 RURA H6 24 RURA H2' 2.5
25 RURA H6 24 RURA H3' 3.7
25 RURA H1' 24 RURA H2' 4.5
25 RURA H5 24 RURA H5 5.0
25 RURA H5 24 RURA H2' 4.5
25 RURA H5 24 RURA H3' 4.5
25 RURA H6 25 RURA H1' 3.7
25 RURA H6 25 RURA H2' 4.5
25 RURA H6 25 RURA H3' 3.7
25 RURA H6 25 RURA H4' 4.5
25 RURA H6 25 RURA Q5' 4.5
25 RURA H1' 25 RURA H5 6.0
25 RURA H5 25 RURA H2' 6.0
25 RURA H1' 26 RGUA H1' 6.0
#  
26 RGUA H8 25 RURA H6 5.0
26 RGUA H8 25 RURA H1' 4.5
26 RGUA H8 25 RURA H2' 2.5
26 RGUA H8 25 RURA H3' 3.7
26 RGUA H1' 25 RURA H2' 4.5
26 RGUA H8 26 RGUA H1' 3.7
26 RGUA H8 26 RGUA H2' 4.5
26 RGUA H8 26 RGUA H3' 3.7
26 RGUA H8 26 RGUA H4' 4.5
26 RGUA H8 26 RGUA Q5' 4.5
26 RGUA H8 27 RGUA H8 5.0
#   
27 RGUA H8 26 RGUA H8 5.0
27 RGUA H8 26 RGUA H1' 4.5
27 RGUA H8 26 RGUA H2' 2.5
27 RGUA H8 26 RGUA H3' 3.0
27 RGUA H8 27 RGUA H1' 3.7
27 RGUA H8 27 RGUA H2' 4.5
27 RGUA H8 27 RGUA H3' 3.7
27 RGUA H8 27 RGUA H4' 4.5
27 RGUA H8 27 RGUA Q5' 4.5
27 RGUA H2' 28 RCYT H1' 3.7
27 RGUA H8 28 RCYT H6 5.0
27 RGUA H8 28 RCYT H5 4.5
#   
28 RCYT H6 27 RGUA H8 5.0
28 RCYT H6 27 RGUA H1' 4.5
28 RCYT H6 27 RGUA H2' 2.5
28 RCYT H6 27 RGUA H3' 3.0
28 RCYT H6 27 RGUA H4' 5.0
28 RCYT H5 27 RGUA H1' 6.0
28 RCYT H5 27 RGUA H2' 4.5
28 RCYT H5 27 RGUA H3' 3.7
28 RCYT H6 28 RCYT H1' 3.7
28 RCYT H6 28 RCYT H2' 4.5
28 RCYT H6 28 RCYT H3' 3.7
28 RCYT H6 28 RCYT H4' 4.5
28 RCYT H6 28 RCYT Q5' 4.5
28 RCYT H1' 28 RCYT H5 6.0
28 RCYT H6 29 RCYT H5 4.5
28 RCYT H5 29 RCYT H5 5.0
#   
29 RCYT H6 28 RCYT H6 5.0
29 RCYT H6 28 RCYT H1' 4.5
29 RCYT H6 28 RCYT H2' 2.5
29 RCYT H6 28 RCYT H3' 3.0
29 RCYT H5 28 RCYT H2' 4.5
29 RCYT H5 28 RCYT H3' 3.7
29 RCYT H6 29 RCYT H1' 3.7
29 RCYT H6 29 RCYT H2' 4.5
29 RCYT H6 29 RCYT H3' 3.7
29 RCYT H6 29 RCYT H4' 4.5
29 RCYT H6 29 RCYT Q5' 5.0
#
1       RGUA    H21     29      RCYT O2 2.0 
1       RGUA    N2      29      RCYT O2 3.0 
1       RGUA    H1      29      RCYT N3 2.0 
1       RGUA    N1      29      RCYT N3 3.0 
1       RGUA    O6      29      RCYT H41 2.0 
1       RGUA    O6      29      RCYT N4 3.0 
2       RGUA    H21     28      RCYT O2 2.0 
2       RGUA    N2      28      RCYT O2 3.0 
2       RGUA    H1      28      RCYT N3 2.0 
2       RGUA    N1      28      RCYT N3 3.0 
2       RGUA    O6      28      RCYT H41 2.0 
2       RGUA    O6      28      RCYT N4 3.0 
3       RCYT    O2      27      RGUA H21 2.0
3       RCYT    O2      27      RGUA N2 3.0
3       RCYT    N3      27      RGUA H1 2.0
3       RCYT    N3      27      RGUA N1 3.0
3       RCYT    H41     27      RGUA O6 2.0
3       RCYT    N4      27      RGUA O6 3.0
4       RCYT    O2      26      RGUA H21 2.0
4       RCYT    O2      26      RGUA N2 3.0
4       RCYT    N3      26      RGUA H1 2.0
4       RCYT    N3      26      RGUA N1 3.0
4       RCYT    H41     26      RGUA O6 2.0
4       RCYT    N4      26      RGUA O6 3.0
5       RADE N1 25      RURA    H3 2.0
5       RADE N1 25      RURA    N3 3.0
5       RADE H61 25      RURA    O4 2.0
5       RADE N6 25      RURA    O4 3.0
6       RURA O2 24      RURA    H3 2.0
6       RURA O2 24      RURA    N3 3.0
6       RURA H3 24      RURA    O4 2.0
6       RURA N3 24      RURA    O4 3.0
10      RGUA    N7 21 RGUA H21 2.0
10      RGUA    N7 21 RGUA N2  3.0
10      RGUA    O6 21 RGUA H1  2.0
10      RGUA    O6 21 RGUA N1  3.0
11 RCYT H41 20 RGUA O6 2.0
11 RCYT N4 20 RGUA O6 3.0
11 RCYT N3 20 RGUA H1 2.0
11 RCYT N3 20 RGUA N1 3.0
11 RCYT O2 20 RGUA H21 2.0
11 RCYT O2 20 RGUA N2 3.0
12 RURA H3 19 RADE N1 2.0
12 RURA N3 19 RADE N1 3.0
12 RURA O4 19 RADE H61 2.0
12 RURA O4 19 RADE N6 3.0
13 RCYT O2 18 RGUA H21 2.0
13 RCYT O2 18 RGUA N2 3.0
13 RCYT N3 18 RGUA H1 2.0
13 RCYT N3 18 RGUA N1 3.0
13 RCYT H41 18 RGUA O6 2.0
13 RCYT N4 18 RGUA O6 3.0
14 RURA O2 17 RGUA H1 2.0
14 RURA O2 17 RGUA N1 3.0
14 RURA O2 17 RGUA H21 2.0
14 RURA O2 17 RGUA N2 3.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -6.950 -14.214 -10.249
    2   2H5*    G   1          2H5*        G   1  -7.115 -12.688  -9.358
    3    H4*    G   1           H4*        G   1  -8.616 -14.360  -8.415
    4    H3*    G   1           H3*        G   1  -6.252 -13.727  -6.617
    5    H2*    G   1           H2*        G   1  -7.498 -14.984  -4.937
    6   2HO*    G   1          2HO*        G   1  -9.620 -14.247  -5.643
    7    H1*    G   1           H1*        G   1  -7.975 -17.058  -6.618
    8    H8     G   1           H8         G   1  -4.637 -15.918  -7.796
    9    H1     G   1           H1         G   1  -4.363 -18.812  -2.077
   10   1H2     G   1          1H2         G   1  -6.404 -18.997  -1.226
   11   2H2     G   1          2H2         G   1  -7.822 -18.450  -2.102
   12    H5T    G   1           H5T        G   1  -5.037 -14.606  -9.177
   13   1H5*    G   2          1H5*        G   2  -9.769 -13.074  -4.406
   14   2H5*    G   2          2H5*        G   2  -9.673 -11.576  -3.459
   15    H4*    G   2           H4*        G   2 -10.253 -13.495  -2.025
   16    H3*    G   2           H3*        G   2  -7.505 -12.292  -1.603
   17    H2*    G   2           H2*        G   2  -7.411 -13.715   0.407
   18   2HO*    G   2          2HO*        G   2  -9.691 -13.491   0.923
   19    H1*    G   2           H1*        G   2  -8.212 -15.923  -0.928
   20    H8     G   2           H8         G   2  -6.301 -14.116  -3.585
   21    H1     G   2           H1         G   2  -2.529 -16.785   0.873
   22   1H2     G   2          1H2         G   2  -3.745 -17.371   2.639
   23   2H2     G   2          2H2         G   2  -5.481 -17.126   2.680
   24   1H5*    C   3          1H5*        C   3  -9.465 -12.243   2.035
   25   2H5*    C   3          2H5*        C   3  -9.181 -10.768   2.978
   26    H4*    C   3           H4*        C   3  -8.489 -12.810   4.214
   27    H3*    C   3           H3*        C   3  -6.251 -10.945   3.366
   28    H2*    C   3           H2*        C   3  -4.839 -12.331   4.810
   29   2HO*    C   3          2HO*        C   3  -6.461 -12.698   6.451
   30    H1*    C   3           H1*        C   3  -5.815 -14.669   3.756
   31   1H4     C   3          1H4         C   3  -0.791 -13.127   0.200
   32   2H4     C   3          2H4         C   3  -1.844 -12.325  -0.951
   33    H5     C   3           H5         C   3  -4.239 -12.001  -0.545
   34    H6     C   3           H6         C   3  -6.037 -12.405   1.017
   35   1H5*    C   4          1H5*        C   4  -6.004 -11.291   7.500
   36   2H5*    C   4          2H5*        C   4  -5.570  -9.760   8.291
   37    H4*    C   4           H4*        C   4  -3.897 -11.521   8.770
   38    H3*    C   4           H3*        C   4  -2.922  -9.311   6.932
   39    H2*    C   4           H2*        C   4  -0.722 -10.308   7.305
   40   2HO*    C   4          2HO*        C   4  -1.080 -10.896   9.537
   41    H1*    C   4           H1*        C   4  -1.632 -12.831   6.820
   42   1H4     C   4          1H4         C   4   0.420 -10.559   1.277
   43   2H4     C   4          2H4         C   4  -1.134  -9.806   0.961
   44    H5     C   4           H5         C   4  -2.962  -9.819   2.598
   45    H6     C   4           H6         C   4  -3.605 -10.524   4.822
   46   1H5*    A   5          1H5*        A   5  -0.341  -9.569  10.337
   47   2H5*    A   5          2H5*        A   5   0.366  -7.997  10.751
   48    H4*    A   5           H4*        A   5   2.081  -9.758  10.242
   49    H3*    A   5           H3*        A   5   1.944  -7.379   8.367
   50    H2*    A   5           H2*        A   5   3.997  -8.293   7.392
   51   2HO*    A   5          2HO*        A   5   4.814  -9.095   9.486
   52    H1*    A   5           H1*        A   5   2.974 -10.789   7.173
   53    H8     A   5           H8         A   5  -0.022  -8.610   6.575
   54   1H6     A   5          1H6         A   5   2.338  -7.778   0.864
   55   2H6     A   5          2H6         A   5   0.907  -7.545   1.854
   56    H2     A   5           H2         A   5   5.458  -9.595   3.408
   57   1H5*    U   6          1H5*        U   6   5.866  -7.795   8.793
   58   2H5*    U   6          2H5*        U   6   6.614  -6.277   9.330
   59    H4*    U   6           H4*        U   6   7.690  -7.067   7.269
   60    H3*    U   6           H3*        U   6   5.957  -4.600   6.975
   61    H2*    U   6           H2*        U   6   6.912  -4.406   4.762
   62   2HO*    U   6          2HO*        U   6   9.061  -5.005   5.238
   63    H1*    U   6           H1*        U   6   6.660  -7.077   4.190
   64    H3     U   6           H3         U   6   3.517  -4.983   1.642
   65    H5     U   6           H5         U   6   1.845  -5.100   5.497
   66    H6     U   6           H6         U   6   3.956  -5.924   6.327
   67   1H5*    C   7          1H5*        C   7  10.376  -4.223   5.950
   68   2H5*    C   7          2H5*        C   7  10.906  -2.602   6.438
   69    H4*    C   7           H4*        C   7  11.712  -3.088   4.183
   70    H3*    C   7           H3*        C   7   9.488  -1.023   4.303
   71    H2*    C   7           H2*        C   7   9.971  -0.624   1.978
   72   2HO*    C   7          2HO*        C   7  12.257  -0.797   2.090
   73    H1*    C   7           H1*        C   7  10.120  -3.282   1.334
   74   1H4     C   7          1H4         C   7   3.989  -2.019   0.312
   75   2H4     C   7          2H4         C   7   3.642  -2.170   2.020
   76    H5     C   7           H5         C   7   5.382  -2.460   3.710
   77    H6     C   7           H6         C   7   7.765  -2.678   4.054
   78   1H5*    U   8          1H5*        U   8  11.978   3.181   2.316
   79   2H5*    U   8          2H5*        U   8  10.409   2.368   2.135
   80    H4*    U   8           H4*        U   8  12.865   1.921   0.378
   81    H3*    U   8           H3*        U   8  10.270   3.437   0.072
   82    H2*    U   8           H2*        U   8  10.225   2.801  -2.270
   83   2HO*    U   8          2HO*        U   8  12.580   2.981  -2.518
   84    H1*    U   8           H1*        U   8  10.783   0.203  -1.832
   85    H3     U   8           H3         U   8   6.301   0.538  -2.650
   86    H5     U   8           H5         U   8   6.722   0.943   1.512
   87    H6     U   8           H6         U   8   9.109   1.102   1.207
   88   1H5*    U   9          1H5*        U   9  12.300   4.411  -3.415
   89   2H5*    U   9          2H5*        U   9  12.193   6.156  -3.717
   90    H4*    U   9           H4*        U   9  11.241   4.929  -5.610
   91    H3*    U   9           H3*        U   9   9.196   6.351  -3.881
   92    H2*    U   9           H2*        U   9   7.607   5.812  -5.631
   93   2HO*    U   9          2HO*        U   9   8.993   6.140  -7.432
   94    H1*    U   9           H1*        U   9   8.429   3.213  -5.831
   95    H3     U   9           H3         U   9   4.425   3.195  -3.631
   96    H5     U   9           H5         U   9   7.227   4.257  -0.693
   97    H6     U   9           H6         U   9   8.916   4.345  -2.413
   98   1H5*    G  10          1H5*        G  10   7.218   9.755  -7.506
   99   2H5*    G  10          2H5*        G  10   6.493   8.728  -6.252
  100    H4*    G  10           H4*        G  10   6.851   7.953  -9.185
  101    H3*    G  10           H3*        G  10   4.478   8.847  -7.518
  102    H2*    G  10           H2*        G  10   3.106   7.472  -8.979
  103   2HO*    G  10          2HO*        G  10   4.363   7.982 -10.923
  104    H1*    G  10           H1*        G  10   4.794   5.339  -8.869
  105    H8     G  10           H8         G  10   2.170   5.013  -8.041
  106    H1     G  10           H1         G  10   4.091   6.674  -2.148
  107   1H2     G  10          1H2         G  10   6.084   7.673  -2.250
  108   2H2     G  10          2H2         G  10   6.907   7.932  -3.775
  109   1H5*    C  11          1H5*        C  11   2.583   8.839 -10.890
  110   2H5*    C  11          2H5*        C  11   1.882  10.436 -11.226
  111    H4*    C  11           H4*        C  11   0.095   8.789 -11.237
  112    H3*    C  11           H3*        C  11   0.140  10.577  -8.791
  113    H2*    C  11           H2*        C  11  -2.021   9.609  -8.247
  114   2HO*    C  11          2HO*        C  11  -3.001   8.146  -9.693
  115    H1*    C  11           H1*        C  11  -1.196   7.060  -8.661
  116   1H4     C  11          1H4         C  11   0.027   8.488  -2.578
  117   2H4     C  11          2H4         C  11   1.682   8.890  -2.998
  118    H5     C  11           H5         C  11   2.482   8.916  -5.316
  119    H6     C  11           H6         C  11   1.836   8.590  -7.623
  120   1H5*    U  12          1H5*        U  12  -3.719  10.760 -10.414
  121   2H5*    U  12          2H5*        U  12  -4.300  12.431 -10.529
  122    H4*    U  12           H4*        U  12  -5.950  11.065  -9.356
  123    H3*    U  12           H3*        U  12  -4.455  13.009  -7.559
  124    H2*    U  12           H2*        U  12  -6.119  12.435  -5.897
  125   2HO*    U  12          2HO*        U  12  -7.840  11.047  -6.445
  126    H1*    U  12           H1*        U  12  -5.870   9.759  -6.319
  127    H3     U  12           H3         U  12  -3.682  10.820  -2.440
  128    H5     U  12           H5         U  12  -0.867  11.408  -5.501
  129    H6     U  12           H6         U  12  -2.638  11.110  -7.113
  130   1H5*    C  13          1H5*        C  13  -8.478  13.712  -6.946
  131   2H5*    C  13          2H5*        C  13  -8.832  15.454  -6.931
  132    H4*    C  13           H4*        C  13  -9.608  14.416  -4.839
  133    H3*    C  13           H3*        C  13  -7.168  16.203  -4.577
  134    H2*    C  13           H2*        C  13  -7.444  15.960  -2.197
  135   2HO*    C  13          2HO*        C  13  -9.811  16.072  -2.303
  136    H1*    C  13           H1*        C  13  -7.976  13.254  -2.316
  137   1H4     C  13          1H4         C  13  -1.854  14.086  -0.881
  138   2H4     C  13          2H4         C  13  -1.418  14.151  -2.579
  139    H5     C  13           H5         C  13  -3.109  14.127  -4.370
  140    H6     C  13           H6         C  13  -5.482  14.033  -4.834
  141   1H5*    U  14          1H5*        U  14  -9.005  17.703  -1.591
  142   2H5*    U  14          2H5*        U  14  -9.026  19.479  -1.630
  143    H4*    U  14           H4*        U  14  -7.780  18.694   0.336
  144    H3*    U  14           H3*        U  14  -6.048  19.903  -1.834
  145    H2*    U  14           H2*        U  14  -4.265  19.808  -0.190
  146   2HO*    U  14          2HO*        U  14  -4.816  18.945   1.935
  147    H1*    U  14           H1*        U  14  -4.845  17.238   0.549
  148    H3     U  14           H3         U  14  -1.035  17.177  -1.984
  149    H5     U  14           H5         U  14  -4.173  17.364  -4.772
  150    H6     U  14           H6         U  14  -5.713  17.676  -2.926
  151   1H5*    U  15          1H5*        U  15  -4.082  22.973   1.295
  152   2H5*    U  15          2H5*        U  15  -5.079  21.593   1.778
  153    H4*    U  15           H4*        U  15  -4.906  24.326   3.102
  154    H3*    U  15           H3*        U  15  -3.336  22.130   3.446
  155    H2*    U  15           H2*        U  15  -5.140  20.586   3.598
  156   2HO*    U  15          2HO*        U  15  -4.450  21.367   6.255
  157    H1*    U  15           H1*        U  15  -6.412  22.467   5.590
  158    H3     U  15           H3         U  15  -9.920  19.721   6.256
  159    H5     U  15           H5         U  15  -9.116  19.221   2.163
  160    H6     U  15           H6         U  15  -7.259  20.763   2.399
  161   1H5*    C  16          1H5*        C  16  -1.895  21.363   5.907
  162   2H5*    C  16          2H5*        C  16  -0.881  22.508   6.797
  163    H4*    C  16           H4*        C  16   0.381  20.548   6.346
  164    H3*    C  16           H3*        C  16   1.365  23.037   5.764
  165    H2*    C  16           H2*        C  16   0.433  22.992   3.503
  166   2HO*    C  16          2HO*        C  16   3.170  22.205   3.406
  167    H1*    C  16           H1*        C  16   1.745  20.264   3.263
  168   1H4     C  16          1H4         C  16  -1.251  20.343  -2.362
  169   2H4     C  16          2H4         C  16  -2.700  21.013  -1.636
  170    H5     C  16           H5         C  16  -2.859  21.565   0.735
  171    H6     C  16           H6         C  16  -1.626  21.648   2.829
  172   1H5*    G  17          1H5*        G  17   3.406  17.500   6.786
  173   2H5*    G  17          2H5*        G  17   2.238  17.033   5.534
  174    H4*    G  17           H4*        G  17   1.657  18.172   8.285
  175    H3*    G  17           H3*        G  17   0.619  15.845   6.613
  176    H2*    G  17           H2*        G  17  -1.256  15.885   8.115
  177   2HO*    G  17          2HO*        G  17   0.091  16.182  10.037
  178    H1*    G  17           H1*        G  17  -1.205  18.695   8.316
  179    H8     G  17           H8         G  17  -3.640  17.796   8.129
  180    H1     G  17           H1         G  17  -2.914  17.141   1.795
  181   1H2     G  17          1H2         G  17  -0.817  17.328   1.254
  182   2H2     G  17          2H2         G  17   0.450  17.555   2.451
  183   1H5*    G  18          1H5*        G  18  -0.780  14.325   9.739
  184   2H5*    G  18          2H5*        G  18  -0.531  12.568   9.766
  185    H4*    G  18           H4*        G  18  -2.918  13.089   9.564
  186    H3*    G  18           H3*        G  18  -1.695  11.929   7.044
  187    H2*    G  18           H2*        G  18  -3.993  11.790   6.231
  188   2HO*    G  18          2HO*        G  18  -5.707  12.441   7.587
  189    H1*    G  18           H1*        G  18  -4.511  14.385   6.827
  190    H8     G  18           H8         G  18  -0.821  14.350   6.161
  191    H1     G  18           H1         G  18  -4.316  13.872   0.805
  192   1H2     G  18          1H2         G  18  -6.443  13.570   1.319
  193   2H2     G  18          2H2         G  18  -6.996  13.452   2.979
  194   1H5*    A  19          1H5*        A  19  -5.090   9.753   8.040
  195   2H5*    A  19          2H5*        A  19  -4.919   8.006   7.791
  196    H4*    A  19           H4*        A  19  -6.871   8.903   6.574
  197    H3*    A  19           H3*        A  19  -4.581   7.969   4.817
  198    H2*    A  19           H2*        A  19  -6.182   8.212   2.992
  199   2HO*    A  19          2HO*        A  19  -8.080   7.575   4.193
  200    H1*    A  19           H1*        A  19  -6.831  10.719   3.710
  201    H8     A  19           H8         A  19  -3.285  10.487   4.896
  202   1H6     A  19          1H6         A  19  -1.579  11.068  -1.045
  203   2H6     A  19          2H6         A  19  -1.010  11.048   0.614
  204    H2     A  19           H2         A  19  -5.968  10.414  -0.930
  205   1H5*    G  20          1H5*        G  20  -8.201   5.925   3.831
  206   2H5*    G  20          2H5*        G  20  -7.908   4.316   3.123
  207    H4*    G  20           H4*        G  20  -9.186   6.004   1.677
  208    H3*    G  20           H3*        G  20  -6.748   4.479   0.783
  209    H2*    G  20           H2*        G  20  -7.028   5.466  -1.405
  210   2HO*    G  20          2HO*        G  20  -9.370   5.323  -1.380
  211    H1*    G  20           H1*        G  20  -7.468   8.008  -0.499
  212    H8     G  20           H8         G  20  -4.986   6.975   2.011
  213    H1     G  20           H1         G  20  -2.336   7.604  -3.796
  214   1H2     G  20          1H2         G  20  -3.897   7.531  -5.358
  215   2H2     G  20          2H2         G  20  -5.600   7.399  -4.960
  216   1H5*    G  21          1H5*        G  21  -9.156   3.364  -2.165
  217   2H5*    G  21          2H5*        G  21  -9.136   1.605  -2.438
  218    H4*    G  21           H4*        G  21  -8.214   2.742  -4.404
  219    H3*    G  21           H3*        G  21  -6.154   1.318  -2.685
  220    H2*    G  21           H2*        G  21  -4.549   1.849  -4.354
  221   2HO*    G  21          2HO*        G  21  -5.870   1.464  -6.213
  222    H1*    G  21           H1*        G  21  -5.339   4.441  -4.656
  223    H8     G  21           H8         G  21  -5.688   3.368  -1.028
  224    H1     G  21           H1         G  21   0.304   4.811  -2.825
  225   1H2     G  21          1H2         G  21   0.371   5.045  -5.058
  226   2H2     G  21          2H2         G  21  -1.075   4.878  -6.029
  227   1H5*    A  22          1H5*        A  22  -4.004  -2.157  -5.765
  228   2H5*    A  22          2H5*        A  22  -3.440  -0.949  -4.589
  229    H4*    A  22           H4*        A  22  -3.549  -0.526  -7.611
  230    H3*    A  22           H3*        A  22  -1.396  -1.467  -5.724
  231    H2*    A  22           H2*        A  22   0.243  -0.149  -6.893
  232   2HO*    A  22          2HO*        A  22  -1.862   0.378  -8.762
  233    H1*    A  22           H1*        A  22  -1.187   2.108  -6.917
  234    H8     A  22           H8         A  22  -2.563   0.805  -3.743
  235   1H6     A  22          1H6         A  22   2.959   2.108  -1.173
  236   2H6     A  22          2H6         A  22   1.300   1.659  -0.826
  237    H2     A  22           H2         A  22   3.381   2.394  -5.567
  238   1H5*    U  23          1H5*        U  23   0.818  -1.448  -8.839
  239   2H5*    U  23          2H5*        U  23   1.495  -3.051  -9.192
  240    H4*    U  23           H4*        U  23   3.325  -1.461  -8.920
  241    H3*    U  23           H3*        U  23   2.976  -3.408  -6.622
  242    H2*    U  23           H2*        U  23   5.128  -2.571  -5.835
  243   2HO*    U  23          2HO*        U  23   6.002  -2.300  -8.033
  244    H1*    U  23           H1*        U  23   4.430   0.036  -6.157
  245    H3     U  23           H3         U  23   4.346  -1.159  -1.722
  246    H5     U  23           H5         U  23   0.479  -1.915  -3.179
  247    H6     U  23           H6         U  23   1.287  -1.454  -5.412
  248   1H5*    U  24          1H5*        U  24   6.897  -3.670  -7.566
  249   2H5*    U  24          2H5*        U  24   7.394  -5.351  -7.855
  250    H4*    U  24           H4*        U  24   8.852  -4.244  -6.186
  251    H3*    U  24           H3*        U  24   7.054  -6.448  -5.130
  252    H2*    U  24           H2*        U  24   8.415  -6.290  -3.120
  253   2HO*    U  24          2HO*        U  24  10.431  -5.938  -4.272
  254    H1*    U  24           H1*        U  24   8.365  -3.515  -3.122
  255    H3     U  24           H3         U  24   5.881  -5.319   0.345
  256    H5     U  24           H5         U  24   3.231  -4.641  -2.844
  257    H6     U  24           H6         U  24   5.138  -4.282  -4.287
  258   1H5*    U  25          1H5*        U  25  10.835  -7.802  -4.000
  259   2H5*    U  25          2H5*        U  25  10.961  -9.540  -4.351
  260    H4*    U  25           H4*        U  25  11.351  -9.161  -1.970
  261    H3*    U  25           H3*        U  25   8.647 -10.410  -2.557
  262    H2*    U  25           H2*        U  25   8.562 -10.780  -0.139
  263   2HO*    U  25          2HO*        U  25  10.828 -11.235   0.139
  264    H1*    U  25           H1*        U  25   9.314  -8.226   0.415
  265    H3     U  25           H3         U  25   4.873  -8.338   1.254
  266    H5     U  25           H5         U  25   5.086  -8.219  -2.934
  267    H6     U  25           H6         U  25   7.488  -8.430  -2.759
  268   1H5*    G  26          1H5*        G  26  10.923 -12.941   0.142
  269   2H5*    G  26          2H5*        G  26  10.592 -14.652  -0.183
  270    H4*    G  26           H4*        G  26  10.265 -14.085   2.200
  271    H3*    G  26           H3*        G  26   7.731 -14.819   0.697
  272    H2*    G  26           H2*        G  26   6.737 -14.917   2.928
  273   2HO*    G  26          2HO*        G  26   8.635 -15.763   4.011
  274    H1*    G  26           H1*        G  26   7.729 -12.499   3.636
  275    H8     G  26           H8         G  26   7.171 -12.188  -0.061
  276    H1     G  26           H1         G  26   1.733 -11.995   3.338
  277   1H2     G  26          1H2         G  26   2.118 -12.682   5.413
  278   2H2     G  26          2H2         G  26   3.722 -13.142   5.950
  279   1H5*    G  27          1H5*        G  27   8.202 -17.452   3.991
  280   2H5*    G  27          2H5*        G  27   7.692 -19.107   3.601
  281    H4*    G  27           H4*        G  27   6.482 -18.237   5.579
  282    H3*    G  27           H3*        G  27   4.808 -18.671   3.109
  283    H2*    G  27           H2*        G  27   2.912 -18.262   4.630
  284   2HO*    G  27          2HO*        G  27   3.310 -17.947   6.844
  285    H1*    G  27           H1*        G  27   4.001 -16.004   5.647
  286    H8     G  27           H8         G  27   5.304 -16.018   2.131
  287    H1     G  27           H1         G  27  -0.906 -14.445   2.511
  288   1H2     G  27          1H2         G  27  -1.689 -14.936   4.527
  289   2H2     G  27          2H2         G  27  -0.663 -15.616   5.776
  290   1H5*    C  28          1H5*        C  28   3.179 -20.744   6.275
  291   2H5*    C  28          2H5*        C  28   2.559 -22.360   5.870
  292    H4*    C  28           H4*        C  28   0.777 -20.944   6.834
  293    H3*    C  28           H3*        C  28   0.486 -21.569   3.879
  294    H2*    C  28           H2*        C  28  -1.723 -20.550   4.082
  295   2HO*    C  28          2HO*        C  28  -2.142 -21.353   6.248
  296    H1*    C  28           H1*        C  28  -0.784 -18.365   5.388
  297   1H4     C  28          1H4         C  28  -0.475 -16.950  -0.789
  298   2H4     C  28          2H4         C  28   1.197 -17.477  -0.840
  299    H5     C  28           H5         C  28   2.292 -18.570   1.059
  300    H6     C  28           H6         C  28   1.997 -19.318   3.335
  301   1H5*    C  29          1H5*        C  29  -3.104 -22.762   5.653
  302   2H5*    C  29          2H5*        C  29  -3.714 -24.293   4.999
  303    H4*    C  29           H4*        C  29  -5.381 -22.505   4.732
  304    H3*    C  29           H3*        C  29  -4.089 -23.457   2.153
  305    H2*    C  29           H2*        C  29  -5.780 -22.135   1.032
  306   2HO*    C  29          2HO*        C  29  -7.508 -22.624   2.530
  307    H1*    C  29           H1*        C  29  -5.408 -19.954   2.633
  308   1H4     C  29          1H4         C  29  -1.615 -19.394  -2.438
  309   2H4     C  29          2H4         C  29  -0.310 -20.199  -1.585
  310    H5     C  29           H5         C  29  -0.598 -21.161   0.656
  311    H6     C  29           H6         C  29  -2.185 -21.542   2.442
  312    H3T    C  29           H3T        C  29  -6.041 -24.673   2.086
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -6.748 -14.115  -9.956
    2   2H5*    G   1          2H5*        G   1  -6.805 -12.508  -9.200
    3    H4*    G   1           H4*        G   1  -8.544 -13.890  -8.233
    4    H3*    G   1           H3*        G   1  -6.204 -13.449  -6.350
    5    H2*    G   1           H2*        G   1  -7.614 -14.487  -4.664
    6   2HO*    G   1          2HO*        G   1  -9.751 -15.101  -5.201
    7    H1*    G   1           H1*        G   1  -8.230 -16.601  -6.237
    8    H8     G   1           H8         G   1  -4.813 -15.758  -7.454
    9    H1     G   1           H1         G   1  -4.779 -18.426  -1.617
   10   1H2     G   1          1H2         G   1  -6.839 -18.441  -0.785
   11   2H2     G   1          2H2         G   1  -8.205 -17.828  -1.697
   12    H5T    G   1           H5T        G   1  -4.669 -13.323  -9.339
   13   1H5*    G   2          1H5*        G   2  -9.676 -12.483  -4.336
   14   2H5*    G   2          2H5*        G   2  -9.557 -10.949  -3.453
   15    H4*    G   2           H4*        G   2 -10.302 -12.748  -1.956
   16    H3*    G   2           H3*        G   2  -7.506 -11.692  -1.465
   17    H2*    G   2           H2*        G   2  -7.574 -13.028   0.603
   18   2HO*    G   2          2HO*        G   2  -9.856 -12.646   1.015
   19    H1*    G   2           H1*        G   2  -8.466 -15.242  -0.657
   20    H8     G   2           H8         G   2  -6.344 -13.676  -3.314
   21    H1     G   2           H1         G   2  -2.923 -16.450   1.355
   22   1H2     G   2          1H2         G   2  -4.235 -16.888   3.093
   23   2H2     G   2          2H2         G   2  -5.948 -16.513   3.073
   24   1H5*    C   3          1H5*        C   3  -9.607 -11.354   2.090
   25   2H5*    C   3          2H5*        C   3  -9.268  -9.851   2.974
   26    H4*    C   3           H4*        C   3  -8.744 -11.854   4.336
   27    H3*    C   3           H3*        C   3  -6.367 -10.179   3.467
   28    H2*    C   3           H2*        C   3  -5.082 -11.574   5.017
   29   2HO*    C   3          2HO*        C   3  -6.754 -11.745   6.632
   30    H1*    C   3           H1*        C   3  -6.188 -13.901   4.071
   31   1H4     C   3          1H4         C   3  -0.985 -12.948   0.567
   32   2H4     C   3          2H4         C   3  -1.944 -12.118  -0.645
   33    H5     C   3           H5         C   3  -4.307 -11.578  -0.314
   34    H6     C   3           H6         C   3  -6.170 -11.760   1.215
   35   1H5*    C   4          1H5*        C   4  -6.240 -10.283   7.628
   36   2H5*    C   4          2H5*        C   4  -5.724  -8.732   8.327
   37    H4*    C   4           H4*        C   4  -4.171 -10.553   8.959
   38    H3*    C   4           H3*        C   4  -3.031  -8.546   6.986
   39    H2*    C   4           H2*        C   4  -0.902  -9.653   7.475
   40   2HO*    C   4          2HO*        C   4  -1.321 -10.057   9.728
   41    H1*    C   4           H1*        C   4  -1.968 -12.139   7.144
   42   1H4     C   4          1H4         C   4   0.301 -10.397   1.504
   43   2H4     C   4          2H4         C   4  -1.178  -9.535   1.117
   44    H5     C   4           H5         C   4  -3.025  -9.303   2.723
   45    H6     C   4           H6         C   4  -3.747  -9.818   4.976
   46   1H5*    A   5          1H5*        A   5  -0.492  -8.668  10.452
   47   2H5*    A   5          2H5*        A   5   0.294  -7.101  10.729
   48    H4*    A   5           H4*        A   5   1.919  -8.978  10.394
   49    H3*    A   5           H3*        A   5   1.910  -6.788   8.296
   50    H2*    A   5           H2*        A   5   3.916  -7.895   7.439
   51   2HO*    A   5          2HO*        A   5   4.697  -8.535   9.592
   52    H1*    A   5           H1*        A   5   2.754 -10.343   7.436
   53    H8     A   5           H8         A   5  -0.106  -8.046   6.642
   54   1H6     A   5          1H6         A   5   2.316  -7.780   0.907
   55   2H6     A   5          2H6         A   5   0.901  -7.388   1.868
   56    H2     A   5           H2         A   5   5.305  -9.611   3.595
   57   1H5*    U   6          1H5*        U   6   5.805  -7.297   8.782
   58   2H5*    U   6          2H5*        U   6   6.613  -5.762   9.166
   59    H4*    U   6           H4*        U   6   7.643  -6.804   7.196
   60    H3*    U   6           H3*        U   6   6.026  -4.305   6.628
   61    H2*    U   6           H2*        U   6   7.032  -4.396   4.417
   62   2HO*    U   6          2HO*        U   6   8.627  -5.938   3.954
   63    H1*    U   6           H1*        U   6   6.556  -7.064   4.116
   64    H3     U   6           H3         U   6   3.544  -4.932   1.450
   65    H5     U   6           H5         U   6   1.871  -4.765   5.304
   66    H6     U   6           H6         U   6   3.941  -5.637   6.180
   67   1H5*    C   7          1H5*        C   7  10.197  -4.169   5.234
   68   2H5*    C   7          2H5*        C   7  10.860  -2.555   5.551
   69    H4*    C   7           H4*        C   7  11.353  -3.184   3.250
   70    H3*    C   7           H3*        C   7   9.194  -1.069   3.507
   71    H2*    C   7           H2*        C   7   9.476  -0.795   1.112
   72   2HO*    C   7          2HO*        C   7  11.741  -1.064   0.973
   73    H1*    C   7           H1*        C   7   9.465  -3.478   0.622
   74   1H4     C   7          1H4         C   7   3.348  -1.901   0.081
   75   2H4     C   7          2H4         C   7   3.150  -1.935   1.821
   76    H5     C   7           H5         C   7   5.024  -2.242   3.365
   77    H6     C   7           H6         C   7   7.414  -2.612   3.504
   78   1H5*    U   8          1H5*        U   8  12.824   0.199   1.242
   79   2H5*    U   8          2H5*        U   8  13.063   1.947   1.426
   80    H4*    U   8           H4*        U   8  13.053   1.291  -0.961
   81    H3*    U   8           H3*        U   8  10.666   2.926  -0.048
   82    H2*    U   8           H2*        U   8  10.136   3.084  -2.415
   83   2HO*    U   8          2HO*        U   8  11.584   2.307  -3.962
   84    H1*    U   8           H1*        U   8  10.610   0.443  -2.895
   85    H3     U   8           H3         U   8   6.125   0.656  -3.186
   86    H5     U   8           H5         U   8   6.862   0.963   0.938
   87    H6     U   8           H6         U   8   9.224   1.052   0.462
   88   1H5*    U   9          1H5*        U   9  12.758   4.639  -3.473
   89   2H5*    U   9          2H5*        U   9  12.662   6.409  -3.477
   90    H4*    U   9           H4*        U   9  11.826   5.483  -5.598
   91    H3*    U   9           H3*        U   9   9.699   6.717  -3.825
   92    H2*    U   9           H2*        U   9   8.228   6.468  -5.737
   93   2HO*    U   9          2HO*        U   9   9.728   7.002  -7.382
   94    H1*    U   9           H1*        U   9   9.024   3.904  -6.261
   95    H3     U   9           H3         U   9   4.934   3.354  -4.375
   96    H5     U   9           H5         U   9   7.373   4.485  -1.151
   97    H6     U   9           H6         U   9   9.185   4.814  -2.712
   98   1H5*    G  10          1H5*        G  10   7.868  10.482  -7.102
   99   2H5*    G  10          2H5*        G  10   7.172   9.298  -5.981
  100    H4*    G  10           H4*        G  10   7.620   8.836  -8.967
  101    H3*    G  10           H3*        G  10   5.170   9.456  -7.292
  102    H2*    G  10           H2*        G  10   3.902   8.191  -8.933
  103   2HO*    G  10          2HO*        G  10   4.968   7.378 -10.795
  104    H1*    G  10           H1*        G  10   5.676   6.121  -8.961
  105    H8     G  10           H8         G  10   3.068   5.577  -8.266
  106    H1     G  10           H1         G  10   4.614   6.938  -2.189
  107   1H2     G  10          1H2         G  10   6.561   8.026  -2.125
  108   2H2     G  10          2H2         G  10   7.452   8.410  -3.586
  109   1H5*    C  11          1H5*        C  11   3.449   9.659 -10.755
  110   2H5*    C  11          2H5*        C  11   2.668  11.235 -11.002
  111    H4*    C  11           H4*        C  11   1.001   9.486 -11.280
  112    H3*    C  11           H3*        C  11   0.760  11.080  -8.716
  113    H2*    C  11           H2*        C  11  -1.364   9.943  -8.394
  114   2HO*    C  11          2HO*        C  11  -2.149   8.535 -10.008
  115    H1*    C  11           H1*        C  11  -0.351   7.486  -8.927
  116   1H4     C  11          1H4         C  11   0.405   8.514  -2.686
  117   2H4     C  11          2H4         C  11   2.055   9.034  -2.971
  118    H5     C  11           H5         C  11   2.988   9.280  -5.219
  119    H6     C  11           H6         C  11   2.506   9.098  -7.581
  120   1H5*    U  12          1H5*        U  12  -2.990  11.157 -10.592
  121   2H5*    U  12          2H5*        U  12  -3.667  12.798 -10.637
  122    H4*    U  12           H4*        U  12  -5.297  11.263  -9.665
  123    H3*    U  12           H3*        U  12  -4.031  13.159  -7.659
  124    H2*    U  12           H2*        U  12  -5.740  12.368  -6.131
  125   2HO*    U  12          2HO*        U  12  -7.341  10.921  -6.872
  126    H1*    U  12           H1*        U  12  -5.302   9.746  -6.716
  127    H3     U  12           H3         U  12  -3.389  10.662  -2.661
  128    H5     U  12           H5         U  12  -0.461  11.626  -5.515
  129    H6     U  12           H6         U  12  -2.127  11.339  -7.238
  130   1H5*    C  13          1H5*        C  13  -8.107  13.589  -7.177
  131   2H5*    C  13          2H5*        C  13  -8.558  15.307  -7.100
  132    H4*    C  13           H4*        C  13  -9.369  14.147  -5.092
  133    H3*    C  13           H3*        C  13  -7.023  16.018  -4.643
  134    H2*    C  13           H2*        C  13  -7.389  15.647  -2.287
  135   2HO*    C  13          2HO*        C  13  -9.750  15.653  -2.490
  136    H1*    C  13           H1*        C  13  -7.779  12.930  -2.556
  137   1H4     C  13          1H4         C  13  -1.753  13.988  -0.878
  138   2H4     C  13          2H4         C  13  -1.267  14.138  -2.558
  139    H5     C  13           H5         C  13  -2.897  14.107  -4.403
  140    H6     C  13           H6         C  13  -5.248  13.933  -4.947
  141   1H5*    U  14          1H5*        U  14  -9.047  17.241  -1.626
  142   2H5*    U  14          2H5*        U  14  -9.190  19.011  -1.603
  143    H4*    U  14           H4*        U  14  -7.994  18.260   0.399
  144    H3*    U  14           H3*        U  14  -6.227  19.613  -1.658
  145    H2*    U  14           H2*        U  14  -4.541  19.605   0.097
  146   2HO*    U  14          2HO*        U  14  -5.191  18.626   2.163
  147    H1*    U  14           H1*        U  14  -5.009  16.986   0.760
  148    H3     U  14           H3         U  14  -1.048  17.143  -1.523
  149    H5     U  14           H5         U  14  -4.006  17.280  -4.503
  150    H6     U  14           H6         U  14  -5.673  17.466  -2.762
  151   1H5*    U  15          1H5*        U  15  -4.564  22.776   1.406
  152   2H5*    U  15          2H5*        U  15  -5.444  21.315   1.882
  153    H4*    U  15           H4*        U  15  -5.426  24.028   3.255
  154    H3*    U  15           H3*        U  15  -3.726  21.913   3.509
  155    H2*    U  15           H2*        U  15  -5.440  20.275   3.689
  156   2HO*    U  15          2HO*        U  15  -5.378  19.567   5.867
  157    H1*    U  15           H1*        U  15  -6.734  22.061   5.748
  158    H3     U  15           H3         U  15 -10.074  19.138   6.524
  159    H5     U  15           H5         U  15  -9.408  18.712   2.397
  160    H6     U  15           H6         U  15  -7.626  20.338   2.572
  161   1H5*    C  16          1H5*        C  16  -2.434  21.161   6.047
  162   2H5*    C  16          2H5*        C  16  -1.321  22.219   6.930
  163    H4*    C  16           H4*        C  16  -0.263  20.115   6.490
  164    H3*    C  16           H3*        C  16   1.057  22.434   5.929
  165    H2*    C  16           H2*        C  16   0.221  22.491   3.634
  166   2HO*    C  16          2HO*        C  16   2.792  21.247   3.665
  167    H1*    C  16           H1*        C  16   1.080  19.580   3.471
  168   1H4     C  16          1H4         C  16  -1.703  20.131  -2.245
  169   2H4     C  16          2H4         C  16  -3.056  21.003  -1.551
  170    H5     C  16           H5         C  16  -3.174  21.601   0.811
  171    H6     C  16           H6         C  16  -1.997  21.490   2.939
  172   1H5*    G  17          1H5*        G  17   2.823  16.798   6.784
  173   2H5*    G  17          2H5*        G  17   1.796  17.852   5.801
  174    H4*    G  17           H4*        G  17   1.335  17.679   8.792
  175    H3*    G  17           H3*        G  17   0.366  15.677   6.722
  176    H2*    G  17           H2*        G  17  -1.492  15.403   8.254
  177   2HO*    G  17          2HO*        G  17  -0.103  15.480  10.177
  178    H1*    G  17           H1*        G  17  -1.585  18.131   8.858
  179    H8     G  17           H8         G  17  -4.029  17.405   8.455
  180    H1     G  17           H1         G  17  -3.057  16.990   2.140
  181   1H2     G  17          1H2         G  17  -0.959  17.076   1.676
  182   2H2     G  17          2H2         G  17   0.290  17.198   2.906
  183   1H5*    G  18          1H5*        G  18  -0.982  13.743   9.706
  184   2H5*    G  18          2H5*        G  18  -0.738  11.993   9.547
  185    H4*    G  18           H4*        G  18  -3.136  12.578   9.458
  186    H3*    G  18           H3*        G  18  -1.950  11.533   6.878
  187    H2*    G  18           H2*        G  18  -4.251  11.496   6.044
  188   2HO*    G  18          2HO*        G  18  -5.229  10.928   8.111
  189    H1*    G  18           H1*        G  18  -4.712  14.063   6.766
  190    H8     G  18           H8         G  18  -1.032  14.115   6.154
  191    H1     G  18           H1         G  18  -4.382  13.638   0.712
  192   1H2     G  18          1H2         G  18  -6.512  13.250   1.164
  193   2H2     G  18          2H2         G  18  -7.098  13.082   2.808
  194   1H5*    A  19          1H5*        A  19  -5.384   9.230   7.641
  195   2H5*    A  19          2H5*        A  19  -5.096   7.504   7.339
  196    H4*    A  19           H4*        A  19  -7.036   8.325   6.057
  197    H3*    A  19           H3*        A  19  -4.601   7.589   4.404
  198    H2*    A  19           H2*        A  19  -6.104   7.799   2.495
  199   2HO*    A  19          2HO*        A  19  -8.023   7.001   3.556
  200    H1*    A  19           H1*        A  19  -6.961  10.230   3.243
  201    H8     A  19           H8         A  19  -3.503  10.234   4.652
  202   1H6     A  19          1H6         A  19  -1.435  11.026  -1.146
  203   2H6     A  19          2H6         A  19  -0.983  11.022   0.546
  204    H2     A  19           H2         A  19  -5.765  10.063  -1.344
  205   1H5*    G  20          1H5*        G  20  -8.020   5.348   3.138
  206   2H5*    G  20          2H5*        G  20  -7.578   3.779   2.413
  207    H4*    G  20           H4*        G  20  -8.868   5.422   0.923
  208    H3*    G  20           H3*        G  20  -6.278   4.091   0.151
  209    H2*    G  20           H2*        G  20  -6.488   5.127  -2.025
  210   2HO*    G  20          2HO*        G  20  -8.810   4.833  -2.166
  211    H1*    G  20           H1*        G  20  -7.150   7.604  -1.073
  212    H8     G  20           H8         G  20  -4.775   6.656   1.560
  213    H1     G  20           H1         G  20  -1.802   7.607  -4.043
  214   1H2     G  20          1H2         G  20  -3.261   7.521  -5.705
  215   2H2     G  20          2H2         G  20  -4.974   7.281  -5.422
  216   1H5*    G  21          1H5*        G  21  -8.396   2.854  -2.989
  217   2H5*    G  21          2H5*        G  21  -8.180   1.114  -3.302
  218    H4*    G  21           H4*        G  21  -7.216   2.399  -5.157
  219    H3*    G  21           H3*        G  21  -5.168   1.162  -3.292
  220    H2*    G  21           H2*        G  21  -3.516   1.861  -4.891
  221   2HO*    G  21          2HO*        G  21  -4.743   1.450  -6.825
  222    H1*    G  21           H1*        G  21  -4.505   4.376  -5.112
  223    H8     G  21           H8         G  21  -5.003   3.108  -1.573
  224    H1     G  21           H1         G  21   1.017   4.886  -2.923
  225   1H2     G  21          1H2         G  21   1.212   5.220  -5.127
  226   2H2     G  21          2H2         G  21  -0.157   5.034  -6.199
  227   1H5*    A  22          1H5*        A  22  -4.574   0.001  -7.502
  228   2H5*    A  22          2H5*        A  22  -4.025  -1.680  -7.575
  229    H4*    A  22           H4*        A  22  -2.604  -0.157  -8.923
  230    H3*    A  22           H3*        A  22  -1.241  -1.448  -6.532
  231    H2*    A  22           H2*        A  22   0.802  -0.598  -7.548
  232   2HO*    A  22          2HO*        A  22   0.034  -0.931  -9.775
  233    H1*    A  22           H1*        A  22  -0.219   1.884  -7.887
  234    H8     A  22           H8         A  22  -1.882   0.712  -4.732
  235   1H6     A  22          1H6         A  22   3.495   1.980  -1.890
  236   2H6     A  22          2H6         A  22   1.805   1.587  -1.639
  237    H2     A  22           H2         A  22   4.168   2.168  -6.271
  238   1H5*    U  23          1H5*        U  23   1.294  -2.132  -9.451
  239   2H5*    U  23          2H5*        U  23   1.790  -3.834  -9.536
  240    H4*    U  23           H4*        U  23   3.756  -2.373  -9.281
  241    H3*    U  23           H3*        U  23   3.060  -4.069  -6.864
  242    H2*    U  23           H2*        U  23   5.244  -3.390  -6.023
  243   2HO*    U  23          2HO*        U  23   6.608  -2.110  -7.331
  244    H1*    U  23           H1*        U  23   4.822  -0.758  -6.619
  245    H3     U  23           H3         U  23   4.499  -1.579  -2.101
  246    H5     U  23           H5         U  23   0.613  -2.017  -3.646
  247    H6     U  23           H6         U  23   1.541  -1.865  -5.877
  248   1H5*    U  24          1H5*        U  24   7.015  -4.717  -7.794
  249   2H5*    U  24          2H5*        U  24   7.390  -6.447  -7.916
  250    H4*    U  24           H4*        U  24   8.988  -5.285  -6.424
  251    H3*    U  24           H3*        U  24   7.087  -7.249  -5.113
  252    H2*    U  24           H2*        U  24   8.474  -6.981  -3.138
  253   2HO*    U  24          2HO*        U  24  10.495  -6.877  -4.334
  254    H1*    U  24           H1*        U  24   8.610  -4.234  -3.388
  255    H3     U  24           H3         U  24   5.987  -5.509   0.197
  256    H5     U  24           H5         U  24   3.399  -5.012  -3.072
  257    H6     U  24           H6         U  24   5.328  -4.899  -4.521
  258   1H5*    U  25          1H5*        U  25  10.789  -8.705  -3.882
  259   2H5*    U  25          2H5*        U  25  10.820 -10.470  -4.075
  260    H4*    U  25           H4*        U  25  11.238  -9.900  -1.737
  261    H3*    U  25           H3*        U  25   8.470 -11.049  -2.223
  262    H2*    U  25           H2*        U  25   8.345 -11.187   0.211
  263   2HO*    U  25          2HO*        U  25  10.583 -11.753   0.547
  264    H1*    U  25           H1*        U  25   9.254  -8.645   0.548
  265    H3     U  25           H3         U  25   4.814  -8.382   1.357
  266    H5     U  25           H5         U  25   5.044  -8.686  -2.821
  267    H6     U  25           H6         U  25   7.425  -9.034  -2.608
  268   1H5*    G  26          1H5*        G  26  10.611 -13.476   0.713
  269   2H5*    G  26          2H5*        G  26  10.205 -15.188   0.499
  270    H4*    G  26           H4*        G  26   9.888 -14.469   2.835
  271    H3*    G  26           H3*        G  26   7.328 -15.148   1.349
  272    H2*    G  26           H2*        G  26   6.302 -15.054   3.560
  273   2HO*    G  26          2HO*        G  26   8.136 -15.940   4.722
  274    H1*    G  26           H1*        G  26   7.421 -12.657   4.142
  275    H8     G  26           H8         G  26   6.945 -12.549   0.422
  276    H1     G  26           H1         G  26   1.474 -11.796   3.689
  277   1H2     G  26          1H2         G  26   1.779 -12.365   5.811
  278   2H2     G  26          2H2         G  26   3.341 -12.888   6.410
  279   1H5*    G  27          1H5*        G  27   7.600 -17.608   4.800
  280   2H5*    G  27          2H5*        G  27   7.015 -19.253   4.492
  281    H4*    G  27           H4*        G  27   5.815 -18.221   6.392
  282    H3*    G  27           H3*        G  27   4.164 -18.696   3.915
  283    H2*    G  27           H2*        G  27   2.260 -18.105   5.373
  284   2HO*    G  27          2HO*        G  27   3.130 -19.106   7.299
  285    H1*    G  27           H1*        G  27   3.445 -15.864   6.295
  286    H8     G  27           H8         G  27   4.828 -16.135   2.818
  287    H1     G  27           H1         G  27  -1.267 -14.135   2.962
  288   1H2     G  27          1H2         G  27  -2.131 -14.480   4.975
  289   2H2     G  27          2H2         G  27  -1.185 -15.168   6.278
  290   1H5*    C  28          1H5*        C  28   2.316 -20.653   7.096
  291   2H5*    C  28          2H5*        C  28   1.632 -22.232   6.651
  292    H4*    C  28           H4*        C  28  -0.119 -20.712   7.515
  293    H3*    C  28           H3*        C  28  -0.288 -21.348   4.552
  294    H2*    C  28           H2*        C  28  -2.453 -20.225   4.648
  295   2HO*    C  28          2HO*        C  28  -3.018 -20.982   6.790
  296    H1*    C  28           H1*        C  28  -1.469 -18.075   5.981
  297   1H4     C  28          1H4         C  28  -0.817 -16.781  -0.205
  298   2H4     C  28          2H4         C  28   0.824 -17.401  -0.175
  299    H5     C  28           H5         C  28   1.783 -18.504   1.796
  300    H6     C  28           H6         C  28   1.351 -19.187   4.069
  301   1H5*    C  29          1H5*        C  29  -4.005 -22.375   6.192
  302   2H5*    C  29          2H5*        C  29  -4.656 -23.878   5.507
  303    H4*    C  29           H4*        C  29  -6.229 -22.010   5.184
  304    H3*    C  29           H3*        C  29  -4.889 -23.015   2.651
  305    H2*    C  29           H2*        C  29  -6.475 -21.618   1.476
  306   2HO*    C  29          2HO*        C  29  -8.111 -20.520   2.634
  307    H1*    C  29           H1*        C  29  -6.047 -19.454   3.098
  308   1H4     C  29          1H4         C  29  -2.081 -19.120  -1.862
  309   2H4     C  29          2H4         C  29  -0.845 -19.985  -0.965
  310    H5     C  29           H5         C  29  -1.247 -20.917   1.271
  311    H6     C  29           H6         C  29  -2.906 -21.208   3.009
  312    H3T    C  29           H3T        C  29  -6.924 -24.113   2.509
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -6.305 -15.244 -10.147
    2   2H5*    G   1          2H5*        G   1  -6.475 -13.593  -9.527
    3    H4*    G   1           H4*        G   1  -8.181 -14.968  -8.517
    4    H3*    G   1           H3*        G   1  -5.937 -14.256  -6.609
    5    H2*    G   1           H2*        G   1  -7.303 -15.255  -4.872
    6   2HO*    G   1          2HO*        G   1  -9.286 -15.527  -6.921
    7    H1*    G   1           H1*        G   1  -7.789 -17.510  -6.278
    8    H8     G   1           H8         G   1  -4.399 -16.598  -7.521
    9    H1     G   1           H1         G   1  -4.316 -18.775  -1.484
   10   1H2     G   1          1H2         G   1  -6.380 -18.821  -0.673
   11   2H2     G   1          2H2         G   1  -7.765 -18.362  -1.644
   12    H5T    G   1           H5T        G   1  -4.295 -14.304  -9.523
   13   1H5*    G   2          1H5*        G   2  -9.504 -13.341  -4.704
   14   2H5*    G   2          2H5*        G   2  -9.477 -11.733  -3.952
   15    H4*    G   2           H4*        G   2 -10.133 -13.440  -2.315
   16    H3*    G   2           H3*        G   2  -7.398 -12.206  -1.901
   17    H2*    G   2           H2*        G   2  -7.409 -13.377   0.264
   18   2HO*    G   2          2HO*        G   2  -9.706 -13.084   0.648
   19    H1*    G   2           H1*        G   2  -8.176 -15.727  -0.817
   20    H8     G   2           H8         G   2  -6.126 -14.253  -3.580
   21    H1     G   2           H1         G   2  -2.583 -16.458   1.296
   22   1H2     G   2          1H2         G   2  -3.877 -16.834   3.062
   23   2H2     G   2          2H2         G   2  -5.608 -16.563   3.008
   24   1H5*    C   3          1H5*        C   3  -9.513 -11.715   1.629
   25   2H5*    C   3          2H5*        C   3  -9.241 -10.140   2.402
   26    H4*    C   3           H4*        C   3  -8.625 -12.025   3.893
   27    H3*    C   3           H3*        C   3  -6.324 -10.298   2.924
   28    H2*    C   3           H2*        C   3  -4.992 -11.530   4.571
   29   2HO*    C   3          2HO*        C   3  -6.684 -11.688   6.175
   30    H1*    C   3           H1*        C   3  -5.958 -13.957   3.752
   31   1H4     C   3          1H4         C   3  -0.809 -12.864   0.200
   32   2H4     C   3          2H4         C   3  -1.818 -12.179  -1.061
   33    H5     C   3           H5         C   3  -4.215 -11.788  -0.765
   34    H6     C   3           H6         C   3  -6.066 -12.003   0.774
   35   1H5*    C   4          1H5*        C   4  -6.248 -10.202   7.090
   36   2H5*    C   4          2H5*        C   4  -5.804  -8.603   7.727
   37    H4*    C   4           H4*        C   4  -4.204 -10.348   8.467
   38    H3*    C   4           H3*        C   4  -3.094  -8.356   6.464
   39    H2*    C   4           H2*        C   4  -0.939  -9.356   7.029
   40   2HO*    C   4          2HO*        C   4  -0.818 -10.936   8.650
   41    H1*    C   4           H1*        C   4  -1.891 -11.899   6.753
   42   1H4     C   4          1H4         C   4   0.420 -10.218   1.100
   43   2H4     C   4          2H4         C   4  -1.108  -9.489   0.649
   44    H5     C   4           H5         C   4  -2.996  -9.312   2.205
   45    H6     C   4           H6         C   4  -3.738  -9.780   4.458
   46   1H5*    A   5          1H5*        A   5  -0.670  -8.452   9.945
   47   2H5*    A   5          2H5*        A   5   0.063  -6.879  10.321
   48    H4*    A   5           H4*        A   5   1.759  -8.683  10.017
   49    H3*    A   5           H3*        A   5   1.766  -6.452   7.967
   50    H2*    A   5           H2*        A   5   3.826  -7.476   7.137
   51   2HO*    A   5          2HO*        A   5   4.558  -8.134   9.307
   52    H1*    A   5           H1*        A   5   2.762  -9.965   7.062
   53    H8     A   5           H8         A   5  -0.160  -7.758   6.215
   54   1H6     A   5          1H6         A   5   2.368  -7.440   0.528
   55   2H6     A   5          2H6         A   5   0.919  -7.092   1.457
   56    H2     A   5           H2         A   5   5.369  -9.134   3.289
   57   1H5*    U   6          1H5*        U   6   5.674  -6.894   8.554
   58   2H5*    U   6          2H5*        U   6   6.423  -5.351   9.000
   59    H4*    U   6           H4*        U   6   7.542  -6.291   7.030
   60    H3*    U   6           H3*        U   6   5.844  -3.836   6.515
   61    H2*    U   6           H2*        U   6   6.839  -3.812   4.315
   62   2HO*    U   6          2HO*        U   6   8.975  -4.394   4.895
   63    H1*    U   6           H1*        U   6   6.579  -6.514   3.933
   64    H3     U   6           H3         U   6   3.498  -4.604   1.178
   65    H5     U   6           H5         U   6   1.762  -4.392   4.999
   66    H6     U   6           H6         U   6   3.844  -5.181   5.927
   67   1H5*    C   7          1H5*        C   7  10.290  -3.522   5.508
   68   2H5*    C   7          2H5*        C   7  10.793  -1.867   5.900
   69    H4*    C   7           H4*        C   7  11.641  -2.471   3.696
   70    H3*    C   7           H3*        C   7   9.373  -0.448   3.635
   71    H2*    C   7           H2*        C   7   9.895  -0.194   1.303
   72   2HO*    C   7          2HO*        C   7  12.184  -0.309   1.475
   73    H1*    C   7           H1*        C   7  10.111  -2.884   0.837
   74   1H4     C   7          1H4         C   7   3.971  -1.786  -0.355
   75   2H4     C   7          2H4         C   7   3.604  -1.806   1.355
   76    H5     C   7           H5         C   7   5.320  -1.952   3.084
   77    H6     C   7           H6         C   7   7.697  -2.139   3.480
   78   1H5*    U   8          1H5*        U   8  11.841   3.717   1.528
   79   2H5*    U   8          2H5*        U   8  10.303   2.860   1.297
   80    H4*    U   8           H4*        U   8  12.855   2.453  -0.330
   81    H3*    U   8           H3*        U   8  10.207   3.828  -0.792
   82    H2*    U   8           H2*        U   8  10.266   3.104  -3.103
   83   2HO*    U   8          2HO*        U   8  12.593   3.413  -3.329
   84    H1*    U   8           H1*        U   8  10.952   0.557  -2.564
   85    H3     U   8           H3         U   8   6.491   0.577  -3.534
   86    H5     U   8           H5         U   8   6.734   1.227   0.609
   87    H6     U   8           H6         U   8   9.119   1.490   0.380
   88   1H5*    U   9          1H5*        U   9  12.262   4.986  -4.202
   89   2H5*    U   9          2H5*        U   9  12.006   6.715  -4.515
   90    H4*    U   9           H4*        U   9  11.160   5.398  -6.401
   91    H3*    U   9           H3*        U   9   8.971   6.608  -4.683
   92    H2*    U   9           H2*        U   9   7.473   5.906  -6.480
   93   2HO*    U   9          2HO*        U   9   8.331   4.945  -8.352
   94    H1*    U   9           H1*        U   9   8.513   3.388  -6.558
   95    H3     U   9           H3         U   9   4.521   3.194  -4.342
   96    H5     U   9           H5         U   9   7.281   4.444  -1.439
   97    H6     U   9           H6         U   9   8.945   4.615  -3.178
   98   1H5*    G  10          1H5*        G  10   8.512   7.666  -8.777
   99   2H5*    G  10          2H5*        G  10   7.933   9.333  -8.987
  100    H4*    G  10           H4*        G  10   6.605   7.714 -10.260
  101    H3*    G  10           H3*        G  10   5.007   8.850  -7.939
  102    H2*    G  10           H2*        G  10   3.158   7.914  -9.212
  103   2HO*    G  10          2HO*        G  10   3.574   6.953 -11.249
  104    H1*    G  10           H1*        G  10   4.546   5.577  -9.631
  105    H8     G  10           H8         G  10   2.175   5.265  -8.639
  106    H1     G  10           H1         G  10   4.318   6.628  -2.758
  107   1H2     G  10          1H2         G  10   6.289   7.638  -2.888
  108   2H2     G  10          2H2         G  10   7.056   7.977  -4.424
  109   1H5*    C  11          1H5*        C  11   2.705   9.427 -11.198
  110   2H5*    C  11          2H5*        C  11   2.065  11.078 -11.257
  111    H4*    C  11           H4*        C  11   0.229   9.467 -11.405
  112    H3*    C  11           H3*        C  11   0.387  10.993  -8.792
  113    H2*    C  11           H2*        C  11  -1.812  10.044  -8.334
  114   2HO*    C  11          2HO*        C  11  -2.850   8.785  -9.922
  115    H1*    C  11           H1*        C  11  -1.068   7.528  -9.030
  116   1H4     C  11          1H4         C  11   0.157   8.273  -2.820
  117   2H4     C  11          2H4         C  11   1.812   8.714  -3.191
  118    H5     C  11           H5         C  11   2.623   8.986  -5.488
  119    H6     C  11           H6         C  11   1.985   8.909  -7.820
  120   1H5*    U  12          1H5*        U  12  -3.473  11.436 -10.453
  121   2H5*    U  12          2H5*        U  12  -4.063  13.106 -10.350
  122    H4*    U  12           H4*        U  12  -5.714  11.565  -9.402
  123    H3*    U  12           H3*        U  12  -4.298  13.296  -7.348
  124    H2*    U  12           H2*        U  12  -5.981  12.483  -5.803
  125   2HO*    U  12          2HO*        U  12  -7.662  11.144  -6.556
  126    H1*    U  12           H1*        U  12  -5.659   9.886  -6.549
  127    H3     U  12           H3         U  12  -3.571  10.497  -2.524
  128    H5     U  12           H5         U  12  -0.724  11.569  -5.419
  129    H6     U  12           H6         U  12  -2.457  11.425  -7.096
  130   1H5*    C  13          1H5*        C  13  -8.335  13.823  -6.694
  131   2H5*    C  13          2H5*        C  13  -8.730  15.543  -6.484
  132    H4*    C  13           H4*        C  13  -9.502  14.255  -4.531
  133    H3*    C  13           H3*        C  13  -7.111  16.062  -4.047
  134    H2*    C  13           H2*        C  13  -7.395  15.542  -1.707
  135   2HO*    C  13          2HO*        C  13  -9.763  15.591  -1.821
  136    H1*    C  13           H1*        C  13  -7.837  12.855  -2.134
  137   1H4     C  13          1H4         C  13  -1.729  13.724  -0.645
  138   2H4     C  13          2H4         C  13  -1.311  13.968  -2.332
  139    H5     C  13           H5         C  13  -3.013  14.067  -4.105
  140    H6     C  13           H6         C  13  -5.388  13.959  -4.560
  141   1H5*    U  14          1H5*        U  14  -9.009  17.118  -0.886
  142   2H5*    U  14          2H5*        U  14  -9.131  18.884  -0.750
  143    H4*    U  14           H4*        U  14  -7.869  18.011   1.159
  144    H3*    U  14           H3*        U  14  -6.171  19.463  -0.889
  145    H2*    U  14           H2*        U  14  -4.414  19.334   0.787
  146   2HO*    U  14          2HO*        U  14  -4.987  18.251   2.820
  147    H1*    U  14           H1*        U  14  -4.888  16.689   1.328
  148    H3     U  14           H3         U  14  -1.019  16.921  -1.101
  149    H5     U  14           H5         U  14  -4.087  17.260  -3.949
  150    H6     U  14           H6         U  14  -5.683  17.374  -2.135
  151   1H5*    U  15          1H5*        U  15  -4.346  22.434   2.271
  152   2H5*    U  15          2H5*        U  15  -5.215  20.953   2.703
  153    H4*    U  15           H4*        U  15  -5.109  23.585   4.223
  154    H3*    U  15           H3*        U  15  -3.429  21.441   4.277
  155    H2*    U  15           H2*        U  15  -5.149  19.811   4.452
  156   2HO*    U  15          2HO*        U  15  -4.998  18.993   6.588
  157    H1*    U  15           H1*        U  15  -6.336  21.492   6.657
  158    H3     U  15           H3         U  15  -9.669  18.556   7.406
  159    H5     U  15           H5         U  15  -9.188  18.365   3.239
  160    H6     U  15           H6         U  15  -7.381  19.963   3.427
  161   1H5*    C  16          1H5*        C  16  -2.015  20.554   6.691
  162   2H5*    C  16          2H5*        C  16  -0.853  21.556   7.577
  163    H4*    C  16           H4*        C  16   0.165  19.476   6.966
  164    H3*    C  16           H3*        C  16   1.476  21.817   6.472
  165    H2*    C  16           H2*        C  16   0.517  22.006   4.233
  166   2HO*    C  16          2HO*        C  16   2.819  22.257   4.120
  167    H1*    C  16           H1*        C  16   1.358  19.112   3.862
  168   1H4     C  16          1H4         C  16  -1.719  19.965  -1.667
  169   2H4     C  16          2H4         C  16  -3.029  20.804  -0.858
  170    H5     C  16           H5         C  16  -3.021  21.273   1.535
  171    H6     C  16           H6         C  16  -1.736  21.048   3.591
  172   1H5*    G  17          1H5*        G  17   3.232  16.137   6.929
  173   2H5*    G  17          2H5*        G  17   2.162  17.251   6.067
  174    H4*    G  17           H4*        G  17   1.867  16.903   9.064
  175    H3*    G  17           H3*        G  17   0.757  15.038   6.934
  176    H2*    G  17           H2*        G  17  -1.012  14.690   8.550
  177   2HO*    G  17          2HO*        G  17   0.480  14.638  10.394
  178    H1*    G  17           H1*        G  17  -1.046  17.375   9.315
  179    H8     G  17           H8         G  17  -3.520  16.702   8.994
  180    H1     G  17           H1         G  17  -2.863  16.617   2.626
  181   1H2     G  17          1H2         G  17  -0.790  16.704   2.063
  182   2H2     G  17          2H2         G  17   0.520  16.749   3.234
  183   1H5*    G  18          1H5*        G  18  -0.470  12.965   9.855
  184   2H5*    G  18          2H5*        G  18  -0.271  11.222   9.593
  185    H4*    G  18           H4*        G  18  -2.659  11.865   9.657
  186    H3*    G  18           H3*        G  18  -1.623  10.913   6.978
  187    H2*    G  18           H2*        G  18  -3.965  10.967   6.258
  188   2HO*    G  18          2HO*        G  18  -4.851  10.330   8.347
  189    H1*    G  18           H1*        G  18  -4.329  13.507   7.113
  190    H8     G  18           H8         G  18  -0.682  13.538   6.344
  191    H1     G  18           H1         G  18  -4.263  13.339   1.032
  192   1H2     G  18          1H2         G  18  -6.377  12.958   1.557
  193   2H2     G  18          2H2         G  18  -6.898  12.729   3.216
  194   1H5*    A  19          1H5*        A  19  -5.079   8.685   7.820
  195   2H5*    A  19          2H5*        A  19  -4.857   6.963   7.462
  196    H4*    A  19           H4*        A  19  -6.833   7.853   6.298
  197    H3*    A  19           H3*        A  19  -4.496   7.131   4.504
  198    H2*    A  19           H2*        A  19  -6.080   7.419   2.682
  199   2HO*    A  19          2HO*        A  19  -8.248   7.938   3.142
  200    H1*    A  19           H1*        A  19  -6.859   9.847   3.543
  201    H8     A  19           H8         A  19  -3.338   9.736   4.788
  202   1H6     A  19          1H6         A  19  -1.535  10.743  -1.065
  203   2H6     A  19          2H6         A  19  -1.003  10.652   0.602
  204    H2     A  19           H2         A  19  -5.889   9.860  -1.092
  205   1H5*    G  20          1H5*        G  20  -8.012   5.155   3.376
  206   2H5*    G  20          2H5*        G  20  -7.758   3.546   2.659
  207    H4*    G  20           H4*        G  20  -8.998   5.211   1.198
  208    H3*    G  20           H3*        G  20  -6.474   3.830   0.302
  209    H2*    G  20           H2*        G  20  -6.743   4.894  -1.846
  210   2HO*    G  20          2HO*        G  20  -9.073   4.642  -1.903
  211    H1*    G  20           H1*        G  20  -7.335   7.372  -0.844
  212    H8     G  20           H8         G  20  -4.837   6.281   1.644
  213    H1     G  20           H1         G  20  -2.157   7.527  -4.050
  214   1H2     G  20          1H2         G  20  -3.699   7.513  -5.635
  215   2H2     G  20          2H2         G  20  -5.397   7.256  -5.275
  216   1H5*    G  21          1H5*        G  21  -8.790   2.376  -2.670
  217   2H5*    G  21          2H5*        G  21  -8.517   0.634  -2.911
  218    H4*    G  21           H4*        G  21  -7.668   1.872  -4.850
  219    H3*    G  21           H3*        G  21  -5.484   0.828  -3.020
  220    H2*    G  21           H2*        G  21  -3.956   1.514  -4.752
  221   2HO*    G  21          2HO*        G  21  -4.745   2.334  -6.728
  222    H1*    G  21           H1*        G  21  -5.063   3.978  -4.995
  223    H8     G  21           H8         G  21  -5.344   2.800  -1.401
  224    H1     G  21           H1         G  21   0.529   4.778  -3.077
  225   1H2     G  21          1H2         G  21   0.589   5.110  -5.290
  226   2H2     G  21          2H2         G  21  -0.830   4.867  -6.284
  227   1H5*    A  22          1H5*        A  22  -5.045  -0.387  -7.154
  228   2H5*    A  22          2H5*        A  22  -4.404  -2.033  -7.285
  229    H4*    A  22           H4*        A  22  -3.171  -0.431  -8.714
  230    H3*    A  22           H3*        A  22  -1.560  -1.605  -6.423
  231    H2*    A  22           H2*        A  22   0.340  -0.607  -7.567
  232   2HO*    A  22          2HO*        A  22  -0.540  -0.998  -9.742
  233    H1*    A  22           H1*        A  22  -0.880   1.793  -7.823
  234    H8     A  22           H8         A  22  -2.245   0.455  -4.586
  235   1H6     A  22          1H6         A  22   3.168   2.223  -2.077
  236   2H6     A  22          2H6         A  22   1.548   1.659  -1.712
  237    H2     A  22           H2         A  22   3.535   2.462  -6.483
  238   1H5*    U  23          1H5*        U  23   0.845  -2.098  -9.521
  239   2H5*    U  23          2H5*        U  23   1.471  -3.755  -9.624
  240    H4*    U  23           H4*        U  23   3.323  -2.139  -9.495
  241    H3*    U  23           H3*        U  23   2.911  -3.859  -7.034
  242    H2*    U  23           H2*        U  23   5.066  -2.970  -6.304
  243   2HO*    U  23          2HO*        U  23   5.968  -2.935  -8.502
  244    H1*    U  23           H1*        U  23   4.405  -0.399  -6.917
  245    H3     U  23           H3         U  23   4.342  -1.009  -2.381
  246    H5     U  23           H5         U  23   0.487  -2.030  -3.705
  247    H6     U  23           H6         U  23   1.270  -1.825  -5.983
  248   1H5*    U  24          1H5*        U  24   6.886  -4.244  -8.051
  249   2H5*    U  24          2H5*        U  24   7.360  -5.951  -8.155
  250    H4*    U  24           H4*        U  24   8.878  -4.668  -6.669
  251    H3*    U  24           H3*        U  24   7.123  -6.764  -5.356
  252    H2*    U  24           H2*        U  24   8.484  -6.386  -3.380
  253   2HO*    U  24          2HO*        U  24  10.495  -6.145  -4.569
  254    H1*    U  24           H1*        U  24   8.421  -3.631  -3.648
  255    H3     U  24           H3         U  24   5.902  -5.067  -0.045
  256    H5     U  24           H5         U  24   3.284  -4.732  -3.314
  257    H6     U  24           H6         U  24   5.204  -4.522  -4.766
  258   1H5*    U  25          1H5*        U  25  10.901  -8.032  -4.123
  259   2H5*    U  25          2H5*        U  25  11.021  -9.794  -4.330
  260    H4*    U  25           H4*        U  25  11.386  -9.236  -1.982
  261    H3*    U  25           H3*        U  25   8.666 -10.486  -2.497
  262    H2*    U  25           H2*        U  25   8.533 -10.644  -0.065
  263   2HO*    U  25          2HO*        U  25  10.790 -11.115   0.291
  264    H1*    U  25           H1*        U  25   9.326  -8.065   0.292
  265    H3     U  25           H3         U  25   4.862  -8.019   1.028
  266    H5     U  25           H5         U  25   5.177  -8.276  -3.148
  267    H6     U  25           H6         U  25   7.567  -8.509  -2.895
  268   1H5*    G  26          1H5*        G  26  10.861 -12.832   0.454
  269   2H5*    G  26          2H5*        G  26  10.499 -14.557   0.260
  270    H4*    G  26           H4*        G  26  10.141 -13.794   2.585
  271    H3*    G  26           H3*        G  26   7.619 -14.595   1.095
  272    H2*    G  26           H2*        G  26   6.580 -14.491   3.300
  273   2HO*    G  26          2HO*        G  26   7.855 -14.036   5.125
  274    H1*    G  26           H1*        G  26   7.606 -12.036   3.827
  275    H8     G  26           H8         G  26   7.151 -12.038   0.103
  276    H1     G  26           H1         G  26   1.624 -11.472   3.313
  277   1H2     G  26          1H2         G  26   1.939 -11.967   5.451
  278   2H2     G  26          2H2         G  26   3.522 -12.392   6.077
  279   1H5*    G  27          1H5*        G  27   8.000 -16.805   4.626
  280   2H5*    G  27          2H5*        G  27   7.491 -18.498   4.471
  281    H4*    G  27           H4*        G  27   6.285 -17.366   6.309
  282    H3*    G  27           H3*        G  27   4.609 -18.139   3.926
  283    H2*    G  27           H2*        G  27   2.704 -17.500   5.359
  284   2HO*    G  27          2HO*        G  27   3.653 -18.275   7.352
  285    H1*    G  27           H1*        G  27   3.798 -15.130   6.054
  286    H8     G  27           H8         G  27   5.150 -15.632   2.592
  287    H1     G  27           H1         G  27  -1.044 -13.963   2.656
  288   1H2     G  27          1H2         G  27  -1.874 -14.200   4.696
  289   2H2     G  27          2H2         G  27  -0.880 -14.726   6.041
  290   1H5*    C  28          1H5*        C  28   2.891 -19.852   7.311
  291   2H5*    C  28          2H5*        C  28   2.267 -21.494   7.033
  292    H4*    C  28           H4*        C  28   0.471 -19.963   7.779
  293    H3*    C  28           H3*        C  28   0.281 -20.911   4.905
  294    H2*    C  28           H2*        C  28  -1.922 -19.862   4.914
  295   2HO*    C  28          2HO*        C  28  -2.425 -20.415   7.136
  296    H1*    C  28           H1*        C  28  -1.008 -17.549   6.003
  297   1H4     C  28          1H4         C  28  -0.477 -16.859  -0.285
  298   2H4     C  28          2H4         C  28   1.190 -17.397  -0.216
  299    H5     C  28           H5         C  28   2.213 -18.256   1.834
  300    H6     C  28           H6         C  28   1.835 -18.732   4.172
  301   1H5*    C  29          1H5*        C  29  -3.377 -21.869   6.692
  302   2H5*    C  29          2H5*        C  29  -3.985 -23.463   6.205
  303    H4*    C  29           H4*        C  29  -5.627 -21.711   5.669
  304    H3*    C  29           H3*        C  29  -4.260 -22.949   3.259
  305    H2*    C  29           H2*        C  29  -5.901 -21.755   1.945
  306   2HO*    C  29          2HO*        C  29  -7.673 -22.069   3.449
  307    H1*    C  29           H1*        C  29  -5.561 -19.408   3.309
  308   1H4     C  29          1H4         C  29  -1.613 -19.438  -1.678
  309   2H4     C  29          2H4         C  29  -0.343 -20.157  -0.704
  310    H5     C  29           H5         C  29  -0.706 -20.860   1.623
  311    H6     C  29           H6         C  29  -2.346 -21.029   3.389
  312    H3T    C  29           H3T        C  29  -5.504 -24.381   4.547
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -7.227 -13.942  -9.573
    2   2H5*    G   1          2H5*        G   1  -7.259 -12.356  -8.779
    3    H4*    G   1           H4*        G   1  -8.907 -13.786  -7.728
    4    H3*    G   1           H3*        G   1  -6.449 -13.357  -6.003
    5    H2*    G   1           H2*        G   1  -7.726 -14.444  -4.245
    6   2HO*    G   1          2HO*        G   1  -9.886 -15.075  -4.646
    7    H1*    G   1           H1*        G   1  -8.429 -16.531  -5.818
    8    H8     G   1           H8         G   1  -5.107 -15.615  -7.230
    9    H1     G   1           H1         G   1  -4.666 -18.448  -1.492
   10   1H2     G   1          1H2         G   1  -6.664 -18.506  -0.528
   11   2H2     G   1          2H2         G   1  -8.095 -17.886  -1.326
   12    H5T    G   1           H5T        G   1  -5.125 -13.132  -9.080
   13   1H5*    G   2          1H5*        G   2  -9.785 -12.463  -3.729
   14   2H5*    G   2          2H5*        G   2  -9.611 -10.952  -2.816
   15    H4*    G   2           H4*        G   2 -10.240 -12.801  -1.320
   16    H3*    G   2           H3*        G   2  -7.422 -11.739  -0.998
   17    H2*    G   2           H2*        G   2  -7.340 -13.132   1.033
   18   2HO*    G   2          2HO*        G   2  -9.591 -12.782   1.614
   19    H1*    G   2           H1*        G   2  -8.302 -15.316  -0.230
   20    H8     G   2           H8         G   2  -6.379 -13.646  -2.973
   21    H1     G   2           H1         G   2  -2.624 -16.522   1.365
   22   1H2     G   2          1H2         G   2  -3.807 -17.023   3.177
   23   2H2     G   2          2H2         G   2  -5.522 -16.668   3.282
   24   1H5*    C   3          1H5*        C   3  -9.264 -11.528   2.700
   25   2H5*    C   3          2H5*        C   3  -8.871 -10.053   3.607
   26    H4*    C   3           H4*        C   3  -8.248 -12.101   4.859
   27    H3*    C   3           H3*        C   3  -5.943 -10.380   3.898
   28    H2*    C   3           H2*        C   3  -4.553 -11.817   5.315
   29   2HO*    C   3          2HO*        C   3  -6.131 -12.059   7.020
   30    H1*    C   3           H1*        C   3  -5.699 -14.117   4.352
   31   1H4     C   3          1H4         C   3  -0.746 -12.967   0.553
   32   2H4     C   3          2H4         C   3  -1.792 -12.110  -0.562
   33    H5     C   3           H5         C   3  -4.138 -11.621  -0.062
   34    H6     C   3           H6         C   3  -5.891 -11.881   1.579
   35   1H5*    C   4          1H5*        C   4  -5.569 -10.637   8.028
   36   2H5*    C   4          2H5*        C   4  -5.033  -9.109   8.762
   37    H4*    C   4           H4*        C   4  -3.428 -10.931   9.236
   38    H3*    C   4           H3*        C   4  -2.420  -8.840   7.276
   39    H2*    C   4           H2*        C   4  -0.259  -9.937   7.608
   40   2HO*    C   4          2HO*        C   4  -0.548 -10.423   9.868
   41    H1*    C   4           H1*        C   4  -1.319 -12.426   7.257
   42   1H4     C   4          1H4         C   4   0.635 -10.480   1.558
   43   2H4     C   4          2H4         C   4  -0.882  -9.642   1.277
   44    H5     C   4           H5         C   4  -2.634  -9.483   2.983
   45    H6     C   4           H6         C   4  -3.231 -10.072   5.252
   46   1H5*    A   5          1H5*        A   5   0.291  -9.053  10.610
   47   2H5*    A   5          2H5*        A   5   1.080  -7.490  10.904
   48    H4*    A   5           H4*        A   5   2.703  -9.340  10.429
   49    H3*    A   5           H3*        A   5   2.573  -7.086   8.408
   50    H2*    A   5           H2*        A   5   4.547  -8.146   7.417
   51   2HO*    A   5          2HO*        A   5   5.432  -8.846   9.510
   52    H1*    A   5           H1*        A   5   3.401 -10.607   7.397
   53    H8     A   5           H8         A   5   0.494  -8.310   6.808
   54   1H6     A   5          1H6         A   5   2.628  -7.864   0.968
   55   2H6     A   5          2H6         A   5   1.255  -7.517   2.005
   56    H2     A   5           H2         A   5   5.767  -9.726   3.461
   57   1H5*    U   6          1H5*        U   6   6.495  -7.544   8.675
   58   2H5*    U   6          2H5*        U   6   7.296  -6.008   9.049
   59    H4*    U   6           H4*        U   6   8.224  -6.972   6.993
   60    H3*    U   6           H3*        U   6   6.527  -4.494   6.587
   61    H2*    U   6           H2*        U   6   7.417  -4.505   4.323
   62   2HO*    U   6          2HO*        U   6   9.004  -6.010   3.730
   63    H1*    U   6           H1*        U   6   6.958  -7.169   3.976
   64    H3     U   6           H3         U   6   3.770  -5.003   1.555
   65    H5     U   6           H5         U   6   2.322  -4.978   5.500
   66    H6     U   6           H6         U   6   4.448  -5.846   6.229
   67   1H5*    C   7          1H5*        C   7  10.589  -4.221   4.966
   68   2H5*    C   7          2H5*        C   7  11.239  -2.600   5.276
   69    H4*    C   7           H4*        C   7  11.595  -3.180   2.933
   70    H3*    C   7           H3*        C   7   9.426  -1.100   3.366
   71    H2*    C   7           H2*        C   7   9.571  -0.780   0.959
   72   2HO*    C   7          2HO*        C   7  11.818  -1.027   0.672
   73    H1*    C   7           H1*        C   7   9.543  -3.451   0.427
   74   1H4     C   7          1H4         C   7   3.397  -1.911   0.301
   75   2H4     C   7          2H4         C   7   3.305  -2.005   2.047
   76    H5     C   7           H5         C   7   5.269  -2.334   3.467
   77    H6     C   7           H6         C   7   7.667  -2.681   3.454
   78   1H5*    U   8          1H5*        U   8  12.881   0.248   0.912
   79   2H5*    U   8          2H5*        U   8  13.104   2.001   1.066
   80    H4*    U   8           H4*        U   8  12.932   1.315  -1.310
   81    H3*    U   8           H3*        U   8  10.601   2.942  -0.249
   82    H2*    U   8           H2*        U   8   9.928   3.078  -2.586
   83   2HO*    U   8          2HO*        U   8  11.283   2.284  -4.206
   84    H1*    U   8           H1*        U   8  10.373   0.431  -3.058
   85    H3     U   8           H3         U   8   5.882   0.682  -3.076
   86    H5     U   8           H5         U   8   6.868   1.008   0.994
   87    H6     U   8           H6         U   8   9.199   1.072   0.372
   88   1H5*    U   9          1H5*        U   9  12.430   4.636  -3.799
   89   2H5*    U   9          2H5*        U   9  12.303   6.404  -3.831
   90    H4*    U   9           H4*        U   9  11.325   5.406  -5.863
   91    H3*    U   9           H3*        U   9   9.310   6.660  -3.979
   92    H2*    U   9           H2*        U   9   7.726   6.350  -5.795
   93   2HO*    U   9          2HO*        U   9   9.121   6.843  -7.543
   94    H1*    U   9           H1*        U   9   8.505   3.779  -6.280
   95    H3     U   9           H3         U   9   4.541   3.323  -4.111
   96    H5     U   9           H5         U   9   7.196   4.528  -1.091
   97    H6     U   9           H6         U   9   8.909   4.780  -2.777
   98   1H5*    G  10          1H5*        G  10   7.254  10.296  -7.326
   99   2H5*    G  10          2H5*        G  10   6.609   9.152  -6.131
  100    H4*    G  10           H4*        G  10   6.973   8.558  -9.103
  101    H3*    G  10           H3*        G  10   4.559   9.259  -7.405
  102    H2*    G  10           H2*        G  10   3.261   7.905  -8.955
  103   2HO*    G  10          2HO*        G  10   4.521   8.571 -10.851
  104    H1*    G  10           H1*        G  10   5.042   5.845  -8.927
  105    H8     G  10           H8         G  10   2.440   5.339  -8.133
  106    H1     G  10           H1         G  10   4.201   6.894  -2.163
  107   1H2     G  10          1H2         G  10   6.146   7.992  -2.205
  108   2H2     G  10          2H2         G  10   6.982   8.326  -3.707
  109   1H5*    C  11          1H5*        C  11   2.735   9.336 -10.860
  110   2H5*    C  11          2H5*        C  11   1.980  10.920 -11.141
  111    H4*    C  11           H4*        C  11   0.272   9.200 -11.322
  112    H3*    C  11           H3*        C  11   0.128  10.878  -8.804
  113    H2*    C  11           H2*        C  11  -2.011   9.787  -8.396
  114   2HO*    C  11          2HO*        C  11  -2.637   9.711 -10.662
  115    H1*    C  11           H1*        C  11  -1.064   7.301  -8.884
  116   1H4     C  11          1H4         C  11  -0.104   8.459  -2.694
  117   2H4     C  11          2H4         C  11   1.553   8.921  -3.035
  118    H5     C  11           H5         C  11   2.427   9.098  -5.316
  119    H6     C  11           H6         C  11   1.871   8.876  -7.658
  120   1H5*    U  12          1H5*        U  12  -3.719  11.128 -10.632
  121   2H5*    U  12          2H5*        U  12  -4.287  12.807 -10.639
  122    H4*    U  12           H4*        U  12  -5.970  11.356  -9.613
  123    H3*    U  12           H3*        U  12  -4.531  13.191  -7.667
  124    H2*    U  12           H2*        U  12  -6.246  12.503  -6.081
  125   2HO*    U  12          2HO*        U  12  -7.969  12.399  -7.690
  126    H1*    U  12           H1*        U  12  -5.972   9.864  -6.659
  127    H3     U  12           H3         U  12  -3.897  10.699  -2.662
  128    H5     U  12           H5         U  12  -0.998  11.466  -5.602
  129    H6     U  12           H6         U  12  -2.719  11.250  -7.279
  130   1H5*    C  13          1H5*        C  13  -8.588  13.962  -7.054
  131   2H5*    C  13          2H5*        C  13  -8.859  15.715  -6.958
  132    H4*    C  13           H4*        C  13  -9.690  14.605  -4.918
  133    H3*    C  13           H3*        C  13  -7.193  16.296  -4.570
  134    H2*    C  13           H2*        C  13  -7.503  15.957  -2.198
  135   2HO*    C  13          2HO*        C  13  -9.866  16.138  -2.322
  136    H1*    C  13           H1*        C  13  -8.102  13.281  -2.443
  137   1H4     C  13          1H4         C  13  -1.961  13.947  -0.981
  138   2H4     C  13          2H4         C  13  -1.524  14.040  -2.678
  139    H5     C  13           H5         C  13  -3.215  14.090  -4.469
  140    H6     C  13           H6         C  13  -5.592  14.059  -4.932
  141   1H5*    U  14          1H5*        U  14  -9.004  17.656  -1.481
  142   2H5*    U  14          2H5*        U  14  -9.049  19.433  -1.466
  143    H4*    U  14           H4*        U  14  -7.830  18.634   0.499
  144    H3*    U  14           H3*        U  14  -6.089  19.884  -1.643
  145    H2*    U  14           H2*        U  14  -4.303  19.783  -0.014
  146   2HO*    U  14          2HO*        U  14  -6.230  18.772   1.839
  147    H1*    U  14           H1*        U  14  -4.883  17.213   0.753
  148    H3     U  14           H3         U  14  -1.044  17.063  -1.715
  149    H5     U  14           H5         U  14  -4.124  17.336  -4.561
  150    H6     U  14           H6         U  14  -5.692  17.664  -2.747
  151   1H5*    U  15          1H5*        U  15  -4.157  22.985   1.391
  152   2H5*    U  15          2H5*        U  15  -5.101  21.579   1.899
  153    H4*    U  15           H4*        U  15  -4.906  24.294   3.245
  154    H3*    U  15           H3*        U  15  -3.343  22.078   3.491
  155    H2*    U  15           H2*        U  15  -5.154  20.549   3.706
  156   2HO*    U  15          2HO*        U  15  -3.732  20.171   5.468
  157    H1*    U  15           H1*        U  15  -6.327  22.404   5.769
  158    H3     U  15           H3         U  15  -9.839  19.682   6.510
  159    H5     U  15           H5         U  15  -9.164  19.223   2.388
  160    H6     U  15           H6         U  15  -7.295  20.753   2.582
  161   1H5*    C  16          1H5*        C  16  -2.058  21.267   6.051
  162   2H5*    C  16          2H5*        C  16  -0.865  22.268   6.891
  163    H4*    C  16           H4*        C  16   0.044  20.093   6.462
  164    H3*    C  16           H3*        C  16   1.511  22.309   5.870
  165    H2*    C  16           H2*        C  16   0.636  22.410   3.587
  166   2HO*    C  16          2HO*        C  16   3.126  21.013   3.586
  167    H1*    C  16           H1*        C  16   1.310  19.452   3.433
  168   1H4     C  16          1H4         C  16  -1.507  20.132  -2.251
  169   2H4     C  16          2H4         C  16  -2.795  21.095  -1.549
  170    H5     C  16           H5         C  16  -2.846  21.711   0.811
  171    H6     C  16           H6         C  16  -1.649  21.544   2.926
  172   1H5*    G  17          1H5*        G  17   2.941  16.558   6.659
  173   2H5*    G  17          2H5*        G  17   1.991  17.678   5.674
  174    H4*    G  17           H4*        G  17   1.491  17.539   8.655
  175    H3*    G  17           H3*        G  17   0.419  15.574   6.601
  176    H2*    G  17           H2*        G  17  -1.445  15.419   8.144
  177   2HO*    G  17          2HO*        G  17  -0.054  15.432  10.062
  178    H1*    G  17           H1*        G  17  -1.376  18.157   8.715
  179    H8     G  17           H8         G  17  -3.860  17.549   8.356
  180    H1     G  17           H1         G  17  -2.997  17.026   2.032
  181   1H2     G  17          1H2         G  17  -0.893  17.036   1.543
  182   2H2     G  17          2H2         G  17   0.370  17.124   2.760
  183   1H5*    G  18          1H5*        G  18  -0.998  13.744   9.623
  184   2H5*    G  18          2H5*        G  18  -0.851  11.982   9.485
  185    H4*    G  18           H4*        G  18  -3.214  12.690   9.430
  186    H3*    G  18           H3*        G  18  -2.134  11.561   6.838
  187    H2*    G  18           H2*        G  18  -4.450  11.633   6.050
  188   2HO*    G  18          2HO*        G  18  -5.417  11.141   8.141
  189    H1*    G  18           H1*        G  18  -4.768  14.226   6.753
  190    H8     G  18           H8         G  18  -1.099  14.089   6.074
  191    H1     G  18           H1         G  18  -4.579  13.762   0.701
  192   1H2     G  18          1H2         G  18  -6.716  13.489   1.201
  193   2H2     G  18          2H2         G  18  -7.273  13.343   2.857
  194   1H5*    A  19          1H5*        A  19  -5.672   9.456   7.708
  195   2H5*    A  19          2H5*        A  19  -5.470   7.711   7.457
  196    H4*    A  19           H4*        A  19  -7.393   8.558   6.182
  197    H3*    A  19           H3*        A  19  -5.010   7.734   4.497
  198    H2*    A  19           H2*        A  19  -6.538   7.938   2.616
  199   2HO*    A  19          2HO*        A  19  -8.716   8.486   2.984
  200    H1*    A  19           H1*        A  19  -7.323  10.412   3.338
  201    H8     A  19           H8         A  19  -3.827  10.312   4.664
  202   1H6     A  19          1H6         A  19  -1.892  11.021  -1.189
  203   2H6     A  19          2H6         A  19  -1.397  11.010   0.492
  204    H2     A  19           H2         A  19  -6.259  10.214  -1.267
  205   1H5*    G  20          1H5*        G  20  -8.487   5.681   3.342
  206   2H5*    G  20          2H5*        G  20  -8.186   4.050   2.689
  207    H4*    G  20           H4*        G  20  -9.394   5.656   1.131
  208    H3*    G  20           H3*        G  20  -6.832   4.256   0.378
  209    H2*    G  20           H2*        G  20  -7.055   5.219  -1.825
  210   2HO*    G  20          2HO*        G  20  -9.386   4.964  -1.923
  211    H1*    G  20           H1*        G  20  -7.655   7.738  -0.944
  212    H8     G  20           H8         G  20  -5.253   6.762   1.679
  213    H1     G  20           H1         G  20  -2.367   7.625  -3.982
  214   1H2     G  20          1H2         G  20  -3.855   7.550  -5.615
  215   2H2     G  20          2H2         G  20  -5.568   7.342  -5.299
  216   1H5*    G  21          1H5*        G  21  -8.908   2.885  -2.687
  217   2H5*    G  21          2H5*        G  21  -8.685   1.136  -2.921
  218    H4*    G  21           H4*        G  21  -7.676   2.353  -4.800
  219    H3*    G  21           H3*        G  21  -5.659   1.200  -2.850
  220    H2*    G  21           H2*        G  21  -3.991   1.837  -4.465
  221   2HO*    G  21          2HO*        G  21  -5.182   1.358  -6.397
  222    H1*    G  21           H1*        G  21  -4.988   4.341  -4.788
  223    H8     G  21           H8         G  21  -5.505   3.215  -1.209
  224    H1     G  21           H1         G  21   0.535   4.886  -2.604
  225   1H2     G  21          1H2         G  21   0.732   5.148  -4.826
  226   2H2     G  21          2H2         G  21  -0.642   4.934  -5.886
  227   1H5*    A  22          1H5*        A  22  -5.021  -0.088  -6.993
  228   2H5*    A  22          2H5*        A  22  -4.434  -1.757  -7.029
  229    H4*    A  22           H4*        A  22  -3.056  -0.210  -8.412
  230    H3*    A  22           H3*        A  22  -1.642  -1.454  -6.027
  231    H2*    A  22           H2*        A  22   0.363  -0.591  -7.087
  232   2HO*    A  22          2HO*        A  22   0.198   0.484  -9.103
  233    H1*    A  22           H1*        A  22  -0.709   1.875  -7.437
  234    H8     A  22           H8         A  22  -2.278   0.772  -4.221
  235   1H6     A  22          1H6         A  22   3.218   1.949  -1.564
  236   2H6     A  22          2H6         A  22   1.530   1.594  -1.252
  237    H2     A  22           H2         A  22   3.749   2.093  -5.963
  238   1H5*    U  23          1H5*        U  23   0.746  -2.102  -9.074
  239   2H5*    U  23          2H5*        U  23   1.308  -3.781  -9.198
  240    H4*    U  23           H4*        U  23   3.219  -2.226  -9.078
  241    H3*    U  23           H3*        U  23   2.780  -3.988  -6.653
  242    H2*    U  23           H2*        U  23   4.982  -3.217  -5.945
  243   2HO*    U  23          2HO*        U  23   6.188  -1.849  -7.318
  244    H1*    U  23           H1*        U  23   4.396  -0.600  -6.454
  245    H3     U  23           H3         U  23   4.403  -1.561  -1.943
  246    H5     U  23           H5         U  23   0.442  -2.076  -3.249
  247    H6     U  23           H6         U  23   1.219  -1.838  -5.529
  248   1H5*    U  24          1H5*        U  24   6.688  -4.421  -7.842
  249   2H5*    U  24          2H5*        U  24   7.135  -6.129  -8.034
  250    H4*    U  24           H4*        U  24   8.769  -4.925  -6.613
  251    H3*    U  24           H3*        U  24   7.047  -7.016  -5.254
  252    H2*    U  24           H2*        U  24   8.523  -6.729  -3.348
  253   2HO*    U  24          2HO*        U  24  10.468  -6.493  -4.651
  254    H1*    U  24           H1*        U  24   8.513  -3.971  -3.524
  255    H3     U  24           H3         U  24   6.152  -5.498   0.150
  256    H5     U  24           H5         U  24   3.371  -4.964  -2.950
  257    H6     U  24           H6         U  24   5.209  -4.732  -4.496
  258   1H5*    U  25          1H5*        U  25  10.848  -8.348  -4.235
  259   2H5*    U  25          2H5*        U  25  10.940 -10.103  -4.510
  260    H4*    U  25           H4*        U  25  11.431  -9.637  -2.166
  261    H3*    U  25           H3*        U  25   8.670 -10.831  -2.588
  262    H2*    U  25           H2*        U  25   8.660 -11.089  -0.162
  263   2HO*    U  25          2HO*        U  25  10.926 -11.606   0.051
  264    H1*    U  25           H1*        U  25   9.514  -8.540   0.253
  265    H3     U  25           H3         U  25   5.108  -8.459   1.259
  266    H5     U  25           H5         U  25   5.162  -8.555  -2.933
  267    H6     U  25           H6         U  25   7.561  -8.832  -2.838
  268   1H5*    G  26          1H5*        G  26  10.954 -13.342   0.143
  269   2H5*    G  26          2H5*        G  26  10.575 -15.048  -0.147
  270    H4*    G  26           H4*        G  26  10.318 -14.471   2.229
  271    H3*    G  26           H3*        G  26   7.707 -15.077   0.801
  272    H2*    G  26           H2*        G  26   6.775 -15.138   3.051
  273   2HO*    G  26          2HO*        G  26   8.148 -14.867   4.846
  274    H1*    G  26           H1*        G  26   7.903 -12.764   3.732
  275    H8     G  26           H8         G  26   7.251 -12.466   0.047
  276    H1     G  26           H1         G  26   1.943 -11.926   3.610
  277   1H2     G  26          1H2         G  26   2.362 -12.578   5.689
  278   2H2     G  26          2H2         G  26   3.957 -13.114   6.185
  279   1H5*    G  27          1H5*        G  27   8.150 -17.608   4.095
  280   2H5*    G  27          2H5*        G  27   7.590 -19.266   3.794
  281    H4*    G  27           H4*        G  27   6.467 -18.312   5.771
  282    H3*    G  27           H3*        G  27   4.691 -18.726   3.369
  283    H2*    G  27           H2*        G  27   2.867 -18.219   4.947
  284   2HO*    G  27          2HO*        G  27   3.356 -17.869   7.138
  285    H1*    G  27           H1*        G  27   4.075 -15.985   5.876
  286    H8     G  27           H8         G  27   5.251 -16.146   2.312
  287    H1     G  27           H1         G  27  -0.845 -14.229   2.890
  288   1H2     G  27          1H2         G  27  -1.578 -14.633   4.947
  289   2H2     G  27          2H2         G  27  -0.543 -15.347   6.167
  290   1H5*    C  28          1H5*        C  28   3.079 -20.686   6.608
  291   2H5*    C  28          2H5*        C  28   2.381 -22.278   6.248
  292    H4*    C  28           H4*        C  28   0.684 -20.786   7.236
  293    H3*    C  28           H3*        C  28   0.286 -21.415   4.291
  294    H2*    C  28           H2*        C  28  -1.871 -20.313   4.549
  295   2HO*    C  28          2HO*        C  28  -2.271 -21.082   6.722
  296    H1*    C  28           H1*        C  28  -0.811 -18.160   5.810
  297   1H4     C  28          1H4         C  28  -0.616 -16.800  -0.383
  298   2H4     C  28          2H4         C  28   1.024 -17.415  -0.483
  299    H5     C  28           H5         C  28   2.127 -18.540   1.393
  300    H6     C  28           H6         C  28   1.870 -19.250   3.685
  301   1H5*    C  29          1H5*        C  29  -3.282 -22.474   6.193
  302   2H5*    C  29          2H5*        C  29  -3.966 -23.989   5.570
  303    H4*    C  29           H4*        C  29  -5.583 -22.147   5.342
  304    H3*    C  29           H3*        C  29  -4.407 -23.130   2.719
  305    H2*    C  29           H2*        C  29  -6.088 -21.753   1.665
  306   2HO*    C  29          2HO*        C  29  -7.774 -22.198   3.227
  307    H1*    C  29           H1*        C  29  -5.591 -19.590   3.265
  308   1H4     C  29          1H4         C  29  -1.987 -19.144  -1.954
  309   2H4     C  29          2H4         C  29  -0.681 -20.008  -1.160
  310    H5     C  29           H5         C  29  -0.910 -20.965   1.088
  311    H6     C  29           H6         C  29  -2.433 -21.294   2.936
  312    H3T    C  29           H3T        C  29  -5.611 -24.673   3.918
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -6.714 -14.272 -10.013
    2   2H5*    G   1          2H5*        G   1  -6.794 -12.667  -9.259
    3    H4*    G   1           H4*        G   1  -8.504 -14.074  -8.275
    4    H3*    G   1           H3*        G   1  -6.155 -13.593  -6.418
    5    H2*    G   1           H2*        G   1  -7.536 -14.643  -4.711
    6   2HO*    G   1          2HO*        G   1  -9.667 -15.290  -5.224
    7    H1*    G   1           H1*        G   1  -8.139 -16.772  -6.272
    8    H8     G   1           H8         G   1  -4.743 -15.882  -7.517
    9    H1     G   1           H1         G   1  -4.619 -18.544  -1.679
   10   1H2     G   1          1H2         G   1  -6.668 -18.589  -0.828
   11   2H2     G   1          2H2         G   1  -8.051 -17.991  -1.723
   12    H5T    G   1           H5T        G   1  -4.644 -13.446  -9.407
   13   1H5*    G   2          1H5*        G   2  -9.641 -12.646  -4.387
   14   2H5*    G   2          2H5*        G   2  -9.530 -11.112  -3.503
   15    H4*    G   2           H4*        G   2 -10.262 -12.926  -2.011
   16    H3*    G   2           H3*        G   2  -7.480 -11.832  -1.516
   17    H2*    G   2           H2*        G   2  -7.519 -13.180   0.543
   18   2HO*    G   2          2HO*        G   2  -9.803 -12.836   0.969
   19    H1*    G   2           H1*        G   2  -8.375 -15.402  -0.724
   20    H8     G   2           H8         G   2  -6.304 -13.782  -3.386
   21    H1     G   2           H1         G   2  -2.792 -16.521   1.235
   22   1H2     G   2          1H2         G   2  -4.074 -16.978   2.990
   23   2H2     G   2          2H2         G   2  -5.794 -16.639   2.986
   24   1H5*    C   3          1H5*        C   3  -9.555 -11.560   2.061
   25   2H5*    C   3          2H5*        C   3  -9.231 -10.063   2.954
   26    H4*    C   3           H4*        C   3  -8.649 -12.069   4.292
   27    H3*    C   3           H3*        C   3  -6.315 -10.346   3.405
   28    H2*    C   3           H2*        C   3  -4.984 -11.733   4.923
   29   2HO*    C   3          2HO*        C   3  -6.639 -11.957   6.552
   30    H1*    C   3           H1*        C   3  -6.056 -14.067   3.962
   31   1H4     C   3          1H4         C   3  -0.936 -12.946   0.378
   32   2H4     C   3          2H4         C   3  -1.935 -12.123  -0.803
   33    H5     C   3           H5         C   3  -4.304 -11.638  -0.423
   34    H6     C   3           H6         C   3  -6.133 -11.884   1.139
   35   1H5*    C   4          1H5*        C   4  -6.124 -10.526   7.564
   36   2H5*    C   4          2H5*        C   4  -5.618  -8.983   8.288
   37    H4*    C   4           H4*        C   4  -4.040 -10.802   8.858
   38    H3*    C   4           H3*        C   4  -2.953  -8.724   6.930
   39    H2*    C   4           H2*        C   4  -0.802  -9.810   7.356
   40   2HO*    C   4          2HO*        C   4  -1.194 -10.280   9.609
   41    H1*    C   4           H1*        C   4  -1.831 -12.305   6.978
   42   1H4     C   4          1H4         C   4   0.339 -10.385   1.349
   43   2H4     C   4          2H4         C   4  -1.169  -9.559   1.000
   44    H5     C   4           H5         C   4  -2.996  -9.407   2.630
   45    H6     C   4           H6         C   4  -3.679  -9.982   4.880
   46   1H5*    A   5          1H5*        A   5  -0.361  -8.942  10.347
   47   2H5*    A   5          2H5*        A   5   0.415  -7.380  10.676
   48    H4*    A   5           H4*        A   5   2.052  -9.234  10.240
   49    H3*    A   5           H3*        A   5   1.993  -6.952   8.247
   50    H2*    A   5           H2*        A   5   3.989  -7.996   7.300
   51   2HO*    A   5          2HO*        A   5   4.864  -9.859   8.310
   52    H1*    A   5           H1*        A   5   2.860 -10.465   7.232
   53    H8     A   5           H8         A   5  -0.030  -8.180   6.526
   54   1H6     A   5          1H6         A   5   2.365  -7.741   0.785
   55   2H6     A   5          2H6         A   5   0.944  -7.389   1.755
   56    H2     A   5           H2         A   5   5.387  -9.594   3.416
   57   1H5*    U   6          1H5*        U   6   5.896  -7.542   8.690
   58   2H5*    U   6          2H5*        U   6   6.732  -6.045   9.138
   59    H4*    U   6           H4*        U   6   7.755  -7.013   7.126
   60    H3*    U   6           H3*        U   6   6.180  -4.460   6.702
   61    H2*    U   6           H2*        U   6   7.118  -4.438   4.477
   62   2HO*    U   6          2HO*        U   6   9.235  -5.148   4.999
   63    H1*    U   6           H1*        U   6   6.707  -7.112   4.046
   64    H3     U   6           H3         U   6   3.671  -4.960   1.419
   65    H5     U   6           H5         U   6   2.018  -4.814   5.280
   66    H6     U   6           H6         U   6   4.087  -5.711   6.139
   67   1H5*    C   7          1H5*        C   7  10.589  -4.366   5.551
   68   2H5*    C   7          2H5*        C   7  11.198  -2.765   6.009
   69    H4*    C   7           H4*        C   7  11.955  -3.297   3.756
   70    H3*    C   7           H3*        C   7   9.800  -1.157   3.873
   71    H2*    C   7           H2*        C   7  10.267  -0.799   1.541
   72   2HO*    C   7          2HO*        C   7  12.547  -1.028   1.635
   73    H1*    C   7           H1*        C   7  10.342  -3.466   0.921
   74   1H4     C   7          1H4         C   7   4.252  -2.001  -0.075
   75   2H4     C   7          2H4         C   7   3.905  -2.129   1.635
   76    H5     C   7           H5         C   7   5.644  -2.480   3.321
   77    H6     C   7           H6         C   7   8.018  -2.787   3.652
   78   1H5*    U   8          1H5*        U   8  12.267   3.002   1.948
   79   2H5*    U   8          2H5*        U   8  10.713   2.169   1.741
   80    H4*    U   8           H4*        U   8  13.174   1.803  -0.027
   81    H3*    U   8           H3*        U   8  10.582   3.333  -0.270
   82    H2*    U   8           H2*        U   8  10.544   2.805  -2.637
   83   2HO*    U   8          2HO*        U   8  12.889   3.004  -2.886
   84    H1*    U   8           H1*        U   8  11.106   0.190  -2.320
   85    H3     U   8           H3         U   8   6.629   0.532  -3.151
   86    H5     U   8           H5         U   8   7.022   0.774   1.027
   87    H6     U   8           H6         U   8   9.409   0.945   0.746
   88   1H5*    U   9          1H5*        U   9  12.700   4.557  -3.653
   89   2H5*    U   9          2H5*        U   9  12.584   6.318  -3.842
   90    H4*    U   9           H4*        U   9  11.693   5.213  -5.837
   91    H3*    U   9           H3*        U   9   9.582   6.486  -4.069
   92    H2*    U   9           H2*        U   9   8.047   6.044  -5.893
   93   2HO*    U   9          2HO*        U   9   9.477   6.501  -7.631
   94    H1*    U   9           H1*        U   9   8.910   3.473  -6.230
   95    H3     U   9           H3         U   9   4.857   3.289  -4.143
   96    H5     U   9           H5         U   9   7.581   4.154  -1.065
   97    H6     U   9           H6         U   9   9.308   4.377  -2.738
   98   1H5*    G  10          1H5*        G  10   7.558  10.043  -7.489
   99   2H5*    G  10          2H5*        G  10   6.869   8.944  -6.276
  100    H4*    G  10           H4*        G  10   7.235   8.295  -9.240
  101    H3*    G  10           H3*        G  10   4.845   9.081  -7.546
  102    H2*    G  10           H2*        G  10   3.501   7.736  -9.063
  103   2HO*    G  10          2HO*        G  10   4.750   8.335 -10.982
  104    H1*    G  10           H1*        G  10   5.227   5.631  -9.020
  105    H8     G  10           H8         G  10   2.607   5.236  -8.215
  106    H1     G  10           H1         G  10   4.475   6.732  -2.262
  107   1H2     G  10          1H2         G  10   6.460   7.751  -2.320
  108   2H2     G  10          2H2         G  10   7.289   8.064  -3.829
  109   1H5*    C  11          1H5*        C  11   2.964   9.139 -10.958
  110   2H5*    C  11          2H5*        C  11   2.254  10.739 -11.246
  111    H4*    C  11           H4*        C  11   0.486   9.079 -11.361
  112    H3*    C  11           H3*        C  11   0.462  10.772  -8.846
  113    H2*    C  11           H2*        C  11  -1.702   9.770  -8.391
  114   2HO*    C  11          2HO*        C  11  -2.645   8.363  -9.921
  115    H1*    C  11           H1*        C  11  -0.855   7.244  -8.893
  116   1H4     C  11          1H4         C  11   0.193   8.414  -2.723
  117   2H4     C  11          2H4         C  11   1.857   8.837  -3.077
  118    H5     C  11           H5         C  11   2.721   8.969  -5.370
  119    H6     C  11           H6         C  11   2.141   8.741  -7.706
  120   1H5*    U  12          1H5*        U  12  -3.366  10.972 -10.600
  121   2H5*    U  12          2H5*        U  12  -3.945  12.645 -10.691
  122    H4*    U  12           H4*        U  12  -5.650  11.265  -9.640
  123    H3*    U  12           H3*        U  12  -4.217  13.120  -7.709
  124    H2*    U  12           H2*        U  12  -5.955  12.491  -6.135
  125   2HO*    U  12          2HO*        U  12  -7.669  12.393  -7.747
  126    H1*    U  12           H1*        U  12  -5.731   9.834  -6.670
  127    H3     U  12           H3         U  12  -3.682  10.593  -2.652
  128    H5     U  12           H5         U  12  -0.749  11.389  -5.552
  129    H6     U  12           H6         U  12  -2.454  11.209  -7.250
  130   1H5*    C  13          1H5*        C  13  -8.285  14.011  -7.237
  131   2H5*    C  13          2H5*        C  13  -8.502  15.775  -7.180
  132    H4*    C  13           H4*        C  13  -9.421  14.742  -5.142
  133    H3*    C  13           H3*        C  13  -6.857  16.325  -4.761
  134    H2*    C  13           H2*        C  13  -7.234  16.040  -2.397
  135   2HO*    C  13          2HO*        C  13  -9.580  16.345  -2.576
  136    H1*    C  13           H1*        C  13  -7.989  13.392  -2.616
  137   1H4     C  13          1H4         C  13  -1.895  13.704  -0.897
  138   2H4     C  13          2H4         C  13  -1.376  13.806  -2.571
  139    H5     C  13           H5         C  13  -2.980  13.964  -4.434
  140    H6     C  13           H6         C  13  -5.333  14.058  -5.001
  141   1H5*    U  14          1H5*        U  14  -8.635  17.887  -1.794
  142   2H5*    U  14          2H5*        U  14  -8.543  19.660  -1.796
  143    H4*    U  14           H4*        U  14  -7.410  18.771   0.184
  144    H3*    U  14           H3*        U  14  -5.535  19.903  -1.910
  145    H2*    U  14           H2*        U  14  -3.798  19.630  -0.269
  146   2HO*    U  14          2HO*        U  14  -5.015  20.300   1.571
  147    H1*    U  14           H1*        U  14  -4.589  17.121   0.476
  148    H3     U  14           H3         U  14  -0.763  16.741  -2.006
  149    H5     U  14           H5         U  14  -3.824  17.227  -4.840
  150    H6     U  14           H6         U  14  -5.362  17.647  -3.019
  151   1H5*    U  15          1H5*        U  15  -6.508  24.309   1.517
  152   2H5*    U  15          2H5*        U  15  -4.755  24.392   1.751
  153    H4*    U  15           H4*        U  15  -5.781  24.764   3.875
  154    H3*    U  15           H3*        U  15  -3.890  22.825   3.636
  155    H2*    U  15           H2*        U  15  -5.495  21.057   3.246
  156   2HO*    U  15          2HO*        U  15  -5.507  19.831   5.180
  157    H1*    U  15           H1*        U  15  -7.044  22.212   5.573
  158    H3     U  15           H3         U  15 -10.463  19.308   5.389
  159    H5     U  15           H5         U  15  -9.012  19.262   1.448
  160    H6     U  15           H6         U  15  -7.349  20.905   2.103
  161   1H5*    C  16          1H5*        C  16  -3.441  21.792   7.151
  162   2H5*    C  16          2H5*        C  16  -2.361  22.750   8.179
  163    H4*    C  16           H4*        C  16  -1.667  20.422   8.078
  164    H3*    C  16           H3*        C  16   0.160  22.420   7.835
  165    H2*    C  16           H2*        C  16  -0.145  22.485   5.429
  166   2HO*    C  16          2HO*        C  16   2.229  21.455   6.275
  167    H1*    C  16           H1*        C  16   0.206  19.488   5.426
  168   1H4     C  16          1H4         C  16  -0.888  20.455  -0.773
  169   2H4     C  16          2H4         C  16  -2.275  21.471  -0.412
  170    H5     C  16           H5         C  16  -2.867  22.137   1.848
  171    H6     C  16           H6         C  16  -2.311  21.855   4.210
  172   1H5*    G  17          1H5*        G  17   2.743  17.107   7.501
  173   2H5*    G  17          2H5*        G  17   1.845  17.137   5.970
  174    H4*    G  17           H4*        G  17   0.721  17.765   8.736
  175    H3*    G  17           H3*        G  17   0.185  15.531   6.747
  176    H2*    G  17           H2*        G  17  -1.886  15.326   7.943
  177   2HO*    G  17          2HO*        G  17  -0.856  15.540  10.068
  178    H1*    G  17           H1*        G  17  -2.035  18.121   8.390
  179    H8     G  17           H8         G  17  -4.432  17.265   7.865
  180    H1     G  17           H1         G  17  -2.930  16.659   1.663
  181   1H2     G  17          1H2         G  17  -0.770  16.804   1.392
  182   2H2     G  17          2H2         G  17   0.332  17.060   2.732
  183   1H5*    G  18          1H5*        G  18  -1.461  13.750   9.791
  184   2H5*    G  18          2H5*        G  18  -1.124  12.009   9.758
  185    H4*    G  18           H4*        G  18  -3.520  12.427   9.444
  186    H3*    G  18           H3*        G  18  -2.111  11.415   6.957
  187    H2*    G  18           H2*        G  18  -4.351  11.203   6.017
  188   2HO*    G  18          2HO*        G  18  -6.164  11.737   7.295
  189    H1*    G  18           H1*        G  18  -5.014  13.750   6.653
  190    H8     G  18           H8         G  18  -1.286  13.883   6.205
  191    H1     G  18           H1         G  18  -4.464  13.474   0.652
  192   1H2     G  18          1H2         G  18  -6.612  13.120   1.038
  193   2H2     G  18          2H2         G  18  -7.243  12.908   2.660
  194   1H5*    A  19          1H5*        A  19  -5.444   9.059   7.734
  195   2H5*    A  19          2H5*        A  19  -5.183   7.328   7.446
  196    H4*    A  19           H4*        A  19  -7.118   8.169   6.163
  197    H3*    A  19           H3*        A  19  -4.707   7.401   4.487
  198    H2*    A  19           H2*        A  19  -6.233   7.613   2.604
  199   2HO*    A  19          2HO*        A  19  -8.421   8.133   2.979
  200    H1*    A  19           H1*        A  19  -7.049  10.067   3.361
  201    H8     A  19           H8         A  19  -3.545   9.955   4.689
  202   1H6     A  19          1H6         A  19  -1.639  10.851  -1.152
  203   2H6     A  19          2H6         A  19  -1.133  10.796   0.526
  204    H2     A  19           H2         A  19  -5.996  10.019  -1.237
  205   1H5*    G  20          1H5*        G  20  -8.167   5.336   3.300
  206   2H5*    G  20          2H5*        G  20  -7.854   3.721   2.614
  207    H4*    G  20           H4*        G  20  -9.080   5.343   1.090
  208    H3*    G  20           H3*        G  20  -6.512   3.972   0.309
  209    H2*    G  20           H2*        G  20  -6.728   4.979  -1.873
  210   2HO*    G  20          2HO*        G  20  -9.056   4.695  -1.991
  211    H1*    G  20           H1*        G  20  -7.377   7.473  -0.955
  212    H8     G  20           H8         G  20  -4.941   6.470   1.639
  213    H1     G  20           H1         G  20  -2.107   7.573  -4.006
  214   1H2     G  20          1H2         G  20  -3.599   7.512  -5.635
  215   2H2     G  20          2H2         G  20  -5.306   7.271  -5.315
  216   1H5*    G  21          1H5*        G  21  -8.662   2.608  -2.755
  217   2H5*    G  21          2H5*        G  21  -8.406   0.869  -3.029
  218    H4*    G  21           H4*        G  21  -7.463   2.142  -4.905
  219    H3*    G  21           H3*        G  21  -5.372   1.009  -3.019
  220    H2*    G  21           H2*        G  21  -3.762   1.715  -4.666
  221   2HO*    G  21          2HO*        G  21  -4.452   2.599  -6.652
  222    H1*    G  21           H1*        G  21  -4.819   4.205  -4.894
  223    H8     G  21           H8         G  21  -5.256   2.952  -1.343
  224    H1     G  21           H1         G  21   0.712   4.848  -2.760
  225   1H2     G  21          1H2         G  21   0.873   5.179  -4.971
  226   2H2     G  21          2H2         G  21  -0.509   4.972  -6.022
  227   1H5*    A  22          1H5*        A  22  -4.778  -0.073  -7.166
  228   2H5*    A  22          2H5*        A  22  -4.184  -1.734  -7.319
  229    H4*    A  22           H4*        A  22  -2.844  -0.132  -8.651
  230    H3*    A  22           H3*        A  22  -1.370  -1.416  -6.325
  231    H2*    A  22           H2*        A  22   0.606  -0.467  -7.360
  232   2HO*    A  22          2HO*        A  22   0.415   0.648  -9.347
  233    H1*    A  22           H1*        A  22  -0.533   1.979  -7.661
  234    H8     A  22           H8         A  22  -2.006   0.700  -4.453
  235   1H6     A  22          1H6         A  22   3.409   2.289  -1.836
  236   2H6     A  22          2H6         A  22   1.764   1.781  -1.502
  237    H2     A  22           H2         A  22   3.884   2.491  -6.233
  238   1H5*    U  23          1H5*        U  23   1.091  -1.915  -9.344
  239   2H5*    U  23          2H5*        U  23   1.664  -3.589  -9.489
  240    H4*    U  23           H4*        U  23   3.580  -2.072  -9.259
  241    H3*    U  23           H3*        U  23   2.992  -3.807  -6.845
  242    H2*    U  23           H2*        U  23   5.149  -3.048  -6.010
  243   2HO*    U  23          2HO*        U  23   6.464  -1.723  -7.327
  244    H1*    U  23           H1*        U  23   4.655  -0.429  -6.622
  245    H3     U  23           H3         U  23   4.389  -1.016  -2.100
  246    H5     U  23           H5         U  23   0.554  -1.916  -3.563
  247    H6     U  23           H6         U  23   1.428  -1.744  -5.810
  248   1H5*    U  24          1H5*        U  24   6.956  -4.307  -7.819
  249   2H5*    U  24          2H5*        U  24   7.384  -6.022  -7.978
  250    H4*    U  24           H4*        U  24   8.957  -4.828  -6.479
  251    H3*    U  24           H3*        U  24   7.150  -6.895  -5.193
  252    H2*    U  24           H2*        U  24   8.562  -6.623  -3.233
  253   2HO*    U  24          2HO*        U  24  10.553  -6.400  -4.461
  254    H1*    U  24           H1*        U  24   8.558  -3.862  -3.414
  255    H3     U  24           H3         U  24   6.027  -5.411   0.148
  256    H5     U  24           H5         U  24   3.396  -4.816  -3.072
  257    H6     U  24           H6         U  24   5.312  -4.595  -4.530
  258   1H5*    U  25          1H5*        U  25  10.863  -8.336  -4.018
  259   2H5*    U  25          2H5*        U  25  10.924 -10.087  -4.313
  260    H4*    U  25           H4*        U  25  11.322  -9.664  -1.944
  261    H3*    U  25           H3*        U  25   8.553 -10.776  -2.493
  262    H2*    U  25           H2*        U  25   8.444 -11.074  -0.076
  263   2HO*    U  25          2HO*        U  25  10.260 -10.586   1.200
  264    H1*    U  25           H1*        U  25   9.331  -8.542   0.407
  265    H3     U  25           H3         U  25   4.881  -8.438   1.221
  266    H5     U  25           H5         U  25   5.133  -8.388  -2.965
  267    H6     U  25           H6         U  25   7.517  -8.718  -2.769
  268   1H5*    G  26          1H5*        G  26  10.684 -13.208   0.324
  269   2H5*    G  26          2H5*        G  26  10.356 -14.934   0.087
  270    H4*    G  26           H4*        G  26  10.014 -14.281   2.432
  271    H3*    G  26           H3*        G  26   7.456 -14.983   0.955
  272    H2*    G  26           H2*        G  26   6.458 -14.974   3.178
  273   2HO*    G  26          2HO*        G  26   7.778 -14.610   5.002
  274    H1*    G  26           H1*        G  26   7.532 -12.561   3.805
  275    H8     G  26           H8         G  26   6.986 -12.403   0.092
  276    H1     G  26           H1         G  26   1.565 -11.816   3.478
  277   1H2     G  26          1H2         G  26   1.928 -12.409   5.587
  278   2H2     G  26          2H2         G  26   3.513 -12.908   6.145
  279   1H5*    G  27          1H5*        G  27   7.843 -17.384   4.372
  280   2H5*    G  27          2H5*        G  27   7.312 -19.060   4.115
  281    H4*    G  27           H4*        G  27   6.119 -18.044   6.022
  282    H3*    G  27           H3*        G  27   4.424 -18.592   3.591
  283    H2*    G  27           H2*        G  27   2.542 -18.036   5.078
  284   2HO*    G  27          2HO*        G  27   2.947 -17.588   7.268
  285    H1*    G  27           H1*        G  27   3.690 -15.750   5.955
  286    H8     G  27           H8         G  27   4.987 -16.041   2.444
  287    H1     G  27           H1         G  27  -1.150 -14.187   2.732
  288   1H2     G  27          1H2         G  27  -1.953 -14.537   4.769
  289   2H2     G  27          2H2         G  27  -0.950 -15.181   6.056
  290   1H5*    C  28          1H5*        C  28   2.703 -20.416   6.861
  291   2H5*    C  28          2H5*        C  28   2.035 -22.032   6.535
  292    H4*    C  28           H4*        C  28   0.285 -20.511   7.383
  293    H3*    C  28           H3*        C  28   0.023 -21.281   4.459
  294    H2*    C  28           H2*        C  28  -2.152 -20.186   4.571
  295   2HO*    C  28          2HO*        C  28  -2.627 -20.861   6.768
  296    H1*    C  28           H1*        C  28  -1.166 -17.965   5.777
  297   1H4     C  28          1H4         C  28  -0.704 -16.877  -0.453
  298   2H4     C  28          2H4         C  28   0.941 -17.485  -0.453
  299    H5     C  28           H5         C  28   1.964 -18.521   1.516
  300    H6     C  28           H6         C  28   1.609 -19.134   3.823
  301   1H5*    C  29          1H5*        C  29  -3.636 -22.256   6.244
  302   2H5*    C  29          2H5*        C  29  -4.294 -23.790   5.644
  303    H4*    C  29           H4*        C  29  -5.885 -21.945   5.275
  304    H3*    C  29           H3*        C  29  -4.605 -23.069   2.763
  305    H2*    C  29           H2*        C  29  -6.221 -21.737   1.556
  306   2HO*    C  29          2HO*        C  29  -7.848 -20.609   2.706
  307    H1*    C  29           H1*        C  29  -5.782 -19.495   3.070
  308   1H4     C  29          1H4         C  29  -1.948 -19.301  -1.995
  309   2H4     C  29          2H4         C  29  -0.685 -20.130  -1.105
  310    H5     C  29           H5         C  29  -1.020 -20.986   1.173
  311    H6     C  29           H6         C  29  -2.624 -21.226   2.964
  312    H3T    C  29           H3T        C  29  -7.176 -23.445   3.937
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -7.024 -14.790  -9.716
    2   2H5*    G   1          2H5*        G   1  -7.106 -13.207  -8.919
    3    H4*    G   1           H4*        G   1  -8.593 -14.779  -7.797
    4    H3*    G   1           H3*        G   1  -6.127 -14.098  -6.159
    5    H2*    G   1           H2*        G   1  -7.316 -15.204  -4.348
    6   2HO*    G   1          2HO*        G   1  -9.437 -15.977  -4.699
    7    H1*    G   1           H1*        G   1  -7.926 -17.371  -5.874
    8    H8     G   1           H8         G   1  -4.617 -16.347  -7.241
    9    H1     G   1           H1         G   1  -4.168 -18.996  -1.416
   10   1H2     G   1          1H2         G   1  -6.182 -19.117  -0.488
   11   2H2     G   1          2H2         G   1  -7.622 -18.580  -1.331
   12    H5T    G   1           H5T        G   1  -5.067 -15.166  -8.719
   13   1H5*    G   2          1H5*        G   2  -9.524 -13.306  -3.917
   14   2H5*    G   2          2H5*        G   2  -9.439 -11.767  -3.039
   15    H4*    G   2           H4*        G   2  -9.991 -13.612  -1.510
   16    H3*    G   2           H3*        G   2  -7.237 -12.395  -1.173
   17    H2*    G   2           H2*        G   2  -7.107 -13.740   0.887
   18   2HO*    G   2          2HO*        G   2  -9.375 -13.499   1.442
   19    H1*    G   2           H1*        G   2  -7.934 -15.994  -0.340
   20    H8     G   2           H8         G   2  -6.066 -14.289  -3.100
   21    H1     G   2           H1         G   2  -2.231 -16.879   1.349
   22   1H2     G   2          1H2         G   2  -3.412 -17.401   3.155
   23   2H2     G   2          2H2         G   2  -5.142 -17.125   3.239
   24   1H5*    C   3          1H5*        C   3  -9.155 -12.197   2.499
   25   2H5*    C   3          2H5*        C   3  -8.852 -10.683   3.375
   26    H4*    C   3           H4*        C   3  -8.145 -12.669   4.688
   27    H3*    C   3           H3*        C   3  -5.915 -10.851   3.722
   28    H2*    C   3           H2*        C   3  -4.474 -12.187   5.186
   29   2HO*    C   3          2HO*        C   3  -6.069 -12.465   6.874
   30    H1*    C   3           H1*        C   3  -5.488 -14.560   4.261
   31   1H4     C   3          1H4         C   3  -0.551 -13.256   0.495
   32   2H4     C   3          2H4         C   3  -1.624 -12.484  -0.654
   33    H5     C   3           H5         C   3  -3.991 -12.085  -0.187
   34    H6     C   3           H6         C   3  -5.753 -12.394   1.436
   35   1H5*    C   4          1H5*        C   4  -5.589 -11.000   7.879
   36   2H5*    C   4          2H5*        C   4  -5.132  -9.431   8.580
   37    H4*    C   4           H4*        C   4  -3.452 -11.168   9.114
   38    H3*    C   4           H3*        C   4  -2.523  -9.064   7.132
   39    H2*    C   4           H2*        C   4  -0.313 -10.054   7.493
   40   2HO*    C   4          2HO*        C   4  -0.587 -10.513   9.756
   41    H1*    C   4           H1*        C   4  -1.244 -12.594   7.174
   42   1H4     C   4          1H4         C   4   0.618 -10.662   1.441
   43   2H4     C   4          2H4         C   4  -0.933  -9.897   1.144
   44    H5     C   4           H5         C   4  -2.692  -9.784   2.850
   45    H6     C   4           H6         C   4  -3.262 -10.360   5.131
   46   1H5*    A   5          1H5*        A   5   0.185  -9.080  10.494
   47   2H5*    A   5          2H5*        A   5   0.889  -7.470  10.758
   48    H4*    A   5           H4*        A   5   2.609  -9.241  10.313
   49    H3*    A   5           H3*        A   5   2.352  -7.025   8.262
   50    H2*    A   5           H2*        A   5   4.358  -7.989   7.258
   51   2HO*    A   5          2HO*        A   5   5.373  -9.776   8.273
   52    H1*    A   5           H1*        A   5   3.358 -10.515   7.296
   53    H8     A   5           H8         A   5   0.331  -8.379   6.689
   54   1H6     A   5          1H6         A   5   2.390  -7.961   0.822
   55   2H6     A   5          2H6         A   5   1.017  -7.649   1.867
   56    H2     A   5           H2         A   5   5.635  -9.619   3.324
   57   1H5*    U   6          1H5*        U   6   6.294  -7.355   8.539
   58   2H5*    U   6          2H5*        U   6   7.056  -5.796   8.903
   59    H4*    U   6           H4*        U   6   8.027  -6.761   6.867
   60    H3*    U   6           H3*        U   6   6.284  -4.317   6.447
   61    H2*    U   6           H2*        U   6   7.118  -4.328   4.170
   62   2HO*    U   6          2HO*        U   6   9.284  -4.931   4.599
   63    H1*    U   6           H1*        U   6   6.801  -7.016   3.839
   64    H3     U   6           H3         U   6   3.500  -5.077   1.373
   65    H5     U   6           H5         U   6   2.081  -4.954   5.327
   66    H6     U   6           H6         U   6   4.241  -5.725   6.067
   67   1H5*    C   7          1H5*        C   7  10.505  -3.994   4.933
   68   2H5*    C   7          2H5*        C   7  11.060  -2.328   5.173
   69    H4*    C   7           H4*        C   7  11.513  -3.049   2.873
   70    H3*    C   7           H3*        C   7   9.303  -0.984   3.129
   71    H2*    C   7           H2*        C   7   9.503  -0.807   0.707
   72   2HO*    C   7          2HO*        C   7  11.758  -1.049   0.490
   73    H1*    C   7           H1*        C   7   9.500  -3.500   0.337
   74   1H4     C   7          1H4         C   7   3.331  -2.066   0.065
   75   2H4     C   7          2H4         C   7   3.230  -2.063   1.811
   76    H5     C   7           H5         C   7   5.182  -2.266   3.261
   77    H6     C   7           H6         C   7   7.587  -2.558   3.288
   78   1H5*    U   8          1H5*        U   8  12.808   0.228   0.678
   79   2H5*    U   8          2H5*        U   8  13.010   1.992   0.697
   80    H4*    U   8           H4*        U   8  12.906   1.106  -1.620
   81    H3*    U   8           H3*        U   8  10.554   2.813  -0.746
   82    H2*    U   8           H2*        U   8   9.895   2.728  -3.091
   83   2HO*    U   8          2HO*        U   8  12.070   2.869  -3.939
   84    H1*    U   8           H1*        U   8  10.395   0.063  -3.345
   85    H3     U   8           H3         U   8   5.904   0.168  -3.470
   86    H5     U   8           H5         U   8   6.786   0.943   0.564
   87    H6     U   8           H6         U   8   9.128   1.003  -0.010
   88   1H5*    U   9          1H5*        U   9  12.357   4.319  -4.453
   89   2H5*    U   9          2H5*        U   9  12.204   6.083  -4.525
   90    H4*    U   9           H4*        U   9  11.190   5.016  -6.508
   91    H3*    U   9           H3*        U   9   9.232   6.329  -4.601
   92    H2*    U   9           H2*        U   9   7.586   5.971  -6.351
   93   2HO*    U   9          2HO*        U   9   8.927   6.421  -8.155
   94    H1*    U   9           H1*        U   9   8.360   3.383  -6.802
   95    H3     U   9           H3         U   9   4.430   3.053  -4.534
   96    H5     U   9           H5         U   9   7.209   4.166  -1.589
   97    H6     U   9           H6         U   9   8.870   4.399  -3.326
   98   1H5*    G  10          1H5*        G  10   7.104   9.943  -7.882
   99   2H5*    G  10          2H5*        G  10   6.485   8.850  -6.627
  100    H4*    G  10           H4*        G  10   6.657   8.193  -9.604
  101    H3*    G  10           H3*        G  10   4.381   9.000  -7.774
  102    H2*    G  10           H2*        G  10   2.939   7.661  -9.206
  103   2HO*    G  10          2HO*        G  10   4.087   8.242 -11.195
  104    H1*    G  10           H1*        G  10   4.646   5.541  -9.251
  105    H8     G  10           H8         G  10   2.076   5.164  -8.284
  106    H1     G  10           H1         G  10   4.303   6.716  -2.470
  107   1H2     G  10          1H2         G  10   6.288   7.720  -2.658
  108   2H2     G  10          2H2         G  10   7.028   8.011  -4.219
  109   1H5*    C  11          1H5*        C  11   2.313   9.052 -11.051
  110   2H5*    C  11          2H5*        C  11   1.577  10.645 -11.315
  111    H4*    C  11           H4*        C  11  -0.183   8.963 -11.297
  112    H3*    C  11           H3*        C  11  -0.076  10.708  -8.824
  113    H2*    C  11           H2*        C  11  -2.203   9.697  -8.225
  114   2HO*    C  11          2HO*        C  11  -3.211   8.242  -9.659
  115    H1*    C  11           H1*        C  11  -1.346   7.168  -8.699
  116   1H4     C  11          1H4         C  11   0.092   8.553  -2.648
  117   2H4     C  11          2H4         C  11   1.731   8.950  -3.129
  118    H5     C  11           H5         C  11   2.440   9.001  -5.474
  119    H6     C  11           H6         C  11   1.704   8.701  -7.758
  120   1H5*    U  12          1H5*        U  12  -3.970  10.848 -10.325
  121   2H5*    U  12          2H5*        U  12  -4.611  12.503 -10.386
  122    H4*    U  12           H4*        U  12  -6.165  11.043  -9.185
  123    H3*    U  12           H3*        U  12  -4.700  13.038  -7.423
  124    H2*    U  12           H2*        U  12  -6.281  12.361  -5.704
  125   2HO*    U  12          2HO*        U  12  -8.092  12.087  -7.198
  126    H1*    U  12           H1*        U  12  -5.909   9.713  -6.156
  127    H3     U  12           H3         U  12  -3.631  10.902  -2.361
  128    H5     U  12           H5         U  12  -0.955  11.570  -5.530
  129    H6     U  12           H6         U  12  -2.774  11.186  -7.072
  130   1H5*    C  13          1H5*        C  13  -8.740  13.622  -6.608
  131   2H5*    C  13          2H5*        C  13  -9.117  15.358  -6.583
  132    H4*    C  13           H4*        C  13  -9.767  14.306  -4.447
  133    H3*    C  13           H3*        C  13  -7.368  16.160  -4.324
  134    H2*    C  13           H2*        C  13  -7.532  15.937  -1.925
  135   2HO*    C  13          2HO*        C  13  -9.311  14.830  -0.998
  136    H1*    C  13           H1*        C  13  -7.966  13.212  -2.004
  137   1H4     C  13          1H4         C  13  -1.826  14.349  -0.889
  138   2H4     C  13          2H4         C  13  -1.476  14.361  -2.610
  139    H5     C  13           H5         C  13  -3.246  14.192  -4.313
  140    H6     C  13           H6         C  13  -5.634  13.994  -4.654
  141   1H5*    U  14          1H5*        U  14  -9.188  17.536  -1.237
  142   2H5*    U  14          2H5*        U  14  -9.348  19.304  -1.274
  143    H4*    U  14           H4*        U  14  -8.045  18.641   0.693
  144    H3*    U  14           H3*        U  14  -6.415  19.945  -1.503
  145    H2*    U  14           H2*        U  14  -4.634  20.021   0.150
  146   2HO*    U  14          2HO*        U  14  -5.152  19.118   2.286
  147    H1*    U  14           H1*        U  14  -5.027  17.428   0.949
  148    H3     U  14           H3         U  14  -1.188  17.519  -1.533
  149    H5     U  14           H5         U  14  -4.291  17.470  -4.364
  150    H6     U  14           H6         U  14  -5.871  17.739  -2.553
  151   1H5*    U  15          1H5*        U  15  -4.658  23.264   1.360
  152   2H5*    U  15          2H5*        U  15  -5.469  21.795   1.923
  153    H4*    U  15           H4*        U  15  -5.465  24.551   3.206
  154    H3*    U  15           H3*        U  15  -3.691  22.492   3.430
  155    H2*    U  15           H2*        U  15  -5.339  20.815   3.772
  156   2HO*    U  15          2HO*        U  15  -5.134  20.194   5.966
  157    H1*    U  15           H1*        U  15  -6.577  22.637   5.833
  158    H3     U  15           H3         U  15  -9.757  19.627   6.892
  159    H5     U  15           H5         U  15  -9.347  19.123   2.741
  160    H6     U  15           H6         U  15  -7.605  20.803   2.765
  161   1H5*    C  16          1H5*        C  16  -2.224  21.886   5.903
  162   2H5*    C  16          2H5*        C  16  -1.094  23.011   6.676
  163    H4*    C  16           H4*        C  16   0.002  20.925   6.244
  164    H3*    C  16           H3*        C  16   1.206  23.265   5.519
  165    H2*    C  16           H2*        C  16   0.217  23.208   3.286
  166   2HO*    C  16          2HO*        C  16   2.505  23.543   3.117
  167    H1*    C  16           H1*        C  16   1.178  20.331   3.173
  168   1H4     C  16          1H4         C  16  -1.983  20.518  -2.368
  169   2H4     C  16          2H4         C  16  -3.318  21.381  -1.627
  170    H5     C  16           H5         C  16  -3.308  22.078   0.710
  171    H6     C  16           H6         C  16  -1.994  22.108   2.760
  172   1H5*    G  17          1H5*        G  17   3.192  17.720   6.425
  173   2H5*    G  17          2H5*        G  17   2.064  18.718   5.497
  174    H4*    G  17           H4*        G  17   1.837  18.589   8.517
  175    H3*    G  17           H3*        G  17   0.764  16.531   6.555
  176    H2*    G  17           H2*        G  17  -0.961  16.237   8.228
  177   2HO*    G  17          2HO*        G  17   0.561  16.383  10.042
  178    H1*    G  17           H1*        G  17  -1.094  18.970   8.792
  179    H8     G  17           H8         G  17  -3.542  18.200   8.565
  180    H1     G  17           H1         G  17  -2.970  17.581   2.218
  181   1H2     G  17          1H2         G  17  -0.908  17.682   1.619
  182   2H2     G  17          2H2         G  17   0.414  17.882   2.758
  183   1H5*    G  18          1H5*        G  18  -0.312  14.627   9.659
  184   2H5*    G  18          2H5*        G  18  -0.051  12.879   9.515
  185    H4*    G  18           H4*        G  18  -2.459  13.441   9.597
  186    H3*    G  18           H3*        G  18  -1.456  12.319   6.972
  187    H2*    G  18           H2*        G  18  -3.816  12.235   6.317
  188   2HO*    G  18          2HO*        G  18  -4.625  11.739   8.473
  189    H1*    G  18           H1*        G  18  -4.251  14.822   6.979
  190    H8     G  18           H8         G  18  -0.631  14.929   6.108
  191    H1     G  18           H1         G  18  -4.327  14.122   0.930
  192   1H2     G  18          1H2         G  18  -6.414  13.732   1.549
  193   2H2     G  18          2H2         G  18  -6.884  13.631   3.235
  194   1H5*    A  19          1H5*        A  19  -4.808  10.046   8.113
  195   2H5*    A  19          2H5*        A  19  -4.554   8.309   7.866
  196    H4*    A  19           H4*        A  19  -6.597   9.088   6.722
  197    H3*    A  19           H3*        A  19  -4.324   8.243   4.905
  198    H2*    A  19           H2*        A  19  -5.976   8.386   3.119
  199   2HO*    A  19          2HO*        A  19  -7.809   7.670   4.382
  200    H1*    A  19           H1*        A  19  -6.744  10.861   3.818
  201    H8     A  19           H8         A  19  -3.183  10.913   4.938
  202   1H6     A  19          1H6         A  19  -1.591  11.370  -1.044
  203   2H6     A  19          2H6         A  19  -1.003  11.465   0.605
  204    H2     A  19           H2         A  19  -5.921  10.417  -0.838
  205   1H5*    G  20          1H5*        G  20  -7.880   6.016   4.077
  206   2H5*    G  20          2H5*        G  20  -7.544   4.400   3.405
  207    H4*    G  20           H4*        G  20  -8.938   5.996   1.955
  208    H3*    G  20           H3*        G  20  -6.469   4.548   1.012
  209    H2*    G  20           H2*        G  20  -6.853   5.473  -1.185
  210   2HO*    G  20          2HO*        G  20  -9.184   5.240  -1.090
  211    H1*    G  20           H1*        G  20  -7.361   8.017  -0.319
  212    H8     G  20           H8         G  20  -4.773   7.162   2.138
  213    H1     G  20           H1         G  20  -2.314   7.688  -3.761
  214   1H2     G  20          1H2         G  20  -3.919   7.529  -5.274
  215   2H2     G  20          2H2         G  20  -5.604   7.349  -4.821
  216   1H5*    G  21          1H5*        G  21  -8.905   3.138  -1.817
  217   2H5*    G  21          2H5*        G  21  -8.748   1.374  -2.013
  218    H4*    G  21           H4*        G  21  -7.936   2.492  -4.040
  219    H3*    G  21           H3*        G  21  -5.730   1.371  -2.282
  220    H2*    G  21           H2*        G  21  -4.242   1.907  -4.099
  221   2HO*    G  21          2HO*        G  21  -5.650   1.373  -5.860
  222    H1*    G  21           H1*        G  21  -5.220   4.416  -4.412
  223    H8     G  21           H8         G  21  -5.376   3.429  -0.756
  224    H1     G  21           H1         G  21   0.508   4.951  -2.823
  225   1H2     G  21          1H2         G  21   0.485   5.126  -5.050
  226   2H2     G  21          2H2         G  21  -0.989   4.908  -5.968
  227   1H5*    A  22          1H5*        A  22  -5.622  -0.140  -6.410
  228   2H5*    A  22          2H5*        A  22  -5.068  -1.821  -6.430
  229    H4*    A  22           H4*        A  22  -3.842  -0.382  -8.040
  230    H3*    A  22           H3*        A  22  -2.194  -1.534  -5.765
  231    H2*    A  22           H2*        A  22  -0.287  -0.727  -7.023
  232   2HO*    A  22          2HO*        A  22  -2.206  -0.045  -9.039
  233    H1*    A  22           H1*        A  22  -1.366   1.725  -7.428
  234    H8     A  22           H8         A  22  -2.599   0.742  -4.014
  235   1H6     A  22          1H6         A  22   3.081   2.271  -1.994
  236   2H6     A  22          2H6         A  22   1.455   1.845  -1.491
  237    H2     A  22           H2         A  22   3.163   2.196  -6.421
  238   1H5*    U  23          1H5*        U  23  -0.066  -2.332  -8.991
  239   2H5*    U  23          2H5*        U  23   0.482  -4.017  -9.070
  240    H4*    U  23           H4*        U  23   2.401  -2.471  -9.168
  241    H3*    U  23           H3*        U  23   2.141  -4.099  -6.625
  242    H2*    U  23           H2*        U  23   4.384  -3.290  -6.113
  243   2HO*    U  23          2HO*        U  23   5.484  -1.990  -7.641
  244    H1*    U  23           H1*        U  23   3.767  -0.704  -6.713
  245    H3     U  23           H3         U  23   4.041  -1.363  -2.173
  246    H5     U  23           H5         U  23   0.032  -2.085  -3.195
  247    H6     U  23           H6         U  23   0.655  -1.939  -5.527
  248   1H5*    U  24          1H5*        U  24   5.961  -4.578  -8.052
  249   2H5*    U  24          2H5*        U  24   6.409  -6.289  -8.198
  250    H4*    U  24           H4*        U  24   8.120  -4.989  -6.946
  251    H3*    U  24           H3*        U  24   6.563  -7.096  -5.424
  252    H2*    U  24           H2*        U  24   8.148  -6.714  -3.622
  253   2HO*    U  24          2HO*        U  24   9.995  -6.426  -5.051
  254    H1*    U  24           H1*        U  24   8.006  -3.970  -3.826
  255    H3     U  24           H3         U  24   5.826  -5.597  -0.061
  256    H5     U  24           H5         U  24   2.924  -5.063  -3.050
  257    H6     U  24           H6         U  24   4.701  -4.788  -4.660
  258   1H5*    U  25          1H5*        U  25  10.450  -8.253  -4.601
  259   2H5*    U  25          2H5*        U  25  10.615 -10.008  -4.829
  260    H4*    U  25           H4*        U  25  11.188  -9.438  -2.524
  261    H3*    U  25           H3*        U  25   8.488 -10.800  -2.783
  262    H2*    U  25           H2*        U  25   8.588 -10.965  -0.350
  263   2HO*    U  25          2HO*        U  25  10.895 -11.334  -0.222
  264    H1*    U  25           H1*        U  25   9.296  -8.358  -0.054
  265    H3     U  25           H3         U  25   4.919  -8.573   1.095
  266    H5     U  25           H5         U  25   4.864  -8.628  -3.099
  267    H6     U  25           H6         U  25   7.273  -8.783  -3.070
  268   1H5*    G  26          1H5*        G  26  10.996 -13.056  -0.045
  269   2H5*    G  26          2H5*        G  26  10.712 -14.795  -0.247
  270    H4*    G  26           H4*        G  26  10.479 -14.112   2.106
  271    H3*    G  26           H3*        G  26   7.891 -14.965   0.769
  272    H2*    G  26           H2*        G  26   6.992 -14.955   3.038
  273   2HO*    G  26          2HO*        G  26   8.948 -15.713   4.082
  274    H1*    G  26           H1*        G  26   7.976 -12.488   3.573
  275    H8     G  26           H8         G  26   7.256 -12.405  -0.113
  276    H1     G  26           H1         G  26   1.974 -12.019   3.507
  277   1H2     G  26          1H2         G  26   2.454 -12.581   5.601
  278   2H2     G  26          2H2         G  26   4.081 -13.004   6.093
  279   1H5*    G  27          1H5*        G  27   8.521 -17.417   4.177
  280   2H5*    G  27          2H5*        G  27   8.023 -19.096   3.884
  281    H4*    G  27           H4*        G  27   6.869 -18.158   5.857
  282    H3*    G  27           H3*        G  27   5.115 -18.709   3.470
  283    H2*    G  27           H2*        G  27   3.268 -18.253   5.036
  284   2HO*    G  27          2HO*        G  27   3.742 -17.830   7.222
  285    H1*    G  27           H1*        G  27   4.365 -15.942   5.918
  286    H8     G  27           H8         G  27   5.551 -16.125   2.363
  287    H1     G  27           H1         G  27  -0.636 -14.497   2.881
  288   1H2     G  27          1H2         G  27  -1.350 -14.886   4.939
  289   2H2     G  27          2H2         G  27  -0.290 -15.519   6.184
  290   1H5*    C  28          1H5*        C  28   3.596 -20.655   6.761
  291   2H5*    C  28          2H5*        C  28   2.972 -22.288   6.436
  292    H4*    C  28           H4*        C  28   1.204 -20.846   7.380
  293    H3*    C  28           H3*        C  28   0.852 -21.584   4.457
  294    H2*    C  28           H2*        C  28  -1.356 -20.575   4.670
  295   2HO*    C  28          2HO*        C  28  -1.721 -21.300   6.871
  296    H1*    C  28           H1*        C  28  -0.408 -18.337   5.875
  297   1H4     C  28          1H4         C  28  -0.230 -17.142  -0.356
  298   2H4     C  28          2H4         C  28   1.436 -17.682  -0.426
  299    H5     C  28           H5         C  28   2.574 -18.704   1.488
  300    H6     C  28           H6         C  28   2.332 -19.364   3.795
  301   1H5*    C  29          1H5*        C  29  -2.682 -22.738   6.380
  302   2H5*    C  29          2H5*        C  29  -3.295 -24.298   5.801
  303    H4*    C  29           H4*        C  29  -4.989 -22.535   5.510
  304    H3*    C  29           H3*        C  29  -3.756 -23.551   2.927
  305    H2*    C  29           H2*        C  29  -5.482 -22.280   1.816
  306   2HO*    C  29          2HO*        C  29  -7.160 -22.745   3.380
  307    H1*    C  29           H1*        C  29  -5.091 -20.048   3.346
  308   1H4     C  29          1H4         C  29  -1.445 -19.605  -1.846
  309   2H4     C  29          2H4         C  29  -0.116 -20.392  -1.013
  310    H5     C  29           H5         C  29  -0.335 -21.303   1.257
  311    H6     C  29           H6         C  29  -1.867 -21.640   3.098
  312    H3T    C  29           H3T        C  29  -4.909 -25.101   4.165
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -6.794 -15.156  -9.489
    2   2H5*    G   1          2H5*        G   1  -7.012 -13.554  -8.756
    3    H4*    G   1           H4*        G   1  -8.536 -15.108  -7.692
    4    H3*    G   1           H3*        G   1  -6.186 -14.348  -5.929
    5    H2*    G   1           H2*        G   1  -7.383 -15.511  -4.158
    6   2HO*    G   1          2HO*        G   1  -9.530 -14.855  -4.900
    7    H1*    G   1           H1*        G   1  -7.823 -17.716  -5.658
    8    H8     G   1           H8         G   1  -4.586 -16.551  -7.075
    9    H1     G   1           H1         G   1  -3.952 -18.982  -1.172
   10   1H2     G   1          1H2         G   1  -5.944 -19.162  -0.213
   11   2H2     G   1          2H2         G   1  -7.419 -18.732  -1.058
   12    H5T    G   1           H5T        G   1  -4.798 -14.127  -8.977
   13   1H5*    G   2          1H5*        G   2  -9.652 -13.654  -3.676
   14   2H5*    G   2          2H5*        G   2  -9.590 -12.073  -2.877
   15    H4*    G   2           H4*        G   2 -10.053 -13.851  -1.245
   16    H3*    G   2           H3*        G   2  -7.330 -12.537  -1.039
   17    H2*    G   2           H2*        G   2  -7.111 -13.770   1.081
   18   2HO*    G   2          2HO*        G   2  -9.377 -13.558   1.674
   19    H1*    G   2           H1*        G   2  -7.902 -16.112  -0.002
   20    H8     G   2           H8         G   2  -6.154 -14.510  -2.895
   21    H1     G   2           H1         G   2  -2.126 -16.720   1.588
   22   1H2     G   2          1H2         G   2  -3.246 -17.172   3.453
   23   2H2     G   2          2H2         G   2  -4.980 -16.949   3.561
   24   1H5*    C   3          1H5*        C   3  -9.125 -12.188   2.675
   25   2H5*    C   3          2H5*        C   3  -8.839 -10.616   3.449
   26    H4*    C   3           H4*        C   3  -8.012 -12.489   4.846
   27    H3*    C   3           H3*        C   3  -5.871 -10.690   3.665
   28    H2*    C   3           H2*        C   3  -4.345 -11.886   5.155
   29   2HO*    C   3          2HO*        C   3  -5.174 -13.415   6.618
   30    H1*    C   3           H1*        C   3  -5.325 -14.339   4.415
   31   1H4     C   3          1H4         C   3  -0.573 -13.064   0.404
   32   2H4     C   3          2H4         C   3  -1.715 -12.391  -0.745
   33    H5     C   3           H5         C   3  -4.082 -12.071  -0.219
   34    H6     C   3           H6         C   3  -5.771 -12.354   1.487
   35   1H5*    C   4          1H5*        C   4  -5.363 -10.738   7.740
   36   2H5*    C   4          2H5*        C   4  -4.920  -9.162   8.430
   37    H4*    C   4           H4*        C   4  -3.197 -10.859   8.936
   38    H3*    C   4           H3*        C   4  -2.348  -8.762   6.910
   39    H2*    C   4           H2*        C   4  -0.116  -9.707   7.229
   40   2HO*    C   4          2HO*        C   4  -0.340 -10.154   9.505
   41    H1*    C   4           H1*        C   4  -1.007 -12.267   6.953
   42   1H4     C   4          1H4         C   4   0.676 -10.342   1.165
   43   2H4     C   4          2H4         C   4  -0.913  -9.651   0.886
   44    H5     C   4           H5         C   4  -2.645  -9.582   2.627
   45    H6     C   4           H6         C   4  -3.143 -10.144   4.924
   46   1H5*    A   5          1H5*        A   5   0.430  -8.742  10.192
   47   2H5*    A   5          2H5*        A   5   1.119  -7.125  10.446
   48    H4*    A   5           H4*        A   5   2.850  -8.880   9.968
   49    H3*    A   5           H3*        A   5   2.540  -6.665   7.922
   50    H2*    A   5           H2*        A   5   4.547  -7.604   6.897
   51   2HO*    A   5          2HO*        A   5   5.593  -9.381   7.899
   52    H1*    A   5           H1*        A   5   3.570 -10.139   6.941
   53    H8     A   5           H8         A   5   0.510  -8.045   6.369
   54   1H6     A   5          1H6         A   5   2.513  -7.575   0.486
   55   2H6     A   5          2H6         A   5   1.145  -7.284   1.544
   56    H2     A   5           H2         A   5   5.804  -9.192   2.953
   57   1H5*    U   6          1H5*        U   6   6.495  -6.967   8.176
   58   2H5*    U   6          2H5*        U   6   7.244  -5.401   8.540
   59    H4*    U   6           H4*        U   6   8.228  -6.353   6.506
   60    H3*    U   6           H3*        U   6   6.444  -3.943   6.060
   61    H2*    U   6           H2*        U   6   7.337  -3.945   3.800
   62   2HO*    U   6          2HO*        U   6   8.996  -5.382   3.233
   63    H1*    U   6           H1*        U   6   7.002  -6.632   3.476
   64    H3     U   6           H3         U   6   3.706  -4.684   1.009
   65    H5     U   6           H5         U   6   2.277  -4.590   4.960
   66    H6     U   6           H6         U   6   4.440  -5.356   5.701
   67   1H5*    C   7          1H5*        C   7  10.569  -3.584   4.547
   68   2H5*    C   7          2H5*        C   7  11.157  -1.934   4.810
   69    H4*    C   7           H4*        C   7  11.602  -2.589   2.506
   70    H3*    C   7           H3*        C   7   9.353  -0.570   2.782
   71    H2*    C   7           H2*        C   7   9.555  -0.351   0.370
   72   2HO*    C   7          2HO*        C   7  11.816  -0.534   0.156
   73    H1*    C   7           H1*        C   7   9.615  -3.036  -0.048
   74   1H4     C   7          1H4         C   7   3.410  -1.748  -0.304
   75   2H4     C   7          2H4         C   7   3.310  -1.727   1.442
   76    H5     C   7           H5         C   7   5.274  -1.888   2.891
   77    H6     C   7           H6         C   7   7.681  -2.149   2.916
   78   1H5*    U   8          1H5*        U   8  12.856   0.796   0.388
   79   2H5*    U   8          2H5*        U   8  13.001   2.564   0.465
   80    H4*    U   8           H4*        U   8  12.952   1.772  -1.880
   81    H3*    U   8           H3*        U   8  10.502   3.318  -0.973
   82    H2*    U   8           H2*        U   8   9.890   3.298  -3.335
   83   2HO*    U   8          2HO*        U   8  12.077   3.579  -4.127
   84    H1*    U   8           H1*        U   8  10.521   0.672  -3.679
   85    H3     U   8           H3         U   8   6.037   0.523  -3.857
   86    H5     U   8           H5         U   8   6.815   1.296   0.197
   87    H6     U   8           H6         U   8   9.160   1.469  -0.336
   88   1H5*    U   9          1H5*        U   9  12.195   5.089  -4.571
   89   2H5*    U   9          2H5*        U   9  11.943   6.845  -4.562
   90    H4*    U   9           H4*        U   9  10.961   5.815  -6.580
   91    H3*    U   9           H3*        U   9   8.951   6.909  -4.589
   92    H2*    U   9           H2*        U   9   7.316   6.542  -6.347
   93   2HO*    U   9          2HO*        U   9   8.610   7.155  -8.136
   94    H1*    U   9           H1*        U   9   8.234   4.028  -6.917
   95    H3     U   9           H3         U   9   4.342   3.412  -4.639
   96    H5     U   9           H5         U   9   7.092   4.515  -1.667
   97    H6     U   9           H6         U   9   8.729   4.895  -3.401
   98   1H5*    G  10          1H5*        G  10   6.575  10.531  -7.718
   99   2H5*    G  10          2H5*        G  10   6.026   9.344  -6.518
  100    H4*    G  10           H4*        G  10   6.253   8.828  -9.519
  101    H3*    G  10           H3*        G  10   3.923   9.435  -7.678
  102    H2*    G  10           H2*        G  10   2.567   8.075  -9.169
  103   2HO*    G  10          2HO*        G  10   3.680   8.803 -11.128
  104    H1*    G  10           H1*        G  10   4.396   6.060  -9.298
  105    H8     G  10           H8         G  10   1.841   5.499  -8.373
  106    H1     G  10           H1         G  10   3.957   6.867  -2.472
  107   1H2     G  10          1H2         G  10   5.881   7.995  -2.593
  108   2H2     G  10          2H2         G  10   6.610   8.404  -4.133
  109   1H5*    C  11          1H5*        C  11   1.862   9.539 -10.999
  110   2H5*    C  11          2H5*        C  11   1.076  11.123 -11.184
  111    H4*    C  11           H4*        C  11  -0.632   9.401 -11.282
  112    H3*    C  11           H3*        C  11  -0.588  10.999  -8.710
  113    H2*    C  11           H2*        C  11  -2.678   9.886  -8.168
  114   2HO*    C  11          2HO*        C  11  -3.649   8.497  -9.691
  115    H1*    C  11           H1*        C  11  -1.764   7.416  -8.808
  116   1H4     C  11          1H4         C  11  -0.331   8.394  -2.678
  117   2H4     C  11          2H4         C  11   1.287   8.895  -3.136
  118    H5     C  11           H5         C  11   1.978   9.145  -5.470
  119    H6     C  11           H6         C  11   1.243   8.987  -7.766
  120   1H5*    U  12          1H5*        U  12  -4.516  11.149 -10.201
  121   2H5*    U  12          2H5*        U  12  -5.167  12.801 -10.161
  122    H4*    U  12           H4*        U  12  -6.712  11.289  -9.028
  123    H3*    U  12           H3*        U  12  -5.193  13.139  -7.154
  124    H2*    U  12           H2*        U  12  -6.745  12.357  -5.457
  125   2HO*    U  12          2HO*        U  12  -8.591  12.222  -6.918
  126    H1*    U  12           H1*        U  12  -6.428   9.742  -6.110
  127    H3     U  12           H3         U  12  -4.055  10.531  -2.283
  128    H5     U  12           H5         U  12  -1.451  11.531  -5.423
  129    H6     U  12           H6         U  12  -3.300  11.303  -6.957
  130   1H5*    C  13          1H5*        C  13  -9.198  13.742  -6.180
  131   2H5*    C  13          2H5*        C  13  -9.521  15.479  -6.020
  132    H4*    C  13           H4*        C  13 -10.132  14.314  -3.940
  133    H3*    C  13           H3*        C  13  -7.649  16.048  -3.767
  134    H2*    C  13           H2*        C  13  -7.759  15.657  -1.383
  135   2HO*    C  13          2HO*        C  13 -10.129  15.780  -1.317
  136    H1*    C  13           H1*        C  13  -8.307  12.968  -1.645
  137   1H4     C  13          1H4         C  13  -2.086  13.794  -0.689
  138   2H4     C  13          2H4         C  13  -1.799  13.958  -2.412
  139    H5     C  13           H5         C  13  -3.636  14.001  -4.051
  140    H6     C  13           H6         C  13  -6.041  13.903  -4.312
  141   1H5*    U  14          1H5*        U  14  -9.232  17.297  -0.509
  142   2H5*    U  14          2H5*        U  14  -9.294  19.071  -0.438
  143    H4*    U  14           H4*        U  14  -7.920  18.240   1.407
  144    H3*    U  14           H3*        U  14  -6.313  19.549  -0.807
  145    H2*    U  14           H2*        U  14  -4.473  19.439   0.771
  146   2HO*    U  14          2HO*        U  14  -4.917  18.510   2.882
  147    H1*    U  14           H1*        U  14  -4.970  16.832   1.430
  148    H3     U  14           H3         U  14  -1.279  16.962  -1.289
  149    H5     U  14           H5         U  14  -4.551  17.217  -3.910
  150    H6     U  14           H6         U  14  -6.006  17.405  -1.985
  151   1H5*    U  15          1H5*        U  15  -6.420  24.026   2.704
  152   2H5*    U  15          2H5*        U  15  -4.699  23.799   2.356
  153    H4*    U  15           H4*        U  15  -4.977  24.233   4.712
  154    H3*    U  15           H3*        U  15  -3.519  22.087   3.843
  155    H2*    U  15           H2*        U  15  -5.311  20.542   3.994
  156   2HO*    U  15          2HO*        U  15  -4.912  19.270   5.867
  157    H1*    U  15           H1*        U  15  -6.011  21.718   6.686
  158    H3     U  15           H3         U  15  -9.826  19.407   7.304
  159    H5     U  15           H5         U  15  -9.153  19.015   3.173
  160    H6     U  15           H6         U  15  -7.236  20.470   3.403
  161   1H5*    C  16          1H5*        C  16  -1.751  20.713   6.340
  162   2H5*    C  16          2H5*        C  16  -0.457  21.625   7.133
  163    H4*    C  16           H4*        C  16   0.411  19.536   6.346
  164    H3*    C  16           H3*        C  16   1.716  21.869   5.760
  165    H2*    C  16           H2*        C  16   0.590  22.151   3.642
  166   2HO*    C  16          2HO*        C  16   2.881  22.240   3.296
  167    H1*    C  16           H1*        C  16   1.185  19.228   3.096
  168   1H4     C  16          1H4         C  16  -2.529  20.417  -1.948
  169   2H4     C  16          2H4         C  16  -3.654  21.330  -0.956
  170    H5     C  16           H5         C  16  -3.264  21.816   1.390
  171    H6     C  16           H6         C  16  -1.774  21.421   3.268
  172   1H5*    G  17          1H5*        G  17   3.399  16.198   6.231
  173   2H5*    G  17          2H5*        G  17   2.233  17.293   5.477
  174    H4*    G  17           H4*        G  17   2.376  17.066   8.500
  175    H3*    G  17           H3*        G  17   0.951  15.172   6.598
  176    H2*    G  17           H2*        G  17  -0.636  14.920   8.405
  177   2HO*    G  17          2HO*        G  17   1.043  14.887  10.078
  178    H1*    G  17           H1*        G  17  -0.569  17.617   9.078
  179    H8     G  17           H8         G  17  -3.065  16.970   8.953
  180    H1     G  17           H1         G  17  -2.865  16.735   2.555
  181   1H2     G  17          1H2         G  17  -0.827  16.789   1.848
  182   2H2     G  17          2H2         G  17   0.557  16.830   2.930
  183   1H5*    G  18          1H5*        G  18  -0.013  13.220   9.671
  184   2H5*    G  18          2H5*        G  18   0.139  11.467   9.451
  185    H4*    G  18           H4*        G  18  -2.225  12.145   9.704
  186    H3*    G  18           H3*        G  18  -1.436  11.106   6.977
  187    H2*    G  18           H2*        G  18  -3.825  11.171   6.448
  188   2HO*    G  18          2HO*        G  18  -4.549  10.600   8.615
  189    H1*    G  18           H1*        G  18  -4.096  13.735   7.265
  190    H8     G  18           H8         G  18  -0.528  13.700   6.197
  191    H1     G  18           H1         G  18  -4.533  13.454   1.200
  192   1H2     G  18          1H2         G  18  -6.598  13.105   1.902
  193   2H2     G  18          2H2         G  18  -6.986  12.907   3.601
  194   1H5*    A  19          1H5*        A  19  -4.841   8.928   8.149
  195   2H5*    A  19          2H5*        A  19  -4.652   7.196   7.817
  196    H4*    A  19           H4*        A  19  -6.709   8.065   6.784
  197    H3*    A  19           H3*        A  19  -4.509   7.292   4.845
  198    H2*    A  19           H2*        A  19  -6.218   7.559   3.125
  199   2HO*    A  19          2HO*        A  19  -8.016   6.788   4.403
  200    H1*    A  19           H1*        A  19  -6.935   9.995   3.990
  201    H8     A  19           H8         A  19  -3.330   9.895   4.976
  202   1H6     A  19          1H6         A  19  -1.958  10.818  -1.005
  203   2H6     A  19          2H6         A  19  -1.309  10.749   0.621
  204    H2     A  19           H2         A  19  -6.306   9.947  -0.701
  205   1H5*    G  20          1H5*        G  20  -8.091   5.144   3.964
  206   2H5*    G  20          2H5*        G  20  -7.768   3.561   3.211
  207    H4*    G  20           H4*        G  20  -9.171   5.202   1.841
  208    H3*    G  20           H3*        G  20  -6.661   3.890   0.808
  209    H2*    G  20           H2*        G  20  -7.098   4.930  -1.328
  210   2HO*    G  20          2HO*        G  20  -9.422   4.621  -1.230
  211    H1*    G  20           H1*        G  20  -7.678   7.396  -0.298
  212    H8     G  20           H8         G  20  -5.024   6.397   2.057
  213    H1     G  20           H1         G  20  -2.678   7.547  -3.800
  214   1H2     G  20          1H2         G  20  -4.306   7.478  -5.301
  215   2H2     G  20          2H2         G  20  -5.975   7.207  -4.841
  216   1H5*    G  21          1H5*        G  21  -9.023   2.519  -2.086
  217   2H5*    G  21          2H5*        G  21  -8.777   0.782  -2.377
  218    H4*    G  21           H4*        G  21  -8.002   2.050  -4.325
  219    H3*    G  21           H3*        G  21  -5.747   0.965  -2.608
  220    H2*    G  21           H2*        G  21  -4.292   1.665  -4.396
  221   2HO*    G  21          2HO*        G  21  -5.165   2.528  -6.323
  222    H1*    G  21           H1*        G  21  -5.395   4.142  -4.550
  223    H8     G  21           H8         G  21  -5.523   2.914  -0.969
  224    H1     G  21           H1         G  21   0.286   4.874  -2.874
  225   1H2     G  21          1H2         G  21   0.265   5.199  -5.091
  226   2H2     G  21          2H2         G  21  -1.193   4.960  -6.029
  227   1H5*    A  22          1H5*        A  22  -5.498  -0.164  -6.763
  228   2H5*    A  22          2H5*        A  22  -4.885  -1.813  -6.960
  229    H4*    A  22           H4*        A  22  -3.708  -0.191  -8.411
  230    H3*    A  22           H3*        A  22  -1.994  -1.424  -6.226
  231    H2*    A  22           H2*        A  22  -0.149  -0.445  -7.481
  232   2HO*    A  22          2HO*        A  22  -1.155  -0.803  -9.601
  233    H1*    A  22           H1*        A  22  -1.359   1.974  -7.653
  234    H8     A  22           H8         A  22  -2.501   0.675  -4.321
  235   1H6     A  22          1H6         A  22   3.121   2.288  -2.211
  236   2H6     A  22          2H6         A  22   1.515   1.763  -1.738
  237    H2     A  22           H2         A  22   3.176   2.549  -6.634
  238   1H5*    U  23          1H5*        U  23   0.197  -1.934  -9.448
  239   2H5*    U  23          2H5*        U  23   0.785  -3.599  -9.619
  240    H4*    U  23           H4*        U  23   2.668  -2.015  -9.592
  241    H3*    U  23           H3*        U  23   2.395  -3.770  -7.137
  242    H2*    U  23           H2*        U  23   4.615  -2.935  -6.549
  243   2HO*    U  23          2HO*        U  23   5.361  -2.857  -8.802
  244    H1*    U  23           H1*        U  23   3.948  -0.342  -7.043
  245    H3     U  23           H3         U  23   4.171  -1.183  -2.531
  246    H5     U  23           H5         U  23   0.187  -1.929  -3.643
  247    H6     U  23           H6         U  23   0.842  -1.680  -5.958
  248   1H5*    U  24          1H5*        U  24   6.280  -4.177  -8.467
  249   2H5*    U  24          2H5*        U  24   6.727  -5.886  -8.641
  250    H4*    U  24           H4*        U  24   8.381  -4.633  -7.274
  251    H3*    U  24           H3*        U  24   6.735  -6.738  -5.846
  252    H2*    U  24           H2*        U  24   8.279  -6.410  -3.999
  253   2HO*    U  24          2HO*        U  24  10.172  -6.148  -5.366
  254    H1*    U  24           H1*        U  24   8.201  -3.653  -4.197
  255    H3     U  24           H3         U  24   6.005  -5.200  -0.426
  256    H5     U  24           H5         U  24   3.106  -4.738  -3.431
  257    H6     U  24           H6         U  24   4.890  -4.493  -5.045
  258   1H5*    U  25          1H5*        U  25  10.615  -7.972  -4.971
  259   2H5*    U  25          2H5*        U  25  10.736  -9.731  -5.191
  260    H4*    U  25           H4*        U  25  11.315  -9.158  -2.886
  261    H3*    U  25           H3*        U  25   8.587 -10.465  -3.151
  262    H2*    U  25           H2*        U  25   8.692 -10.637  -0.715
  263   2HO*    U  25          2HO*        U  25  10.988 -11.052  -0.590
  264    H1*    U  25           H1*        U  25   9.450  -8.039  -0.427
  265    H3     U  25           H3         U  25   5.085  -8.105   0.749
  266    H5     U  25           H5         U  25   4.987  -8.340  -3.439
  267    H6     U  25           H6         U  25   7.395  -8.526  -3.428
  268   1H5*    G  26          1H5*        G  26  11.095 -12.774  -0.441
  269   2H5*    G  26          2H5*        G  26  10.754 -14.505  -0.610
  270    H4*    G  26           H4*        G  26  10.600 -13.762   1.741
  271    H3*    G  26           H3*        G  26   7.965 -14.605   0.492
  272    H2*    G  26           H2*        G  26   7.137 -14.536   2.784
  273   2HO*    G  26          2HO*        G  26   8.566 -14.057   4.486
  274    H1*    G  26           H1*        G  26   8.155 -12.063   3.228
  275    H8     G  26           H8         G  26   7.353 -12.053  -0.438
  276    H1     G  26           H1         G  26   2.140 -11.631   3.277
  277   1H2     G  26          1H2         G  26   2.663 -12.142   5.371
  278   2H2     G  26          2H2         G  26   4.306 -12.535   5.843
  279   1H5*    G  27          1H5*        G  27   8.713 -16.824   3.954
  280   2H5*    G  27          2H5*        G  27   8.248 -18.532   3.826
  281    H4*    G  27           H4*        G  27   7.174 -17.466   5.774
  282    H3*    G  27           H3*        G  27   5.317 -18.249   3.530
  283    H2*    G  27           H2*        G  27   3.526 -17.693   5.132
  284   2HO*    G  27          2HO*        G  27   4.668 -18.479   7.018
  285    H1*    G  27           H1*        G  27   4.610 -15.306   5.781
  286    H8     G  27           H8         G  27   5.664 -15.699   2.204
  287    H1     G  27           H1         G  27  -0.539 -14.196   2.853
  288   1H2     G  27          1H2         G  27  -1.180 -14.503   4.958
  289   2H2     G  27          2H2         G  27  -0.055 -15.032   6.194
  290   1H5*    C  28          1H5*        C  28   3.949 -20.093   7.003
  291   2H5*    C  28          2H5*        C  28   3.357 -21.749   6.738
  292    H4*    C  28           H4*        C  28   1.574 -20.307   7.658
  293    H3*    C  28           H3*        C  28   1.201 -21.167   4.772
  294    H2*    C  28           H2*        C  28  -1.027 -20.215   4.980
  295   2HO*    C  28          2HO*        C  28  -1.728 -19.399   6.982
  296    H1*    C  28           H1*        C  28  -0.118 -17.900   6.086
  297   1H4     C  28          1H4         C  28  -0.139 -16.992  -0.194
  298   2H4     C  28          2H4         C  28   1.543 -17.477  -0.286
  299    H5     C  28           H5         C  28   2.765 -18.373   1.644
  300    H6     C  28           H6         C  28   2.602 -18.932   3.987
  301   1H5*    C  29          1H5*        C  29  -2.236 -22.208   6.796
  302   2H5*    C  29          2H5*        C  29  -2.881 -23.801   6.352
  303    H4*    C  29           H4*        C  29  -4.576 -22.059   6.000
  304    H3*    C  29           H3*        C  29  -3.426 -23.257   3.460
  305    H2*    C  29           H2*        C  29  -5.180 -22.054   2.305
  306   2HO*    C  29          2HO*        C  29  -6.820 -22.395   3.940
  307    H1*    C  29           H1*        C  29  -4.745 -19.726   3.670
  308   1H4     C  29          1H4         C  29  -1.239 -19.586  -1.629
  309   2H4     C  29          2H4         C  29   0.115 -20.320  -0.789
  310    H5     C  29           H5         C  29  -0.043 -21.093   1.537
  311    H6     C  29           H6         C  29  -1.523 -21.324   3.435
  312    H3T    C  29           H3T        C  29  -5.368 -24.473   3.622
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  -7.574 -15.437  -8.975
    2   2H5*    G   1          2H5*        G   1  -7.663 -13.785  -8.334
    3    H4*    G   1           H4*        G   1  -9.141 -15.198  -7.038
    4    H3*    G   1           H3*        G   1  -6.610 -14.456  -5.539
    5    H2*    G   1           H2*        G   1  -7.696 -15.444  -3.602
    6   2HO*    G   1          2HO*        G   1  -9.833 -16.231  -3.786
    7    H1*    G   1           H1*        G   1  -8.364 -17.709  -4.919
    8    H8     G   1           H8         G   1  -5.212 -16.737  -6.649
    9    H1     G   1           H1         G   1  -4.201 -18.992  -0.727
   10   1H2     G   1          1H2         G   1  -6.123 -19.076   0.383
   11   2H2     G   1          2H2         G   1  -7.641 -18.612  -0.363
   12    H5T    G   1           H5T        G   1  -5.503 -14.457  -8.707
   13   1H5*    G   2          1H5*        G   2  -9.841 -13.549  -3.121
   14   2H5*    G   2          2H5*        G   2  -9.706 -11.945  -2.375
   15    H4*    G   2           H4*        G   2 -10.111 -13.655  -0.662
   16    H3*    G   2           H3*        G   2  -7.346 -12.416  -0.659
   17    H2*    G   2           H2*        G   2  -7.030 -13.580   1.479
   18   2HO*    G   2          2HO*        G   2  -8.768 -14.730   2.385
   19    H1*    G   2           H1*        G   2  -7.953 -15.936   0.529
   20    H8     G   2           H8         G   2  -6.334 -14.442  -2.503
   21    H1     G   2           H1         G   2  -2.120 -16.711   1.775
   22   1H2     G   2          1H2         G   2  -3.140 -17.109   3.707
   23   2H2     G   2          2H2         G   2  -4.860 -16.833   3.913
   24   1H5*    C   3          1H5*        C   3  -8.957 -11.990   3.089
   25   2H5*    C   3          2H5*        C   3  -8.639 -10.422   3.858
   26    H4*    C   3           H4*        C   3  -7.797 -12.287   5.249
   27    H3*    C   3           H3*        C   3  -5.659 -10.543   3.981
   28    H2*    C   3           H2*        C   3  -4.106 -11.755   5.428
   29   2HO*    C   3          2HO*        C   3  -4.915 -13.257   6.932
   30    H1*    C   3           H1*        C   3  -5.157 -14.197   4.753
   31   1H4     C   3          1H4         C   3  -0.537 -13.104   0.540
   32   2H4     C   3          2H4         C   3  -1.699 -12.392  -0.564
   33    H5     C   3           H5         C   3  -4.028 -11.984   0.057
   34    H6     C   3           H6         C   3  -5.661 -12.207   1.828
   35   1H5*    C   4          1H5*        C   4  -5.023 -10.552   8.055
   36   2H5*    C   4          2H5*        C   4  -4.515  -8.975   8.700
   37    H4*    C   4           H4*        C   4  -2.821 -10.706   9.179
   38    H3*    C   4           H3*        C   4  -1.985  -8.668   7.090
   39    H2*    C   4           H2*        C   4   0.233  -9.678   7.347
   40   2HO*    C   4          2HO*        C   4   0.071 -10.080   9.635
   41    H1*    C   4           H1*        C   4  -0.741 -12.211   7.136
   42   1H4     C   4          1H4         C   4   0.773 -10.408   1.266
   43   2H4     C   4          2H4         C   4  -0.802  -9.668   1.039
   44    H5     C   4           H5         C   4  -2.461  -9.522   2.844
   45    H6     C   4           H6         C   4  -2.889 -10.043   5.165
   46   1H5*    A   5          1H5*        A   5   0.924  -8.677  10.268
   47   2H5*    A   5          2H5*        A   5   1.672  -7.080  10.463
   48    H4*    A   5           H4*        A   5   3.324  -8.897   9.954
   49    H3*    A   5           H3*        A   5   3.014  -6.694   7.894
   50    H2*    A   5           H2*        A   5   4.952  -7.725   6.806
   51   2HO*    A   5          2HO*        A   5   5.974  -8.354   8.866
   52    H1*    A   5           H1*        A   5   3.887 -10.213   6.903
   53    H8     A   5           H8         A   5   0.861  -8.040   6.463
   54   1H6     A   5          1H6         A   5   2.584  -7.641   0.492
   55   2H6     A   5          2H6         A   5   1.274  -7.317   1.614
   56    H2     A   5           H2         A   5   5.955  -9.320   2.801
   57   1H5*    U   6          1H5*        U   6   6.962  -7.109   7.933
   58   2H5*    U   6          2H5*        U   6   7.764  -5.559   8.243
   59    H4*    U   6           H4*        U   6   8.600  -6.550   6.159
   60    H3*    U   6           H3*        U   6   6.869  -4.089   5.809
   61    H2*    U   6           H2*        U   6   7.617  -4.129   3.498
   62   2HO*    U   6          2HO*        U   6   9.195  -5.614   2.837
   63    H1*    U   6           H1*        U   6   7.186  -6.805   3.210
   64    H3     U   6           H3         U   6   3.817  -4.761   0.934
   65    H5     U   6           H5         U   6   2.610  -4.641   4.957
   66    H6     U   6           H6         U   6   4.791  -5.464   5.578
   67   1H5*    C   7          1H5*        C   7  10.889  -3.860   4.014
   68   2H5*    C   7          2H5*        C   7  11.546  -2.230   4.243
   69    H4*    C   7           H4*        C   7  11.815  -2.880   1.912
   70    H3*    C   7           H3*        C   7   9.652  -0.798   2.362
   71    H2*    C   7           H2*        C   7   9.684  -0.558  -0.053
   72   2HO*    C   7          2HO*        C   7  11.921  -0.796  -0.430
   73    H1*    C   7           H1*        C   7   9.648  -3.244  -0.503
   74   1H4     C   7          1H4         C   7   3.477  -1.786  -0.336
   75   2H4     C   7          2H4         C   7   3.494  -1.776   1.414
   76    H5     C   7           H5         C   7   5.539  -2.010   2.725
   77    H6     C   7           H6         C   7   7.937  -2.340   2.589
   78   1H5*    U   8          1H5*        U   8  13.015   0.485  -0.275
   79   2H5*    U   8          2H5*        U   8  13.225   2.244  -0.169
   80    H4*    U   8           H4*        U   8  12.984   1.523  -2.522
   81    H3*    U   8           H3*        U   8  10.650   3.105  -1.403
   82    H2*    U   8           H2*        U   8   9.871   3.180  -3.704
   83   2HO*    U   8          2HO*        U   8  11.177   2.401  -5.376
   84    H1*    U   8           H1*        U   8  10.398   0.542  -4.167
   85    H3     U   8           H3         U   8   5.913   0.536  -4.034
   86    H5     U   8           H5         U   8   6.998   1.142  -0.022
   87    H6     U   8           H6         U   8   9.304   1.275  -0.716
   88   1H5*    U   9          1H5*        U   9  12.157   4.834  -5.052
   89   2H5*    U   9          2H5*        U   9  11.995   6.599  -5.051
   90    H4*    U   9           H4*        U   9  10.860   5.623  -7.004
   91    H3*    U   9           H3*        U   9   8.990   6.773  -4.913
   92    H2*    U   9           H2*        U   9   7.257   6.469  -6.587
   93   2HO*    U   9          2HO*        U   9   8.485   7.049  -8.437
   94    H1*    U   9           H1*        U   9   8.055   3.932  -7.210
   95    H3     U   9           H3         U   9   4.297   3.366  -4.724
   96    H5     U   9           H5         U   9   7.206   4.478  -1.910
   97    H6     U   9           H6         U   9   8.755   4.817  -3.731
   98   1H5*    G  10          1H5*        G  10   6.559  10.477  -7.892
   99   2H5*    G  10          2H5*        G  10   6.046   9.294  -6.672
  100    H4*    G  10           H4*        G  10   6.108   8.796  -9.686
  101    H3*    G  10           H3*        G  10   3.883   9.421  -7.725
  102    H2*    G  10           H2*        G  10   2.438   8.107  -9.180
  103   2HO*    G  10          2HO*        G  10   3.491   8.839 -11.173
  104    H1*    G  10           H1*        G  10   4.221   6.060  -9.401
  105    H8     G  10           H8         G  10   1.701   5.529  -8.364
  106    H1     G  10           H1         G  10   4.082   6.858  -2.557
  107   1H2     G  10          1H2         G  10   6.017   7.957  -2.760
  108   2H2     G  10          2H2         G  10   6.692   8.347  -4.329
  109   1H5*    C  11          1H5*        C  11   1.715   9.580 -10.948
  110   2H5*    C  11          2H5*        C  11   0.880  11.141 -11.088
  111    H4*    C  11           H4*        C  11  -0.767   9.341 -11.126
  112    H3*    C  11           H3*        C  11  -0.708  10.980  -8.578
  113    H2*    C  11           H2*        C  11  -2.745   9.790  -7.966
  114   2HO*    C  11          2HO*        C  11  -3.599   9.716 -10.156
  115    H1*    C  11           H1*        C  11  -1.749   7.356  -8.591
  116   1H4     C  11          1H4         C  11  -0.203   8.489  -2.514
  117   2H4     C  11          2H4         C  11   1.390   9.018  -3.020
  118    H5     C  11           H5         C  11   2.019   9.250  -5.376
  119    H6     C  11           H6         C  11   1.231   9.031  -7.651
  120   1H5*    U  12          1H5*        U  12  -4.736  11.038 -10.004
  121   2H5*    U  12          2H5*        U  12  -5.389  12.685  -9.945
  122    H4*    U  12           H4*        U  12  -6.894  11.137  -8.790
  123    H3*    U  12           H3*        U  12  -5.406  13.064  -6.976
  124    H2*    U  12           H2*        U  12  -6.903  12.271  -5.235
  125   2HO*    U  12          2HO*        U  12  -8.771  12.060  -6.653
  126    H1*    U  12           H1*        U  12  -6.535   9.652  -5.842
  127    H3     U  12           H3         U  12  -4.132  10.632  -2.062
  128    H5     U  12           H5         U  12  -1.570  11.495  -5.277
  129    H6     U  12           H6         U  12  -3.438  11.199  -6.776
  130   1H5*    C  13          1H5*        C  13  -9.455  13.581  -5.996
  131   2H5*    C  13          2H5*        C  13  -9.823  15.318  -5.899
  132    H4*    C  13           H4*        C  13 -10.404  14.198  -3.777
  133    H3*    C  13           H3*        C  13  -7.996  16.041  -3.700
  134    H2*    C  13           H2*        C  13  -8.000  15.730  -1.320
  135   2HO*    C  13          2HO*        C  13  -9.736  14.641  -0.300
  136    H1*    C  13           H1*        C  13  -8.525  13.015  -1.443
  137   1H4     C  13          1H4         C  13  -2.308  13.898  -0.570
  138   2H4     C  13          2H4         C  13  -2.032  13.997  -2.300
  139    H5     C  13           H5         C  13  -3.884  13.990  -3.923
  140    H6     C  13           H6         C  13  -6.290  13.881  -4.163
  141   1H5*    U  14          1H5*        U  14  -9.474  17.390  -0.501
  142   2H5*    U  14          2H5*        U  14  -9.580  19.163  -0.490
  143    H4*    U  14           H4*        U  14  -8.053  18.437   1.279
  144    H3*    U  14           H3*        U  14  -6.694  19.724  -1.102
  145    H2*    U  14           H2*        U  14  -4.670  19.665   0.193
  146   2HO*    U  14          2HO*        U  14  -5.607  20.246   2.205
  147    H1*    U  14           H1*        U  14  -5.075  17.110   1.120
  148    H3     U  14           H3         U  14  -1.641  17.004  -1.900
  149    H5     U  14           H5         U  14  -5.113  17.167  -4.259
  150    H6     U  14           H6         U  14  -6.403  17.479  -2.237
  151   1H5*    U  15          1H5*        U  15  -6.357  24.162   2.481
  152   2H5*    U  15          2H5*        U  15  -4.659  23.795   2.146
  153    H4*    U  15           H4*        U  15  -4.983  24.284   4.505
  154    H3*    U  15           H3*        U  15  -3.583  22.068   3.651
  155    H2*    U  15           H2*        U  15  -5.367  20.551   3.914
  156   2HO*    U  15          2HO*        U  15  -4.059  20.686   6.441
  157    H1*    U  15           H1*        U  15  -6.081  21.913   6.518
  158    H3     U  15           H3         U  15  -9.806  19.495   7.252
  159    H5     U  15           H5         U  15  -9.248  19.107   3.104
  160    H6     U  15           H6         U  15  -7.348  20.594   3.278
  161   1H5*    C  16          1H5*        C  16  -1.639  20.710   5.871
  162   2H5*    C  16          2H5*        C  16  -0.388  21.669   6.682
  163    H4*    C  16           H4*        C  16   0.602  19.705   5.760
  164    H3*    C  16           H3*        C  16   1.680  22.178   5.319
  165    H2*    C  16           H2*        C  16   0.385  22.540   3.290
  166   2HO*    C  16          2HO*        C  16   2.618  22.962   2.839
  167    H1*    C  16           H1*        C  16   1.309  19.780   2.437
  168   1H4     C  16          1H4         C  16  -2.736  20.854  -2.363
  169   2H4     C  16          2H4         C  16  -3.906  21.584  -1.276
  170    H5     C  16           H5         C  16  -3.488  21.921   1.092
  171    H6     C  16           H6         C  16  -1.894  21.565   2.886
  172   1H5*    G  17          1H5*        G  17   3.731  16.763   6.231
  173   2H5*    G  17          2H5*        G  17   2.384  16.164   5.245
  174    H4*    G  17           H4*        G  17   2.268  17.489   7.960
  175    H3*    G  17           H3*        G  17   0.896  15.166   6.544
  176    H2*    G  17           H2*        G  17  -0.780  15.328   8.249
  177   2HO*    G  17          2HO*        G  17   0.802  15.602   9.989
  178    H1*    G  17           H1*        G  17  -0.608  18.130   8.384
  179    H8     G  17           H8         G  17  -3.074  17.237   8.494
  180    H1     G  17           H1         G  17  -3.111  16.771   2.102
  181   1H2     G  17          1H2         G  17  -1.078  16.923   1.326
  182   2H2     G  17          2H2         G  17   0.320  17.078   2.376
  183   1H5*    G  18          1H5*        G  18  -0.181  13.743   9.815
  184   2H5*    G  18          2H5*        G  18   0.038  11.982   9.840
  185    H4*    G  18           H4*        G  18  -2.346  12.513   9.872
  186    H3*    G  18           H3*        G  18  -1.391  11.387   7.225
  187    H2*    G  18           H2*        G  18  -3.759  11.265   6.644
  188   2HO*    G  18          2HO*        G  18  -5.326  11.891   8.178
  189    H1*    G  18           H1*        G  18  -4.206  13.846   7.336
  190    H8     G  18           H8         G  18  -0.601  13.752   6.287
  191    H1     G  18           H1         G  18  -4.657  13.573   1.325
  192   1H2     G  18          1H2         G  18  -6.723  13.270   2.050
  193   2H2     G  18          2H2         G  18  -7.096  13.086   3.753
  194   1H5*    A  19          1H5*        A  19  -4.685   9.171   8.441
  195   2H5*    A  19          2H5*        A  19  -4.493   7.431   8.154
  196    H4*    A  19           H4*        A  19  -6.543   8.263   7.100
  197    H3*    A  19           H3*        A  19  -4.356   7.492   5.146
  198    H2*    A  19           H2*        A  19  -6.079   7.714   3.449
  199   2HO*    A  19          2HO*        A  19  -7.845   8.242   5.643
  200    H1*    A  19           H1*        A  19  -6.800  10.165   4.290
  201    H8     A  19           H8         A  19  -3.162   9.999   5.203
  202   1H6     A  19          1H6         A  19  -1.936  10.925  -0.808
  203   2H6     A  19          2H6         A  19  -1.242  10.838   0.798
  204    H2     A  19           H2         A  19  -6.289  10.152  -0.390
  205   1H5*    G  20          1H5*        G  20  -7.908   5.433   4.286
  206   2H5*    G  20          2H5*        G  20  -7.641   3.829   3.552
  207    H4*    G  20           H4*        G  20  -9.017   5.474   2.178
  208    H3*    G  20           H3*        G  20  -6.543   4.103   1.136
  209    H2*    G  20           H2*        G  20  -6.994   5.120  -1.012
  210   2HO*    G  20          2HO*        G  20  -9.319   4.851  -0.882
  211    H1*    G  20           H1*        G  20  -7.517   7.612  -0.012
  212    H8     G  20           H8         G  20  -4.849   6.612   2.323
  213    H1     G  20           H1         G  20  -2.572   7.592  -3.592
  214   1H2     G  20          1H2         G  20  -4.219   7.510  -5.066
  215   2H2     G  20          2H2         G  20  -5.885   7.277  -4.575
  216   1H5*    G  21          1H5*        G  21  -8.982   2.777  -1.711
  217   2H5*    G  21          2H5*        G  21  -8.778   1.033  -2.003
  218    H4*    G  21           H4*        G  21  -8.015   2.281  -3.970
  219    H3*    G  21           H3*        G  21  -5.755   1.144  -2.293
  220    H2*    G  21           H2*        G  21  -4.318   1.800  -4.109
  221   2HO*    G  21          2HO*        G  21  -5.197   2.668  -6.025
  222    H1*    G  21           H1*        G  21  -5.363   4.301  -4.258
  223    H8     G  21           H8         G  21  -5.431   3.100  -0.662
  224    H1     G  21           H1         G  21   0.376   4.889  -2.736
  225   1H2     G  21          1H2         G  21   0.307   5.189  -4.958
  226   2H2     G  21          2H2         G  21  -1.177   4.974  -5.856
  227   1H5*    A  22          1H5*        A  22  -5.651  -0.014  -6.445
  228   2H5*    A  22          2H5*        A  22  -5.090  -1.682  -6.650
  229    H4*    A  22           H4*        A  22  -3.918  -0.101  -8.150
  230    H3*    A  22           H3*        A  22  -2.164  -1.372  -6.018
  231    H2*    A  22           H2*        A  22  -0.338  -0.449  -7.335
  232   2HO*    A  22          2HO*        A  22  -1.444  -0.792  -9.419
  233    H1*    A  22           H1*        A  22  -1.484   1.998  -7.487
  234    H8     A  22           H8         A  22  -2.553   0.776  -4.100
  235   1H6     A  22          1H6         A  22   3.195   2.209  -2.211
  236   2H6     A  22          2H6         A  22   1.592   1.743  -1.673
  237    H2     A  22           H2         A  22   3.099   2.427  -6.637
  238   1H5*    U  23          1H5*        U  23  -0.131  -1.968  -9.339
  239   2H5*    U  23          2H5*        U  23   0.409  -3.649  -9.520
  240    H4*    U  23           H4*        U  23   2.328  -2.104  -9.591
  241    H3*    U  23           H3*        U  23   2.127  -3.854  -7.125
  242    H2*    U  23           H2*        U  23   4.392  -3.075  -6.643
  243   2HO*    U  23          2HO*        U  23   5.033  -3.021  -8.927
  244    H1*    U  23           H1*        U  23   3.769  -0.464  -7.111
  245    H3     U  23           H3         U  23   4.191  -1.313  -2.611
  246    H5     U  23           H5         U  23   0.138  -1.938  -3.527
  247    H6     U  23           H6         U  23   0.689  -1.721  -5.873
  248   1H5*    U  24          1H5*        U  24   5.935  -4.364  -8.669
  249   2H5*    U  24          2H5*        U  24   6.325  -6.083  -8.864
  250    H4*    U  24           H4*        U  24   8.087  -4.882  -7.586
  251    H3*    U  24           H3*        U  24   6.445  -6.930  -6.073
  252    H2*    U  24           H2*        U  24   8.069  -6.651  -4.297
  253   2HO*    U  24          2HO*        U  24   9.928  -5.376  -4.641
  254    H1*    U  24           H1*        U  24   8.083  -3.889  -4.508
  255    H3     U  24           H3         U  24   6.033  -5.322  -0.623
  256    H5     U  24           H5         U  24   3.001  -4.842  -3.494
  257    H6     U  24           H6         U  24   4.709  -4.648  -5.193
  258   1H5*    U  25          1H5*        U  25  10.337  -8.162  -5.378
  259   2H5*    U  25          2H5*        U  25  10.475  -9.921  -5.597
  260    H4*    U  25           H4*        U  25  11.179  -9.352  -3.333
  261    H3*    U  25           H3*        U  25   8.430 -10.638  -3.420
  262    H2*    U  25           H2*        U  25   8.672 -10.795  -0.999
  263   2HO*    U  25          2HO*        U  25  10.618 -10.133  -0.018
  264    H1*    U  25           H1*        U  25   9.467  -8.197  -0.774
  265    H3     U  25           H3         U  25   5.171  -8.227   0.640
  266    H5     U  25           H5         U  25   4.846  -8.475  -3.537
  267    H6     U  25           H6         U  25   7.249  -8.685  -3.655
  268   1H5*    G  26          1H5*        G  26  11.020 -12.809  -0.800
  269   2H5*    G  26          2H5*        G  26  10.755 -14.559  -0.921
  270    H4*    G  26           H4*        G  26  10.656 -13.813   1.419
  271    H3*    G  26           H3*        G  26   7.981 -14.692   0.282
  272    H2*    G  26           H2*        G  26   7.243 -14.620   2.602
  273   2HO*    G  26          2HO*        G  26   8.736 -14.117   4.246
  274    H1*    G  26           H1*        G  26   8.260 -12.132   2.993
  275    H8     G  26           H8         G  26   7.299 -12.166  -0.636
  276    H1     G  26           H1         G  26   2.260 -11.708   3.308
  277   1H2     G  26          1H2         G  26   2.876 -12.204   5.381
  278   2H2     G  26          2H2         G  26   4.537 -12.593   5.782
  279   1H5*    G  27          1H5*        G  27   8.849 -16.893   3.731
  280   2H5*    G  27          2H5*        G  27   8.373 -18.598   3.618
  281    H4*    G  27           H4*        G  27   7.357 -17.528   5.595
  282    H3*    G  27           H3*        G  27   5.424 -18.294   3.412
  283    H2*    G  27           H2*        G  27   3.698 -17.734   5.089
  284   2HO*    G  27          2HO*        G  27   4.915 -18.527   6.930
  285    H1*    G  27           H1*        G  27   4.817 -15.352   5.686
  286    H8     G  27           H8         G  27   5.732 -15.771   2.074
  287    H1     G  27           H1         G  27  -0.433 -14.226   2.948
  288   1H2     G  27          1H2         G  27  -0.989 -14.499   5.075
  289   2H2     G  27          2H2         G  27   0.172 -15.028   6.274
  290   1H5*    C  28          1H5*        C  28   4.191 -20.119   6.948
  291   2H5*    C  28          2H5*        C  28   3.569 -21.766   6.713
  292    H4*    C  28           H4*        C  28   1.860 -20.292   7.726
  293    H3*    C  28           H3*        C  28   1.306 -21.178   4.876
  294    H2*    C  28           H2*        C  28  -0.899 -20.190   5.217
  295   2HO*    C  28          2HO*        C  28  -1.078 -20.808   7.471
  296    H1*    C  28           H1*        C  28   0.107 -17.883   6.229
  297   1H4     C  28          1H4         C  28  -0.248 -17.051  -0.057
  298   2H4     C  28          2H4         C  28   1.423 -17.552  -0.226
  299    H5     C  28           H5         C  28   2.737 -18.424   1.640
  300    H6     C  28           H6         C  28   2.696 -18.955   3.997
  301   1H5*    C  29          1H5*        C  29  -2.047 -22.291   7.134
  302   2H5*    C  29          2H5*        C  29  -2.685 -23.880   6.668
  303    H4*    C  29           H4*        C  29  -4.412 -22.137   6.450
  304    H3*    C  29           H3*        C  29  -3.390 -23.284   3.833
  305    H2*    C  29           H2*        C  29  -5.217 -22.083   2.796
  306   2HO*    C  29          2HO*        C  29  -6.752 -20.999   4.100
  307    H1*    C  29           H1*        C  29  -4.724 -19.767   4.172
  308   1H4     C  29          1H4         C  29  -1.544 -19.588  -1.328
  309   2H4     C  29          2H4         C  29  -0.135 -20.306  -0.573
  310    H5     C  29           H5         C  29  -0.144 -21.081   1.759
  311    H6     C  29           H6         C  29  -1.508 -21.332   3.740
  312    H3T    C  29           H3T        C  29  -5.781 -23.752   5.315
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -5.596 -15.884 -10.340
    2   2H5*    G   1          2H5*        G   1  -5.819 -14.196  -9.841
    3    H4*    G   1           H4*        G   1  -7.540 -15.550  -8.800
    4    H3*    G   1           H3*        G   1  -5.386 -14.663  -6.856
    5    H2*    G   1           H2*        G   1  -6.845 -15.544  -5.126
    6   2HO*    G   1          2HO*        G   1  -8.895 -16.386  -5.697
    7    H1*    G   1           H1*        G   1  -7.216 -17.904  -6.395
    8    H8     G   1           H8         G   1  -3.772 -17.019  -7.493
    9    H1     G   1           H1         G   1  -4.033 -18.749  -1.318
   10   1H2     G   1          1H2         G   1  -6.143 -18.776  -0.632
   11   2H2     G   1          2H2         G   1  -7.470 -18.410  -1.718
   12    H5T    G   1           H5T        G   1  -3.628 -14.867  -9.704
   13   1H5*    G   2          1H5*        G   2  -9.070 -13.654  -5.251
   14   2H5*    G   2          2H5*        G   2  -9.111 -12.003  -4.605
   15    H4*    G   2           H4*        G   2  -9.867 -13.620  -2.911
   16    H3*    G   2           H3*        G   2  -7.197 -12.292  -2.385
   17    H2*    G   2           H2*        G   2  -7.333 -13.322  -0.157
   18   2HO*    G   2          2HO*        G   2  -9.665 -13.062   0.041
   19    H1*    G   2           H1*        G   2  -7.973 -15.755  -1.129
   20    H8     G   2           H8         G   2  -5.769 -14.434  -3.846
   21    H1     G   2           H1         G   2  -2.523 -16.173   1.413
   22   1H2     G   2          1H2         G   2  -3.926 -16.439   3.114
   23   2H2     G   2          2H2         G   2  -5.654 -16.218   2.926
   24   1H5*    C   3          1H5*        C   3  -9.547 -11.618   0.952
   25   2H5*    C   3          2H5*        C   3  -9.366  -9.985   1.622
   26    H4*    C   3           H4*        C   3  -8.792 -11.733   3.287
   27    H3*    C   3           H3*        C   3  -6.477 -10.025   2.324
   28    H2*    C   3           H2*        C   3  -5.219 -11.086   4.133
   29   2HO*    C   3          2HO*        C   3  -6.284 -12.504   5.553
   30    H1*    C   3           H1*        C   3  -6.080 -13.598   3.442
   31   1H4     C   3          1H4         C   3  -0.745 -12.607   0.144
   32   2H4     C   3          2H4         C   3  -1.689 -12.046  -1.225
   33    H5     C   3           H5         C   3  -4.113 -11.714  -1.107
   34    H6     C   3           H6         C   3  -6.051 -11.877   0.325
   35   1H5*    C   4          1H5*        C   4  -6.646  -9.745   6.416
   36   2H5*    C   4          2H5*        C   4  -6.323  -8.113   7.046
   37    H4*    C   4           H4*        C   4  -4.713  -9.743   7.966
   38    H3*    C   4           H3*        C   4  -3.533  -7.792   5.960
   39    H2*    C   4           H2*        C   4  -1.384  -8.686   6.712
   40   2HO*    C   4          2HO*        C   4  -1.983  -8.966   8.944
   41    H1*    C   4           H1*        C   4  -2.215 -11.268   6.482
   42   1H4     C   4          1H4         C   4   0.363  -9.813   0.895
   43   2H4     C   4          2H4         C   4  -1.161  -9.168   0.312
   44    H5     C   4           H5         C   4  -3.141  -8.969   1.749
   45    H6     C   4           H6         C   4  -3.999  -9.343   3.977
   46   1H5*    A   5          1H5*        A   5  -1.371  -7.497   9.688
   47   2H5*    A   5          2H5*        A   5  -0.734  -5.858   9.937
   48    H4*    A   5           H4*        A   5   1.049  -7.620   9.912
   49    H3*    A   5           H3*        A   5   1.112  -5.553   7.696
   50    H2*    A   5           H2*        A   5   3.259  -6.552   7.088
   51   2HO*    A   5          2HO*        A   5   3.865  -6.997   9.350
   52    H1*    A   5           H1*        A   5   2.301  -9.091   7.162
   53    H8     A   5           H8         A   5  -0.615  -7.065   5.930
   54   1H6     A   5          1H6         A   5   2.252  -7.186   0.406
   55   2H6     A   5          2H6         A   5   0.744  -6.801   1.216
   56    H2     A   5           H2         A   5   5.120  -8.542   3.489
   57   1H5*    U   6          1H5*        U   6   4.989  -5.753   8.618
   58   2H5*    U   6          2H5*        U   6   5.640  -4.143   8.970
   59    H4*    U   6           H4*        U   6   6.934  -5.199   7.169
   60    H3*    U   6           H3*        U   6   5.184  -2.871   6.335
   61    H2*    U   6           H2*        U   6   6.296  -3.002   4.196
   62   2HO*    U   6          2HO*        U   6   8.414  -3.444   4.910
   63    H1*    U   6           H1*        U   6   6.174  -5.723   4.038
   64    H3     U   6           H3         U   6   3.162  -4.280   0.961
   65    H5     U   6           H5         U   6   1.218  -3.731   4.644
   66    H6     U   6           H6         U   6   3.270  -4.344   5.757
   67   1H5*    C   7          1H5*        C   7   9.630  -2.480   5.478
   68   2H5*    C   7          2H5*        C   7  10.075  -0.767   5.582
   69    H4*    C   7           H4*        C   7  10.900  -1.738   3.486
   70    H3*    C   7           H3*        C   7   8.615   0.229   3.134
   71    H2*    C   7           H2*        C   7   9.160   0.091   0.771
   72   2HO*    C   7          2HO*        C   7  11.432  -0.063   0.918
   73    H1*    C   7           H1*        C   7   9.289  -2.618   0.763
   74   1H4     C   7          1H4         C   7   3.137  -1.605  -0.434
   75   2H4     C   7          2H4         C   7   2.840  -1.228   1.249
   76    H5     C   7           H5         C   7   4.605  -1.074   2.912
   77    H6     C   7           H6         C   7   6.989  -1.276   3.274
   78   1H5*    U   8          1H5*        U   8  12.434   1.315   1.077
   79   2H5*    U   8          2H5*        U   8  12.530   3.073   0.851
   80    H4*    U   8           H4*        U   8  12.842   1.883  -1.291
   81    H3*    U   8           H3*        U   8  10.223   3.408  -1.081
   82    H2*    U   8           H2*        U   8  10.033   2.962  -3.449
   83   2HO*    U   8          2HO*        U   8  11.736   1.972  -4.569
   84    H1*    U   8           H1*        U   8  10.699   0.324  -3.173
   85    H3     U   8           H3         U   8   6.238   0.082  -3.835
   86    H5     U   8           H5         U   8   6.558   1.729   0.014
   87    H6     U   8           H6         U   8   8.951   1.795  -0.269
   88   1H5*    U   9          1H5*        U   9  12.902   4.693  -4.429
   89   2H5*    U   9          2H5*        U   9  12.649   6.424  -4.737
   90    H4*    U   9           H4*        U   9  12.473   5.207  -6.836
   91    H3*    U   9           H3*        U   9   9.768   6.113  -5.800
   92    H2*    U   9           H2*        U   9   8.955   5.489  -7.997
   93   2HO*    U   9          2HO*        U   9  10.758   6.163  -9.243
   94    H1*    U   9           H1*        U   9  10.243   3.080  -7.934
   95    H3     U   9           H3         U   9   5.910   2.056  -7.133
   96    H5     U   9           H5         U   9   7.172   3.869  -3.561
   97    H6     U   9           H6         U   9   9.283   4.352  -4.607
   98   1H5*    G  10          1H5*        G  10   7.492   9.822  -7.200
   99   2H5*    G  10          2H5*        G  10   6.817   8.837  -5.891
  100    H4*    G  10           H4*        G  10   7.187   7.896  -8.775
  101    H3*    G  10           H3*        G  10   4.773   8.763  -7.161
  102    H2*    G  10           H2*        G  10   3.507   7.340  -8.670
  103   2HO*    G  10          2HO*        G  10   4.799   7.928 -10.567
  104    H1*    G  10           H1*        G  10   5.373   5.312  -8.565
  105    H8     G  10           H8         G  10   2.587   4.950  -8.051
  106    H1     G  10           H1         G  10   4.120   5.725  -1.868
  107   1H2     G  10          1H2         G  10   6.119   6.697  -1.697
  108   2H2     G  10          2H2         G  10   7.046   7.143  -3.111
  109   1H5*    C  11          1H5*        C  11   2.989   8.776 -10.653
  110   2H5*    C  11          2H5*        C  11   2.247  10.362 -10.949
  111    H4*    C  11           H4*        C  11   0.511   8.675 -11.091
  112    H3*    C  11           H3*        C  11   0.428  10.320  -8.546
  113    H2*    C  11           H2*        C  11  -1.719   9.250  -8.128
  114   2HO*    C  11          2HO*        C  11  -2.376   9.213 -10.385
  115    H1*    C  11           H1*        C  11  -0.800   6.761  -8.671
  116   1H4     C  11          1H4         C  11   0.227   7.753  -2.474
  117   2H4     C  11          2H4         C  11   1.870   8.261  -2.814
  118    H5     C  11           H5         C  11   2.720   8.517  -5.101
  119    H6     C  11           H6         C  11   2.142   8.348  -7.443
  120   1H5*    U  12          1H5*        U  12  -3.443  10.647 -10.241
  121   2H5*    U  12          2H5*        U  12  -3.978  12.340 -10.227
  122    H4*    U  12           H4*        U  12  -5.661  10.924  -9.161
  123    H3*    U  12           H3*        U  12  -4.131  12.702  -7.230
  124    H2*    U  12           H2*        U  12  -5.814  12.034  -5.612
  125   2HO*    U  12          2HO*        U  12  -7.583  11.986  -7.177
  126    H1*    U  12           H1*        U  12  -5.613   9.396  -6.228
  127    H3     U  12           H3         U  12  -3.424  10.178  -2.279
  128    H5     U  12           H5         U  12  -0.576  10.857  -5.289
  129    H6     U  12           H6         U  12  -2.343  10.693  -6.924
  130   1H5*    C  13          1H5*        C  13  -8.139  13.541  -6.495
  131   2H5*    C  13          2H5*        C  13  -8.377  15.297  -6.371
  132    H4*    C  13           H4*        C  13  -9.171  14.175  -4.322
  133    H3*    C  13           H3*        C  13  -6.630  15.804  -4.010
  134    H2*    C  13           H2*        C  13  -6.898  15.448  -1.639
  135   2HO*    C  13          2HO*        C  13  -8.794  14.440  -0.840
  136    H1*    C  13           H1*        C  13  -7.566  12.782  -1.916
  137   1H4     C  13          1H4         C  13  -1.415  13.334  -0.492
  138   2H4     C  13          2H4         C  13  -0.984  13.431  -2.192
  139    H5     C  13           H5         C  13  -2.687  13.514  -3.972
  140    H6     C  13           H6         C  13  -5.064  13.530  -4.419
  141   1H5*    U  14          1H5*        U  14  -8.383  17.126  -0.865
  142   2H5*    U  14          2H5*        U  14  -8.422  18.903  -0.823
  143    H4*    U  14           H4*        U  14  -7.211  18.082   1.136
  144    H3*    U  14           H3*        U  14  -5.458  19.357  -0.984
  145    H2*    U  14           H2*        U  14  -3.676  19.218   0.622
  146   2HO*    U  14          2HO*        U  14  -4.918  19.803   2.462
  147    H1*    U  14           H1*        U  14  -4.303  16.664   1.428
  148    H3     U  14           H3         U  14  -0.421  16.468  -0.989
  149    H5     U  14           H5         U  14  -3.453  16.772  -3.882
  150    H6     U  14           H6         U  14  -5.046  17.118  -2.096
  151   1H5*    U  15          1H5*        U  15  -5.727  23.752   2.657
  152   2H5*    U  15          2H5*        U  15  -3.986  23.449   2.541
  153    H4*    U  15           H4*        U  15  -4.599  23.873   4.843
  154    H3*    U  15           H3*        U  15  -3.087  21.682   4.132
  155    H2*    U  15           H2*        U  15  -4.892  20.149   4.140
  156   2HO*    U  15          2HO*        U  15  -3.912  20.228   6.814
  157    H1*    U  15           H1*        U  15  -5.921  21.443   6.665
  158    H3     U  15           H3         U  15  -9.718  19.038   6.868
  159    H5     U  15           H5         U  15  -8.659  18.751   2.812
  160    H6     U  15           H6         U  15  -6.781  20.208   3.258
  161   1H5*    C  16          1H5*        C  16  -1.620  20.324   6.767
  162   2H5*    C  16          2H5*        C  16  -0.397  21.207   7.699
  163    H4*    C  16           H4*        C  16   0.498  19.099   6.988
  164    H3*    C  16           H3*        C  16   1.916  21.401   6.593
  165    H2*    C  16           H2*        C  16   1.026  21.742   4.370
  166   2HO*    C  16          2HO*        C  16   3.339  21.803   4.272
  167    H1*    C  16           H1*        C  16   1.631  18.818   3.839
  168   1H4     C  16          1H4         C  16  -1.428  20.191  -1.579
  169   2H4     C  16          2H4         C  16  -2.651  21.107  -0.709
  170    H5     C  16           H5         C  16  -2.547  21.516   1.686
  171    H6     C  16           H6         C  16  -1.296  21.048   3.717
  172   1H5*    G  17          1H5*        G  17   3.387  15.665   7.089
  173   2H5*    G  17          2H5*        G  17   2.356  16.814   6.225
  174    H4*    G  17           H4*        G  17   2.114  16.526   9.235
  175    H3*    G  17           H3*        G  17   0.897  14.692   7.144
  176    H2*    G  17           H2*        G  17  -0.894  14.445   8.757
  177   2HO*    G  17          2HO*        G  17   0.583  14.356  10.607
  178    H1*    G  17           H1*        G  17  -0.850  17.135   9.473
  179    H8     G  17           H8         G  17  -3.328  16.540   9.061
  180    H1     G  17           H1         G  17  -2.422  16.384   2.721
  181   1H2     G  17          1H2         G  17  -0.309  16.426   2.248
  182   2H2     G  17          2H2         G  17   0.941  16.452   3.483
  183   1H5*    G  18          1H5*        G  18  -0.413  12.693  10.067
  184   2H5*    G  18          2H5*        G  18  -0.266  10.942   9.829
  185    H4*    G  18           H4*        G  18  -2.634  11.651   9.855
  186    H3*    G  18           H3*        G  18  -1.590  10.652   7.198
  187    H2*    G  18           H2*        G  18  -3.914  10.774   6.436
  188   2HO*    G  18          2HO*        G  18  -4.851  10.171   8.515
  189    H1*    G  18           H1*        G  18  -4.225  13.323   7.279
  190    H8     G  18           H8         G  18  -0.570  13.246   6.561
  191    H1     G  18           H1         G  18  -4.078  13.155   1.200
  192   1H2     G  18          1H2         G  18  -6.209  12.854   1.694
  193   2H2     G  18          2H2         G  18  -6.762  12.638   3.345
  194   1H5*    A  19          1H5*        A  19  -5.125   8.516   8.023
  195   2H5*    A  19          2H5*        A  19  -4.964   6.795   7.631
  196    H4*    A  19           H4*        A  19  -6.902   7.805   6.478
  197    H3*    A  19           H3*        A  19  -4.603   6.984   4.682
  198    H2*    A  19           H2*        A  19  -6.166   7.386   2.860
  199   2HO*    A  19          2HO*        A  19  -8.304   8.011   3.324
  200    H1*    A  19           H1*        A  19  -6.807   9.843   3.754
  201    H8     A  19           H8         A  19  -3.300   9.516   4.995
  202   1H6     A  19          1H6         A  19  -1.427  10.404  -0.854
  203   2H6     A  19          2H6         A  19  -0.906  10.297   0.817
  204    H2     A  19           H2         A  19  -5.821   9.786  -0.891
  205   1H5*    G  20          1H5*        G  20  -8.226   5.190   3.491
  206   2H5*    G  20          2H5*        G  20  -8.028   3.607   2.695
  207    H4*    G  20           H4*        G  20  -9.198   5.432   1.335
  208    H3*    G  20           H3*        G  20  -6.823   3.852   0.375
  209    H2*    G  20           H2*        G  20  -6.996   4.993  -1.744
  210   2HO*    G  20          2HO*        G  20  -9.348   4.968  -1.776
  211    H1*    G  20           H1*        G  20  -7.333   7.491  -0.687
  212    H8     G  20           H8         G  20  -4.975   6.212   1.817
  213    H1     G  20           H1         G  20  -2.137   6.978  -3.879
  214   1H2     G  20          1H2         G  20  -3.656   7.048  -5.484
  215   2H2     G  20          2H2         G  20  -5.374   6.972  -5.141
  216   1H5*    G  21          1H5*        G  21  -9.141   3.097  -2.727
  217   2H5*    G  21          2H5*        G  21  -9.246   1.360  -3.089
  218    H4*    G  21           H4*        G  21  -8.160   2.487  -4.963
  219    H3*    G  21           H3*        G  21  -6.286   0.865  -3.210
  220    H2*    G  21           H2*        G  21  -4.567   1.333  -4.787
  221   2HO*    G  21          2HO*        G  21  -5.821   1.102  -6.711
  222    H1*    G  21           H1*        G  21  -5.165   3.983  -5.037
  223    H8     G  21           H8         G  21  -5.741   2.806  -1.465
  224    H1     G  21           H1         G  21   0.390   4.044  -2.913
  225   1H2     G  21          1H2         G  21   0.582   4.397  -5.116
  226   2H2     G  21          2H2         G  21  -0.812   4.323  -6.172
  227   1H5*    A  22          1H5*        A  22  -4.314  -2.687  -6.454
  228   2H5*    A  22          2H5*        A  22  -3.653  -1.576  -5.238
  229    H4*    A  22           H4*        A  22  -3.702  -1.089  -8.250
  230    H3*    A  22           H3*        A  22  -1.607  -2.067  -6.311
  231    H2*    A  22           H2*        A  22   0.076  -0.785  -7.459
  232   2HO*    A  22          2HO*        A  22  -0.853  -1.136  -9.613
  233    H1*    A  22           H1*        A  22  -1.307   1.501  -7.460
  234    H8     A  22           H8         A  22  -2.816   0.096  -4.382
  235   1H6     A  22          1H6         A  22   2.584   1.280  -1.531
  236   2H6     A  22          2H6         A  22   0.903   0.845  -1.270
  237    H2     A  22           H2         A  22   3.193   1.744  -5.887
  238   1H5*    U  23          1H5*        U  23   0.665  -2.295  -9.507
  239   2H5*    U  23          2H5*        U  23   1.292  -3.942  -9.731
  240    H4*    U  23           H4*        U  23   3.163  -2.369  -9.562
  241    H3*    U  23           H3*        U  23   2.777  -4.147  -7.137
  242    H2*    U  23           H2*        U  23   4.938  -3.297  -6.406
  243   2HO*    U  23          2HO*        U  23   6.113  -1.889  -7.764
  244    H1*    U  23           H1*        U  23   4.259  -0.702  -6.890
  245    H3     U  23           H3         U  23   4.186  -1.720  -2.402
  246    H5     U  23           H5         U  23   0.298  -2.456  -3.818
  247    H6     U  23           H6         U  23   1.111  -2.123  -6.070
  248   1H5*    U  24          1H5*        U  24   6.748  -4.464  -8.093
  249   2H5*    U  24          2H5*        U  24   7.235  -6.165  -8.236
  250    H4*    U  24           H4*        U  24   8.737  -4.943  -6.701
  251    H3*    U  24           H3*        U  24   6.925  -7.009  -5.417
  252    H2*    U  24           H2*        U  24   8.257  -6.657  -3.417
  253   2HO*    U  24          2HO*        U  24  10.292  -6.461  -4.589
  254    H1*    U  24           H1*        U  24   8.281  -3.910  -3.685
  255    H3     U  24           H3         U  24   5.676  -5.028  -0.085
  256    H5     U  24           H5         U  24   3.119  -5.095  -3.417
  257    H6     U  24           H6         U  24   5.060  -4.937  -4.849
  258   1H5*    U  25          1H5*        U  25  10.766  -8.162  -4.113
  259   2H5*    U  25          2H5*        U  25  10.893  -9.933  -4.165
  260    H4*    U  25           H4*        U  25  11.265  -9.132  -1.878
  261    H3*    U  25           H3*        U  25   8.606 -10.540  -2.265
  262    H2*    U  25           H2*        U  25   8.476 -10.479   0.176
  263   2HO*    U  25          2HO*        U  25  10.763 -10.811   0.542
  264    H1*    U  25           H1*        U  25   9.156  -7.848   0.293
  265    H3     U  25           H3         U  25   4.697  -7.816   1.029
  266    H5     U  25           H5         U  25   5.007  -8.639  -3.074
  267    H6     U  25           H6         U  25   7.402  -8.762  -2.810
  268   1H5*    G  26          1H5*        G  26  10.787 -12.506   0.912
  269   2H5*    G  26          2H5*        G  26  10.482 -14.251   0.888
  270    H4*    G  26           H4*        G  26  10.004 -13.275   3.103
  271    H3*    G  26           H3*        G  26   7.558 -14.262   1.598
  272    H2*    G  26           H2*        G  26   6.423 -13.965   3.734
  273   2HO*    G  26          2HO*        G  26   7.614 -13.307   5.562
  274    H1*    G  26           H1*        G  26   7.400 -11.455   4.067
  275    H8     G  26           H8         G  26   7.073 -11.865   0.344
  276    H1     G  26           H1         G  26   1.452 -10.938   3.296
  277   1H2     G  26          1H2         G  26   1.692 -11.226   5.482
  278   2H2     G  26          2H2         G  26   3.251 -11.583   6.201
  279   1H5*    G  27          1H5*        G  27   7.800 -16.121   5.345
  280   2H5*    G  27          2H5*        G  27   7.328 -17.833   5.322
  281    H4*    G  27           H4*        G  27   6.012 -16.574   6.988
  282    H3*    G  27           H3*        G  27   4.470 -17.576   4.598
  283    H2*    G  27           H2*        G  27   2.488 -16.845   5.863
  284   2HO*    G  27          2HO*        G  27   3.329 -17.443   7.966
  285    H1*    G  27           H1*        G  27   3.513 -14.413   6.425
  286    H8     G  27           H8         G  27   5.047 -15.192   3.090
  287    H1     G  27           H1         G  27  -1.137 -13.535   2.695
  288   1H2     G  27          1H2         G  27  -2.077 -13.629   4.702
  289   2H2     G  27          2H2         G  27  -1.154 -14.037   6.136
  290   1H5*    C  28          1H5*        C  28   2.581 -19.037   8.000
  291   2H5*    C  28          2H5*        C  28   1.996 -20.705   7.815
  292    H4*    C  28           H4*        C  28   0.134 -19.161   8.319
  293    H3*    C  28           H3*        C  28   0.152 -20.313   5.512
  294    H2*    C  28           H2*        C  28  -2.064 -19.313   5.305
  295   2HO*    C  28          2HO*        C  28  -2.704 -19.713   7.527
  296    H1*    C  28           H1*        C  28  -1.257 -16.913   6.279
  297   1H4     C  28          1H4         C  28  -0.314 -16.657   0.008
  298   2H4     C  28          2H4         C  28   1.346 -17.179   0.221
  299    H5     C  28           H5         C  28   2.241 -17.881   2.390
  300    H6     C  28           H6         C  28   1.713 -18.192   4.726
  301   1H5*    C  29          1H5*        C  29  -3.605 -21.234   7.114
  302   2H5*    C  29          2H5*        C  29  -4.147 -22.867   6.678
  303    H4*    C  29           H4*        C  29  -5.773 -21.174   5.935
  304    H3*    C  29           H3*        C  29  -4.235 -22.540   3.704
  305    H2*    C  29           H2*        C  29  -5.809 -21.466   2.214
  306   2HO*    C  29          2HO*        C  29  -7.560 -20.271   3.071
  307    H1*    C  29           H1*        C  29  -5.578 -19.030   3.438
  308   1H4     C  29          1H4         C  29  -1.322 -19.339  -1.278
  309   2H4     C  29          2H4         C  29  -0.107 -19.958  -0.174
  310    H5     C  29           H5         C  29  -0.609 -20.508   2.163
  311    H6     C  29           H6         C  29  -2.359 -20.587   3.832
  312    H3T    C  29           H3T        C  29  -6.206 -23.757   3.656
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  -6.819 -14.525  -9.730
    2   2H5*    G   1          2H5*        G   1  -6.909 -12.888  -9.057
    3    H4*    G   1           H4*        G   1  -8.565 -14.270  -7.957
    4    H3*    G   1           H3*        G   1  -6.179 -13.652  -6.192
    5    H2*    G   1           H2*        G   1  -7.497 -14.648  -4.396
    6   2HO*    G   1          2HO*        G   1  -9.573 -13.847  -5.179
    7    H1*    G   1           H1*        G   1  -8.094 -16.857  -5.828
    8    H8     G   1           H8         G   1  -4.755 -15.998  -7.228
    9    H1     G   1           H1         G   1  -4.404 -18.302  -1.249
   10   1H2     G   1          1H2         G   1  -6.424 -18.302  -0.323
   11   2H2     G   1          2H2         G   1  -7.845 -17.781  -1.208
   12    H5T    G   1           H5T        G   1  -4.749 -13.651  -9.233
   13   1H5*    G   2          1H5*        G   2  -9.602 -12.578  -4.020
   14   2H5*    G   2          2H5*        G   2  -9.405 -10.995  -3.243
   15    H4*    G   2           H4*        G   2 -10.057 -12.713  -1.604
   16    H3*    G   2           H3*        G   2  -7.244 -11.618  -1.345
   17    H2*    G   2           H2*        G   2  -7.177 -12.837   0.796
   18   2HO*    G   2          2HO*        G   2  -9.437 -12.441   1.321
   19    H1*    G   2           H1*        G   2  -8.116 -15.123  -0.282
   20    H8     G   2           H8         G   2  -6.192 -13.707  -3.157
   21    H1     G   2           H1         G   2  -2.426 -16.079   1.468
   22   1H2     G   2          1H2         G   2  -3.617 -16.422   3.311
   23   2H2     G   2          2H2         G   2  -5.336 -16.083   3.372
   24   1H5*    C   3          1H5*        C   3  -9.120 -11.112   2.307
   25   2H5*    C   3          2H5*        C   3  -8.749  -9.565   3.094
   26    H4*    C   3           H4*        C   3  -8.119 -11.504   4.513
   27    H3*    C   3           H3*        C   3  -5.827  -9.825   3.449
   28    H2*    C   3           H2*        C   3  -4.433 -11.131   4.986
   29   2HO*    C   3          2HO*        C   3  -6.038 -11.270   6.686
   30    H1*    C   3           H1*        C   3  -5.531 -13.514   4.187
   31   1H4     C   3          1H4         C   3  -0.565 -12.560   0.345
   32   2H4     C   3          2H4         C   3  -1.626 -11.833  -0.848
   33    H5     C   3           H5         C   3  -3.984 -11.363  -0.406
   34    H6     C   3           H6         C   3  -5.746 -11.529   1.241
   35   1H5*    C   4          1H5*        C   4  -5.493  -9.800   7.591
   36   2H5*    C   4          2H5*        C   4  -4.992  -8.218   8.225
   37    H4*    C   4           H4*        C   4  -3.362  -9.975   8.839
   38    H3*    C   4           H3*        C   4  -2.368  -7.988   6.767
   39    H2*    C   4           H2*        C   4  -0.191  -9.015   7.186
   40   2HO*    C   4          2HO*        C   4  -0.500  -9.369   9.468
   41    H1*    C   4           H1*        C   4  -1.188 -11.542   6.976
   42   1H4     C   4          1H4         C   4   0.732  -9.963   1.160
   43   2H4     C   4          2H4         C   4  -0.799  -9.174   0.821
   44    H5     C   4           H5         C   4  -2.552  -8.921   2.515
   45    H6     C   4           H6         C   4  -3.141  -9.364   4.820
   46   1H5*    A   5          1H5*        A   5   0.285  -7.975  10.154
   47   2H5*    A   5          2H5*        A   5   1.039  -6.383  10.382
   48    H4*    A   5           H4*        A   5   2.708  -8.217  10.037
   49    H3*    A   5           H3*        A   5   2.560  -6.075   7.898
   50    H2*    A   5           H2*        A   5   4.562  -7.133   6.977
   51   2HO*    A   5          2HO*        A   5   5.444  -7.692   9.117
   52    H1*    A   5           H1*        A   5   3.498  -9.626   7.096
   53    H8     A   5           H8         A   5   0.554  -7.407   6.341
   54   1H6     A   5          1H6         A   5   2.651  -7.475   0.475
   55   2H6     A   5          2H6         A   5   1.289  -7.038   1.490
   56    H2     A   5           H2         A   5   5.810  -9.115   3.102
   57   1H5*    U   6          1H5*        U   6   6.501  -6.479   8.262
   58   2H5*    U   6          2H5*        U   6   7.266  -4.914   8.588
   59    H4*    U   6           H4*        U   6   8.278  -5.923   6.603
   60    H3*    U   6           H3*        U   6   6.489  -3.542   6.051
   61    H2*    U   6           H2*        U   6   7.365  -3.618   3.804
   62   2HO*    U   6          2HO*        U   6   9.544  -4.120   4.297
   63    H1*    U   6           H1*        U   6   7.140  -6.346   3.587
   64    H3     U   6           H3         U   6   3.830  -4.691   0.930
   65    H5     U   6           H5         U   6   2.383  -4.163   4.838
   66    H6     U   6           H6         U   6   4.529  -4.894   5.670
   67   1H5*    C   7          1H5*        C   7  10.947  -3.173   4.935
   68   2H5*    C   7          2H5*        C   7  11.399  -1.473   5.164
   69    H4*    C   7           H4*        C   7  12.242  -2.249   3.013
   70    H3*    C   7           H3*        C   7   9.895  -0.331   2.787
   71    H2*    C   7           H2*        C   7  10.378  -0.301   0.427
   72   2HO*    C   7          2HO*        C   7  12.664  -0.316   0.559
   73    H1*    C   7           H1*        C   7  10.678  -3.011   0.238
   74   1H4     C   7          1H4         C   7   4.500  -2.234  -0.946
   75   2H4     C   7          2H4         C   7   4.152  -2.049   0.757
   76    H5     C   7           H5         C   7   5.900  -1.955   2.464
   77    H6     C   7           H6         C   7   8.289  -2.034   2.833
   78   1H5*    U   8          1H5*        U   8  12.147   3.607   0.060
   79   2H5*    U   8          2H5*        U   8  10.615   2.706   0.042
   80    H4*    U   8           H4*        U   8  13.082   2.085  -1.646
   81    H3*    U   8           H3*        U   8  10.392   3.352  -2.183
   82    H2*    U   8           H2*        U   8  10.379   2.298  -4.365
   83   2HO*    U   8          2HO*        U   8  12.694   2.579  -4.719
   84    H1*    U   8           H1*        U   8  11.089  -0.145  -3.463
   85    H3     U   8           H3         U   8   6.562  -0.148  -4.221
   86    H5     U   8           H5         U   8   7.043   1.050  -0.225
   87    H6     U   8           H6         U   8   9.413   1.229  -0.611
   88   1H5*    U   9          1H5*        U   9  12.120   4.096  -5.765
   89   2H5*    U   9          2H5*        U   9  11.922   5.777  -6.267
   90    H4*    U   9           H4*        U   9  10.897   4.316  -7.929
   91    H3*    U   9           H3*        U   9   8.769   5.704  -6.254
   92    H2*    U   9           H2*        U   9   7.191   4.687  -7.793
   93   2HO*    U   9          2HO*        U   9   8.539   4.876  -9.692
   94    H1*    U   9           H1*        U   9   8.261   2.220  -7.552
   95    H3     U   9           H3         U   9   4.444   2.659  -5.007
   96    H5     U   9           H5         U   9   7.591   3.902  -2.525
   97    H6     U   9           H6         U   9   9.063   3.789  -4.430
   98   1H5*    G  10          1H5*        G  10   7.704   9.822  -7.202
   99   2H5*    G  10          2H5*        G  10   7.033   9.053  -5.755
  100    H4*    G  10           H4*        G  10   7.141   7.799  -8.540
  101    H3*    G  10           H3*        G  10   4.889   8.969  -6.865
  102    H2*    G  10           H2*        G  10   3.452   7.522  -8.195
  103   2HO*    G  10          2HO*        G  10   4.676   7.877 -10.194
  104    H1*    G  10           H1*        G  10   5.203   5.401  -8.020
  105    H8     G  10           H8         G  10   2.452   5.200  -7.350
  106    H1     G  10           H1         G  10   4.264   6.486  -1.333
  107   1H2     G  10          1H2         G  10   6.302   7.395  -1.327
  108   2H2     G  10          2H2         G  10   7.191   7.662  -2.811
  109   1H5*    C  11          1H5*        C  11   2.970   8.765 -10.335
  110   2H5*    C  11          2H5*        C  11   2.196  10.322 -10.690
  111    H4*    C  11           H4*        C  11   0.496   8.581 -10.663
  112    H3*    C  11           H3*        C  11   0.426  10.414  -8.247
  113    H2*    C  11           H2*        C  11  -1.705   9.335  -7.744
  114   2HO*    C  11          2HO*        C  11  -2.369   9.121  -9.989
  115    H1*    C  11           H1*        C  11  -0.734   6.836  -8.118
  116   1H4     C  11          1H4         C  11   0.231   8.273  -2.000
  117   2H4     C  11          2H4         C  11   1.844   8.854  -2.373
  118    H5     C  11           H5         C  11   2.693   8.998  -4.666
  119    H6     C  11           H6         C  11   2.138   8.643  -6.995
  120   1H5*    U  12          1H5*        U  12  -3.466  10.458 -10.000
  121   2H5*    U  12          2H5*        U  12  -4.117  12.107 -10.027
  122    H4*    U  12           H4*        U  12  -5.691  10.574  -8.935
  123    H3*    U  12           H3*        U  12  -4.358  12.550  -7.052
  124    H2*    U  12           H2*        U  12  -6.019  11.801  -5.447
  125   2HO*    U  12          2HO*        U  12  -7.624  10.313  -6.091
  126    H1*    U  12           H1*        U  12  -5.567   9.167  -5.958
  127    H3     U  12           H3         U  12  -3.564  10.267  -1.990
  128    H5     U  12           H5         U  12  -0.737  11.201  -4.955
  129    H6     U  12           H6         U  12  -2.435  10.800  -6.624
  130   1H5*    C  13          1H5*        C  13  -8.418  12.940  -6.464
  131   2H5*    C  13          2H5*        C  13  -8.895  14.650  -6.414
  132    H4*    C  13           H4*        C  13  -9.629  13.511  -4.360
  133    H3*    C  13           H3*        C  13  -7.318  15.449  -4.012
  134    H2*    C  13           H2*        C  13  -7.628  15.128  -1.639
  135   2HO*    C  13          2HO*        C  13  -9.996  15.066  -1.800
  136    H1*    C  13           H1*        C  13  -7.940  12.398  -1.838
  137   1H4     C  13          1H4         C  13  -1.918  13.726  -0.335
  138   2H4     C  13          2H4         C  13  -1.475  13.840  -2.029
  139    H5     C  13           H5         C  13  -3.143  13.680  -3.835
  140    H6     C  13           H6         C  13  -5.498  13.401  -4.319
  141   1H5*    U  14          1H5*        U  14  -9.309  16.711  -0.989
  142   2H5*    U  14          2H5*        U  14  -9.511  18.475  -1.025
  143    H4*    U  14           H4*        U  14  -8.265  17.855   0.985
  144    H3*    U  14           H3*        U  14  -6.551  19.164  -1.146
  145    H2*    U  14           H2*        U  14  -4.866  19.282   0.597
  146   2HO*    U  14          2HO*        U  14  -5.436  18.464   2.712
  147    H1*    U  14           H1*        U  14  -5.242  16.684   1.367
  148    H3     U  14           H3         U  14  -1.315  16.940  -0.988
  149    H5     U  14           H5         U  14  -4.320  16.792  -3.921
  150    H6     U  14           H6         U  14  -5.966  16.987  -2.157
  151   1H5*    U  15          1H5*        U  15  -7.326  23.799   2.075
  152   2H5*    U  15          2H5*        U  15  -5.565  23.688   1.919
  153    H4*    U  15           H4*        U  15  -6.119  24.220   4.202
  154    H3*    U  15           H3*        U  15  -4.434  22.143   3.617
  155    H2*    U  15           H2*        U  15  -6.115  20.473   3.688
  156   2HO*    U  15          2HO*        U  15  -5.096  20.691   6.340
  157    H1*    U  15           H1*        U  15  -7.191  21.739   6.210
  158    H3     U  15           H3         U  15 -10.886  19.193   6.546
  159    H5     U  15           H5         U  15  -9.725  18.628   2.547
  160    H6     U  15           H6         U  15  -7.948  20.230   2.896
  161   1H5*    C  16          1H5*        C  16  -2.837  21.049   6.375
  162   2H5*    C  16          2H5*        C  16  -1.702  22.107   7.230
  163    H4*    C  16           H4*        C  16  -0.612  20.050   6.667
  164    H3*    C  16           H3*        C  16   0.585  22.441   6.083
  165    H2*    C  16           H2*        C  16  -0.346  22.526   3.850
  166   2HO*    C  16          2HO*        C  16   1.434  22.122   2.460
  167    H1*    C  16           H1*        C  16   0.530  19.639   3.538
  168   1H4     C  16          1H4         C  16  -2.700  20.256  -1.925
  169   2H4     C  16          2H4         C  16  -3.995  21.117  -1.109
  170    H5     C  16           H5         C  16  -3.902  21.748   1.234
  171    H6     C  16           H6         C  16  -2.590  21.579   3.276
  172   1H5*    G  17          1H5*        G  17   2.594  16.936   7.007
  173   2H5*    G  17          2H5*        G  17   1.445  17.912   6.082
  174    H4*    G  17           H4*        G  17   1.275  17.823   9.111
  175    H3*    G  17           H3*        G  17   0.209  15.741   7.171
  176    H2*    G  17           H2*        G  17  -1.542  15.443   8.810
  177   2HO*    G  17          2HO*        G  17  -0.049  15.609  10.647
  178    H1*    G  17           H1*        G  17  -1.742  18.163   9.354
  179    H8     G  17           H8         G  17  -4.162  17.328   9.006
  180    H1     G  17           H1         G  17  -3.264  16.798   2.689
  181   1H2     G  17          1H2         G  17  -1.174  16.989   2.188
  182   2H2     G  17          2H2         G  17   0.080  17.203   3.403
  183   1H5*    G  18          1H5*        G  18  -0.929  13.840  10.216
  184   2H5*    G  18          2H5*        G  18  -0.622  12.096  10.093
  185    H4*    G  18           H4*        G  18  -3.043  12.587  10.069
  186    H3*    G  18           H3*        G  18  -1.899  11.523   7.479
  187    H2*    G  18           H2*        G  18  -4.222  11.375   6.723
  188   2HO*    G  18          2HO*        G  18  -5.118  10.831   8.833
  189    H1*    G  18           H1*        G  18  -4.760  13.942   7.391
  190    H8     G  18           H8         G  18  -1.110  14.144   6.688
  191    H1     G  18           H1         G  18  -4.537  13.347   1.332
  192   1H2     G  18          1H2         G  18  -6.637  12.881   1.839
  193   2H2     G  18          2H2         G  18  -7.186  12.735   3.499
  194   1H5*    A  19          1H5*        A  19  -5.222   9.130   8.415
  195   2H5*    A  19          2H5*        A  19  -4.889   7.408   8.157
  196    H4*    A  19           H4*        A  19  -6.896   8.128   6.919
  197    H3*    A  19           H3*        A  19  -4.500   7.403   5.205
  198    H2*    A  19           H2*        A  19  -6.078   7.514   3.345
  199   2HO*    A  19          2HO*        A  19  -7.935   6.702   4.499
  200    H1*    A  19           H1*        A  19  -6.969   9.946   4.045
  201    H8     A  19           H8         A  19  -3.472  10.101   5.340
  202   1H6     A  19          1H6         A  19  -1.601  10.743  -0.540
  203   2H6     A  19          2H6         A  19  -1.102  10.814   1.138
  204    H2     A  19           H2         A  19  -5.902   9.639  -0.574
  205   1H5*    G  20          1H5*        G  20  -7.922   5.025   4.165
  206   2H5*    G  20          2H5*        G  20  -7.469   3.454   3.455
  207    H4*    G  20           H4*        G  20  -8.879   5.045   2.006
  208    H3*    G  20           H3*        G  20  -6.335   3.688   1.147
  209    H2*    G  20           H2*        G  20  -6.622   4.660  -1.044
  210   2HO*    G  20          2HO*        G  20  -8.945   4.350  -1.095
  211    H1*    G  20           H1*        G  20  -7.277   7.165  -0.159
  212    H8     G  20           H8         G  20  -4.780   6.347   2.406
  213    H1     G  20           H1         G  20  -2.057   7.174  -3.338
  214   1H2     G  20          1H2         G  20  -3.573   7.000  -4.935
  215   2H2     G  20          2H2         G  20  -5.272   6.743  -4.579
  216   1H5*    G  21          1H5*        G  21  -8.764   2.314  -1.789
  217   2H5*    G  21          2H5*        G  21  -8.553   0.569  -2.064
  218    H4*    G  21           H4*        G  21  -7.791   1.805  -4.044
  219    H3*    G  21           H3*        G  21  -5.547   0.670  -2.346
  220    H2*    G  21           H2*        G  21  -4.082   1.330  -4.138
  221   2HO*    G  21          2HO*        G  21  -5.430   0.860  -5.939
  222    H1*    G  21           H1*        G  21  -5.117   3.825  -4.320
  223    H8     G  21           H8         G  21  -5.258   2.613  -0.727
  224    H1     G  21           H1         G  21   0.562   4.525  -2.634
  225   1H2     G  21          1H2         G  21   0.552   4.824  -4.853
  226   2H2     G  21          2H2         G  21  -0.905   4.589  -5.798
  227   1H5*    A  22          1H5*        A  22  -5.545  -0.671  -6.568
  228   2H5*    A  22          2H5*        A  22  -4.901  -2.317  -6.694
  229    H4*    A  22           H4*        A  22  -3.837  -0.728  -8.293
  230    H3*    A  22           H3*        A  22  -2.005  -1.888  -6.159
  231    H2*    A  22           H2*        A  22  -0.227  -0.908  -7.499
  232   2HO*    A  22          2HO*        A  22  -1.315  -1.339  -9.569
  233    H1*    A  22           H1*        A  22  -1.473   1.490  -7.694
  234    H8     A  22           H8         A  22  -2.459   0.281  -4.269
  235   1H6     A  22          1H6         A  22   3.231   2.059  -2.481
  236   2H6     A  22          2H6         A  22   1.660   1.527  -1.908
  237    H2     A  22           H2         A  22   3.074   2.156  -6.904
  238   1H5*    U  23          1H5*        U  23   0.068  -2.476  -9.495
  239   2H5*    U  23          2H5*        U  23   0.659  -4.144  -9.624
  240    H4*    U  23           H4*        U  23   2.545  -2.574  -9.717
  241    H3*    U  23           H3*        U  23   2.330  -4.205  -7.171
  242    H2*    U  23           H2*        U  23   4.550  -3.339  -6.655
  243   2HO*    U  23          2HO*        U  23   5.258  -3.388  -8.928
  244    H1*    U  23           H1*        U  23   3.888  -0.775  -7.286
  245    H3     U  23           H3         U  23   4.165  -1.196  -2.752
  246    H5     U  23           H5         U  23   0.212  -2.240  -3.723
  247    H6     U  23           H6         U  23   0.819  -2.137  -6.062
  248   1H5*    U  24          1H5*        U  24   6.203  -4.676  -8.544
  249   2H5*    U  24          2H5*        U  24   6.638  -6.393  -8.639
  250    H4*    U  24           H4*        U  24   8.314  -5.068  -7.358
  251    H3*    U  24           H3*        U  24   6.706  -7.132  -5.824
  252    H2*    U  24           H2*        U  24   8.263  -6.715  -4.008
  253   2HO*    U  24          2HO*        U  24  10.139  -6.500  -5.415
  254    H1*    U  24           H1*        U  24   8.179  -3.966  -4.327
  255    H3     U  24           H3         U  24   6.046  -5.323  -0.446
  256    H5     U  24           H5         U  24   3.101  -5.040  -3.433
  257    H6     U  24           H6         U  24   4.858  -4.862  -5.081
  258   1H5*    U  25          1H5*        U  25  10.596  -8.362  -4.961
  259   2H5*    U  25          2H5*        U  25  10.700 -10.129  -5.136
  260    H4*    U  25           H4*        U  25  11.299  -9.510  -2.851
  261    H3*    U  25           H3*        U  25   8.547 -10.777  -3.056
  262    H2*    U  25           H2*        U  25   8.658 -10.874  -0.621
  263   2HO*    U  25          2HO*        U  25  10.950 -11.331  -0.501
  264    H1*    U  25           H1*        U  25   9.471  -8.287  -0.410
  265    H3     U  25           H3         U  25   5.107  -8.216   0.769
  266    H5     U  25           H5         U  25   4.999  -8.592  -3.410
  267    H6     U  25           H6         U  25   7.403  -8.824  -3.392
  268   1H5*    G  26          1H5*        G  26  10.963 -13.057  -0.249
  269   2H5*    G  26          2H5*        G  26  10.579 -14.780  -0.388
  270    H4*    G  26           H4*        G  26  10.390 -13.999   1.941
  271    H3*    G  26           H3*        G  26   7.753 -14.749   0.636
  272    H2*    G  26           H2*        G  26   6.864 -14.612   2.900
  273   2HO*    G  26          2HO*        G  26   8.265 -14.183   4.639
  274    H1*    G  26           H1*        G  26   7.993 -12.184   3.352
  275    H8     G  26           H8         G  26   7.245 -12.234  -0.333
  276    H1     G  26           H1         G  26   2.041 -11.299   3.301
  277   1H2     G  26          1H2         G  26   2.508 -11.764   5.417
  278   2H2     G  26          2H2         G  26   4.109 -12.265   5.924
  279   1H5*    G  27          1H5*        G  27   8.297 -16.979   4.142
  280   2H5*    G  27          2H5*        G  27   7.740 -18.659   4.004
  281    H4*    G  27           H4*        G  27   6.656 -17.538   5.912
  282    H3*    G  27           H3*        G  27   4.831 -18.177   3.599
  283    H2*    G  27           H2*        G  27   3.035 -17.518   5.149
  284   2HO*    G  27          2HO*        G  27   3.555 -16.975   7.293
  285    H1*    G  27           H1*        G  27   4.258 -15.212   5.857
  286    H8     G  27           H8         G  27   5.365 -15.715   2.302
  287    H1     G  27           H1         G  27  -0.695 -13.669   2.806
  288   1H2     G  27          1H2         G  27  -1.397 -13.884   4.899
  289   2H2     G  27          2H2         G  27  -0.347 -14.486   6.166
  290   1H5*    C  28          1H5*        C  28   3.264 -19.814   7.037
  291   2H5*    C  28          2H5*        C  28   2.558 -21.431   6.827
  292    H4*    C  28           H4*        C  28   0.870 -19.848   7.686
  293    H3*    C  28           H3*        C  28   0.456 -20.743   4.815
  294    H2*    C  28           H2*        C  28  -1.695 -19.612   4.980
  295   2HO*    C  28          2HO*        C  28  -2.077 -20.179   7.225
  296    H1*    C  28           H1*        C  28  -0.622 -17.355   6.040
  297   1H4     C  28          1H4         C  28  -0.452 -16.542  -0.247
  298   2H4     C  28          2H4         C  28   1.176 -17.188  -0.303
  299    H5     C  28           H5         C  28   2.276 -18.165   1.653
  300    H6     C  28           H6         C  28   2.029 -18.667   4.001
  301   1H5*    C  29          1H5*        C  29  -3.125 -21.587   6.805
  302   2H5*    C  29          2H5*        C  29  -3.828 -23.143   6.317
  303    H4*    C  29           H4*        C  29  -5.421 -21.307   5.927
  304    H3*    C  29           H3*        C  29  -4.257 -22.549   3.415
  305    H2*    C  29           H2*        C  29  -5.921 -21.254   2.225
  306   2HO*    C  29          2HO*        C  29  -7.617 -21.516   3.813
  307    H1*    C  29           H1*        C  29  -5.395 -18.955   3.611
  308   1H4     C  29          1H4         C  29  -1.760 -19.058  -1.611
  309   2H4     C  29          2H4         C  29  -0.471 -19.857  -0.730
  310    H5     C  29           H5         C  29  -0.725 -20.593   1.598
  311    H6     C  29           H6         C  29  -2.263 -20.726   3.460
  312    H3T    C  29           H3T        C  29  -6.267 -23.661   3.510
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -7.380 -15.362  -8.875
    2   2H5*    G   1          2H5*        G   1  -7.536 -13.761  -8.125
    3    H4*    G   1           H4*        G   1  -8.945 -15.320  -6.926
    4    H3*    G   1           H3*        G   1  -6.446 -14.556  -5.386
    5    H2*    G   1           H2*        G   1  -7.468 -15.713  -3.512
    6   2HO*    G   1          2HO*        G   1  -9.567 -16.591  -3.735
    7    H1*    G   1           H1*        G   1  -8.036 -17.924  -4.967
    8    H8     G   1           H8         G   1  -4.948 -16.721  -6.660
    9    H1     G   1           H1         G   1  -3.779 -19.203  -0.860
   10   1H2     G   1          1H2         G   1  -5.686 -19.429   0.259
   11   2H2     G   1          2H2         G   1  -7.229 -19.004  -0.456
   12    H5T    G   1           H5T        G   1  -5.350 -14.318  -8.551
   13   1H5*    G   2          1H5*        G   2  -9.695 -13.952  -2.899
   14   2H5*    G   2          2H5*        G   2  -9.639 -12.376  -2.083
   15    H4*    G   2           H4*        G   2  -9.940 -14.175  -0.441
   16    H3*    G   2           H3*        G   2  -7.242 -12.803  -0.414
   17    H2*    G   2           H2*        G   2  -6.837 -14.039   1.667
   18   2HO*    G   2          2HO*        G   2  -8.504 -15.310   2.546
   19    H1*    G   2           H1*        G   2  -7.665 -16.395   0.628
   20    H8     G   2           H8         G   2  -6.147 -14.716  -2.354
   21    H1     G   2           H1         G   2  -1.794 -16.974   1.789
   22   1H2     G   2          1H2         G   2  -2.777 -17.489   3.712
   23   2H2     G   2          2H2         G   2  -4.503 -17.288   3.947
   24   1H5*    C   3          1H5*        C   3  -8.803 -12.614   3.374
   25   2H5*    C   3          2H5*        C   3  -8.554 -11.061   4.197
   26    H4*    C   3           H4*        C   3  -7.586 -12.919   5.501
   27    H3*    C   3           H3*        C   3  -5.566 -11.037   4.242
   28    H2*    C   3           H2*        C   3  -3.920 -12.214   5.606
   29   2HO*    C   3          2HO*        C   3  -4.608 -13.785   7.095
   30    H1*    C   3           H1*        C   3  -4.876 -14.686   4.888
   31   1H4     C   3          1H4         C   3  -0.405 -13.291   0.620
   32   2H4     C   3          2H4         C   3  -1.611 -12.583  -0.438
   33    H5     C   3           H5         C   3  -3.945 -12.273   0.249
   34    H6     C   3           H6         C   3  -5.525 -12.616   2.044
   35   1H5*    C   4          1H5*        C   4  -4.808 -11.109   8.285
   36   2H5*    C   4          2H5*        C   4  -4.367  -9.521   8.950
   37    H4*    C   4           H4*        C   4  -2.560 -11.161   9.331
   38    H3*    C   4           H3*        C   4  -1.910  -9.050   7.246
   39    H2*    C   4           H2*        C   4   0.363  -9.936   7.416
   40   2HO*    C   4          2HO*        C   4   0.295 -10.379   9.709
   41    H1*    C   4           H1*        C   4  -0.481 -12.518   7.205
   42   1H4     C   4          1H4         C   4   0.760 -10.558   1.316
   43   2H4     C   4          2H4         C   4  -0.845  -9.869   1.155
   44    H5     C   4           H5         C   4  -2.454  -9.834   3.012
   45    H6     C   4           H6         C   4  -2.786 -10.412   5.338
   46   1H5*    A   5          1H5*        A   5   1.109  -8.935  10.315
   47   2H5*    A   5          2H5*        A   5   1.773  -7.299  10.494
   48    H4*    A   5           H4*        A   5   3.502  -9.025   9.902
   49    H3*    A   5           H3*        A   5   2.996  -6.828   7.876
   50    H2*    A   5           H2*        A   5   4.947  -7.735   6.714
   51   2HO*    A   5          2HO*        A   5   6.088  -9.493   7.649
   52    H1*    A   5           H1*        A   5   4.025 -10.286   6.838
   53    H8     A   5           H8         A   5   0.884  -8.267   6.472
   54   1H6     A   5          1H6         A   5   2.478  -7.755   0.468
   55   2H6     A   5          2H6         A   5   1.173  -7.499   1.615
   56    H2     A   5           H2         A   5   5.964  -9.288   2.705
   57   1H5*    U   6          1H5*        U   6   6.966  -7.081   7.864
   58   2H5*    U   6          2H5*        U   6   7.721  -5.507   8.165
   59    H4*    U   6           H4*        U   6   8.588  -6.472   6.082
   60    H3*    U   6           H3*        U   6   6.775  -4.070   5.731
   61    H2*    U   6           H2*        U   6   7.529  -4.084   3.424
   62   2HO*    U   6          2HO*        U   6   9.155  -5.518   2.762
   63    H1*    U   6           H1*        U   6   7.179  -6.770   3.128
   64    H3     U   6           H3         U   6   3.721  -4.836   0.876
   65    H5     U   6           H5         U   6   2.544  -4.760   4.907
   66    H6     U   6           H6         U   6   4.757  -5.504   5.509
   67   1H5*    C   7          1H5*        C   7  10.800  -3.737   3.969
   68   2H5*    C   7          2H5*        C   7  11.416  -2.090   4.190
   69    H4*    C   7           H4*        C   7  11.717  -2.757   1.865
   70    H3*    C   7           H3*        C   7   9.515  -0.710   2.283
   71    H2*    C   7           H2*        C   7   9.565  -0.488  -0.138
   72   2HO*    C   7          2HO*        C   7  11.804  -0.705  -0.502
   73    H1*    C   7           H1*        C   7   9.566  -3.175  -0.560
   74   1H4     C   7          1H4         C   7   3.370  -1.833  -0.423
   75   2H4     C   7          2H4         C   7   3.381  -1.836   1.328
   76    H5     C   7           H5         C   7   5.425  -2.025   2.648
   77    H6     C   7           H6         C   7   7.830  -2.293   2.519
   78   1H5*    U   8          1H5*        U   8  12.874   0.595  -0.329
   79   2H5*    U   8          2H5*        U   8  13.062   2.358  -0.264
   80    H4*    U   8           H4*        U   8  12.844   1.569  -2.601
   81    H3*    U   8           H3*        U   8  10.488   3.160  -1.539
   82    H2*    U   8           H2*        U   8   9.725   3.161  -3.851
   83   2HO*    U   8          2HO*        U   8  11.055   2.332  -5.485
   84    H1*    U   8           H1*        U   8  10.279   0.517  -4.232
   85    H3     U   8           H3         U   8   5.793   0.462  -4.128
   86    H5     U   8           H5         U   8   6.845   1.202  -0.129
   87    H6     U   8           H6         U   8   9.156   1.333  -0.811
   88   1H5*    U   9          1H5*        U   9  11.981   4.791  -5.225
   89   2H5*    U   9          2H5*        U   9  11.811   6.555  -5.269
   90    H4*    U   9           H4*        U   9  10.670   5.525  -7.191
   91    H3*    U   9           H3*        U   9   8.814   6.726  -5.117
   92    H2*    U   9           H2*        U   9   7.068   6.377  -6.764
   93   2HO*    U   9          2HO*        U   9   8.272   6.912  -8.640
   94    H1*    U   9           H1*        U   9   7.868   3.825  -7.338
   95    H3     U   9           H3         U   9   4.120   3.321  -4.818
   96    H5     U   9           H5         U   9   7.054   4.470  -2.043
   97    H6     U   9           H6         U   9   8.589   4.778  -3.882
   98   1H5*    G  10          1H5*        G  10   6.354  10.350  -8.148
   99   2H5*    G  10          2H5*        G  10   5.867   9.194  -6.894
  100    H4*    G  10           H4*        G  10   5.876   8.628  -9.896
  101    H3*    G  10           H3*        G  10   3.682   9.286  -7.907
  102    H2*    G  10           H2*        G  10   2.216   7.935  -9.304
  103   2HO*    G  10          2HO*        G  10   3.231   8.630 -11.332
  104    H1*    G  10           H1*        G  10   4.004   5.890  -9.508
  105    H8     G  10           H8         G  10   1.516   5.366  -8.417
  106    H1     G  10           H1         G  10   3.968   6.885  -2.685
  107   1H2     G  10          1H2         G  10   5.900   7.977  -2.946
  108   2H2     G  10          2H2         G  10   6.548   8.327  -4.536
  109   1H5*    C  11          1H5*        C  11   1.440   9.361 -11.098
  110   2H5*    C  11          2H5*        C  11   0.658  10.945 -11.275
  111    H4*    C  11           H4*        C  11  -1.054   9.215 -11.267
  112    H3*    C  11           H3*        C  11  -0.910  10.882  -8.743
  113    H2*    C  11           H2*        C  11  -2.986   9.784  -8.096
  114   2HO*    C  11          2HO*        C  11  -3.862   9.712 -10.278
  115    H1*    C  11           H1*        C  11  -2.092   7.303  -8.693
  116   1H4     C  11          1H4         C  11  -0.437   8.488  -2.653
  117   2H4     C  11          2H4         C  11   1.173   8.939  -3.184
  118    H5     C  11           H5         C  11   1.789   9.083  -5.550
  119    H6     C  11           H6         C  11   0.969   8.850  -7.812
  120   1H5*    U  12          1H5*        U  12  -4.932  11.112 -10.097
  121   2H5*    U  12          2H5*        U  12  -5.512  12.786 -10.046
  122    H4*    U  12           H4*        U  12  -7.053  11.331  -8.822
  123    H3*    U  12           H3*        U  12  -5.408  13.170  -7.051
  124    H2*    U  12           H2*        U  12  -6.917  12.473  -5.284
  125   2HO*    U  12          2HO*        U  12  -8.680  11.111  -5.766
  126    H1*    U  12           H1*        U  12  -6.692   9.831  -5.896
  127    H3     U  12           H3         U  12  -4.187  10.725  -2.161
  128    H5     U  12           H5         U  12  -1.649  11.492  -5.419
  129    H6     U  12           H6         U  12  -3.548  11.243  -6.887
  130   1H5*    C  13          1H5*        C  13  -9.331  13.790  -5.987
  131   2H5*    C  13          2H5*        C  13  -9.694  15.524  -5.843
  132    H4*    C  13           H4*        C  13 -10.245  14.373  -3.739
  133    H3*    C  13           H3*        C  13  -7.796  16.167  -3.638
  134    H2*    C  13           H2*        C  13  -7.835  15.803  -1.250
  135   2HO*    C  13          2HO*        C  13 -10.201  15.884  -1.116
  136    H1*    C  13           H1*        C  13  -8.345  13.101  -1.461
  137   1H4     C  13          1H4         C  13  -2.121  14.013  -0.651
  138   2H4     C  13          2H4         C  13  -1.867  14.133  -2.384
  139    H5     C  13           H5         C  13  -3.739  14.126  -3.985
  140    H6     C  13           H6         C  13  -6.149  14.009  -4.193
  141   1H5*    U  14          1H5*        U  14  -9.298  17.445  -0.343
  142   2H5*    U  14          2H5*        U  14  -9.436  19.215  -0.341
  143    H4*    U  14           H4*        U  14  -7.965  18.535   1.486
  144    H3*    U  14           H3*        U  14  -6.532  19.816  -0.857
  145    H2*    U  14           H2*        U  14  -4.577  19.824   0.541
  146   2HO*    U  14          2HO*        U  14  -5.622  20.414   2.493
  147    H1*    U  14           H1*        U  14  -4.971  17.272   1.484
  148    H3     U  14           H3         U  14  -1.380  17.202  -1.352
  149    H5     U  14           H5         U  14  -4.730  17.252  -3.888
  150    H6     U  14           H6         U  14  -6.132  17.565  -1.941
  151   1H5*    U  15          1H5*        U  15  -6.623  24.330   2.643
  152   2H5*    U  15          2H5*        U  15  -4.892  24.105   2.345
  153    H4*    U  15           H4*        U  15  -5.269  24.590   4.685
  154    H3*    U  15           H3*        U  15  -3.730  22.453   3.892
  155    H2*    U  15           H2*        U  15  -5.451  20.842   4.132
  156   2HO*    U  15          2HO*        U  15  -5.036  19.716   6.085
  157    H1*    U  15           H1*        U  15  -6.258  22.169   6.717
  158    H3     U  15           H3         U  15  -9.901  19.617   7.416
  159    H5     U  15           H5         U  15  -9.252  19.198   3.286
  160    H6     U  15           H6         U  15  -7.413  20.756   3.472
  161   1H5*    C  16          1H5*        C  16  -1.939  21.245   6.376
  162   2H5*    C  16          2H5*        C  16  -0.667  22.213   7.145
  163    H4*    C  16           H4*        C  16   0.247  20.122   6.405
  164    H3*    C  16           H3*        C  16   1.509  22.469   5.792
  165    H2*    C  16           H2*        C  16   0.367  22.697   3.670
  166   2HO*    C  16          2HO*        C  16   1.981  22.262   2.093
  167    H1*    C  16           H1*        C  16   1.053  19.786   3.162
  168   1H4     C  16          1H4         C  16  -2.640  20.828  -1.930
  169   2H4     C  16          2H4         C  16  -3.802  21.716  -0.956
  170    H5     C  16           H5         C  16  -3.460  22.213   1.396
  171    H6     C  16           H6         C  16  -1.974  21.878   3.290
  172   1H5*    G  17          1H5*        G  17   3.290  16.825   6.297
  173   2H5*    G  17          2H5*        G  17   2.117  17.896   5.520
  174    H4*    G  17           H4*        G  17   2.218  17.697   8.546
  175    H3*    G  17           H3*        G  17   0.864  15.746   6.651
  176    H2*    G  17           H2*        G  17  -0.729  15.477   8.454
  177   2HO*    G  17          2HO*        G  17   0.937  15.515  10.140
  178    H1*    G  17           H1*        G  17  -0.735  18.188   9.082
  179    H8     G  17           H8         G  17  -3.216  17.474   8.948
  180    H1     G  17           H1         G  17  -2.963  17.143   2.558
  181   1H2     G  17          1H2         G  17  -0.916  17.249   1.865
  182   2H2     G  17          2H2         G  17   0.455  17.366   2.958
  183   1H5*    G  18          1H5*        G  18  -0.052  13.802   9.751
  184   2H5*    G  18          2H5*        G  18   0.146  12.050   9.550
  185    H4*    G  18           H4*        G  18  -2.233  12.667   9.807
  186    H3*    G  18           H3*        G  18  -1.432  11.611   7.087
  187    H2*    G  18           H2*        G  18  -3.827  11.609   6.576
  188   2HO*    G  18          2HO*        G  18  -4.516  11.055   8.760
  189    H1*    G  18           H1*        G  18  -4.153  14.177   7.353
  190    H8     G  18           H8         G  18  -0.590  14.229   6.271
  191    H1     G  18           H1         G  18  -4.606  13.749   1.300
  192   1H2     G  18          1H2         G  18  -6.657  13.364   2.021
  193   2H2     G  18          2H2         G  18  -7.031  13.190   3.726
  194   1H5*    A  19          1H5*        A  19  -4.773   9.401   8.331
  195   2H5*    A  19          2H5*        A  19  -4.572   7.668   8.023
  196    H4*    A  19           H4*        A  19  -6.652   8.514   7.006
  197    H3*    A  19           H3*        A  19  -4.483   7.705   5.050
  198    H2*    A  19           H2*        A  19  -6.227   7.925   3.356
  199   2HO*    A  19          2HO*        A  19  -7.998   7.179   4.676
  200    H1*    A  19           H1*        A  19  -6.933  10.384   4.181
  201    H8     A  19           H8         A  19  -3.310  10.332   5.102
  202   1H6     A  19          1H6         A  19  -2.045  11.051  -0.931
  203   2H6     A  19          2H6         A  19  -1.368  11.052   0.686
  204    H2     A  19           H2         A  19  -6.378  10.163  -0.525
  205   1H5*    G  20          1H5*        G  20  -8.082   5.526   4.288
  206   2H5*    G  20          2H5*        G  20  -7.766   3.937   3.541
  207    H4*    G  20           H4*        G  20  -9.213   5.569   2.197
  208    H3*    G  20           H3*        G  20  -6.740   4.214   1.135
  209    H2*    G  20           H2*        G  20  -7.215   5.199  -1.015
  210   2HO*    G  20          2HO*        G  20  -9.172   6.329  -1.359
  211    H1*    G  20           H1*        G  20  -7.747   7.701  -0.034
  212    H8     G  20           H8         G  20  -5.049   6.751   2.280
  213    H1     G  20           H1         G  20  -2.842   7.648  -3.673
  214   1H2     G  20          1H2         G  20  -4.511   7.560  -5.126
  215   2H2     G  20          2H2         G  20  -6.172   7.335  -4.612
  216   1H5*    G  21          1H5*        G  21  -9.145   3.026  -1.723
  217   2H5*    G  21          2H5*        G  21  -9.015   1.280  -2.051
  218    H4*    G  21           H4*        G  21  -8.216   2.526  -4.005
  219    H3*    G  21           H3*        G  21  -5.997   1.278  -2.354
  220    H2*    G  21           H2*        G  21  -4.521   1.931  -4.140
  221   2HO*    G  21          2HO*        G  21  -5.943   1.528  -5.923
  222    H1*    G  21           H1*        G  21  -5.495   4.460  -4.274
  223    H8     G  21           H8         G  21  -5.607   3.221  -0.691
  224    H1     G  21           H1         G  21   0.239   4.933  -2.720
  225   1H2     G  21          1H2         G  21   0.185   5.249  -4.937
  226   2H2     G  21          2H2         G  21  -1.300   5.067  -5.844
  227   1H5*    A  22          1H5*        A  22  -5.911   0.074  -6.584
  228   2H5*    A  22          2H5*        A  22  -5.350  -1.601  -6.721
  229    H4*    A  22           H4*        A  22  -4.127  -0.055  -8.232
  230    H3*    A  22           H3*        A  22  -2.447  -1.308  -6.030
  231    H2*    A  22           H2*        A  22  -0.581  -0.446  -7.326
  232   2HO*    A  22          2HO*        A  22  -0.987   0.620  -9.310
  233    H1*    A  22           H1*        A  22  -1.700   2.018  -7.565
  234    H8     A  22           H8         A  22  -2.795   0.861  -4.161
  235   1H6     A  22          1H6         A  22   2.959   2.308  -2.284
  236   2H6     A  22          2H6         A  22   1.356   1.851  -1.738
  237    H2     A  22           H2         A  22   2.870   2.448  -6.710
  238   1H5*    U  23          1H5*        U  23  -0.440  -1.973  -9.354
  239   2H5*    U  23          2H5*        U  23   0.124  -3.648  -9.519
  240    H4*    U  23           H4*        U  23   2.013  -2.068  -9.649
  241    H3*    U  23           H3*        U  23   1.898  -3.803  -7.163
  242    H2*    U  23           H2*        U  23   4.158  -2.974  -6.740
  243   2HO*    U  23          2HO*        U  23   4.744  -2.920  -9.040
  244    H1*    U  23           H1*        U  23   3.473  -0.382  -7.204
  245    H3     U  23           H3         U  23   3.992  -1.188  -2.710
  246    H5     U  23           H5         U  23  -0.061  -1.910  -3.547
  247    H6     U  23           H6         U  23   0.439  -1.686  -5.903
  248   1H5*    U  24          1H5*        U  24   5.679  -4.232  -8.735
  249   2H5*    U  24          2H5*        U  24   6.108  -5.942  -8.929
  250    H4*    U  24           H4*        U  24   7.848  -4.681  -7.677
  251    H3*    U  24           H3*        U  24   6.302  -6.788  -6.139
  252    H2*    U  24           H2*        U  24   7.976  -6.459  -4.405
  253   2HO*    U  24          2HO*        U  24   9.760  -6.184  -5.910
  254    H1*    U  24           H1*        U  24   7.860  -3.703  -4.590
  255    H3     U  24           H3         U  24   5.900  -5.301  -0.702
  256    H5     U  24           H5         U  24   2.827  -4.816  -3.524
  257    H6     U  24           H6         U  24   4.508  -4.542  -5.236
  258   1H5*    U  25          1H5*        U  25  10.225  -7.996  -5.519
  259   2H5*    U  25          2H5*        U  25  10.356  -9.752  -5.752
  260    H4*    U  25           H4*        U  25  11.080  -9.179  -3.485
  261    H3*    U  25           H3*        U  25   8.355 -10.512  -3.567
  262    H2*    U  25           H2*        U  25   8.627 -10.694  -1.151
  263   2HO*    U  25          2HO*        U  25  10.568 -10.007  -0.180
  264    H1*    U  25           H1*        U  25   9.373  -8.085  -0.905
  265    H3     U  25           H3         U  25   5.095  -8.262   0.565
  266    H5     U  25           H5         U  25   4.723  -8.394  -3.613
  267    H6     U  25           H6         U  25   7.131  -8.548  -3.763
  268   1H5*    G  26          1H5*        G  26  11.057 -12.631  -1.013
  269   2H5*    G  26          2H5*        G  26  10.849 -14.385  -1.145
  270    H4*    G  26           H4*        G  26  10.788 -13.667   1.202
  271    H3*    G  26           H3*        G  26   8.115 -14.626   0.128
  272    H2*    G  26           H2*        G  26   7.435 -14.604   2.464
  273   2HO*    G  26          2HO*        G  26   8.950 -14.061   4.075
  274    H1*    G  26           H1*        G  26   8.373 -12.088   2.862
  275    H8     G  26           H8         G  26   7.326 -12.122  -0.744
  276    H1     G  26           H1         G  26   2.377 -11.835   3.329
  277   1H2     G  26          1H2         G  26   3.062 -12.336   5.381
  278   2H2     G  26          2H2         G  26   4.745 -12.688   5.732
  279   1H5*    G  27          1H5*        G  27   9.160 -16.841   3.519
  280   2H5*    G  27          2H5*        G  27   8.760 -18.566   3.386
  281    H4*    G  27           H4*        G  27   7.745 -17.594   5.408
  282    H3*    G  27           H3*        G  27   5.795 -18.374   3.244
  283    H2*    G  27           H2*        G  27   4.084 -17.926   4.964
  284   2HO*    G  27          2HO*        G  27   5.354 -18.723   6.762
  285    H1*    G  27           H1*        G  27   5.124 -15.525   5.621
  286    H8     G  27           H8         G  27   5.971 -15.819   1.973
  287    H1     G  27           H1         G  27  -0.208 -14.456   3.038
  288   1H2     G  27          1H2         G  27  -0.708 -14.816   5.167
  289   2H2     G  27          2H2         G  27   0.500 -15.345   6.323
  290   1H5*    C  28          1H5*        C  28   4.684 -20.365   6.728
  291   2H5*    C  28          2H5*        C  28   4.122 -22.025   6.439
  292    H4*    C  28           H4*        C  28   2.361 -20.658   7.513
  293    H3*    C  28           H3*        C  28   1.828 -21.445   4.629
  294    H2*    C  28           H2*        C  28  -0.410 -20.556   5.015
  295   2HO*    C  28          2HO*        C  28  -0.551 -21.277   7.246
  296    H1*    C  28           H1*        C  28   0.513 -18.258   6.126
  297   1H4     C  28          1H4         C  28   0.090 -17.156  -0.110
  298   2H4     C  28          2H4         C  28   1.773 -17.603  -0.318
  299    H5     C  28           H5         C  28   3.128 -18.523   1.501
  300    H6     C  28           H6         C  28   3.123 -19.155   3.831
  301   1H5*    C  29          1H5*        C  29  -1.470 -22.765   6.830
  302   2H5*    C  29          2H5*        C  29  -2.050 -24.356   6.307
  303    H4*    C  29           H4*        C  29  -3.846 -22.678   6.150
  304    H3*    C  29           H3*        C  29  -2.781 -23.659   3.480
  305    H2*    C  29           H2*        C  29  -4.659 -22.485   2.511
  306   2HO*    C  29          2HO*        C  29  -6.169 -23.015   4.226
  307    H1*    C  29           H1*        C  29  -4.248 -20.222   3.990
  308   1H4     C  29          1H4         C  29  -1.094 -19.670  -1.507
  309   2H4     C  29          2H4         C  29   0.340 -20.383  -0.791
  310    H5     C  29           H5         C  29   0.369 -21.263   1.501
  311    H6     C  29           H6         C  29  -0.976 -21.651   3.476
  312    H3T    C  29           H3T        C  29  -3.747 -25.251   4.821
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -7.485 -15.092  -9.195
    2   2H5*    G   1          2H5*        G   1  -7.531 -13.449  -8.525
    3    H4*    G   1           H4*        G   1  -9.113 -14.826  -7.314
    4    H3*    G   1           H3*        G   1  -6.617 -14.194  -5.709
    5    H2*    G   1           H2*        G   1  -7.813 -15.180  -3.829
    6   2HO*    G   1          2HO*        G   1  -9.937 -14.385  -4.500
    7    H1*    G   1           H1*        G   1  -8.489 -17.403  -5.200
    8    H8     G   1           H8         G   1  -5.261 -16.554  -6.842
    9    H1     G   1           H1         G   1  -4.476 -18.739  -0.859
   10   1H2     G   1          1H2         G   1  -6.426 -18.746   0.201
   11   2H2     G   1          2H2         G   1  -7.910 -18.253  -0.592
   12    H5T    G   1           H5T        G   1  -5.392 -14.198  -8.836
   13   1H5*    G   2          1H5*        G   2  -9.881 -13.142  -3.331
   14   2H5*    G   2          2H5*        G   2  -9.660 -11.551  -2.580
   15    H4*    G   2           H4*        G   2 -10.182 -13.257  -0.887
   16    H3*    G   2           H3*        G   2  -7.371 -12.130  -0.819
   17    H2*    G   2           H2*        G   2  -7.162 -13.321   1.330
   18   2HO*    G   2          2HO*        G   2  -9.388 -12.945   1.986
   19    H1*    G   2           H1*        G   2  -8.137 -15.628   0.336
   20    H8     G   2           H8         G   2  -6.416 -14.241  -2.675
   21    H1     G   2           H1         G   2  -2.335 -16.492   1.739
   22   1H2     G   2          1H2         G   2  -3.404 -16.831   3.655
   23   2H2     G   2          2H2         G   2  -5.118 -16.507   3.824
   24   1H5*    C   3          1H5*        C   3  -9.049 -11.602   2.927
   25   2H5*    C   3          2H5*        C   3  -8.653 -10.042   3.676
   26    H4*    C   3           H4*        C   3  -7.932 -11.955   5.084
   27    H3*    C   3           H3*        C   3  -5.711 -10.279   3.877
   28    H2*    C   3           H2*        C   3  -4.230 -11.552   5.359
   29   2HO*    C   3          2HO*        C   3  -5.122 -13.029   6.831
   30    H1*    C   3           H1*        C   3  -5.348 -13.954   4.642
   31   1H4     C   3          1H4         C   3  -0.589 -12.971   0.549
   32   2H4     C   3          2H4         C   3  -1.717 -12.263  -0.592
   33    H5     C   3           H5         C   3  -4.055 -11.821  -0.037
   34    H6     C   3           H6         C   3  -5.733 -11.995   1.693
   35   1H5*    C   4          1H5*        C   4  -5.209 -10.324   7.959
   36   2H5*    C   4          2H5*        C   4  -4.704  -8.762   8.644
   37    H4*    C   4           H4*        C   4  -3.048 -10.511   9.168
   38    H3*    C   4           H3*        C   4  -2.122  -8.476   7.114
   39    H2*    C   4           H2*        C   4   0.073  -9.506   7.429
   40   2HO*    C   4          2HO*        C   4  -0.143  -9.908   9.711
   41    H1*    C   4           H1*        C   4  -0.918 -12.033   7.204
   42   1H4     C   4          1H4         C   4   0.774 -10.345   1.348
   43   2H4     C   4          2H4         C   4  -0.778  -9.572   1.076
   44    H5     C   4           H5         C   4  -2.472  -9.363   2.835
   45    H6     C   4           H6         C   4  -2.970  -9.844   5.154
   46   1H5*    A   5          1H5*        A   5   0.665  -8.498  10.411
   47   2H5*    A   5          2H5*        A   5   1.406  -6.901  10.631
   48    H4*    A   5           H4*        A   5   3.084  -8.706  10.183
   49    H3*    A   5           H3*        A   5   2.813  -6.533   8.086
   50    H2*    A   5           H2*        A   5   4.787  -7.557   7.062
   51   2HO*    A   5          2HO*        A   5   5.768  -8.145   9.149
   52    H1*    A   5           H1*        A   5   3.744 -10.058   7.174
   53    H8     A   5           H8         A   5   0.746  -7.862   6.607
   54   1H6     A   5          1H6         A   5   2.590  -7.737   0.657
   55   2H6     A   5          2H6         A   5   1.266  -7.345   1.742
   56    H2     A   5           H2         A   5   5.887  -9.380   3.101
   57   1H5*    U   6          1H5*        U   6   6.767  -6.883   8.238
   58   2H5*    U   6          2H5*        U   6   7.531  -5.309   8.542
   59    H4*    U   6           H4*        U   6   8.438  -6.302   6.489
   60    H3*    U   6           H3*        U   6   6.628  -3.909   6.072
   61    H2*    U   6           H2*        U   6   7.395  -3.957   3.776
   62   2HO*    U   6          2HO*        U   6   9.586  -4.486   4.148
   63    H1*    U   6           H1*        U   6   7.134  -6.671   3.534
   64    H3     U   6           H3         U   6   3.726  -4.904   1.081
   65    H5     U   6           H5         U   6   2.437  -4.562   5.066
   66    H6     U   6           H6         U   6   4.624  -5.297   5.778
   67   1H5*    C   7          1H5*        C   7  10.909  -3.517   4.575
   68   2H5*    C   7          2H5*        C   7  11.394  -1.822   4.752
   69    H4*    C   7           H4*        C   7  11.951  -2.617   2.507
   70    H3*    C   7           H3*        C   7   9.627  -0.664   2.570
   71    H2*    C   7           H2*        C   7   9.925  -0.602   0.156
   72   2HO*    C   7          2HO*        C   7  11.647  -1.683  -0.806
   73    H1*    C   7           H1*        C   7  10.034  -3.313  -0.058
   74   1H4     C   7          1H4         C   7   3.815  -2.149  -0.538
   75   2H4     C   7          2H4         C   7   3.670  -2.032   1.201
   76    H5     C   7           H5         C   7   5.599  -2.076   2.703
   77    H6     C   7           H6         C   7   8.010  -2.274   2.796
   78   1H5*    U   8          1H5*        U   8  13.039   0.520   0.104
   79   2H5*    U   8          2H5*        U   8  13.197   2.285  -0.007
   80    H4*    U   8           H4*        U   8  13.144   1.256  -2.248
   81    H3*    U   8           H3*        U   8  10.680   2.876  -1.538
   82    H2*    U   8           H2*        U   8  10.105   2.600  -3.890
   83   2HO*    U   8          2HO*        U   8  11.574   1.634  -5.315
   84    H1*    U   8           H1*        U   8  10.713  -0.055  -3.924
   85    H3     U   8           H3         U   8   6.216  -0.126  -4.080
   86    H5     U   8           H5         U   8   7.039   1.025  -0.125
   87    H6     U   8           H6         U   8   9.382   1.126  -0.693
   88   1H5*    U   9          1H5*        U   9  12.307   4.207  -5.243
   89   2H5*    U   9          2H5*        U   9  12.107   5.943  -5.490
   90    H4*    U   9           H4*        U   9  11.094   4.675  -7.333
   91    H3*    U   9           H3*        U   9   8.965   5.960  -5.580
   92    H2*    U   9           H2*        U   9   7.443   5.216  -7.332
   93   2HO*    U   9          2HO*        U   9   8.270   4.155  -9.171
   94    H1*    U   9           H1*        U   9   8.403   2.690  -7.310
   95    H3     U   9           H3         U   9   4.492   2.702  -4.950
   96    H5     U   9           H5         U   9   7.354   4.120  -2.230
   97    H6     U   9           H6         U   9   8.961   4.162  -4.029
   98   1H5*    G  10          1H5*        G  10   7.918  10.142  -6.325
   99   2H5*    G  10          2H5*        G  10   7.097   9.332  -4.979
  100    H4*    G  10           H4*        G  10   7.486   8.154  -7.772
  101    H3*    G  10           H3*        G  10   5.087   9.325  -6.319
  102    H2*    G  10           H2*        G  10   3.769   7.920  -7.802
  103   2HO*    G  10          2HO*        G  10   5.186   8.296  -9.668
  104    H1*    G  10           H1*        G  10   5.484   5.775  -7.518
  105    H8     G  10           H8         G  10   2.662   5.606  -7.138
  106    H1     G  10           H1         G  10   3.946   6.515  -0.919
  107   1H2     G  10          1H2         G  10   5.979   7.405  -0.682
  108   2H2     G  10          2H2         G  10   6.995   7.748  -2.066
  109   1H5*    C  11          1H5*        C  11   3.545   9.200  -9.987
  110   2H5*    C  11          2H5*        C  11   2.818  10.766 -10.395
  111    H4*    C  11           H4*        C  11   1.111   9.043 -10.561
  112    H3*    C  11           H3*        C  11   0.828  10.834  -8.132
  113    H2*    C  11           H2*        C  11  -1.344   9.763  -7.835
  114   2HO*    C  11          2HO*        C  11  -1.803   9.599 -10.138
  115    H1*    C  11           H1*        C  11  -0.364   7.259  -8.174
  116   1H4     C  11          1H4         C  11   0.096   8.472  -1.953
  117   2H4     C  11          2H4         C  11   1.726   9.078  -2.175
  118    H5     C  11           H5         C  11   2.749   9.334  -4.386
  119    H6     C  11           H6         C  11   2.390   9.059  -6.760
  120   1H5*    U  12          1H5*        U  12  -2.894  10.963 -10.218
  121   2H5*    U  12          2H5*        U  12  -3.501  12.626 -10.295
  122    H4*    U  12           H4*        U  12  -5.208  11.148  -9.350
  123    H3*    U  12           H3*        U  12  -3.956  13.053  -7.344
  124    H2*    U  12           H2*        U  12  -5.750  12.351  -5.871
  125   2HO*    U  12          2HO*        U  12  -7.363  10.929  -6.645
  126    H1*    U  12           H1*        U  12  -5.361   9.704  -6.380
  127    H3     U  12           H3         U  12  -3.601  10.646  -2.264
  128    H5     U  12           H5         U  12  -0.541  11.531  -5.004
  129    H6     U  12           H6         U  12  -2.135  11.238  -6.794
  130   1H5*    C  13          1H5*        C  13  -8.037  13.599  -7.040
  131   2H5*    C  13          2H5*        C  13  -8.447  15.328  -7.003
  132    H4*    C  13           H4*        C  13  -9.360  14.209  -5.011
  133    H3*    C  13           H3*        C  13  -7.001  16.050  -4.506
  134    H2*    C  13           H2*        C  13  -7.459  15.731  -2.157
  135   2HO*    C  13          2HO*        C  13  -9.812  15.780  -2.452
  136    H1*    C  13           H1*        C  13  -7.897  13.018  -2.396
  137   1H4     C  13          1H4         C  13  -1.926  13.988  -0.488
  138   2H4     C  13          2H4         C  13  -1.367  14.096  -2.147
  139    H5     C  13           H5         C  13  -2.918  14.064  -4.059
  140    H6     C  13           H6         C  13  -5.249  13.922  -4.697
  141   1H5*    U  14          1H5*        U  14  -9.081  17.382  -1.589
  142   2H5*    U  14          2H5*        U  14  -9.199  19.154  -1.621
  143    H4*    U  14           H4*        U  14  -8.073  18.458   0.433
  144    H3*    U  14           H3*        U  14  -6.248  19.722  -1.629
  145    H2*    U  14           H2*        U  14  -4.569  19.732   0.119
  146   2HO*    U  14          2HO*        U  14  -6.575  18.675   1.861
  147    H1*    U  14           H1*        U  14  -5.102  17.158   0.906
  148    H3     U  14           H3         U  14  -1.104  17.115  -1.301
  149    H5     U  14           H5         U  14  -3.993  17.216  -4.351
  150    H6     U  14           H6         U  14  -5.692  17.504  -2.652
  151   1H5*    U  15          1H5*        U  15  -4.595  22.954   1.412
  152   2H5*    U  15          2H5*        U  15  -5.509  21.522   1.900
  153    H4*    U  15           H4*        U  15  -5.489  24.270   3.196
  154    H3*    U  15           H3*        U  15  -3.859  22.124   3.582
  155    H2*    U  15           H2*        U  15  -5.616  20.529   3.729
  156   2HO*    U  15          2HO*        U  15  -5.674  19.882   5.925
  157    H1*    U  15           H1*        U  15  -6.970  22.386   5.679
  158    H3     U  15           H3         U  15 -10.393  19.521   6.319
  159    H5     U  15           H5         U  15  -9.539  19.051   2.232
  160    H6     U  15           H6         U  15  -7.738  20.652   2.482
  161   1H5*    C  16          1H5*        C  16  -2.720  21.391   6.210
  162   2H5*    C  16          2H5*        C  16  -1.623  22.443   7.119
  163    H4*    C  16           H4*        C  16  -0.610  20.303   6.792
  164    H3*    C  16           H3*        C  16   0.814  22.558   6.249
  165    H2*    C  16           H2*        C  16   0.088  22.589   3.915
  166   2HO*    C  16          2HO*        C  16   2.397  22.776   4.022
  167    H1*    C  16           H1*        C  16   0.874  19.656   3.857
  168   1H4     C  16          1H4         C  16  -1.618  20.125  -1.998
  169   2H4     C  16          2H4         C  16  -2.973  21.062  -1.395
  170    H5     C  16           H5         C  16  -3.186  21.729   0.942
  171    H6     C  16           H6         C  16  -2.116  21.638   3.127
  172   1H5*    G  17          1H5*        G  17   2.393  16.897   7.338
  173   2H5*    G  17          2H5*        G  17   1.471  17.940   6.248
  174    H4*    G  17           H4*        G  17   0.776  17.892   9.193
  175    H3*    G  17           H3*        G  17  -0.083  15.818   7.142
  176    H2*    G  17           H2*        G  17  -2.047  15.648   8.545
  177   2HO*    G  17          2HO*        G  17  -0.802  15.763  10.560
  178    H1*    G  17           H1*        G  17  -2.097  18.402   9.051
  179    H8     G  17           H8         G  17  -4.537  17.707   8.568
  180    H1     G  17           H1         G  17  -3.295  17.082   2.317
  181   1H2     G  17          1H2         G  17  -1.164  17.127   1.950
  182   2H2     G  17          2H2         G  17   0.021  17.274   3.239
  183   1H5*    G  18          1H5*        G  18  -1.660  14.029  10.130
  184   2H5*    G  18          2H5*        G  18  -1.438  12.270  10.051
  185    H4*    G  18           H4*        G  18  -3.816  12.885   9.815
  186    H3*    G  18           H3*        G  18  -2.520  11.746   7.328
  187    H2*    G  18           H2*        G  18  -4.782  11.720   6.387
  188   2HO*    G  18          2HO*        G  18  -5.873  11.234   8.413
  189    H1*    G  18           H1*        G  18  -5.232  14.313   7.011
  190    H8     G  18           H8         G  18  -1.521  14.273   6.572
  191    H1     G  18           H1         G  18  -4.632  13.739   0.993
  192   1H2     G  18          1H2         G  18  -6.786  13.409   1.358
  193   2H2     G  18          2H2         G  18  -7.451  13.300   2.977
  194   1H5*    A  19          1H5*        A  19  -6.036   9.539   8.004
  195   2H5*    A  19          2H5*        A  19  -5.784   7.801   7.756
  196    H4*    A  19           H4*        A  19  -7.647   8.645   6.378
  197    H3*    A  19           H3*        A  19  -5.176   7.793   4.841
  198    H2*    A  19           H2*        A  19  -6.593   8.005   2.871
  199   2HO*    A  19          2HO*        A  19  -8.578   7.299   3.871
  200    H1*    A  19           H1*        A  19  -7.396  10.481   3.525
  201    H8     A  19           H8         A  19  -3.995  10.408   5.067
  202   1H6     A  19          1H6         A  19  -1.683  10.992  -0.662
  203   2H6     A  19          2H6         A  19  -1.296  11.018   1.046
  204    H2     A  19           H2         A  19  -6.027  10.157  -1.008
  205   1H5*    G  20          1H5*        G  20  -8.638   5.640   3.509
  206   2H5*    G  20          2H5*        G  20  -8.227   4.046   2.823
  207    H4*    G  20           H4*        G  20  -9.411   5.718   1.273
  208    H3*    G  20           H3*        G  20  -6.876   4.235   0.617
  209    H2*    G  20           H2*        G  20  -6.943   5.223  -1.585
  210   2HO*    G  20          2HO*        G  20  -9.269   5.035  -1.807
  211    H1*    G  20           H1*        G  20  -7.526   7.755  -0.733
  212    H8     G  20           H8         G  20  -5.295   6.775   2.020
  213    H1     G  20           H1         G  20  -2.070   7.493  -3.473
  214   1H2     G  20          1H2         G  20  -3.456   7.427  -5.189
  215   2H2     G  20          2H2         G  20  -5.190   7.258  -4.974
  216   1H5*    G  21          1H5*        G  21  -9.096   2.974  -2.498
  217   2H5*    G  21          2H5*        G  21  -8.968   1.216  -2.747
  218    H4*    G  21           H4*        G  21  -7.963   2.365  -4.656
  219    H3*    G  21           H3*        G  21  -5.919   1.175  -2.753
  220    H2*    G  21           H2*        G  21  -4.296   1.705  -4.447
  221   2HO*    G  21          2HO*        G  21  -4.951   2.556  -6.455
  222    H1*    G  21           H1*        G  21  -5.185   4.253  -4.734
  223    H8     G  21           H8         G  21  -5.693   3.106  -1.155
  224    H1     G  21           H1         G  21   0.353   4.725  -2.566
  225   1H2     G  21          1H2         G  21   0.546   5.017  -4.775
  226   2H2     G  21          2H2         G  21  -0.829   4.829  -5.844
  227   1H5*    A  22          1H5*        A  22  -5.606  -0.126  -6.861
  228   2H5*    A  22          2H5*        A  22  -5.110  -1.825  -6.987
  229    H4*    A  22           H4*        A  22  -3.776  -0.354  -8.463
  230    H3*    A  22           H3*        A  22  -2.212  -1.590  -6.166
  231    H2*    A  22           H2*        A  22  -0.276  -0.793  -7.388
  232   2HO*    A  22          2HO*        A  22  -0.562   0.218  -9.419
  233    H1*    A  22           H1*        A  22  -1.340   1.679  -7.754
  234    H8     A  22           H8         A  22  -2.590   0.688  -4.350
  235   1H6     A  22          1H6         A  22   3.122   2.109  -2.326
  236   2H6     A  22          2H6         A  22   1.492   1.706  -1.815
  237    H2     A  22           H2         A  22   3.197   2.047  -6.749
  238   1H5*    U  23          1H5*        U  23  -0.098  -2.397  -9.414
  239   2H5*    U  23          2H5*        U  23   0.430  -4.090  -9.509
  240    H4*    U  23           H4*        U  23   2.371  -2.578  -9.609
  241    H3*    U  23           H3*        U  23   2.088  -4.180  -7.054
  242    H2*    U  23           H2*        U  23   4.340  -3.403  -6.545
  243   2HO*    U  23          2HO*        U  23   5.467  -2.145  -8.087
  244    H1*    U  23           H1*        U  23   3.766  -0.814  -7.202
  245    H3     U  23           H3         U  23   4.094  -1.275  -2.662
  246    H5     U  23           H5         U  23   0.084  -2.121  -3.590
  247    H6     U  23           H6         U  23   0.666  -2.042  -5.936
  248   1H5*    U  24          1H5*        U  24   5.889  -4.728  -8.475
  249   2H5*    U  24          2H5*        U  24   6.318  -6.445  -8.611
  250    H4*    U  24           H4*        U  24   8.047  -5.155  -7.375
  251    H3*    U  24           H3*        U  24   6.462  -7.216  -5.819
  252    H2*    U  24           H2*        U  24   8.062  -6.854  -4.041
  253   2HO*    U  24          2HO*        U  24   9.893  -5.537  -4.401
  254    H1*    U  24           H1*        U  24   8.013  -4.095  -4.314
  255    H3     U  24           H3         U  24   5.959  -5.497  -0.407
  256    H5     U  24           H5         U  24   2.947  -5.104  -3.310
  257    H6     U  24           H6         U  24   4.665  -4.923  -4.999
  258   1H5*    U  25          1H5*        U  25  10.364  -8.358  -5.064
  259   2H5*    U  25          2H5*        U  25  10.538 -10.116  -5.256
  260    H4*    U  25           H4*        U  25  11.196  -9.506  -2.990
  261    H3*    U  25           H3*        U  25   8.474 -10.845  -3.109
  262    H2*    U  25           H2*        U  25   8.664 -10.952  -0.676
  263   2HO*    U  25          2HO*        U  25  10.966 -11.352  -0.624
  264    H1*    U  25           H1*        U  25   9.421  -8.347  -0.476
  265    H3     U  25           H3         U  25   5.098  -8.380   0.851
  266    H5     U  25           H5         U  25   4.859  -8.711  -3.326
  267    H6     U  25           H6         U  25   7.263  -8.905  -3.389
  268   1H5*    G  26          1H5*        G  26  11.029 -13.103  -0.419
  269   2H5*    G  26          2H5*        G  26  10.687 -14.835  -0.571
  270    H4*    G  26           H4*        G  26  10.541 -14.101   1.776
  271    H3*    G  26           H3*        G  26   7.878 -14.874   0.536
  272    H2*    G  26           H2*        G  26   7.066 -14.798   2.831
  273   2HO*    G  26          2HO*        G  26   8.519 -14.375   4.529
  274    H1*    G  26           H1*        G  26   8.162 -12.353   3.287
  275    H8     G  26           H8         G  26   7.299 -12.352  -0.371
  276    H1     G  26           H1         G  26   2.190 -11.648   3.446
  277   1H2     G  26          1H2         G  26   2.736 -12.144   5.534
  278   2H2     G  26          2H2         G  26   4.367 -12.607   5.980
  279   1H5*    G  27          1H5*        G  27   8.564 -17.141   3.981
  280   2H5*    G  27          2H5*        G  27   8.022 -18.825   3.845
  281    H4*    G  27           H4*        G  27   6.996 -17.718   5.799
  282    H3*    G  27           H3*        G  27   5.094 -18.392   3.558
  283    H2*    G  27           H2*        G  27   3.350 -17.766   5.186
  284   2HO*    G  27          2HO*        G  27   4.466 -18.616   7.059
  285    H1*    G  27           H1*        G  27   4.552 -15.437   5.830
  286    H8     G  27           H8         G  27   5.539 -15.891   2.237
  287    H1     G  27           H1         G  27  -0.567 -14.063   2.973
  288   1H2     G  27          1H2         G  27  -1.183 -14.307   5.090
  289   2H2     G  27          2H2         G  27  -0.067 -14.884   6.313
  290   1H5*    C  28          1H5*        C  28   3.691 -20.185   7.056
  291   2H5*    C  28          2H5*        C  28   2.999 -21.799   6.789
  292    H4*    C  28           H4*        C  28   1.333 -20.251   7.775
  293    H3*    C  28           H3*        C  28   0.810 -21.095   4.909
  294    H2*    C  28           H2*        C  28  -1.354 -20.014   5.198
  295   2HO*    C  28          2HO*        C  28  -1.922 -19.145   7.221
  296    H1*    C  28           H1*        C  28  -0.267 -17.752   6.246
  297   1H4     C  28          1H4         C  28  -0.443 -16.926  -0.052
  298   2H4     C  28          2H4         C  28   1.210 -17.500  -0.183
  299    H5     C  28           H5         C  28   2.441 -18.422   1.719
  300    H6     C  28           H6         C  28   2.321 -18.943   4.074
  301   1H5*    C  29          1H5*        C  29  -2.595 -21.926   7.083
  302   2H5*    C  29          2H5*        C  29  -3.353 -23.482   6.684
  303    H4*    C  29           H4*        C  29  -4.956 -21.639   6.396
  304    H3*    C  29           H3*        C  29  -4.007 -22.929   3.819
  305    H2*    C  29           H2*        C  29  -5.725 -21.627   2.725
  306   2HO*    C  29          2HO*        C  29  -7.368 -21.799   4.312
  307    H1*    C  29           H1*        C  29  -5.091 -19.319   4.042
  308   1H4     C  29          1H4         C  29  -1.813 -19.463  -1.402
  309   2H4     C  29          2H4         C  29  -0.463 -20.249  -0.599
  310    H5     C  29           H5         C  29  -0.570 -20.983   1.741
  311    H6     C  29           H6         C  29  -1.984 -21.110   3.698
  312    H3T    C  29           H3T        C  29  -6.356 -23.207   5.430
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -6.852 -15.368  -9.853
    2   2H5*    G   1          2H5*        G   1  -6.975 -13.677  -9.323
    3    H4*    G   1           H4*        G   1  -8.644 -14.980  -8.151
    4    H3*    G   1           H3*        G   1  -6.304 -14.202  -6.386
    5    H2*    G   1           H2*        G   1  -7.658 -15.047  -4.552
    6   2HO*    G   1          2HO*        G   1  -9.776 -15.802  -4.965
    7    H1*    G   1           H1*        G   1  -8.216 -17.377  -5.813
    8    H8     G   1           H8         G   1  -4.837 -16.574  -7.163
    9    H1     G   1           H1         G   1  -4.676 -18.457  -1.030
   10   1H2     G   1          1H2         G   1  -6.727 -18.440  -0.185
   11   2H2     G   1          2H2         G   1  -8.122 -18.004  -1.153
   12    H5T    G   1           H5T        G   1  -4.806 -14.422  -9.388
   13   1H5*    G   2          1H5*        G   2  -9.802 -13.076  -4.461
   14   2H5*    G   2          2H5*        G   2  -9.712 -11.438  -3.787
   15    H4*    G   2           H4*        G   2 -10.387 -13.050  -2.060
   16    H3*    G   2           H3*        G   2  -7.615 -11.864  -1.748
   17    H2*    G   2           H2*        G   2  -7.624 -12.925   0.473
   18   2HO*    G   2          2HO*        G   2  -9.908 -12.561   0.870
   19    H1*    G   2           H1*        G   2  -8.451 -15.307  -0.488
   20    H8     G   2           H8         G   2  -6.415 -14.012  -3.349
   21    H1     G   2           H1         G   2  -2.849 -16.036   1.588
   22   1H2     G   2          1H2         G   2  -4.124 -16.302   3.384
   23   2H2     G   2          2H2         G   2  -5.850 -16.002   3.342
   24   1H5*    C   3          1H5*        C   3  -9.671 -11.146   1.769
   25   2H5*    C   3          2H5*        C   3  -9.359  -9.542   2.460
   26    H4*    C   3           H4*        C   3  -8.770 -11.367   4.040
   27    H3*    C   3           H3*        C   3  -6.446  -9.735   2.968
   28    H2*    C   3           H2*        C   3  -5.121 -10.908   4.664
   29   2HO*    C   3          2HO*        C   3  -6.807 -10.952   6.287
   30    H1*    C   3           H1*        C   3  -6.149 -13.356   3.981
   31   1H4     C   3          1H4         C   3  -0.989 -12.574   0.361
   32   2H4     C   3          2H4         C   3  -1.987 -11.934  -0.931
   33    H5     C   3           H5         C   3  -4.374 -11.476  -0.651
   34    H6     C   3           H6         C   3  -6.227 -11.567   0.899
   35   1H5*    C   4          1H5*        C   4  -6.329  -9.408   7.110
   36   2H5*    C   4          2H5*        C   4  -5.857  -7.785   7.660
   37    H4*    C   4           H4*        C   4  -4.270  -9.505   8.471
   38    H3*    C   4           H3*        C   4  -3.157  -7.640   6.348
   39    H2*    C   4           H2*        C   4  -1.007  -8.647   6.954
   40   2HO*    C   4          2HO*        C   4  -1.456  -8.870   9.231
   41    H1*    C   4           H1*        C   4  -1.996 -11.178   6.824
   42   1H4     C   4          1H4         C   4   0.267  -9.858   1.059
   43   2H4     C   4          2H4         C   4  -1.254  -9.123   0.585
   44    H5     C   4           H5         C   4  -3.119  -8.825   2.150
   45    H6     C   4           H6         C   4  -3.838  -9.152   4.439
   46   1H5*    A   5          1H5*        A   5  -0.705  -7.450   9.877
   47   2H5*    A   5          2H5*        A   5   0.050  -5.856  10.069
   48    H4*    A   5           H4*        A   5   1.710  -7.736   9.919
   49    H3*    A   5           H3*        A   5   1.746  -5.665   7.706
   50    H2*    A   5           H2*        A   5   3.785  -6.790   6.958
   51   2HO*    A   5          2HO*        A   5   4.497  -7.300   9.181
   52    H1*    A   5           H1*        A   5   2.673  -9.258   7.077
   53    H8     A   5           H8         A   5  -0.215  -7.091   6.050
   54   1H6     A   5          1H6         A   5   2.327  -7.243   0.362
   55   2H6     A   5          2H6         A   5   0.881  -6.805   1.257
   56    H2     A   5           H2         A   5   5.305  -8.746   3.258
   57   1H5*    U   6          1H5*        U   6   5.653  -6.166   8.368
   58   2H5*    U   6          2H5*        U   6   6.440  -4.611   8.699
   59    H4*    U   6           H4*        U   6   7.558  -5.740   6.831
   60    H3*    U   6           H3*        U   6   5.938  -3.287   6.102
   61    H2*    U   6           H2*        U   6   6.958  -3.458   3.922
   62   2HO*    U   6          2HO*        U   6   9.073  -4.034   4.571
   63    H1*    U   6           H1*        U   6   6.639  -6.178   3.746
   64    H3     U   6           H3         U   6   3.629  -4.437   0.800
   65    H5     U   6           H5         U   6   1.874  -3.837   4.570
   66    H6     U   6           H6         U   6   3.925  -4.606   5.584
   67   1H5*    C   7          1H5*        C   7  10.469  -3.178   5.278
   68   2H5*    C   7          2H5*        C   7  11.000  -1.506   5.535
   69    H4*    C   7           H4*        C   7  11.946  -2.334   3.452
   70    H3*    C   7           H3*        C   7   9.735  -0.286   3.070
   71    H2*    C   7           H2*        C   7  10.369  -0.287   0.748
   72   2HO*    C   7          2HO*        C   7  12.641  -0.430   1.040
   73    H1*    C   7           H1*        C   7  10.531  -3.008   0.564
   74   1H4     C   7          1H4         C   7   4.488  -1.907  -1.000
   75   2H4     C   7          2H4         C   7   4.041  -1.738   0.682
   76    H5     C   7           H5         C   7   5.678  -1.744   2.497
   77    H6     C   7           H6         C   7   8.036  -1.937   3.011
   78   1H5*    U   8          1H5*        U   8  12.291   3.556   0.563
   79   2H5*    U   8          2H5*        U   8  10.744   2.696   0.435
   80    H4*    U   8           H4*        U   8  13.295   2.040  -1.112
   81    H3*    U   8           H3*        U   8  10.678   3.398  -1.781
   82    H2*    U   8           H2*        U   8  10.782   2.401  -3.993
   83   2HO*    U   8          2HO*        U   8  13.115   2.627  -4.200
   84    H1*    U   8           H1*        U   8  11.375  -0.081  -3.110
   85    H3     U   8           H3         U   8   6.923   0.022  -4.186
   86    H5     U   8           H5         U   8   7.130   1.167  -0.149
   87    H6     U   8           H6         U   8   9.530   1.288  -0.356
   88   1H5*    U   9          1H5*        U   9  12.635   4.229  -5.217
   89   2H5*    U   9          2H5*        U   9  12.508   5.937  -5.651
   90    H4*    U   9           H4*        U   9  11.544   4.590  -7.434
   91    H3*    U   9           H3*        U   9   9.351   5.930  -5.802
   92    H2*    U   9           H2*        U   9   7.847   5.034  -7.486
   93   2HO*    U   9          2HO*        U   9   9.313   5.297  -9.288
   94    H1*    U   9           H1*        U   9   8.853   2.538  -7.313
   95    H3     U   9           H3         U   9   4.907   2.925  -4.968
   96    H5     U   9           H5         U   9   7.924   3.990  -2.253
   97    H6     U   9           H6         U   9   9.504   3.928  -4.075
   98   1H5*    G  10          1H5*        G  10   8.410  10.134  -6.531
   99   2H5*    G  10          2H5*        G  10   7.619   9.253  -5.212
  100    H4*    G  10           H4*        G  10   7.912   8.257  -8.088
  101    H3*    G  10           H3*        G  10   5.556   9.297  -6.474
  102    H2*    G  10           H2*        G  10   4.211   8.039  -8.053
  103   2HO*    G  10          2HO*        G  10   5.210   7.044  -9.851
  104    H1*    G  10           H1*        G  10   5.919   5.867  -7.950
  105    H8     G  10           H8         G  10   3.150   5.601  -7.540
  106    H1     G  10           H1         G  10   4.366   6.443  -1.298
  107   1H2     G  10          1H2         G  10   6.379   7.369  -1.031
  108   2H2     G  10          2H2         G  10   7.398   7.754  -2.403
  109   1H5*    C  11          1H5*        C  11   3.986   9.456 -10.093
  110   2H5*    C  11          2H5*        C  11   3.261  11.048 -10.397
  111    H4*    C  11           H4*        C  11   1.556   9.349 -10.711
  112    H3*    C  11           H3*        C  11   1.240  10.938  -8.148
  113    H2*    C  11           H2*        C  11  -0.937   9.852  -7.978
  114   2HO*    C  11          2HO*        C  11  -1.359   9.879 -10.290
  115    H1*    C  11           H1*        C  11   0.048   7.384  -8.498
  116   1H4     C  11          1H4         C  11   0.374   8.165  -2.199
  117   2H4     C  11          2H4         C  11   2.013   8.770  -2.341
  118    H5     C  11           H5         C  11   3.095   9.154  -4.506
  119    H6     C  11           H6         C  11   2.790   9.045  -6.902
  120   1H5*    U  12          1H5*        U  12  -2.450  11.246 -10.288
  121   2H5*    U  12          2H5*        U  12  -3.070  12.906 -10.216
  122    H4*    U  12           H4*        U  12  -4.774  11.321  -9.449
  123    H3*    U  12           H3*        U  12  -3.601  13.060  -7.250
  124    H2*    U  12           H2*        U  12  -5.426  12.193  -5.896
  125   2HO*    U  12          2HO*        U  12  -6.979  12.143  -7.675
  126    H1*    U  12           H1*        U  12  -4.976   9.617  -6.630
  127    H3     U  12           H3         U  12  -3.327  10.198  -2.404
  128    H5     U  12           H5         U  12  -0.220  11.389  -4.967
  129    H6     U  12           H6         U  12  -1.762  11.227  -6.819
  130   1H5*    C  13          1H5*        C  13  -7.722  13.596  -6.976
  131   2H5*    C  13          2H5*        C  13  -8.097  15.321  -6.773
  132    H4*    C  13           H4*        C  13  -9.056  14.017  -4.914
  133    H3*    C  13           H3*        C  13  -6.684  15.767  -4.190
  134    H2*    C  13           H2*        C  13  -7.216  15.236  -1.896
  135   2HO*    C  13          2HO*        C  13  -9.562  15.327  -2.253
  136    H1*    C  13           H1*        C  13  -7.650  12.561  -2.404
  137   1H4     C  13          1H4         C  13  -1.727  13.382  -0.284
  138   2H4     C  13          2H4         C  13  -1.131  13.637  -1.916
  139    H5     C  13           H5         C  13  -2.639  13.761  -3.856
  140    H6     C  13           H6         C  13  -4.954  13.662  -4.557
  141   1H5*    U  14          1H5*        U  14  -8.844  16.830  -1.209
  142   2H5*    U  14          2H5*        U  14  -8.946  18.598  -1.070
  143    H4*    U  14           H4*        U  14  -7.905  17.694   0.947
  144    H3*    U  14           H3*        U  14  -5.948  19.104  -0.888
  145    H2*    U  14           H2*        U  14  -4.418  18.937   0.993
  146   2HO*    U  14          2HO*        U  14  -5.223  17.912   2.944
  147    H1*    U  14           H1*        U  14  -4.990  16.300   1.429
  148    H3     U  14           H3         U  14  -0.875  16.586  -0.579
  149    H5     U  14           H5         U  14  -3.633  16.940  -3.727
  150    H6     U  14           H6         U  14  -5.410  17.024  -2.083
  151   1H5*    U  15          1H5*        U  15  -6.728  23.426   2.729
  152   2H5*    U  15          2H5*        U  15  -4.968  23.221   2.682
  153    H4*    U  15           H4*        U  15  -5.663  23.554   4.964
  154    H3*    U  15           H3*        U  15  -4.051  21.449   4.286
  155    H2*    U  15           H2*        U  15  -5.821  19.890   4.057
  156   2HO*    U  15          2HO*        U  15  -5.745  18.547   5.920
  157    H1*    U  15           H1*        U  15  -7.007  20.957   6.624
  158    H3     U  15           H3         U  15 -10.852  18.630   6.455
  159    H5     U  15           H5         U  15  -9.437  18.384   2.504
  160    H6     U  15           H6         U  15  -7.606  19.831   3.130
  161   1H5*    C  16          1H5*        C  16  -2.740  19.980   6.997
  162   2H5*    C  16          2H5*        C  16  -1.615  20.861   8.043
  163    H4*    C  16           H4*        C  16  -0.602  18.807   7.340
  164    H3*    C  16           H3*        C  16   0.765  21.164   7.101
  165    H2*    C  16           H2*        C  16   0.030  21.538   4.830
  166   2HO*    C  16          2HO*        C  16   1.892  21.143   3.538
  167    H1*    C  16           H1*        C  16   0.749  18.647   4.269
  168   1H4     C  16          1H4         C  16  -2.023  20.029  -1.302
  169   2H4     C  16          2H4         C  16  -3.318  20.898  -0.490
  170    H5     C  16           H5         C  16  -3.361  21.280   1.907
  171    H6     C  16           H6         C  16  -2.221  20.814   4.004
  172   1H5*    G  17          1H5*        G  17   2.390  15.483   7.617
  173   2H5*    G  17          2H5*        G  17   1.369  16.610   6.716
  174    H4*    G  17           H4*        G  17   0.967  16.248   9.704
  175    H3*    G  17           H3*        G  17  -0.070  14.431   7.498
  176    H2*    G  17           H2*        G  17  -1.954  14.100   8.973
  177   2HO*    G  17          2HO*        G  17  -0.605  13.998  10.922
  178    H1*    G  17           H1*        G  17  -2.034  16.765   9.765
  179    H8     G  17           H8         G  17  -4.464  16.119   9.164
  180    H1     G  17           H1         G  17  -3.114  16.172   2.906
  181   1H2     G  17          1H2         G  17  -0.986  16.253   2.578
  182   2H2     G  17          2H2         G  17   0.184  16.256   3.891
  183   1H5*    G  18          1H5*        G  18  -1.563  12.344  10.248
  184   2H5*    G  18          2H5*        G  18  -1.360  10.603   9.978
  185    H4*    G  18           H4*        G  18  -3.736  11.265   9.822
  186    H3*    G  18           H3*        G  18  -2.449  10.364   7.238
  187    H2*    G  18           H2*        G  18  -4.704  10.450   6.289
  188   2HO*    G  18          2HO*        G  18  -5.797   9.771   8.269
  189    H1*    G  18           H1*        G  18  -5.147  12.970   7.165
  190    H8     G  18           H8         G  18  -1.443  12.989   6.764
  191    H1     G  18           H1         G  18  -4.466  12.958   1.113
  192   1H2     G  18          1H2         G  18  -6.621  12.582   1.409
  193   2H2     G  18          2H2         G  18  -7.311  12.313   2.999
  194   1H5*    A  19          1H5*        A  19  -5.982   8.141   7.649
  195   2H5*    A  19          2H5*        A  19  -5.729   6.427   7.273
  196    H4*    A  19           H4*        A  19  -7.561   7.361   5.923
  197    H3*    A  19           H3*        A  19  -5.043   6.670   4.381
  198    H2*    A  19           H2*        A  19  -6.419   7.023   2.398
  199   2HO*    A  19          2HO*        A  19  -8.412   6.203   3.303
  200    H1*    A  19           H1*        A  19  -7.283   9.424   3.237
  201    H8     A  19           H8         A  19  -3.917   9.264   4.852
  202   1H6     A  19          1H6         A  19  -1.485  10.423  -0.737
  203   2H6     A  19          2H6         A  19  -1.140  10.286   0.976
  204    H2     A  19           H2         A  19  -5.810   9.561  -1.265
  205   1H5*    G  20          1H5*        G  20  -8.422   4.573   2.795
  206   2H5*    G  20          2H5*        G  20  -7.964   3.044   2.001
  207    H4*    G  20           H4*        G  20  -9.132   4.799   0.541
  208    H3*    G  20           H3*        G  20  -6.529   3.448  -0.141
  209    H2*    G  20           H2*        G  20  -6.561   4.613  -2.259
  210   2HO*    G  20          2HO*        G  20  -8.867   4.364  -2.581
  211    H1*    G  20           H1*        G  20  -7.269   7.047  -1.227
  212    H8     G  20           H8         G  20  -5.068   5.898   1.489
  213    H1     G  20           H1         G  20  -1.750   7.266  -3.825
  214   1H2     G  20          1H2         G  20  -3.094   7.289  -5.578
  215   2H2     G  20          2H2         G  20  -4.822   7.031  -5.425
  216   1H5*    G  21          1H5*        G  21  -8.587   2.365  -3.435
  217   2H5*    G  21          2H5*        G  21  -8.365   0.640  -3.819
  218    H4*    G  21           H4*        G  21  -7.332   2.002  -5.579
  219    H3*    G  21           H3*        G  21  -5.340   0.709  -3.688
  220    H2*    G  21           H2*        G  21  -3.648   1.464  -5.226
  221   2HO*    G  21          2HO*        G  21  -4.757   1.147  -7.215
  222    H1*    G  21           H1*        G  21  -4.639   3.983  -5.363
  223    H8     G  21           H8         G  21  -5.227   2.515  -1.909
  224    H1     G  21           H1         G  21   0.778   4.531  -2.947
  225   1H2     G  21          1H2         G  21   1.028   5.022  -5.121
  226   2H2     G  21          2H2         G  21  -0.303   4.862  -6.246
  227   1H5*    A  22          1H5*        A  22  -4.775  -0.332  -7.952
  228   2H5*    A  22          2H5*        A  22  -4.146  -1.984  -8.094
  229    H4*    A  22           H4*        A  22  -2.831  -0.352  -9.424
  230    H3*    A  22           H3*        A  22  -1.347  -1.633  -7.099
  231    H2*    A  22           H2*        A  22   0.619  -0.646  -8.130
  232   2HO*    A  22          2HO*        A  22  -0.165  -0.978 -10.351
  233    H1*    A  22           H1*        A  22  -0.557   1.780  -8.410
  234    H8     A  22           H8         A  22  -1.999   0.410  -5.206
  235   1H6     A  22          1H6         A  22   3.367   2.153  -2.580
  236   2H6     A  22          2H6         A  22   1.742   1.581  -2.248
  237    H2     A  22           H2         A  22   3.803   2.478  -6.971
  238   1H5*    U  23          1H5*        U  23   1.140  -2.183 -10.167
  239   2H5*    U  23          2H5*        U  23   1.725  -3.855 -10.245
  240    H4*    U  23           H4*        U  23   3.622  -2.304 -10.058
  241    H3*    U  23           H3*        U  23   3.057  -3.962  -7.580
  242    H2*    U  23           H2*        U  23   5.216  -3.138  -6.791
  243   2HO*    U  23          2HO*        U  23   6.200  -3.175  -8.955
  244    H1*    U  23           H1*        U  23   4.661  -0.558  -7.477
  245    H3     U  23           H3         U  23   4.416  -1.007  -2.946
  246    H5     U  23           H5         U  23   0.603  -2.061  -4.366
  247    H6     U  23           H6         U  23   1.465  -1.932  -6.621
  248   1H5*    U  24          1H5*        U  24   7.053  -4.490  -8.415
  249   2H5*    U  24          2H5*        U  24   7.476  -6.212  -8.460
  250    H4*    U  24           H4*        U  24   8.974  -4.935  -6.948
  251    H3*    U  24           H3*        U  24   7.110  -6.930  -5.629
  252    H2*    U  24           H2*        U  24   8.467  -6.555  -3.646
  253   2HO*    U  24          2HO*        U  24  10.496  -6.406  -4.821
  254    H1*    U  24           H1*        U  24   8.493  -3.805  -3.996
  255    H3     U  24           H3         U  24   5.918  -5.096  -0.368
  256    H5     U  24           H5         U  24   3.324  -4.738  -3.656
  257    H6     U  24           H6         U  24   5.257  -4.620  -5.104
  258   1H5*    U  25          1H5*        U  25  10.842  -8.241  -4.297
  259   2H5*    U  25          2H5*        U  25  10.915 -10.013  -4.413
  260    H4*    U  25           H4*        U  25  11.296  -9.334  -2.095
  261    H3*    U  25           H3*        U  25   8.553 -10.556  -2.541
  262    H2*    U  25           H2*        U  25   8.440 -10.604  -0.102
  263   2HO*    U  25          2HO*        U  25  10.241  -9.935   1.120
  264    H1*    U  25           H1*        U  25   9.261  -8.013   0.110
  265    H3     U  25           H3         U  25   4.807  -7.911   0.889
  266    H5     U  25           H5         U  25   5.078  -8.356  -3.274
  267    H6     U  25           H6         U  25   7.470  -8.607  -3.034
  268   1H5*    G  26          1H5*        G  26  10.669 -12.624   0.520
  269   2H5*    G  26          2H5*        G  26  10.362 -14.368   0.495
  270    H4*    G  26           H4*        G  26   9.973 -13.423   2.733
  271    H3*    G  26           H3*        G  26   7.455 -14.367   1.317
  272    H2*    G  26           H2*        G  26   6.415 -14.084   3.508
  273   2HO*    G  26          2HO*        G  26   8.277 -14.767   4.757
  274    H1*    G  26           H1*        G  26   7.442 -11.595   3.836
  275    H8     G  26           H8         G  26   6.952 -11.905   0.126
  276    H1     G  26           H1         G  26   1.472 -10.999   3.338
  277   1H2     G  26          1H2         G  26   1.801 -11.347   5.503
  278   2H2     G  26          2H2         G  26   3.382 -11.754   6.143
  279   1H5*    G  27          1H5*        G  27   7.799 -16.421   5.020
  280   2H5*    G  27          2H5*        G  27   7.264 -18.109   4.892
  281    H4*    G  27           H4*        G  27   6.024 -16.908   6.664
  282    H3*    G  27           H3*        G  27   4.399 -17.703   4.251
  283    H2*    G  27           H2*        G  27   2.478 -17.019   5.638
  284   2HO*    G  27          2HO*        G  27   2.829 -16.358   7.777
  285    H1*    G  27           H1*        G  27   3.591 -14.648   6.304
  286    H8     G  27           H8         G  27   4.973 -15.270   2.871
  287    H1     G  27           H1         G  27  -1.197 -13.506   2.827
  288   1H2     G  27          1H2         G  27  -2.040 -13.640   4.871
  289   2H2     G  27          2H2         G  27  -1.061 -14.126   6.243
  290   1H5*    C  28          1H5*        C  28   2.660 -19.208   7.668
  291   2H5*    C  28          2H5*        C  28   2.012 -20.856   7.514
  292    H4*    C  28           H4*        C  28   0.245 -19.273   8.196
  293    H3*    C  28           H3*        C  28  -0.004 -20.362   5.375
  294    H2*    C  28           H2*        C  28  -2.193 -19.287   5.360
  295   2HO*    C  28          2HO*        C  28  -2.671 -19.723   7.614
  296    H1*    C  28           H1*        C  28  -1.236 -16.936   6.324
  297   1H4     C  28          1H4         C  28  -0.758 -16.521   0.008
  298   2H4     C  28          2H4         C  28   0.899 -17.085   0.086
  299    H5     C  28           H5         C  28   1.926 -17.885   2.158
  300    H6     C  28           H6         C  28   1.563 -18.259   4.514
  301   1H5*    C  29          1H5*        C  29  -3.647 -21.200   7.252
  302   2H5*    C  29          2H5*        C  29  -4.271 -22.813   6.848
  303    H4*    C  29           H4*        C  29  -5.907 -21.077   6.253
  304    H3*    C  29           H3*        C  29  -4.575 -22.423   3.877
  305    H2*    C  29           H2*        C  29  -6.223 -21.274   2.535
  306   2HO*    C  29          2HO*        C  29  -7.974 -21.521   4.074
  307    H1*    C  29           H1*        C  29  -5.855 -18.877   3.799
  308   1H4     C  29          1H4         C  29  -1.970 -19.131  -1.229
  309   2H4     C  29          2H4         C  29  -0.695 -19.822  -0.244
  310    H5     C  29           H5         C  29  -1.035 -20.440   2.105
  311    H6     C  29           H6         C  29  -2.651 -20.527   3.902
  312    H3T    C  29           H3T        C  29  -5.815 -23.791   5.239
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -7.190 -14.766  -9.505
    2   2H5*    G   1          2H5*        G   1  -7.215 -13.112  -8.866
    3    H4*    G   1           H4*        G   1  -8.880 -14.419  -7.694
    4    H3*    G   1           H3*        G   1  -6.430 -13.841  -6.005
    5    H2*    G   1           H2*        G   1  -7.728 -14.744  -4.156
    6   2HO*    G   1          2HO*        G   1  -9.890 -15.391  -4.507
    7    H1*    G   1           H1*        G   1  -8.432 -16.972  -5.519
    8    H8     G   1           H8         G   1  -5.100 -16.216  -7.003
    9    H1     G   1           H1         G   1  -4.695 -18.444  -1.001
   10   1H2     G   1          1H2         G   1  -6.698 -18.397  -0.043
   11   2H2     G   1          2H2         G   1  -8.123 -17.854  -0.909
   12    H5T    G   1           H5T        G   1  -5.083 -13.928  -9.074
   13   1H5*    G   2          1H5*        G   2  -9.773 -12.704  -3.856
   14   2H5*    G   2          2H5*        G   2  -9.595 -11.110  -3.092
   15    H4*    G   2           H4*        G   2 -10.253 -12.803  -1.432
   16    H3*    G   2           H3*        G   2  -7.435 -11.722  -1.176
   17    H2*    G   2           H2*        G   2  -7.377 -12.916   0.974
   18   2HO*    G   2          2HO*        G   2  -9.634 -12.503   1.493
   19    H1*    G   2           H1*        G   2  -8.328 -15.210  -0.080
   20    H8     G   2           H8         G   2  -6.389 -13.821  -2.961
   21    H1     G   2           H1         G   2  -2.657 -16.236   1.669
   22   1H2     G   2          1H2         G   2  -3.852 -16.560   3.513
   23   2H2     G   2          2H2         G   2  -5.566 -16.194   3.577
   24   1H5*    C   3          1H5*        C   3  -9.313 -11.167   2.472
   25   2H5*    C   3          2H5*        C   3  -8.928  -9.613   3.240
   26    H4*    C   3           H4*        C   3  -8.314 -11.540   4.682
   27    H3*    C   3           H3*        C   3  -6.005  -9.905   3.587
   28    H2*    C   3           H2*        C   3  -4.621 -11.209   5.132
   29   2HO*    C   3          2HO*        C   3  -6.225 -11.303   6.838
   30    H1*    C   3           H1*        C   3  -5.751 -13.588   4.370
   31   1H4     C   3          1H4         C   3  -0.786 -12.732   0.509
   32   2H4     C   3          2H4         C   3  -1.834 -11.990  -0.684
   33    H5     C   3           H5         C   3  -4.185 -11.482  -0.241
   34    H6     C   3           H6         C   3  -5.945 -11.613   1.410
   35   1H5*    C   4          1H5*        C   4  -5.638  -9.835   7.728
   36   2H5*    C   4          2H5*        C   4  -5.099  -8.256   8.341
   37    H4*    C   4           H4*        C   4  -3.503 -10.044   8.954
   38    H3*    C   4           H3*        C   4  -2.484  -8.088   6.865
   39    H2*    C   4           H2*        C   4  -0.323  -9.163   7.269
   40   2HO*    C   4          2HO*        C   4  -0.617  -9.499   9.556
   41    H1*    C   4           H1*        C   4  -1.374 -11.669   7.081
   42   1H4     C   4          1H4         C   4   0.548 -10.115   1.256
   43   2H4     C   4          2H4         C   4  -0.974  -9.308   0.920
   44    H5     C   4           H5         C   4  -2.725  -9.039   2.619
   45    H6     C   4           H6         C   4  -3.308  -9.471   4.928
   46   1H5*    A   5          1H5*        A   5   0.227  -8.109  10.203
   47   2H5*    A   5          2H5*        A   5   1.017  -6.532  10.402
   48    H4*    A   5           H4*        A   5   2.633  -8.415  10.039
   49    H3*    A   5           H3*        A   5   2.519  -6.262   7.906
   50    H2*    A   5           H2*        A   5   4.476  -7.384   6.958
   51   2HO*    A   5          2HO*        A   5   5.364  -7.978   9.088
   52    H1*    A   5           H1*        A   5   3.338  -9.842   7.080
   53    H8     A   5           H8         A   5   0.427  -7.579   6.369
   54   1H6     A   5          1H6         A   5   2.504  -7.543   0.496
   55   2H6     A   5          2H6         A   5   1.146  -7.117   1.522
   56    H2     A   5           H2         A   5   5.665  -9.239   3.078
   57   1H5*    U   6          1H5*        U   6   6.439  -6.789   8.212
   58   2H5*    U   6          2H5*        U   6   7.270  -5.253   8.520
   59    H4*    U   6           H4*        U   6   8.195  -6.331   6.515
   60    H3*    U   6           H3*        U   6   6.560  -3.830   6.022
   61    H2*    U   6           H2*        U   6   7.370  -3.949   3.747
   62   2HO*    U   6          2HO*        U   6   9.516  -4.607   4.180
   63    H1*    U   6           H1*        U   6   6.967  -6.640   3.511
   64    H3     U   6           H3         U   6   3.749  -4.708   0.941
   65    H5     U   6           H5         U   6   2.325  -4.319   4.876
   66    H6     U   6           H6         U   6   4.449  -5.144   5.667
   67   1H5*    C   7          1H5*        C   7  10.849  -3.759   4.547
   68   2H5*    C   7          2H5*        C   7  11.457  -2.105   4.746
   69    H4*    C   7           H4*        C   7  11.950  -2.901   2.485
   70    H3*    C   7           H3*        C   7   9.778  -0.783   2.615
   71    H2*    C   7           H2*        C   7  10.040  -0.683   0.205
   72   2HO*    C   7          2HO*        C   7  12.296  -0.967   0.050
   73    H1*    C   7           H1*        C   7  10.000  -3.389  -0.090
   74   1H4     C   7          1H4         C   7   3.852  -1.873  -0.538
   75   2H4     C   7          2H4         C   7   3.729  -1.743   1.201
   76    H5     C   7           H5         C   7   5.650  -1.919   2.695
   77    H6     C   7           H6         C   7   8.046  -2.268   2.780
   78   1H5*    U   8          1H5*        U   8  13.412   0.334   0.264
   79   2H5*    U   8          2H5*        U   8  13.620   2.098   0.268
   80    H4*    U   8           H4*        U   8  13.621   1.206  -2.040
   81    H3*    U   8           H3*        U   8  11.177   2.847  -1.301
   82    H2*    U   8           H2*        U   8  10.649   2.737  -3.667
   83   2HO*    U   8          2HO*        U   8  12.784   2.975  -4.472
   84    H1*    U   8           H1*        U   8  11.221   0.070  -3.864
   85    H3     U   8           H3         U   8   6.729   0.122  -4.179
   86    H5     U   8           H5         U   8   7.425   1.089  -0.150
   87    H6     U   8           H6         U   8   9.790   1.105  -0.612
   88   1H5*    U   9          1H5*        U   9  11.482   6.831  -4.765
   89   2H5*    U   9          2H5*        U   9  10.165   5.938  -3.998
   90    H4*    U   9           H4*        U   9  11.470   5.331  -6.690
   91    H3*    U   9           H3*        U   9   8.782   6.329  -5.761
   92    H2*    U   9           H2*        U   9   7.628   5.004  -7.384
   93   2HO*    U   9          2HO*        U   9  10.229   4.336  -8.372
   94    H1*    U   9           H1*        U   9   8.880   2.709  -6.803
   95    H3     U   9           H3         U   9   4.796   3.181  -4.607
   96    H5     U   9           H5         U   9   7.788   4.271  -1.874
   97    H6     U   9           H6         U   9   9.381   4.212  -3.679
   98   1H5*    G  10          1H5*        G  10   7.886  10.358  -6.852
   99   2H5*    G  10          2H5*        G  10   7.148   9.578  -5.444
  100    H4*    G  10           H4*        G  10   7.513   8.304  -8.199
  101    H3*    G  10           H3*        G  10   5.091   9.353  -6.692
  102    H2*    G  10           H2*        G  10   3.829   7.837  -8.105
  103   2HO*    G  10          2HO*        G  10   5.152   8.250 -10.025
  104    H1*    G  10           H1*        G  10   5.689   5.815  -7.808
  105    H8     G  10           H8         G  10   2.934   5.414  -7.334
  106    H1     G  10           H1         G  10   4.200   6.847  -1.209
  107   1H2     G  10          1H2         G  10   6.154   7.920  -1.067
  108   2H2     G  10          2H2         G  10   7.120   8.251  -2.488
  109   1H5*    C  11          1H5*        C  11   3.394   9.116 -10.271
  110   2H5*    C  11          2H5*        C  11   2.637  10.671 -10.675
  111    H4*    C  11           H4*        C  11   0.928   8.954 -10.768
  112    H3*    C  11           H3*        C  11   0.745  10.717  -8.308
  113    H2*    C  11           H2*        C  11  -1.402   9.641  -7.927
  114   2HO*    C  11          2HO*        C  11  -2.215   8.166  -9.460
  115    H1*    C  11           H1*        C  11  -0.425   7.141  -8.326
  116   1H4     C  11          1H4         C  11   0.260   8.426  -2.137
  117   2H4     C  11          2H4         C  11   1.891   9.010  -2.420
  118    H5     C  11           H5         C  11   2.846   9.207  -4.669
  119    H6     C  11           H6         C  11   2.400   8.908  -7.029
  120   1H5*    U  12          1H5*        U  12  -3.013  10.757 -10.210
  121   2H5*    U  12          2H5*        U  12  -3.681  12.400 -10.296
  122    H4*    U  12           H4*        U  12  -5.317  10.895  -9.287
  123    H3*    U  12           H3*        U  12  -4.052  12.832  -7.315
  124    H2*    U  12           H2*        U  12  -5.791  12.088  -5.795
  125   2HO*    U  12          2HO*        U  12  -7.390  10.635  -6.527
  126    H1*    U  12           H1*        U  12  -5.362   9.453  -6.322
  127    H3     U  12           H3         U  12  -3.513  10.417  -2.251
  128    H5     U  12           H5         U  12  -0.553  11.402  -5.063
  129    H6     U  12           H6         U  12  -2.183  11.072  -6.812
  130   1H5*    C  13          1H5*        C  13  -8.125  13.284  -6.880
  131   2H5*    C  13          2H5*        C  13  -8.571  15.001  -6.801
  132    H4*    C  13           H4*        C  13  -9.387  13.827  -4.797
  133    H3*    C  13           H3*        C  13  -7.056  15.716  -4.333
  134    H2*    C  13           H2*        C  13  -7.451  15.348  -1.979
  135   2HO*    C  13          2HO*        C  13  -9.813  15.333  -2.221
  136    H1*    C  13           H1*        C  13  -7.819  12.627  -2.255
  137   1H4     C  13          1H4         C  13  -1.843  13.790  -0.470
  138   2H4     C  13          2H4         C  13  -1.327  13.954  -2.141
  139    H5     C  13           H5         C  13  -2.918  13.881  -4.016
  140    H6     C  13           H6         C  13  -5.257  13.654  -4.606
  141   1H5*    U  14          1H5*        U  14  -9.099  16.911  -1.319
  142   2H5*    U  14          2H5*        U  14  -9.300  18.676  -1.321
  143    H4*    U  14           H4*        U  14  -8.111  18.012   0.710
  144    H3*    U  14           H3*        U  14  -6.375  19.385  -1.363
  145    H2*    U  14           H2*        U  14  -4.669  19.437   0.335
  146   2HO*    U  14          2HO*        U  14  -6.048  19.949   2.098
  147    H1*    U  14           H1*        U  14  -5.109  16.855   1.165
  148    H3     U  14           H3         U  14  -1.113  16.992  -1.071
  149    H5     U  14           H5         U  14  -4.021  16.964  -4.102
  150    H6     U  14           H6         U  14  -5.725  17.175  -2.397
  151   1H5*    U  15          1H5*        U  15  -7.180  23.826   2.130
  152   2H5*    U  15          2H5*        U  15  -5.416  23.674   2.094
  153    H4*    U  15           H4*        U  15  -6.158  24.098   4.357
  154    H3*    U  15           H3*        U  15  -4.440  22.025   3.769
  155    H2*    U  15           H2*        U  15  -6.103  20.343   3.757
  156   2HO*    U  15          2HO*        U  15  -5.256  20.585   6.467
  157    H1*    U  15           H1*        U  15  -7.350  21.617   6.191
  158    H3     U  15           H3         U  15 -10.929  18.894   6.318
  159    H5     U  15           H5         U  15  -9.680  18.592   2.317
  160    H6     U  15           H6         U  15  -7.955  20.220   2.790
  161   1H5*    C  16          1H5*        C  16  -2.978  20.859   6.497
  162   2H5*    C  16          2H5*        C  16  -1.871  21.865   7.446
  163    H4*    C  16           H4*        C  16  -0.786  19.816   6.840
  164    H3*    C  16           H3*        C  16   0.469  22.212   6.427
  165    H2*    C  16           H2*        C  16  -0.344  22.415   4.154
  166   2HO*    C  16          2HO*        C  16   2.216  21.156   4.089
  167    H1*    C  16           H1*        C  16   0.494  19.528   3.744
  168   1H4     C  16          1H4         C  16  -2.427  20.532  -1.828
  169   2H4     C  16          2H4         C  16  -3.753  21.368  -1.034
  170    H5     C  16           H5         C  16  -3.784  21.840   1.349
  171    H6     C  16           H6         C  16  -2.585  21.528   3.440
  172   1H5*    G  17          1H5*        G  17   2.366  16.629   7.178
  173   2H5*    G  17          2H5*        G  17   1.281  17.658   6.236
  174    H4*    G  17           H4*        G  17   0.940  17.465   9.242
  175    H3*    G  17           H3*        G  17  -0.037  15.455   7.184
  176    H2*    G  17           H2*        G  17  -1.873  15.130   8.723
  177   2HO*    G  17          2HO*        G  17  -0.496  15.230  10.646
  178    H1*    G  17           H1*        G  17  -2.077  17.838   9.327
  179    H8     G  17           H8         G  17  -4.476  17.012   8.835
  180    H1     G  17           H1         G  17  -3.276  16.748   2.550
  181   1H2     G  17          1H2         G  17  -1.153  16.951   2.166
  182   2H2     G  17          2H2         G  17   0.034  17.108   3.451
  183   1H5*    G  18          1H5*        G  18  -1.337  13.470  10.117
  184   2H5*    G  18          2H5*        G  18  -1.038  11.729   9.956
  185    H4*    G  18           H4*        G  18  -3.454  12.241   9.835
  186    H3*    G  18           H3*        G  18  -2.192  11.244   7.271
  187    H2*    G  18           H2*        G  18  -4.476  11.144   6.394
  188   2HO*    G  18          2HO*        G  18  -5.478  10.536   8.434
  189    H1*    G  18           H1*        G  18  -5.037  13.685   7.120
  190    H8     G  18           H8         G  18  -1.352  13.885   6.593
  191    H1     G  18           H1         G  18  -4.552  13.359   1.065
  192   1H2     G  18          1H2         G  18  -6.675  12.902   1.463
  193   2H2     G  18          2H2         G  18  -7.294  12.681   3.089
  194   1H5*    A  19          1H5*        A  19  -5.580   8.843   8.030
  195   2H5*    A  19          2H5*        A  19  -5.265   7.127   7.705
  196    H4*    A  19           H4*        A  19  -7.222   7.940   6.438
  197    H3*    A  19           H3*        A  19  -4.784   7.248   4.774
  198    H2*    A  19           H2*        A  19  -6.286   7.460   2.872
  199   2HO*    A  19          2HO*        A  19  -8.487   7.929   3.220
  200    H1*    A  19           H1*        A  19  -7.163   9.886   3.647
  201    H8     A  19           H8         A  19  -3.701   9.877   5.053
  202   1H6     A  19          1H6         A  19  -1.640  10.787  -0.727
  203   2H6     A  19          2H6         A  19  -1.194  10.758   0.969
  204    H2     A  19           H2         A  19  -5.965   9.800  -0.944
  205   1H5*    G  20          1H5*        G  20  -8.193   5.121   3.502
  206   2H5*    G  20          2H5*        G  20  -7.829   3.529   2.788
  207    H4*    G  20           H4*        G  20  -9.071   5.175   1.290
  208    H3*    G  20           H3*        G  20  -6.501   3.810   0.519
  209    H2*    G  20           H2*        G  20  -6.675   4.857  -1.652
  210   2HO*    G  20          2HO*        G  20  -8.994   4.584  -1.821
  211    H1*    G  20           H1*        G  20  -7.322   7.339  -0.712
  212    H8     G  20           H8         G  20  -4.970   6.341   1.936
  213    H1     G  20           H1         G  20  -1.961   7.379  -3.627
  214   1H2     G  20          1H2         G  20  -3.399   7.294  -5.300
  215   2H2     G  20          2H2         G  20  -5.116   7.049  -5.038
  216   1H5*    G  21          1H5*        G  21  -8.697   2.559  -2.591
  217   2H5*    G  21          2H5*        G  21  -8.469   0.826  -2.923
  218    H4*    G  21           H4*        G  21  -7.543   2.149  -4.775
  219    H3*    G  21           H3*        G  21  -5.435   0.930  -2.961
  220    H2*    G  21           H2*        G  21  -3.845   1.659  -4.615
  221   2HO*    G  21          2HO*        G  21  -4.552   2.621  -6.559
  222    H1*    G  21           H1*        G  21  -4.860   4.170  -4.735
  223    H8     G  21           H8         G  21  -5.281   2.803  -1.227
  224    H1     G  21           H1         G  21   0.696   4.669  -2.622
  225   1H2     G  21          1H2         G  21   0.852   5.060  -4.823
  226   2H2     G  21          2H2         G  21  -0.531   4.880  -5.881
  227   1H5*    A  22          1H5*        A  22  -4.987  -0.024  -7.146
  228   2H5*    A  22          2H5*        A  22  -4.416  -1.684  -7.385
  229    H4*    A  22           H4*        A  22  -3.121  -0.041  -8.711
  230    H3*    A  22           H3*        A  22  -1.546  -1.427  -6.509
  231    H2*    A  22           H2*        A  22   0.379  -0.468  -7.634
  232   2HO*    A  22          2HO*        A  22  -0.535  -0.710  -9.813
  233    H1*    A  22           H1*        A  22  -0.743   1.998  -7.772
  234    H8     A  22           H8         A  22  -2.078   0.701  -4.522
  235   1H6     A  22          1H6         A  22   3.561   1.885  -2.174
  236   2H6     A  22          2H6         A  22   1.906   1.471  -1.764
  237    H2     A  22           H2         A  22   3.795   2.230  -6.581
  238   1H5*    U  23          1H5*        U  23   0.725  -1.975  -9.690
  239   2H5*    U  23          2H5*        U  23   1.223  -3.668  -9.881
  240    H4*    U  23           H4*        U  23   3.201  -2.213  -9.756
  241    H3*    U  23           H3*        U  23   2.720  -3.948  -7.314
  242    H2*    U  23           H2*        U  23   4.965  -3.271  -6.649
  243   2HO*    U  23          2HO*        U  23   6.209  -1.972  -8.055
  244    H1*    U  23           H1*        U  23   4.484  -0.632  -7.185
  245    H3     U  23           H3         U  23   4.601  -1.470  -2.676
  246    H5     U  23           H5         U  23   0.592  -1.977  -3.833
  247    H6     U  23           H6         U  23   1.289  -1.780  -6.143
  248   1H5*    U  24          1H5*        U  24   6.588  -4.583  -8.498
  249   2H5*    U  24          2H5*        U  24   6.951  -6.313  -8.669
  250    H4*    U  24           H4*        U  24   8.633  -5.182  -7.252
  251    H3*    U  24           H3*        U  24   6.799  -7.144  -5.847
  252    H2*    U  24           H2*        U  24   8.322  -6.905  -3.965
  253   2HO*    U  24          2HO*        U  24  10.256  -6.800  -5.298
  254    H1*    U  24           H1*        U  24   8.452  -4.155  -4.204
  255    H3     U  24           H3         U  24   6.072  -5.394  -0.449
  256    H5     U  24           H5         U  24   3.271  -4.919  -3.544
  257    H6     U  24           H6         U  24   5.105  -4.836  -5.120
  258   1H5*    U  25          1H5*        U  25  10.596  -8.601  -4.860
  259   2H5*    U  25          2H5*        U  25  10.606 -10.371  -5.018
  260    H4*    U  25           H4*        U  25  11.195  -9.741  -2.728
  261    H3*    U  25           H3*        U  25   8.409 -10.916  -2.978
  262    H2*    U  25           H2*        U  25   8.474 -10.996  -0.536
  263   2HO*    U  25          2HO*        U  25  10.738 -11.530  -0.358
  264    H1*    U  25           H1*        U  25   9.374  -8.436  -0.334
  265    H3     U  25           H3         U  25   5.003  -8.199   0.790
  266    H5     U  25           H5         U  25   4.925  -8.632  -3.384
  267    H6     U  25           H6         U  25   7.321  -8.951  -3.334
  268   1H5*    G  26          1H5*        G  26  10.767 -13.234  -0.143
  269   2H5*    G  26          2H5*        G  26  10.348 -14.953  -0.246
  270    H4*    G  26           H4*        G  26  10.202 -14.108   2.070
  271    H3*    G  26           H3*        G  26   7.546 -14.872   0.816
  272    H2*    G  26           H2*        G  26   6.685 -14.658   3.093
  273   2HO*    G  26          2HO*        G  26   8.601 -15.476   4.163
  274    H1*    G  26           H1*        G  26   7.831 -12.232   3.456
  275    H8     G  26           H8         G  26   7.067 -12.330  -0.218
  276    H1     G  26           H1         G  26   1.855 -11.430   3.413
  277   1H2     G  26          1H2         G  26   2.328 -11.881   5.533
  278   2H2     G  26          2H2         G  26   3.936 -12.364   6.041
  279   1H5*    G  27          1H5*        G  27   8.095 -17.133   4.381
  280   2H5*    G  27          2H5*        G  27   7.474 -18.788   4.227
  281    H4*    G  27           H4*        G  27   6.447 -17.606   6.145
  282    H3*    G  27           H3*        G  27   4.595 -18.268   3.861
  283    H2*    G  27           H2*        G  27   2.819 -17.553   5.416
  284   2HO*    G  27          2HO*        G  27   3.852 -18.400   7.342
  285    H1*    G  27           H1*        G  27   4.067 -15.251   6.062
  286    H8     G  27           H8         G  27   5.173 -15.776   2.521
  287    H1     G  27           H1         G  27  -0.917 -13.819   2.983
  288   1H2     G  27          1H2         G  27  -1.627 -14.027   5.073
  289   2H2     G  27          2H2         G  27  -0.575 -14.603   6.352
  290   1H5*    C  28          1H5*        C  28   3.003 -19.935   7.328
  291   2H5*    C  28          2H5*        C  28   2.283 -21.541   7.074
  292    H4*    C  28           H4*        C  28   0.614 -19.934   7.941
  293    H3*    C  28           H3*        C  28   0.207 -20.838   5.076
  294    H2*    C  28           H2*        C  28  -1.940 -19.685   5.228
  295   2HO*    C  28          2HO*        C  28  -2.329 -20.241   7.478
  296    H1*    C  28           H1*        C  28  -0.853 -17.434   6.277
  297   1H4     C  28          1H4         C  28  -0.673 -16.711  -0.026
  298   2H4     C  28          2H4         C  28   0.967 -17.331  -0.064
  299    H5     C  28           H5         C  28   2.075 -18.250   1.918
  300    H6     C  28           H6         C  28   1.816 -18.727   4.270
  301   1H5*    C  29          1H5*        C  29  -3.375 -21.665   7.074
  302   2H5*    C  29          2H5*        C  29  -4.080 -23.221   6.595
  303    H4*    C  29           H4*        C  29  -5.669 -21.385   6.199
  304    H3*    C  29           H3*        C  29  -4.517 -22.650   3.692
  305    H2*    C  29           H2*        C  29  -6.180 -21.361   2.497
  306   2HO*    C  29          2HO*        C  29  -7.874 -21.610   4.086
  307    H1*    C  29           H1*        C  29  -5.647 -19.052   3.862
  308   1H4     C  29          1H4         C  29  -2.030 -19.202  -1.367
  309   2H4     C  29          2H4         C  29  -0.734 -19.987  -0.482
  310    H5     C  29           H5         C  29  -0.981 -20.702   1.853
  311    H6     C  29           H6         C  29  -2.511 -20.822   3.721
  312    H3T    C  29           H3T        C  29  -6.526 -23.765   3.807
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -7.083 -14.091  -9.698
    2   2H5*    G   1          2H5*        G   1  -7.082 -12.480  -8.952
    3    H4*    G   1           H4*        G   1  -8.785 -13.835  -7.888
    4    H3*    G   1           H3*        G   1  -6.346 -13.394  -6.143
    5    H2*    G   1           H2*        G   1  -7.668 -14.410  -4.365
    6   2HO*    G   1          2HO*        G   1  -9.718 -13.485  -5.074
    7    H1*    G   1           H1*        G   1  -8.394 -16.527  -5.872
    8    H8     G   1           H8         G   1  -5.049 -15.772  -7.313
    9    H1     G   1           H1         G   1  -4.678 -18.298  -1.426
   10   1H2     G   1          1H2         G   1  -6.672 -18.241  -0.454
   11   2H2     G   1          2H2         G   1  -8.088 -17.626  -1.284
   12    H5T    G   1           H5T        G   1  -4.964 -13.333  -9.199
   13   1H5*    G   2          1H5*        G   2  -9.687 -12.270  -3.877
   14   2H5*    G   2          2H5*        G   2  -9.420 -10.729  -3.040
   15    H4*    G   2           H4*        G   2 -10.122 -12.488  -1.463
   16    H3*    G   2           H3*        G   2  -7.270 -11.505  -1.196
   17    H2*    G   2           H2*        G   2  -7.221 -12.809   0.893
   18   2HO*    G   2          2HO*        G   2  -9.452 -12.359   1.469
   19    H1*    G   2           H1*        G   2  -8.258 -15.016  -0.261
   20    H8     G   2           H8         G   2  -6.321 -13.564  -3.107
   21    H1     G   2           H1         G   2  -2.590 -16.287   1.350
   22   1H2     G   2          1H2         G   2  -3.762 -16.658   3.196
   23   2H2     G   2          2H2         G   2  -5.462 -16.242   3.307
   24   1H5*    C   3          1H5*        C   3  -9.120 -11.080   2.495
   25   2H5*    C   3          2H5*        C   3  -8.681  -9.583   3.343
   26    H4*    C   3           H4*        C   3  -8.132 -11.603   4.677
   27    H3*    C   3           H3*        C   3  -5.777  -9.973   3.678
   28    H2*    C   3           H2*        C   3  -4.423 -11.405   5.138
   29   2HO*    C   3          2HO*        C   3  -6.002 -11.558   6.850
   30    H1*    C   3           H1*        C   3  -5.621 -13.703   4.249
   31   1H4     C   3          1H4         C   3  -0.666 -12.812   0.387
   32   2H4     C   3          2H4         C   3  -1.698 -11.970  -0.753
   33    H5     C   3           H5         C   3  -4.026 -11.404  -0.257
   34    H6     C   3           H6         C   3  -5.775 -11.564   1.401
   35   1H5*    C   4          1H5*        C   4  -5.432 -10.134   7.827
   36   2H5*    C   4          2H5*        C   4  -4.862  -8.601   8.524
   37    H4*    C   4           H4*        C   4  -3.307 -10.444   9.062
   38    H3*    C   4           H3*        C   4  -2.238  -8.434   7.054
   39    H2*    C   4           H2*        C   4  -0.108  -9.570   7.410
   40   2HO*    C   4          2HO*        C   4   0.047 -11.218   8.963
   41    H1*    C   4           H1*        C   4  -1.223 -12.047   7.118
   42   1H4     C   4          1H4         C   4   0.717 -10.325   1.347
   43   2H4     C   4          2H4         C   4  -0.779  -9.457   1.057
   44    H5     C   4           H5         C   4  -2.503  -9.187   2.780
   45    H6     C   4           H6         C   4  -3.088  -9.689   5.073
   46   1H5*    A   5          1H5*        A   5   0.452  -8.749  10.340
   47   2H5*    A   5          2H5*        A   5   1.284  -7.216  10.681
   48    H4*    A   5           H4*        A   5   2.875  -9.078  10.201
   49    H3*    A   5           H3*        A   5   2.787  -6.829   8.171
   50    H2*    A   5           H2*        A   5   4.712  -7.922   7.152
   51   2HO*    A   5          2HO*        A   5   5.607  -9.784   8.152
   52    H1*    A   5           H1*        A   5   3.543 -10.378   7.174
   53    H8     A   5           H8         A   5   0.697  -7.990   6.592
   54   1H6     A   5          1H6         A   5   2.726  -7.774   0.707
   55   2H6     A   5          2H6         A   5   1.391  -7.349   1.764
   56    H2     A   5           H2         A   5   5.843  -9.697   3.186
   57   1H5*    U   6          1H5*        U   6   6.688  -7.407   8.427
   58   2H5*    U   6          2H5*        U   6   7.549  -5.898   8.787
   59    H4*    U   6           H4*        U   6   8.434  -6.898   6.728
   60    H3*    U   6           H3*        U   6   6.817  -4.365   6.342
   61    H2*    U   6           H2*        U   6   7.602  -4.415   4.050
   62   2HO*    U   6          2HO*        U   6   9.746  -5.135   4.464
   63    H1*    U   6           H1*        U   6   7.138  -7.081   3.724
   64    H3     U   6           H3         U   6   3.910  -4.976   1.315
   65    H5     U   6           H5         U   6   2.574  -4.735   5.292
   66    H6     U   6           H6         U   6   4.694  -5.642   6.001
   67   1H5*    C   7          1H5*        C   7  11.032  -4.223   4.721
   68   2H5*    C   7          2H5*        C   7  11.647  -2.579   4.971
   69    H4*    C   7           H4*        C   7  12.033  -3.278   2.656
   70    H3*    C   7           H3*        C   7   9.888  -1.154   2.973
   71    H2*    C   7           H2*        C   7  10.075  -0.944   0.551
   72   2HO*    C   7          2HO*        C   7  11.656  -2.088  -0.570
   73    H1*    C   7           H1*        C   7   9.961  -3.635   0.149
   74   1H4     C   7          1H4         C   7   3.840  -1.980   0.025
   75   2H4     C   7          2H4         C   7   3.779  -1.972   1.773
   76    H5     C   7           H5         C   7   5.753  -2.263   3.178
   77    H6     C   7           H6         C   7   8.141  -2.664   3.153
   78   1H5*    U   8          1H5*        U   8  13.269  -0.079   0.422
   79   2H5*    U   8          2H5*        U   8  13.591   1.666   0.451
   80    H4*    U   8           H4*        U   8  13.346   0.860  -1.866
   81    H3*    U   8           H3*        U   8  11.081   2.621  -0.876
   82    H2*    U   8           H2*        U   8  10.362   2.622  -3.207
   83   2HO*    U   8          2HO*        U   8  12.534   2.698  -4.094
   84    H1*    U   8           H1*        U   8  10.738  -0.055  -3.529
   85    H3     U   8           H3         U   8   6.257   0.220  -3.464
   86    H5     U   8           H5         U   8   7.330   0.904   0.540
   87    H6     U   8           H6         U   8   9.649   0.886  -0.132
   88   1H5*    U   9          1H5*        U   9  12.737   4.192  -4.596
   89   2H5*    U   9          2H5*        U   9  12.642   5.961  -4.593
   90    H4*    U   9           H4*        U   9  11.479   5.016  -6.551
   91    H3*    U   9           H3*        U   9   9.665   6.279  -4.475
   92    H2*    U   9           H2*        U   9   7.925   6.060  -6.154
   93   2HO*    U   9          2HO*        U   9   9.191   6.561  -8.003
   94    H1*    U   9           H1*        U   9   8.596   3.477  -6.757
   95    H3     U   9           H3         U   9   4.772   3.207  -4.309
   96    H5     U   9           H5         U   9   7.738   4.072  -1.466
   97    H6     U   9           H6         U   9   9.321   4.306  -3.274
   98   1H5*    G  10          1H5*        G  10   7.487  10.137  -7.438
   99   2H5*    G  10          2H5*        G  10   6.870   8.982  -6.242
  100    H4*    G  10           H4*        G  10   6.911   8.534  -9.264
  101    H3*    G  10           H3*        G  10   4.740   9.306  -7.294
  102    H2*    G  10           H2*        G  10   3.186   8.149  -8.747
  103   2HO*    G  10          2HO*        G  10   4.156   8.805 -10.753
  104    H1*    G  10           H1*        G  10   4.790   5.964  -9.037
  105    H8     G  10           H8         G  10   2.250   5.609  -8.001
  106    H1     G  10           H1         G  10   4.726   6.661  -2.178
  107   1H2     G  10          1H2         G  10   6.744   7.601  -2.367
  108   2H2     G  10          2H2         G  10   7.445   7.966  -3.929
  109   1H5*    C  11          1H5*        C  11   1.025  11.812  -9.350
  110   2H5*    C  11          2H5*        C  11   1.281  10.820  -7.908
  111    H4*    C  11           H4*        C  11   0.266   9.816 -10.607
  112    H3*    C  11           H3*        C  11  -0.999  10.846  -8.114
  113    H2*    C  11           H2*        C  11  -2.495   9.015  -7.847
  114   2HO*    C  11          2HO*        C  11  -2.989   8.868 -10.136
  115    H1*    C  11           H1*        C  11  -0.775   7.025  -8.333
  116   1H4     C  11          1H4         C  11   0.119   8.589  -2.173
  117   2H4     C  11          2H4         C  11   1.713   9.165  -2.621
  118    H5     C  11           H5         C  11   2.464   9.290  -4.940
  119    H6     C  11           H6         C  11   1.824   8.920  -7.238
  120   1H5*    U  12          1H5*        U  12  -4.575  10.280  -9.901
  121   2H5*    U  12          2H5*        U  12  -5.449  11.818 -10.044
  122    H4*    U  12           H4*        U  12  -6.798  10.292  -8.738
  123    H3*    U  12           H3*        U  12  -5.459  12.453  -7.076
  124    H2*    U  12           H2*        U  12  -6.835  11.654  -5.244
  125   2HO*    U  12          2HO*        U  12  -8.712  11.192  -6.579
  126    H1*    U  12           H1*        U  12  -6.257   9.043  -5.679
  127    H3     U  12           H3         U  12  -3.857  10.614  -2.082
  128    H5     U  12           H5         U  12  -1.399  11.171  -5.443
  129    H6     U  12           H6         U  12  -3.275  10.590  -6.847
  130   1H5*    C  13          1H5*        C  13  -9.532  12.738  -6.059
  131   2H5*    C  13          2H5*        C  13 -10.021  14.446  -6.082
  132    H4*    C  13           H4*        C  13 -10.497  13.465  -3.875
  133    H3*    C  13           H3*        C  13  -8.194  15.442  -3.961
  134    H2*    C  13           H2*        C  13  -8.190  15.304  -1.558
  135   2HO*    C  13          2HO*        C  13 -10.556  15.228  -1.398
  136    H1*    C  13           H1*        C  13  -8.509  12.564  -1.493
  137   1H4     C  13          1H4         C  13  -2.354  13.947  -0.827
  138   2H4     C  13          2H4         C  13  -2.124  13.963  -2.567
  139    H5     C  13           H5         C  13  -3.997  13.702  -4.141
  140    H6     C  13           H6         C  13  -6.393  13.394  -4.314
  141   1H5*    U  14          1H5*        U  14  -9.767  16.948  -0.850
  142   2H5*    U  14          2H5*        U  14  -9.936  18.713  -0.965
  143    H4*    U  14           H4*        U  14  -8.397  18.141   0.859
  144    H3*    U  14           H3*        U  14  -7.042  19.349  -1.568
  145    H2*    U  14           H2*        U  14  -5.078  19.482  -0.157
  146   2HO*    U  14          2HO*        U  14  -5.260  18.773   2.053
  147    H1*    U  14           H1*        U  14  -5.358  16.925   0.777
  148    H3     U  14           H3         U  14  -1.896  17.034  -2.235
  149    H5     U  14           H5         U  14  -5.367  16.812  -4.594
  150    H6     U  14           H6         U  14  -6.682  17.090  -2.578
  151   1H5*    U  15          1H5*        U  15  -7.066  24.101   1.584
  152   2H5*    U  15          2H5*        U  15  -5.352  23.849   1.216
  153    H4*    U  15           H4*        U  15  -5.612  24.498   3.538
  154    H3*    U  15           H3*        U  15  -4.097  22.333   2.828
  155    H2*    U  15           H2*        U  15  -5.826  20.751   3.141
  156   2HO*    U  15          2HO*        U  15  -4.046  20.122   4.477
  157    H1*    U  15           H1*        U  15  -6.539  22.134   5.732
  158    H3     U  15           H3         U  15 -10.258  19.753   6.604
  159    H5     U  15           H5         U  15  -9.602  19.007   2.517
  160    H6     U  15           H6         U  15  -7.745  20.554   2.595
  161   1H5*    C  16          1H5*        C  16  -2.036  21.205   5.178
  162   2H5*    C  16          2H5*        C  16  -0.855  22.305   5.908
  163    H4*    C  16           H4*        C  16   0.279  20.362   5.121
  164    H3*    C  16           H3*        C  16   1.164  22.867   4.478
  165    H2*    C  16           H2*        C  16  -0.181  22.976   2.448
  166   2HO*    C  16          2HO*        C  16   1.333  22.868   0.732
  167    H1*    C  16           H1*        C  16   0.954  20.240   1.791
  168   1H4     C  16          1H4         C  16  -3.220  20.575  -3.006
  169   2H4     C  16          2H4         C  16  -4.433  21.304  -1.961
  170    H5     C  16           H5         C  16  -4.012  21.884   0.354
  171    H6     C  16           H6         C  16  -2.373  21.813   2.142
  172   1H5*    G  17          1H5*        G  17   3.627  17.652   5.623
  173   2H5*    G  17          2H5*        G  17   2.294  16.919   4.712
  174    H4*    G  17           H4*        G  17   2.183  18.344   7.374
  175    H3*    G  17           H3*        G  17   0.916  15.883   6.099
  176    H2*    G  17           H2*        G  17  -0.696  16.002   7.869
  177   2HO*    G  17          2HO*        G  17   0.927  16.462   9.530
  178    H1*    G  17           H1*        G  17  -0.731  18.810   7.875
  179    H8     G  17           H8         G  17  -3.129  17.793   8.080
  180    H1     G  17           H1         G  17  -3.258  16.881   1.739
  181   1H2     G  17          1H2         G  17  -1.267  17.122   0.905
  182   2H2     G  17          2H2         G  17   0.146  17.437   1.900
  183   1H5*    G  18          1H5*        G  18   0.061  14.542   9.465
  184   2H5*    G  18          2H5*        G  18   0.388  12.802   9.570
  185    H4*    G  18           H4*        G  18  -2.021  13.212   9.677
  186    H3*    G  18           H3*        G  18  -1.093  11.948   7.085
  187    H2*    G  18           H2*        G  18  -3.458  11.691   6.557
  188   2HO*    G  18          2HO*        G  18  -3.919  12.751   9.177
  189    H1*    G  18           H1*        G  18  -4.035  14.277   7.103
  190    H8     G  18           H8         G  18  -0.461  14.351   5.967
  191    H1     G  18           H1         G  18  -4.599  13.549   1.138
  192   1H2     G  18          1H2         G  18  -6.624  13.165   1.936
  193   2H2     G  18          2H2         G  18  -6.944  13.080   3.658
  194   1H5*    A  19          1H5*        A  19  -4.284   9.699   8.481
  195   2H5*    A  19          2H5*        A  19  -4.025   7.951   8.317
  196    H4*    A  19           H4*        A  19  -6.110   8.635   7.210
  197    H3*    A  19           H3*        A  19  -3.891   7.785   5.324
  198    H2*    A  19           H2*        A  19  -5.635   7.817   3.618
  199   2HO*    A  19          2HO*        A  19  -7.375   7.086   5.003
  200    H1*    A  19           H1*        A  19  -6.451  10.292   4.284
  201    H8     A  19           H8         A  19  -2.806  10.371   5.163
  202   1H6     A  19          1H6         A  19  -1.679  10.937  -0.916
  203   2H6     A  19          2H6         A  19  -0.966  11.001   0.683
  204    H2     A  19           H2         A  19  -5.975   9.948  -0.393
  205   1H5*    G  20          1H5*        G  20  -7.392   5.379   4.646
  206   2H5*    G  20          2H5*        G  20  -6.964   3.785   3.965
  207    H4*    G  20           H4*        G  20  -8.482   5.276   2.540
  208    H3*    G  20           H3*        G  20  -5.933   3.990   1.589
  209    H2*    G  20           H2*        G  20  -6.400   4.847  -0.614
  210   2HO*    G  20          2HO*        G  20  -8.396   5.856  -1.066
  211    H1*    G  20           H1*        G  20  -7.085   7.366   0.215
  212    H8     G  20           H8         G  20  -4.400   6.631   2.637
  213    H1     G  20           H1         G  20  -2.088   7.454  -3.287
  214   1H2     G  20          1H2         G  20  -3.706   7.242  -4.775
  215   2H2     G  20          2H2         G  20  -5.370   6.955  -4.301
  216   1H5*    G  21          1H5*        G  21  -8.352   2.660  -1.249
  217   2H5*    G  21          2H5*        G  21  -8.167   0.917  -1.555
  218    H4*    G  21           H4*        G  21  -7.464   2.161  -3.547
  219    H3*    G  21           H3*        G  21  -5.176   0.994  -1.932
  220    H2*    G  21           H2*        G  21  -3.747   1.676  -3.742
  221   2HO*    G  21          2HO*        G  21  -5.163   1.220  -5.510
  222    H1*    G  21           H1*        G  21  -4.792   4.173  -3.888
  223    H8     G  21           H8         G  21  -4.818   2.980  -0.286
  224    H1     G  21           H1         G  21   0.942   4.853  -2.417
  225   1H2     G  21          1H2         G  21   0.850   5.148  -4.638
  226   2H2     G  21          2H2         G  21  -0.638   4.900  -5.522
  227   1H5*    A  22          1H5*        A  22  -5.177  -0.242  -6.151
  228   2H5*    A  22          2H5*        A  22  -4.566  -1.899  -6.306
  229    H4*    A  22           H4*        A  22  -3.440  -0.304  -7.851
  230    H3*    A  22           H3*        A  22  -1.675  -1.542  -5.711
  231    H2*    A  22           H2*        A  22   0.151  -0.588  -7.011
  232   2HO*    A  22          2HO*        A  22  -0.925  -0.954  -9.102
  233    H1*    A  22           H1*        A  22  -1.033   1.845  -7.174
  234    H8     A  22           H8         A  22  -2.096   0.565  -3.801
  235   1H6     A  22          1H6         A  22   3.582   2.198  -1.861
  236   2H6     A  22          2H6         A  22   1.992   1.678  -1.336
  237    H2     A  22           H2         A  22   3.511   2.432  -6.285
  238   1H5*    U  23          1H5*        U  23   0.425  -2.097  -8.992
  239   2H5*    U  23          2H5*        U  23   0.965  -3.778  -9.179
  240    H4*    U  23           H4*        U  23   2.890  -2.240  -9.201
  241    H3*    U  23           H3*        U  23   2.631  -4.010  -6.754
  242    H2*    U  23           H2*        U  23   4.884  -3.237  -6.206
  243   2HO*    U  23          2HO*        U  23   5.588  -3.151  -8.471
  244    H1*    U  23           H1*        U  23   4.274  -0.624  -6.650
  245    H3     U  23           H3         U  23   4.549  -1.580  -2.157
  246    H5     U  23           H5         U  23   0.510  -2.079  -3.209
  247    H6     U  23           H6         U  23   1.140  -1.842  -5.531
  248   1H5*    U  24          1H5*        U  24   6.487  -4.519  -8.162
  249   2H5*    U  24          2H5*        U  24   6.872  -6.241  -8.353
  250    H4*    U  24           H4*        U  24   8.585  -5.057  -6.997
  251    H3*    U  24           H3*        U  24   6.885  -7.126  -5.576
  252    H2*    U  24           H2*        U  24   8.435  -6.866  -3.727
  253   2HO*    U  24          2HO*        U  24  10.336  -6.659  -5.082
  254    H1*    U  24           H1*        U  24   8.451  -4.104  -3.900
  255    H3     U  24           H3         U  24   6.199  -5.599  -0.141
  256    H5     U  24           H5         U  24   3.323  -4.996  -3.142
  257    H6     U  24           H6         U  24   5.113  -4.811  -4.752
  258   1H5*    U  25          1H5*        U  25  10.711  -8.569  -4.733
  259   2H5*    U  25          2H5*        U  25  10.741 -10.323  -5.022
  260    H4*    U  25           H4*        U  25  11.339  -9.886  -2.694
  261    H3*    U  25           H3*        U  25   8.531 -10.998  -3.010
  262    H2*    U  25           H2*        U  25   8.602 -11.266  -0.591
  263   2HO*    U  25          2HO*        U  25  10.511 -10.770   0.544
  264    H1*    U  25           H1*        U  25   9.541  -8.738  -0.197
  265    H3     U  25           H3         U  25   5.170  -8.549   0.950
  266    H5     U  25           H5         U  25   5.093  -8.613  -3.245
  267    H6     U  25           H6         U  25   7.484  -8.957  -3.225
  268   1H5*    G  26          1H5*        G  26  10.830 -13.424  -0.330
  269   2H5*    G  26          2H5*        G  26  10.470 -15.148  -0.538
  270    H4*    G  26           H4*        G  26  10.278 -14.496   1.818
  271    H3*    G  26           H3*        G  26   7.620 -15.139   0.499
  272    H2*    G  26           H2*        G  26   6.756 -15.107   2.778
  273   2HO*    G  26          2HO*        G  26   8.189 -14.780   4.521
  274    H1*    G  26           H1*        G  26   7.923 -12.719   3.340
  275    H8     G  26           H8         G  26   7.148 -12.582  -0.339
  276    H1     G  26           H1         G  26   1.985 -11.762   3.383
  277   1H2     G  26          1H2         G  26   2.460 -12.343   5.468
  278   2H2     G  26          2H2         G  26   4.057 -12.896   5.934
  279   1H5*    G  27          1H5*        G  27   8.145 -17.545   3.890
  280   2H5*    G  27          2H5*        G  27   7.536 -19.201   3.683
  281    H4*    G  27           H4*        G  27   6.505 -18.114   5.648
  282    H3*    G  27           H3*        G  27   4.636 -18.637   3.339
  283    H2*    G  27           H2*        G  27   2.875 -17.983   4.944
  284   2HO*    G  27          2HO*        G  27   3.917 -18.945   6.809
  285    H1*    G  27           H1*        G  27   4.160 -15.731   5.695
  286    H8     G  27           H8         G  27   5.218 -16.131   2.112
  287    H1     G  27           H1         G  27  -0.807 -14.022   2.752
  288   1H2     G  27          1H2         G  27  -1.490 -14.297   4.838
  289   2H2     G  27          2H2         G  27  -0.441 -14.961   6.075
  290   1H5*    C  28          1H5*        C  28   3.032 -20.456   6.735
  291   2H5*    C  28          2H5*        C  28   2.276 -22.028   6.396
  292    H4*    C  28           H4*        C  28   0.645 -20.435   7.361
  293    H3*    C  28           H3*        C  28   0.203 -21.169   4.452
  294    H2*    C  28           H2*        C  28  -1.914 -19.990   4.682
  295   2HO*    C  28          2HO*        C  28  -2.533 -19.161   6.708
  296    H1*    C  28           H1*        C  28  -0.777 -17.817   5.854
  297   1H4     C  28          1H4         C  28  -0.654 -16.773  -0.412
  298   2H4     C  28          2H4         C  28   0.967 -17.436  -0.501
  299    H5     C  28           H5         C  28   2.074 -18.479   1.413
  300    H6     C  28           H6         C  28   1.839 -19.069   3.741
  301   1H5*    C  29          1H5*        C  29  -3.329 -21.890   6.458
  302   2H5*    C  29          2H5*        C  29  -4.144 -23.391   5.980
  303    H4*    C  29           H4*        C  29  -5.643 -21.468   5.672
  304    H3*    C  29           H3*        C  29  -4.629 -22.710   3.091
  305    H2*    C  29           H2*        C  29  -6.243 -21.299   1.983
  306   2HO*    C  29          2HO*        C  29  -7.900 -21.521   3.626
  307    H1*    C  29           H1*        C  29  -5.559 -19.067   3.406
  308   1H4     C  29          1H4         C  29  -2.055 -19.185  -1.894
  309   2H4     C  29          2H4         C  29  -0.788 -20.079  -1.074
  310    H5     C  29           H5         C  29  -1.033 -20.890   1.232
  311    H6     C  29           H6         C  29  -2.532 -21.006   3.124
  312    H3T    C  29           H3T        C  29  -5.896 -24.071   4.435
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -7.281 -15.137  -9.745
    2   2H5*    G   1          2H5*        G   1  -7.311 -13.480  -9.106
    3    H4*    G   1           H4*        G   1  -8.916 -14.820  -7.880
    4    H3*    G   1           H3*        G   1  -6.421 -14.196  -6.269
    5    H2*    G   1           H2*        G   1  -7.653 -15.116  -4.382
    6   2HO*    G   1          2HO*        G   1  -9.816 -15.796  -4.670
    7    H1*    G   1           H1*        G   1  -8.362 -17.356  -5.726
    8    H8     G   1           H8         G   1  -5.080 -16.546  -7.288
    9    H1     G   1           H1         G   1  -4.492 -18.770  -1.297
   10   1H2     G   1          1H2         G   1  -6.478 -18.768  -0.296
   11   2H2     G   1          2H2         G   1  -7.930 -18.259  -1.135
   12    H5T    G   1           H5T        G   1  -5.174 -14.270  -9.389
   13   1H5*    G   2          1H5*        G   2  -9.729 -13.109  -4.037
   14   2H5*    G   2          2H5*        G   2  -9.555 -11.526  -3.255
   15    H4*    G   2           H4*        G   2 -10.155 -13.261  -1.611
   16    H3*    G   2           H3*        G   2  -7.361 -12.116  -1.385
   17    H2*    G   2           H2*        G   2  -7.232 -13.348   0.741
   18   2HO*    G   2          2HO*        G   2  -9.490 -13.005   1.305
   19    H1*    G   2           H1*        G   2  -8.143 -15.647  -0.338
   20    H8     G   2           H8         G   2  -6.297 -14.169  -3.232
   21    H1     G   2           H1         G   2  -2.404 -16.509   1.303
   22   1H2     G   2          1H2         G   2  -3.553 -16.885   3.165
   23   2H2     G   2          2H2         G   2  -5.276 -16.581   3.262
   24   1H5*    C   3          1H5*        C   3  -9.173 -11.701   2.312
   25   2H5*    C   3          2H5*        C   3  -8.808 -10.161   3.116
   26    H4*    C   3           H4*        C   3  -8.128 -12.121   4.486
   27    H3*    C   3           H3*        C   3  -5.878 -10.386   3.420
   28    H2*    C   3           H2*        C   3  -4.442 -11.706   4.911
   29   2HO*    C   3          2HO*        C   3  -6.009 -11.913   6.629
   30    H1*    C   3           H1*        C   3  -5.506 -14.083   4.068
   31   1H4     C   3          1H4         C   3  -0.622 -12.908   0.177
   32   2H4     C   3          2H4         C   3  -1.716 -12.176  -0.981
   33    H5     C   3           H5         C   3  -4.081 -11.774  -0.489
   34    H6     C   3           H6         C   3  -5.811 -12.025   1.178
   35   1H5*    C   4          1H5*        C   4  -5.486 -10.470   7.563
   36   2H5*    C   4          2H5*        C   4  -4.986  -8.903   8.236
   37    H4*    C   4           H4*        C   4  -3.343 -10.674   8.779
   38    H3*    C   4           H3*        C   4  -2.384  -8.608   6.774
   39    H2*    C   4           H2*        C   4  -0.194  -9.629   7.134
   40   2HO*    C   4          2HO*        C   4   0.043 -11.271   8.679
   41    H1*    C   4           H1*        C   4  -1.172 -12.158   6.835
   42   1H4     C   4          1H4         C   4   0.699 -10.297   1.083
   43   2H4     C   4          2H4         C   4  -0.859  -9.550   0.775
   44    H5     C   4           H5         C   4  -2.616  -9.413   2.481
   45    H6     C   4           H6         C   4  -3.181  -9.953   4.768
   46   1H5*    A   5          1H5*        A   5   0.298  -8.823  10.048
   47   2H5*    A   5          2H5*        A   5   1.055  -7.262  10.421
   48    H4*    A   5           H4*        A   5   2.733  -9.037   9.913
   49    H3*    A   5           H3*        A   5   2.551  -6.745   7.934
   50    H2*    A   5           H2*        A   5   4.547  -7.723   6.921
   51   2HO*    A   5          2HO*        A   5   5.456  -8.435   9.003
   52    H1*    A   5           H1*        A   5   3.498 -10.221   6.861
   53    H8     A   5           H8         A   5   0.517  -7.997   6.305
   54   1H6     A   5          1H6         A   5   2.574  -7.561   0.439
   55   2H6     A   5          2H6         A   5   1.208  -7.232   1.491
   56    H2     A   5           H2         A   5   5.789  -9.316   2.914
   57   1H5*    U   6          1H5*        U   6   6.485  -7.152   8.182
   58   2H5*    U   6          2H5*        U   6   7.256  -5.613   8.608
   59    H4*    U   6           H4*        U   6   8.218  -6.478   6.527
   60    H3*    U   6           H3*        U   6   6.431  -4.051   6.202
   61    H2*    U   6           H2*        U   6   7.265  -3.959   3.935
   62   2HO*    U   6          2HO*        U   6   9.447  -4.510   4.342
   63    H1*    U   6           H1*        U   6   7.018  -6.656   3.517
   64    H3     U   6           H3         U   6   3.710  -4.730   1.050
   65    H5     U   6           H5         U   6   2.276  -4.618   4.998
   66    H6     U   6           H6         U   6   4.432  -5.400   5.745
   67   1H5*    C   7          1H5*        C   7  10.774  -3.622   4.890
   68   2H5*    C   7          2H5*        C   7  11.273  -1.964   5.281
   69    H4*    C   7           H4*        C   7  11.980  -2.503   3.016
   70    H3*    C   7           H3*        C   7   9.664  -0.538   3.149
   71    H2*    C   7           H2*        C   7  10.034  -0.218   0.795
   72   2HO*    C   7          2HO*        C   7  12.328  -0.281   0.816
   73    H1*    C   7           H1*        C   7  10.276  -2.892   0.256
   74   1H4     C   7          1H4         C   7   4.050  -1.883  -0.509
   75   2H4     C   7          2H4         C   7   3.795  -1.944   1.220
   76    H5     C   7           H5         C   7   5.625  -2.109   2.830
   77    H6     C   7           H6         C   7   8.025  -2.256   3.062
   78   1H5*    U   8          1H5*        U   8  11.910   3.721   0.979
   79   2H5*    U   8          2H5*        U   8  10.370   2.853   0.825
   80    H4*    U   8           H4*        U   8  12.819   2.497  -0.965
   81    H3*    U   8           H3*        U   8  10.160   3.899  -1.220
   82    H2*    U   8           H2*        U   8  10.050   3.231  -3.545
   83   2HO*    U   8          2HO*        U   8  12.374   3.532  -3.901
   84    H1*    U   8           H1*        U   8  10.766   0.667  -3.127
   85    H3     U   8           H3         U   8   6.245   0.734  -3.791
   86    H5     U   8           H5         U   8   6.787   1.158   0.355
   87    H6     U   8           H6         U   8   9.148   1.458  -0.032
   88   1H5*    U   9          1H5*        U   9  12.080   5.019  -4.758
   89   2H5*    U   9          2H5*        U   9  11.901   6.767  -5.013
   90    H4*    U   9           H4*        U   9  10.948   5.568  -6.918
   91    H3*    U   9           H3*        U   9   8.897   6.840  -5.081
   92    H2*    U   9           H2*        U   9   7.267   6.273  -6.777
   93   2HO*    U   9          2HO*        U   9   8.554   6.729  -8.623
   94    H1*    U   9           H1*        U   9   8.212   3.727  -7.112
   95    H3     U   9           H3         U   9   4.308   3.383  -4.778
   96    H5     U   9           H5         U   9   7.160   4.476  -1.898
   97    H6     U   9           H6         U   9   8.766   4.754  -3.676
   98   1H5*    G  10          1H5*        G  10   6.527  10.257  -8.346
   99   2H5*    G  10          2H5*        G  10   5.993   9.156  -7.060
  100    H4*    G  10           H4*        G  10   6.055   8.496 -10.042
  101    H3*    G  10           H3*        G  10   3.846   9.198  -8.088
  102    H2*    G  10           H2*        G  10   2.387   7.808  -9.445
  103   2HO*    G  10          2HO*        G  10   3.396   8.449 -11.493
  104    H1*    G  10           H1*        G  10   4.176   5.763  -9.602
  105    H8     G  10           H8         G  10   1.692   5.258  -8.501
  106    H1     G  10           H1         G  10   4.141   6.903  -2.803
  107   1H2     G  10          1H2         G  10   6.058   8.010  -3.087
  108   2H2     G  10          2H2         G  10   6.703   8.343  -4.681
  109   1H5*    C  11          1H5*        C  11   1.577   9.206 -11.232
  110   2H5*    C  11          2H5*        C  11   0.757  10.770 -11.409
  111    H4*    C  11           H4*        C  11  -0.925   9.020 -11.301
  112    H3*    C  11           H3*        C  11  -0.710  10.705  -8.791
  113    H2*    C  11           H2*        C  11  -2.748   9.589  -8.077
  114   2HO*    C  11          2HO*        C  11  -3.799   8.140  -9.479
  115    H1*    C  11           H1*        C  11  -1.828   7.112  -8.693
  116   1H4     C  11          1H4         C  11  -0.066   8.380  -2.705
  117   2H4     C  11          2H4         C  11   1.507   8.906  -3.272
  118    H5     C  11           H5         C  11   2.060   9.075  -5.653
  119    H6     C  11           H6         C  11   1.202   8.791  -7.897
  120   1H5*    U  12          1H5*        U  12  -4.722  10.725 -10.009
  121   2H5*    U  12          2H5*        U  12  -5.427  12.352  -9.953
  122    H4*    U  12           H4*        U  12  -6.826  10.788  -8.696
  123    H3*    U  12           H3*        U  12  -5.303  12.760  -6.958
  124    H2*    U  12           H2*        U  12  -6.729  11.953  -5.163
  125   2HO*    U  12          2HO*        U  12  -8.635  11.686  -6.520
  126    H1*    U  12           H1*        U  12  -6.308   9.339  -5.770
  127    H3     U  12           H3         U  12  -3.801  10.383  -2.088
  128    H5     U  12           H5         U  12  -1.398  11.378  -5.385
  129    H6     U  12           H6         U  12  -3.303  11.006  -6.817
  130   1H5*    C  13          1H5*        C  13  -9.277  13.172  -5.794
  131   2H5*    C  13          2H5*        C  13  -9.694  14.895  -5.672
  132    H4*    C  13           H4*        C  13 -10.127  13.751  -3.526
  133    H3*    C  13           H3*        C  13  -7.762  15.653  -3.546
  134    H2*    C  13           H2*        C  13  -7.705  15.345  -1.157
  135   2HO*    C  13          2HO*        C  13  -9.378  14.183  -0.108
  136    H1*    C  13           H1*        C  13  -8.137  12.615  -1.296
  137   1H4     C  13          1H4         C  13  -1.949  13.777  -0.553
  138   2H4     C  13          2H4         C  13  -1.714  13.880  -2.291
  139    H5     C  13           H5         C  13  -3.595  13.767  -3.878
  140    H6     C  13           H6         C  13  -6.000  13.545  -4.067
  141   1H5*    U  14          1H5*        U  14  -9.240  16.887  -0.246
  142   2H5*    U  14          2H5*        U  14  -9.471  18.648  -0.241
  143    H4*    U  14           H4*        U  14  -7.929  18.049   1.558
  144    H3*    U  14           H3*        U  14  -6.630  19.402  -0.821
  145    H2*    U  14           H2*        U  14  -4.636  19.513   0.505
  146   2HO*    U  14          2HO*        U  14  -5.646  20.077   2.480
  147    H1*    U  14           H1*        U  14  -4.885  16.958   1.512
  148    H3     U  14           H3         U  14  -1.335  16.961  -1.382
  149    H5     U  14           H5         U  14  -4.722  16.887  -3.868
  150    H6     U  14           H6         U  14  -6.102  17.170  -1.900
  151   1H5*    U  15          1H5*        U  15  -6.662  23.937   2.639
  152   2H5*    U  15          2H5*        U  15  -4.945  23.648   2.313
  153    H4*    U  15           H4*        U  15  -5.293  24.187   4.657
  154    H3*    U  15           H3*        U  15  -3.797  22.010   3.868
  155    H2*    U  15           H2*        U  15  -5.500  20.420   4.185
  156   2HO*    U  15          2HO*        U  15  -5.074  19.349   6.166
  157    H1*    U  15           H1*        U  15  -6.300  21.817   6.737
  158    H3     U  15           H3         U  15  -9.992  19.328   7.455
  159    H5     U  15           H5         U  15  -9.229  18.719   3.365
  160    H6     U  15           H6         U  15  -7.410  20.301   3.529
  161   1H5*    C  16          1H5*        C  16  -1.859  20.816   6.171
  162   2H5*    C  16          2H5*        C  16  -0.581  21.801   6.907
  163    H4*    C  16           H4*        C  16   0.357  19.755   6.071
  164    H3*    C  16           H3*        C  16   1.508  22.183   5.440
  165    H2*    C  16           H2*        C  16   0.170  22.439   3.428
  166   2HO*    C  16          2HO*        C  16   2.408  22.762   2.921
  167    H1*    C  16           H1*        C  16   1.004  19.599   2.762
  168   1H4     C  16          1H4         C  16  -2.966  20.634  -2.111
  169   2H4     C  16          2H4         C  16  -4.117  21.451  -1.061
  170    H5     C  16           H5         C  16  -3.693  21.874   1.299
  171    H6     C  16           H6         C  16  -2.113  21.529   3.113
  172   1H5*    G  17          1H5*        G  17   3.601  17.525   6.963
  173   2H5*    G  17          2H5*        G  17   2.273  17.857   5.815
  174    H4*    G  17           H4*        G  17   1.966  17.751   8.851
  175    H3*    G  17           H3*        G  17   1.086  15.786   6.702
  176    H2*    G  17           H2*        G  17  -0.649  15.247   8.293
  177   2HO*    G  17          2HO*        G  17   0.853  15.318  10.142
  178    H1*    G  17           H1*        G  17  -0.924  17.904   9.143
  179    H8     G  17           H8         G  17  -3.330  17.226   8.869
  180    H1     G  17           H1         G  17  -2.867  16.791   2.506
  181   1H2     G  17          1H2         G  17  -0.821  16.973   1.873
  182   2H2     G  17          2H2         G  17   0.519  17.143   2.998
  183   1H5*    G  18          1H5*        G  18   0.181  13.622   9.877
  184   2H5*    G  18          2H5*        G  18   0.533  11.904   9.621
  185    H4*    G  18           H4*        G  18  -1.890  12.308   9.887
  186    H3*    G  18           H3*        G  18  -1.015  11.401   7.137
  187    H2*    G  18           H2*        G  18  -3.399  11.205   6.637
  188   2HO*    G  18          2HO*        G  18  -4.930  11.690   8.265
  189    H1*    G  18           H1*        G  18  -3.928  13.729   7.464
  190    H8     G  18           H8         G  18  -0.375  14.050   6.368
  191    H1     G  18           H1         G  18  -4.387  13.374   1.417
  192   1H2     G  18          1H2         G  18  -6.411  12.867   2.146
  193   2H2     G  18          2H2         G  18  -6.757  12.650   3.852
  194   1H5*    A  19          1H5*        A  19  -4.156   8.998   8.378
  195   2H5*    A  19          2H5*        A  19  -3.882   7.270   8.073
  196    H4*    A  19           H4*        A  19  -6.021   8.002   7.100
  197    H3*    A  19           H3*        A  19  -3.857   7.327   5.086
  198    H2*    A  19           H2*        A  19  -5.640   7.457   3.439
  199   2HO*    A  19          2HO*        A  19  -7.773   7.872   4.113
  200    H1*    A  19           H1*        A  19  -6.452   9.874   4.288
  201    H8     A  19           H8         A  19  -2.815   9.998   5.148
  202   1H6     A  19          1H6         A  19  -1.698  10.829  -0.897
  203   2H6     A  19          2H6         A  19  -0.995  10.850   0.709
  204    H2     A  19           H2         A  19  -5.974   9.720  -0.425
  205   1H5*    G  20          1H5*        G  20  -7.361   5.097   4.431
  206   2H5*    G  20          2H5*        G  20  -7.078   3.488   3.718
  207    H4*    G  20           H4*        G  20  -8.587   5.048   2.379
  208    H3*    G  20           H3*        G  20  -6.119   3.737   1.258
  209    H2*    G  20           H2*        G  20  -6.663   4.693  -0.885
  210   2HO*    G  20          2HO*        G  20  -8.657   5.758  -1.202
  211    H1*    G  20           H1*        G  20  -7.265   7.192   0.079
  212    H8     G  20           H8         G  20  -4.464   6.337   2.316
  213    H1     G  20           H1         G  20  -2.475   7.377  -3.692
  214   1H2     G  20          1H2         G  20  -4.177   7.211  -5.096
  215   2H2     G  20          2H2         G  20  -5.810   6.906  -4.540
  216   1H5*    G  21          1H5*        G  21  -8.674   2.360  -1.469
  217   2H5*    G  21          2H5*        G  21  -8.459   0.621  -1.785
  218    H4*    G  21           H4*        G  21  -7.836   1.885  -3.788
  219    H3*    G  21           H3*        G  21  -5.471   0.774  -2.248
  220    H2*    G  21           H2*        G  21  -4.121   1.507  -4.104
  221   2HO*    G  21          2HO*        G  21  -5.605   1.022  -5.817
  222    H1*    G  21           H1*        G  21  -5.232   3.978  -4.187
  223    H8     G  21           H8         G  21  -5.128   2.730  -0.604
  224    H1     G  21           H1         G  21   0.519   4.778  -2.865
  225   1H2     G  21          1H2         G  21   0.353   5.106  -5.076
  226   2H2     G  21          2H2         G  21  -1.158   4.850  -5.919
  227   1H5*    A  22          1H5*        A  22  -5.513  -0.458  -6.496
  228   2H5*    A  22          2H5*        A  22  -4.852  -2.096  -6.644
  229    H4*    A  22           H4*        A  22  -3.795  -0.488  -8.215
  230    H3*    A  22           H3*        A  22  -1.963  -1.642  -6.082
  231    H2*    A  22           H2*        A  22  -0.188  -0.643  -7.415
  232   2HO*    A  22          2HO*        A  22  -1.278  -1.069  -9.491
  233    H1*    A  22           H1*        A  22  -1.449   1.747  -7.595
  234    H8     A  22           H8         A  22  -2.432   0.443  -4.204
  235   1H6     A  22          1H6         A  22   3.173   2.362  -2.321
  236   2H6     A  22          2H6         A  22   1.616   1.764  -1.781
  237    H2     A  22           H2         A  22   3.063   2.540  -6.749
  238   1H5*    U  23          1H5*        U  23   0.150  -2.138  -9.363
  239   2H5*    U  23          2H5*        U  23   0.765  -3.798  -9.517
  240    H4*    U  23           H4*        U  23   2.628  -2.195  -9.551
  241    H3*    U  23           H3*        U  23   2.407  -3.896  -7.053
  242    H2*    U  23           H2*        U  23   4.614  -3.019  -6.499
  243   2HO*    U  23          2HO*        U  23   5.349  -3.007  -8.756
  244    H1*    U  23           H1*        U  23   3.932  -0.444  -7.082
  245    H3     U  23           H3         U  23   4.206  -0.991  -2.549
  246    H5     U  23           H5         U  23   0.259  -2.015  -3.558
  247    H6     U  23           H6         U  23   0.868  -1.841  -5.894
  248   1H5*    U  24          1H5*        U  24   6.281  -4.305  -8.431
  249   2H5*    U  24          2H5*        U  24   6.740  -6.015  -8.569
  250    H4*    U  24           H4*        U  24   8.392  -4.706  -7.245
  251    H3*    U  24           H3*        U  24   6.791  -6.829  -5.787
  252    H2*    U  24           H2*        U  24   8.310  -6.445  -3.934
  253   2HO*    U  24          2HO*        U  24  10.210  -6.186  -5.284
  254    H1*    U  24           H1*        U  24   8.211  -3.690  -4.178
  255    H3     U  24           H3         U  24   6.021  -5.135  -0.371
  256    H5     U  24           H5         U  24   3.128  -4.846  -3.404
  257    H6     U  24           H6         U  24   4.915  -4.615  -5.018
  258   1H5*    U  25          1H5*        U  25  10.675  -8.091  -4.925
  259   2H5*    U  25          2H5*        U  25  10.784  -9.847  -5.180
  260    H4*    U  25           H4*        U  25  11.352  -9.344  -2.862
  261    H3*    U  25           H3*        U  25   8.593 -10.577  -3.165
  262    H2*    U  25           H2*        U  25   8.666 -10.783  -0.733
  263   2HO*    U  25          2HO*        U  25  10.943 -11.271  -0.584
  264    H1*    U  25           H1*        U  25   9.502  -8.217  -0.392
  265    H3     U  25           H3         U  25   5.116  -8.159   0.724
  266    H5     U  25           H5         U  25   5.073  -8.326  -3.469
  267    H6     U  25           H6         U  25   7.473  -8.584  -3.424
  268   1H5*    G  26          1H5*        G  26  11.012 -13.007  -0.469
  269   2H5*    G  26          2H5*        G  26  10.626 -14.723  -0.681
  270    H4*    G  26           H4*        G  26  10.465 -14.034   1.683
  271    H3*    G  26           H3*        G  26   7.819 -14.756   0.383
  272    H2*    G  26           H2*        G  26   6.960 -14.711   2.663
  273   2HO*    G  26          2HO*        G  26   8.382 -14.319   4.397
  274    H1*    G  26           H1*        G  26   8.058 -12.286   3.183
  275    H8     G  26           H8         G  26   7.302 -12.179  -0.491
  276    H1     G  26           H1         G  26   2.064 -11.632   3.173
  277   1H2     G  26          1H2         G  26   2.549 -12.184   5.266
  278   2H2     G  26          2H2         G  26   4.170 -12.645   5.750
  279   1H5*    G  27          1H5*        G  27   8.438 -17.095   3.809
  280   2H5*    G  27          2H5*        G  27   7.875 -18.771   3.647
  281    H4*    G  27           H4*        G  27   6.845 -17.658   5.602
  282    H3*    G  27           H3*        G  27   4.966 -18.337   3.343
  283    H2*    G  27           H2*        G  27   3.198 -17.692   4.942
  284   2HO*    G  27          2HO*        G  27   4.302 -18.540   6.830
  285    H1*    G  27           H1*        G  27   4.395 -15.365   5.591
  286    H8     G  27           H8         G  27   5.460 -15.804   2.026
  287    H1     G  27           H1         G  27  -0.690 -14.076   2.613
  288   1H2     G  27          1H2         G  27  -1.360 -14.356   4.706
  289   2H2     G  27          2H2         G  27  -0.269 -14.917   5.958
  290   1H5*    C  28          1H5*        C  28   3.483 -20.072   6.826
  291   2H5*    C  28          2H5*        C  28   2.789 -21.687   6.572
  292    H4*    C  28           H4*        C  28   1.113 -20.112   7.497
  293    H3*    C  28           H3*        C  28   0.643 -21.025   4.643
  294    H2*    C  28           H2*        C  28  -1.523 -19.921   4.861
  295   2HO*    C  28          2HO*        C  28  -1.832 -20.479   7.121
  296    H1*    C  28           H1*        C  28  -0.453 -17.643   5.872
  297   1H4     C  28          1H4         C  28  -0.453 -16.935  -0.440
  298   2H4     C  28          2H4         C  28   1.203 -17.509  -0.514
  299    H5     C  28           H5         C  28   2.383 -18.389   1.441
  300    H6     C  28           H6         C  28   2.196 -18.868   3.801
  301   1H5*    C  29          1H5*        C  29  -2.865 -21.913   6.743
  302   2H5*    C  29          2H5*        C  29  -3.550 -23.491   6.302
  303    H4*    C  29           H4*        C  29  -5.193 -21.697   5.938
  304    H3*    C  29           H3*        C  29  -4.085 -22.940   3.396
  305    H2*    C  29           H2*        C  29  -5.813 -21.699   2.252
  306   2HO*    C  29          2HO*        C  29  -7.444 -21.987   3.907
  307    H1*    C  29           H1*        C  29  -5.290 -19.374   3.593
  308   1H4     C  29          1H4         C  29  -1.810 -19.456  -1.733
  309   2H4     C  29          2H4         C  29  -0.472 -20.203  -0.876
  310    H5     C  29           H5         C  29  -0.641 -20.913   1.465
  311    H6     C  29           H6         C  29  -2.120 -21.063   3.375
  312    H3T    C  29           H3T        C  29  -5.243 -24.361   4.783
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -6.254 -15.242  -9.691
    2   2H5*    G   1          2H5*        G   1  -6.473 -13.650  -8.941
    3    H4*    G   1           H4*        G   1  -8.010 -15.213  -7.911
    4    H3*    G   1           H3*        G   1  -5.675 -14.481  -6.120
    5    H2*    G   1           H2*        G   1  -6.887 -15.668  -4.371
    6   2HO*    G   1          2HO*        G   1  -9.025 -14.996  -5.104
    7    H1*    G   1           H1*        G   1  -7.328 -17.848  -5.906
    8    H8     G   1           H8         G   1  -4.069 -16.676  -7.267
    9    H1     G   1           H1         G   1  -3.523 -19.239  -1.408
   10   1H2     G   1          1H2         G   1  -5.529 -19.429  -0.479
   11   2H2     G   1          2H2         G   1  -6.989 -18.968  -1.333
   12    H5T    G   1           H5T        G   1  -4.259 -14.225  -9.147
   13   1H5*    G   2          1H5*        G   2  -9.188 -13.785  -3.910
   14   2H5*    G   2          2H5*        G   2  -9.118 -12.229  -3.059
   15    H4*    G   2           H4*        G   2  -9.632 -14.065  -1.498
   16    H3*    G   2           H3*        G   2  -6.916 -12.763  -1.193
   17    H2*    G   2           H2*        G   2  -6.725 -14.065   0.879
   18   2HO*    G   2          2HO*        G   2  -8.492 -15.326   1.565
   19    H1*    G   2           H1*        G   2  -7.500 -16.375  -0.293
   20    H8     G   2           H8         G   2  -5.712 -14.662  -3.095
   21    H1     G   2           H1         G   2  -1.743 -17.010   1.370
   22   1H2     G   2          1H2         G   2  -2.889 -17.541   3.199
   23   2H2     G   2          2H2         G   2  -4.628 -17.330   3.289
   24   1H5*    C   3          1H5*        C   3  -8.796 -12.689   2.450
   25   2H5*    C   3          2H5*        C   3  -8.597 -11.178   3.361
   26    H4*    C   3           H4*        C   3  -7.784 -13.128   4.648
   27    H3*    C   3           H3*        C   3  -5.654 -11.177   3.728
   28    H2*    C   3           H2*        C   3  -4.140 -12.466   5.162
   29   2HO*    C   3          2HO*        C   3  -5.722 -12.875   6.839
   30    H1*    C   3           H1*        C   3  -5.006 -14.872   4.191
   31   1H4     C   3          1H4         C   3  -0.216 -13.229   0.376
   32   2H4     C   3          2H4         C   3  -1.348 -12.488  -0.740
   33    H5     C   3           H5         C   3  -3.729 -12.242  -0.234
   34    H6     C   3           H6         C   3  -5.441 -12.675   1.414
   35   1H5*    C   4          1H5*        C   4  -5.292 -11.496   7.832
   36   2H5*    C   4          2H5*        C   4  -4.936  -9.948   8.625
   37    H4*    C   4           H4*        C   4  -3.160 -11.615   9.059
   38    H3*    C   4           H3*        C   4  -2.350  -9.289   7.275
   39    H2*    C   4           H2*        C   4  -0.103 -10.142   7.504
   40   2HO*    C   4          2HO*        C   4  -0.244 -10.747   9.726
   41    H1*    C   4           H1*        C   4  -0.847 -12.749   7.069
   42   1H4     C   4          1H4         C   4   0.766 -10.567   1.353
   43   2H4     C   4          2H4         C   4  -0.833  -9.882   1.120
   44    H5     C   4           H5         C   4  -2.543  -9.899   2.873
   45    H6     C   4           H6         C   4  -3.022 -10.562   5.147
   46   1H5*    A   5          1H5*        A   5   1.275  -6.699   9.728
   47   2H5*    A   5          2H5*        A   5   0.857  -7.223   8.083
   48    H4*    A   5           H4*        A   5   2.728  -8.691   9.995
   49    H3*    A   5           H3*        A   5   3.079  -6.779   7.708
   50    H2*    A   5           H2*        A   5   4.839  -8.096   6.736
   51   2HO*    A   5          2HO*        A   5   5.769  -8.686   8.843
   52    H1*    A   5           H1*        A   5   3.590 -10.450   6.897
   53    H8     A   5           H8         A   5   0.509  -8.457   6.457
   54   1H6     A   5          1H6         A   5   2.239  -7.764   0.509
   55   2H6     A   5          2H6         A   5   0.911  -7.536   1.634
   56    H2     A   5           H2         A   5   5.697  -9.298   2.784
   57   1H5*    U   6          1H5*        U   6   6.807  -7.429   7.868
   58   2H5*    U   6          2H5*        U   6   7.731  -5.950   8.199
   59    H4*    U   6           H4*        U   6   8.441  -6.899   6.055
   60    H3*    U   6           H3*        U   6   6.793  -4.364   5.853
   61    H2*    U   6           H2*        U   6   7.382  -4.356   3.514
   62   2HO*    U   6          2HO*        U   6   9.560  -5.035   3.702
   63    H1*    U   6           H1*        U   6   6.935  -7.045   3.180
   64    H3     U   6           H3         U   6   3.531  -4.925   1.011
   65    H5     U   6           H5         U   6   2.440  -4.826   5.068
   66    H6     U   6           H6         U   6   4.622  -5.693   5.617
   67   1H5*    C   7          1H5*        C   7  11.022  -4.193   4.130
   68   2H5*    C   7          2H5*        C   7  11.647  -2.560   4.428
   69    H4*    C   7           H4*        C   7  12.072  -3.190   2.109
   70    H3*    C   7           H3*        C   7   9.913  -1.076   2.436
   71    H2*    C   7           H2*        C   7  10.045  -0.838   0.042
   72   2HO*    C   7          2HO*        C   7  12.311  -1.063  -0.189
   73    H1*    C   7           H1*        C   7  10.035  -3.530  -0.434
   74   1H4     C   7          1H4         C   7   3.847  -2.123  -0.532
   75   2H4     C   7          2H4         C   7   3.780  -2.171   1.215
   76    H5     C   7           H5         C   7   5.760  -2.434   2.618
   77    H6     C   7           H6         C   7   8.161  -2.714   2.588
   78   1H5*    U   8          1H5*        U   8  12.231   2.936  -0.221
   79   2H5*    U   8          2H5*        U   8  10.617   2.197  -0.134
   80    H4*    U   8           H4*        U   8  12.796   1.544  -2.170
   81    H3*    U   8           H3*        U   8  10.177   3.051  -2.235
   82    H2*    U   8           H2*        U   8   9.792   2.207  -4.475
   83   2HO*    U   8          2HO*        U   8  12.060   2.343  -5.111
   84    H1*    U   8           H1*        U   8  10.390  -0.354  -3.885
   85    H3     U   8           H3         U   8   5.828   0.067  -4.006
   86    H5     U   8           H5         U   8   6.933   0.813  -0.020
   87    H6     U   8           H6         U   8   9.236   0.862  -0.719
   88   1H5*    U   9          1H5*        U   9  11.614   3.890  -5.990
   89   2H5*    U   9          2H5*        U   9  11.431   5.596  -6.405
   90    H4*    U   9           H4*        U   9  10.206   4.204  -8.002
   91    H3*    U   9           H3*        U   9   8.294   5.677  -6.144
   92    H2*    U   9           H2*        U   9   6.563   4.786  -7.595
   93   2HO*    U   9          2HO*        U   9   7.799   4.935  -9.576
   94    H1*    U   9           H1*        U   9   7.496   2.262  -7.456
   95    H3     U   9           H3         U   9   3.904   2.837  -4.640
   96    H5     U   9           H5         U   9   7.265   3.940  -2.383
   97    H6     U   9           H6         U   9   8.592   3.772  -4.385
   98   1H5*    G  10          1H5*        G  10   7.245   9.820  -7.167
   99   2H5*    G  10          2H5*        G  10   6.584   9.147  -5.670
  100    H4*    G  10           H4*        G  10   6.591   7.743  -8.383
  101    H3*    G  10           H3*        G  10   4.423   9.083  -6.729
  102    H2*    G  10           H2*        G  10   2.901   7.604  -7.923
  103   2HO*    G  10          2HO*        G  10   4.069   7.802  -9.976
  104    H1*    G  10           H1*        G  10   4.606   5.443  -7.691
  105    H8     G  10           H8         G  10   1.847   5.389  -6.948
  106    H1     G  10           H1         G  10   3.931   6.724  -1.027
  107   1H2     G  10          1H2         G  10   6.004   7.544  -1.117
  108   2H2     G  10          2H2         G  10   6.844   7.744  -2.640
  109   1H5*    C  11          1H5*        C  11   2.407   8.710 -10.156
  110   2H5*    C  11          2H5*        C  11   1.682  10.270 -10.597
  111    H4*    C  11           H4*        C  11  -0.085   8.610 -10.430
  112    H3*    C  11           H3*        C  11  -0.021  10.573  -8.122
  113    H2*    C  11           H2*        C  11  -2.173   9.619  -7.499
  114   2HO*    C  11          2HO*        C  11  -3.153   8.064  -8.843
  115    H1*    C  11           H1*        C  11  -1.319   7.054  -7.768
  116   1H4     C  11          1H4         C  11  -0.118   8.704  -1.751
  117   2H4     C  11          2H4         C  11   1.499   9.214  -2.196
  118    H5     C  11           H5         C  11   2.278   9.254  -4.518
  119    H6     C  11           H6         C  11   1.643   8.824  -6.812
  120   1H5*    U  12          1H5*        U  12  -3.899  10.571  -9.783
  121   2H5*    U  12          2H5*        U  12  -4.561  12.210  -9.936
  122    H4*    U  12           H4*        U  12  -6.124  10.783  -8.711
  123    H3*    U  12           H3*        U  12  -4.740  12.877  -6.994
  124    H2*    U  12           H2*        U  12  -6.367  12.251  -5.298
  125   2HO*    U  12          2HO*        U  12  -8.125  11.897  -6.836
  126    H1*    U  12           H1*        U  12  -5.955   9.590  -5.634
  127    H3     U  12           H3         U  12  -3.795  10.835  -1.806
  128    H5     U  12           H5         U  12  -1.068  11.603  -4.906
  129    H6     U  12           H6         U  12  -2.832  11.166  -6.492
  130   1H5*    C  13          1H5*        C  13  -8.812  13.450  -6.304
  131   2H5*    C  13          2H5*        C  13  -9.192  15.185  -6.344
  132    H4*    C  13           H4*        C  13  -9.886  14.211  -4.190
  133    H3*    C  13           H3*        C  13  -7.478  16.055  -4.072
  134    H2*    C  13           H2*        C  13  -7.702  15.908  -1.671
  135   2HO*    C  13          2HO*        C  13 -10.075  15.949  -1.737
  136    H1*    C  13           H1*        C  13  -8.154  13.188  -1.672
  137   1H4     C  13          1H4         C  13  -2.026  14.317  -0.471
  138   2H4     C  13          2H4         C  13  -1.644  14.318  -2.185
  139    H5     C  13           H5         C  13  -3.384  14.134  -3.914
  140    H6     C  13           H6         C  13  -5.765  13.933  -4.297
  141   1H5*    U  14          1H5*        U  14  -9.264  17.581  -1.058
  142   2H5*    U  14          2H5*        U  14  -9.386  19.349  -1.185
  143    H4*    U  14           H4*        U  14  -8.078  18.780   0.798
  144    H3*    U  14           H3*        U  14  -6.403  19.886  -1.474
  145    H2*    U  14           H2*        U  14  -4.641  20.018   0.189
  146   2HO*    U  14          2HO*        U  14  -5.156  19.324   2.367
  147    H1*    U  14           H1*        U  14  -5.095  17.485   1.112
  148    H3     U  14           H3         U  14  -1.280  17.430  -1.435
  149    H5     U  14           H5         U  14  -4.427  17.288  -4.215
  150    H6     U  14           H6         U  14  -5.978  17.639  -2.388
  151   1H5*    U  15          1H5*        U  15  -6.841  24.730   1.487
  152   2H5*    U  15          2H5*        U  15  -5.095  24.535   1.248
  153    H4*    U  15           H4*        U  15  -5.505  25.222   3.521
  154    H3*    U  15           H3*        U  15  -3.934  23.052   2.978
  155    H2*    U  15           H2*        U  15  -5.681  21.459   3.224
  156   2HO*    U  15          2HO*        U  15  -3.981  20.884   4.678
  157    H1*    U  15           H1*        U  15  -6.554  22.906   5.724
  158    H3     U  15           H3         U  15 -10.308  20.532   6.428
  159    H5     U  15           H5         U  15  -9.420  19.695   2.408
  160    H6     U  15           H6         U  15  -7.568  21.244   2.553
  161   1H5*    C  16          1H5*        C  16  -2.271  22.028   5.743
  162   2H5*    C  16          2H5*        C  16  -1.041  23.073   6.474
  163    H4*    C  16           H4*        C  16  -0.088  20.927   6.000
  164    H3*    C  16           H3*        C  16   1.198  23.208   5.203
  165    H2*    C  16           H2*        C  16   0.185  23.199   3.006
  166   2HO*    C  16          2HO*        C  16   2.678  21.823   2.862
  167    H1*    C  16           H1*        C  16   0.865  20.247   2.854
  168   1H4     C  16          1H4         C  16  -2.573  20.733  -2.488
  169   2H4     C  16          2H4         C  16  -3.771  21.734  -1.677
  170    H5     C  16           H5         C  16  -3.529  22.498   0.612
  171    H6     C  16           H6         C  16  -2.138  22.368   2.603
  172   1H5*    G  17          1H5*        G  17   3.009  17.675   6.403
  173   2H5*    G  17          2H5*        G  17   1.867  18.634   5.453
  174    H4*    G  17           H4*        G  17   1.810  18.773   8.484
  175    H3*    G  17           H3*        G  17   0.581  16.607   6.745
  176    H2*    G  17           H2*        G  17  -1.108  16.503   8.467
  177   2HO*    G  17          2HO*        G  17  -0.824  17.637  10.432
  178    H1*    G  17           H1*        G  17  -1.168  19.270   8.811
  179    H8     G  17           H8         G  17  -3.631  18.507   8.634
  180    H1     G  17           H1         G  17  -3.052  17.528   2.331
  181   1H2     G  17          1H2         G  17  -0.984  17.597   1.729
  182   2H2     G  17          2H2         G  17   0.337  17.832   2.865
  183   1H5*    G  18          1H5*        G  18  -0.490  15.004   9.962
  184   2H5*    G  18          2H5*        G  18  -0.261  13.245   9.978
  185    H4*    G  18           H4*        G  18  -2.659  13.823  10.012
  186    H3*    G  18           H3*        G  18  -1.666  12.532   7.462
  187    H2*    G  18           H2*        G  18  -4.016  12.420   6.806
  188   2HO*    G  18          2HO*        G  18  -5.623  13.164   8.244
  189    H1*    G  18           H1*        G  18  -4.448  15.044   7.315
  190    H8     G  18           H8         G  18  -0.824  15.034   6.440
  191    H1     G  18           H1         G  18  -4.548  14.097   1.310
  192   1H2     G  18          1H2         G  18  -6.641  13.768   1.942
  193   2H2     G  18          2H2         G  18  -7.108  13.741   3.633
  194   1H5*    A  19          1H5*        A  19  -5.039  10.455   8.695
  195   2H5*    A  19          2H5*        A  19  -4.848   8.694   8.596
  196    H4*    A  19           H4*        A  19  -6.851   9.418   7.369
  197    H3*    A  19           H3*        A  19  -4.575   8.437   5.625
  198    H2*    A  19           H2*        A  19  -6.210   8.494   3.819
  199   2HO*    A  19          2HO*        A  19  -8.063   7.873   5.102
  200    H1*    A  19           H1*        A  19  -6.950  11.019   4.364
  201    H8     A  19           H8         A  19  -3.391  11.022   5.511
  202   1H6     A  19          1H6         A  19  -1.757  11.257  -0.470
  203   2H6     A  19          2H6         A  19  -1.180  11.375   1.181
  204    H2     A  19           H2         A  19  -6.114  10.414  -0.260
  205   1H5*    G  20          1H5*        G  20  -8.144   6.170   4.869
  206   2H5*    G  20          2H5*        G  20  -7.786   4.530   4.267
  207    H4*    G  20           H4*        G  20  -9.161   6.060   2.732
  208    H3*    G  20           H3*        G  20  -6.678   4.568   1.912
  209    H2*    G  20           H2*        G  20  -7.014   5.389  -0.336
  210   2HO*    G  20          2HO*        G  20  -9.340   5.146  -0.300
  211    H1*    G  20           H1*        G  20  -7.565   7.966   0.387
  212    H8     G  20           H8         G  20  -5.010   7.200   2.923
  213    H1     G  20           H1         G  20  -2.453   7.649  -2.940
  214   1H2     G  20          1H2         G  20  -4.026   7.444  -4.477
  215   2H2     G  20          2H2         G  20  -5.718   7.262  -4.055
  216   1H5*    G  21          1H5*        G  21  -9.247   3.062  -0.832
  217   2H5*    G  21          2H5*        G  21  -9.078   1.301  -1.027
  218    H4*    G  21           H4*        G  21  -8.365   2.436  -3.087
  219    H3*    G  21           H3*        G  21  -6.084   1.316  -1.429
  220    H2*    G  21           H2*        G  21  -4.676   1.873  -3.305
  221   2HO*    G  21          2HO*        G  21  -6.091   1.386  -5.041
  222    H1*    G  21           H1*        G  21  -5.658   4.384  -3.534
  223    H8     G  21           H8         G  21  -5.700   3.325   0.105
  224    H1     G  21           H1         G  21   0.107   4.943  -2.086
  225   1H2     G  21          1H2         G  21   0.024   5.154  -4.313
  226   2H2     G  21          2H2         G  21  -1.469   4.926  -5.197
  227   1H5*    A  22          1H5*        A  22  -6.288  -0.136  -5.587
  228   2H5*    A  22          2H5*        A  22  -5.654  -1.785  -5.728
  229    H4*    A  22           H4*        A  22  -4.676  -0.182  -7.380
  230    H3*    A  22           H3*        A  22  -2.738  -1.402  -5.382
  231    H2*    A  22           H2*        A  22  -1.032  -0.440  -6.828
  232   2HO*    A  22          2HO*        A  22  -2.267  -0.810  -8.829
  233    H1*    A  22           H1*        A  22  -2.233   1.984  -6.892
  234    H8     A  22           H8         A  22  -3.055   0.807  -3.428
  235   1H6     A  22          1H6         A  22   2.838   2.191  -1.988
  236   2H6     A  22          2H6         A  22   1.274   1.757  -1.319
  237    H2     A  22           H2         A  22   2.418   2.349  -6.388
  238   1H5*    U  23          1H5*        U  23  -0.946  -1.986  -8.882
  239   2H5*    U  23          2H5*        U  23  -0.395  -3.660  -9.089
  240    H4*    U  23           H4*        U  23   1.489  -2.088  -9.331
  241    H3*    U  23           H3*        U  23   1.510  -3.823  -6.846
  242    H2*    U  23           H2*        U  23   3.782  -2.987  -6.521
  243   2HO*    U  23          2HO*        U  23   4.259  -2.936  -8.850
  244    H1*    U  23           H1*        U  23   3.079  -0.397  -6.954
  245    H3     U  23           H3         U  23   3.794  -1.165  -2.492
  246    H5     U  23           H5         U  23  -0.284  -1.945  -3.143
  247    H6     U  23           H6         U  23   0.105  -1.712  -5.516
  248   1H5*    U  24          1H5*        U  24   5.220  -4.265  -8.578
  249   2H5*    U  24          2H5*        U  24   5.629  -5.979  -8.798
  250    H4*    U  24           H4*        U  24   7.422  -4.732  -7.604
  251    H3*    U  24           H3*        U  24   5.932  -6.861  -6.038
  252    H2*    U  24           H2*        U  24   7.652  -6.535  -4.345
  253   2HO*    U  24          2HO*        U  24   9.394  -6.226  -5.892
  254    H1*    U  24           H1*        U  24   7.509  -3.783  -4.477
  255    H3     U  24           H3         U  24   5.606  -5.492  -0.600
  256    H5     U  24           H5         U  24   2.495  -4.884  -3.360
  257    H6     U  24           H6         U  24   4.154  -4.583  -5.089
  258   1H5*    U  25          1H5*        U  25   9.889  -8.039  -5.531
  259   2H5*    U  25          2H5*        U  25  10.028  -9.796  -5.760
  260    H4*    U  25           H4*        U  25  10.798  -9.183  -3.512
  261    H3*    U  25           H3*        U  25   8.120 -10.609  -3.540
  262    H2*    U  25           H2*        U  25   8.424 -10.747  -1.120
  263   2HO*    U  25          2HO*        U  25  10.742 -11.062  -1.179
  264    H1*    U  25           H1*        U  25   9.089  -8.120  -0.904
  265    H3     U  25           H3         U  25   4.827  -8.465   0.606
  266    H5     U  25           H5         U  25   4.432  -8.477  -3.571
  267    H6     U  25           H6         U  25   6.838  -8.588  -3.739
  268   1H5*    G  26          1H5*        G  26  10.944 -12.757  -0.999
  269   2H5*    G  26          2H5*        G  26  10.686 -14.505  -1.136
  270    H4*    G  26           H4*        G  26  10.664 -13.756   1.220
  271    H3*    G  26           H3*        G  26   8.010 -14.756   0.144
  272    H2*    G  26           H2*        G  26   7.296 -14.691   2.481
  273   2HO*    G  26          2HO*        G  26   9.332 -15.343   3.405
  274    H1*    G  26           H1*        G  26   8.223 -12.176   2.861
  275    H8     G  26           H8         G  26   7.212 -12.242  -0.756
  276    H1     G  26           H1         G  26   2.213 -11.907   3.253
  277   1H2     G  26          1H2         G  26   2.863 -12.401   5.313
  278   2H2     G  26          2H2         G  26   4.539 -12.745   5.696
  279   1H5*    G  27          1H5*        G  27   9.045 -17.074   3.594
  280   2H5*    G  27          2H5*        G  27   8.582 -18.775   3.404
  281    H4*    G  27           H4*        G  27   7.579 -17.785   5.440
  282    H3*    G  27           H3*        G  27   5.647 -18.538   3.253
  283    H2*    G  27           H2*        G  27   3.911 -18.043   4.925
  284   2HO*    G  27          2HO*        G  27   5.151 -18.863   6.751
  285    H1*    G  27           H1*        G  27   4.978 -15.655   5.597
  286    H8     G  27           H8         G  27   5.929 -15.984   1.987
  287    H1     G  27           H1         G  27  -0.266 -14.555   2.817
  288   1H2     G  27          1H2         G  27  -0.851 -14.901   4.923
  289   2H2     G  27          2H2         G  27   0.307 -15.429   6.132
  290   1H5*    C  28          1H5*        C  28   4.348 -20.435   6.709
  291   2H5*    C  28          2H5*        C  28   3.765 -22.089   6.421
  292    H4*    C  28           H4*        C  28   1.985 -20.665   7.382
  293    H3*    C  28           H3*        C  28   1.577 -21.510   4.499
  294    H2*    C  28           H2*        C  28  -0.653 -20.552   4.739
  295   2HO*    C  28          2HO*        C  28  -0.932 -21.211   6.973
  296    H1*    C  28           H1*        C  28   0.262 -18.248   5.837
  297   1H4     C  28          1H4         C  28   0.235 -17.285  -0.435
  298   2H4     C  28          2H4         C  28   1.917 -17.764  -0.529
  299    H5     C  28           H5         C  28   3.141 -18.661   1.390
  300    H6     C  28           H6         C  28   2.981 -19.240   3.729
  301   1H5*    C  29          1H5*        C  29  -1.890 -22.660   6.535
  302   2H5*    C  29          2H5*        C  29  -2.489 -24.250   6.020
  303    H4*    C  29           H4*        C  29  -4.211 -22.517   5.702
  304    H3*    C  29           H3*        C  29  -3.017 -23.644   3.150
  305    H2*    C  29           H2*        C  29  -4.767 -22.447   1.996
  306   2HO*    C  29          2HO*        C  29  -6.485 -22.795   3.469
  307    H1*    C  29           H1*        C  29  -4.400 -20.141   3.419
  308   1H4     C  29          1H4         C  29  -0.843 -19.857  -1.843
  309   2H4     C  29          2H4         C  29   0.513 -20.580  -0.999
  310    H5     C  29           H5         C  29   0.348 -21.394   1.309
  311    H6     C  29           H6         C  29  -1.147 -21.678   3.189
  312    H3T    C  29           H3T        C  29  -5.426 -24.159   4.604
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -6.708 -14.800  -9.946
    2   2H5*    G   1          2H5*        G   1  -6.800 -13.139  -9.327
    3    H4*    G   1           H4*        G   1  -8.526 -14.466  -8.266
    4    H3*    G   1           H3*        G   1  -6.211 -13.815  -6.417
    5    H2*    G   1           H2*        G   1  -7.613 -14.743  -4.650
    6   2HO*    G   1          2HO*        G   1  -9.641 -13.935  -5.557
    7    H1*    G   1           H1*        G   1  -8.192 -16.988  -6.039
    8    H8     G   1           H8         G   1  -4.778 -16.226  -7.313
    9    H1     G   1           H1         G   1  -4.734 -18.367  -1.261
   10   1H2     G   1          1H2         G   1  -6.790 -18.308  -0.427
   11   2H2     G   1          2H2         G   1  -8.160 -17.786  -1.389
   12    H5T    G   1           H5T        G   1  -4.647 -13.934  -9.379
   13   1H5*    G   2          1H5*        G   2  -9.711 -12.636  -4.422
   14   2H5*    G   2          2H5*        G   2  -9.524 -11.027  -3.698
   15    H4*    G   2           H4*        G   2 -10.253 -12.662  -2.012
   16    H3*    G   2           H3*        G   2  -7.421 -11.635  -1.708
   17    H2*    G   2           H2*        G   2  -7.457 -12.754   0.476
   18   2HO*    G   2          2HO*        G   2  -9.376 -13.750   1.183
   19    H1*    G   2           H1*        G   2  -8.426 -15.064  -0.543
   20    H8     G   2           H8         G   2  -6.360 -13.778  -3.384
   21    H1     G   2           H1         G   2  -2.834 -16.113   1.445
   22   1H2     G   2          1H2         G   2  -4.108 -16.390   3.243
   23   2H2     G   2          2H2         G   2  -5.821 -16.020   3.226
   24   1H5*    C   3          1H5*        C   3  -9.404 -11.017   1.804
   25   2H5*    C   3          2H5*        C   3  -9.072  -9.458   2.588
   26    H4*    C   3           H4*        C   3  -8.539 -11.356   4.083
   27    H3*    C   3           H3*        C   3  -6.155  -9.763   3.087
   28    H2*    C   3           H2*        C   3  -4.874 -11.046   4.727
   29   2HO*    C   3          2HO*        C   3  -5.956 -12.468   6.130
   30    H1*    C   3           H1*        C   3  -5.982 -13.431   3.942
   31   1H4     C   3          1H4         C   3  -0.802 -12.658   0.351
   32   2H4     C   3          2H4         C   3  -1.778 -11.928  -0.909
   33    H5     C   3           H5         C   3  -4.150 -11.404  -0.606
   34    H6     C   3           H6         C   3  -6.000 -11.499   0.944
   35   1H5*    C   4          1H5*        C   4  -6.045  -9.750   7.196
   36   2H5*    C   4          2H5*        C   4  -5.550  -8.192   7.896
   37    H4*    C   4           H4*        C   4  -4.018  -9.991   8.599
   38    H3*    C   4           H3*        C   4  -2.824  -8.028   6.614
   39    H2*    C   4           H2*        C   4  -0.709  -9.130   7.158
   40   2HO*    C   4          2HO*        C   4  -1.178  -9.485   9.415
   41    H1*    C   4           H1*        C   4  -1.765 -11.620   6.868
   42   1H4     C   4          1H4         C   4   0.558 -10.045   1.197
   43   2H4     C   4          2H4         C   4  -0.932  -9.226   0.765
   44    H5     C   4           H5         C   4  -2.790  -8.946   2.346
   45    H6     C   4           H6         C   4  -3.532  -9.388   4.605
   46   1H5*    A   5          1H5*        A   5  -0.369  -8.096  10.164
   47   2H5*    A   5          2H5*        A   5   0.407  -6.523  10.437
   48    H4*    A   5           H4*        A   5   2.047  -8.403  10.184
   49    H3*    A   5           H3*        A   5   2.087  -6.254   8.044
   50    H2*    A   5           H2*        A   5   4.110  -7.375   7.244
   51   2HO*    A   5          2HO*        A   5   4.853  -7.966   9.423
   52    H1*    A   5           H1*        A   5   2.954  -9.832   7.279
   53    H8     A   5           H8         A   5   0.118  -7.542   6.376
   54   1H6     A   5          1H6         A   5   2.596  -7.502   0.661
   55   2H6     A   5          2H6         A   5   1.173  -7.068   1.594
   56    H2     A   5           H2         A   5   5.557  -9.232   3.449
   57   1H5*    U   6          1H5*        U   6   5.981  -6.724   8.605
   58   2H5*    U   6          2H5*        U   6   6.771  -5.177   8.957
   59    H4*    U   6           H4*        U   6   7.820  -6.244   7.008
   60    H3*    U   6           H3*        U   6   6.180  -3.766   6.418
   61    H2*    U   6           H2*        U   6   7.124  -3.875   4.190
   62   2HO*    U   6          2HO*        U   6   9.250  -4.524   4.793
   63    H1*    U   6           H1*        U   6   6.753  -6.569   3.941
   64    H3     U   6           H3         U   6   3.681  -4.626   1.202
   65    H5     U   6           H5         U   6   2.016  -4.310   5.049
   66    H6     U   6           H6         U   6   4.096  -5.130   5.956
   67   1H5*    C   7          1H5*        C   7  10.495  -3.567   5.054
   68   2H5*    C   7          2H5*        C   7  11.045  -1.901   5.316
   69    H4*    C   7           H4*        C   7  11.610  -2.611   3.042
   70    H3*    C   7           H3*        C   7   9.372  -0.567   3.205
   71    H2*    C   7           H2*        C   7   9.655  -0.379   0.801
   72   2HO*    C   7          2HO*        C   7  11.932  -0.567   0.695
   73    H1*    C   7           H1*        C   7   9.745  -3.075   0.411
   74   1H4     C   7          1H4         C   7   3.570  -1.756  -0.202
   75   2H4     C   7          2H4         C   7   3.382  -1.675   1.537
   76    H5     C   7           H5         C   7   5.255  -1.830   3.089
   77    H6     C   7           H6         C   7   7.655  -2.131   3.254
   78   1H5*    U   8          1H5*        U   8  12.975   0.752   0.887
   79   2H5*    U   8          2H5*        U   8  13.132   2.516   0.994
   80    H4*    U   8           H4*        U   8  13.162   1.759  -1.362
   81    H3*    U   8           H3*        U   8  10.702   3.321  -0.516
   82    H2*    U   8           H2*        U   8  10.152   3.335  -2.890
   83   2HO*    U   8          2HO*        U   8  12.346   3.613  -3.635
   84    H1*    U   8           H1*        U   8  10.769   0.711  -3.257
   85    H3     U   8           H3         U   8   6.286   0.617  -3.544
   86    H5     U   8           H5         U   8   6.985   1.257   0.547
   87    H6     U   8           H6         U   8   9.341   1.441   0.067
   88   1H5*    U   9          1H5*        U   9  12.590   5.124  -4.052
   89   2H5*    U   9          2H5*        U   9  12.340   6.877  -4.029
   90    H4*    U   9           H4*        U   9  11.468   5.870  -6.115
   91    H3*    U   9           H3*        U   9   9.369   6.967  -4.224
   92    H2*    U   9           H2*        U   9   7.814   6.617  -6.060
   93   2HO*    U   9          2HO*        U   9   9.189   7.236  -7.781
   94    H1*    U   9           H1*        U   9   8.749   4.105  -6.609
   95    H3     U   9           H3         U   9   4.769   3.409  -4.534
   96    H5     U   9           H5         U   9   7.333   4.575  -1.421
   97    H6     U   9           H6         U   9   9.053   4.979  -3.067
   98   1H5*    G  10          1H5*        G  10   7.176  10.637  -7.423
   99   2H5*    G  10          2H5*        G  10   6.555   9.410  -6.299
  100    H4*    G  10           H4*        G  10   6.952   9.010  -9.298
  101    H3*    G  10           H3*        G  10   4.520   9.536  -7.567
  102    H2*    G  10           H2*        G  10   3.245   8.213  -9.141
  103   2HO*    G  10          2HO*        G  10   5.642   8.220 -10.708
  104    H1*    G  10           H1*        G  10   5.095   6.217  -9.274
  105    H8     G  10           H8         G  10   2.525   5.583  -8.487
  106    H1     G  10           H1         G  10   4.313   6.832  -2.454
  107   1H2     G  10          1H2         G  10   6.212   8.010  -2.449
  108   2H2     G  10          2H2         G  10   7.011   8.470  -3.937
  109   1H5*    C  11          1H5*        C  11   2.663   9.705 -10.977
  110   2H5*    C  11          2H5*        C  11   1.838  11.264 -11.181
  111    H4*    C  11           H4*        C  11   0.194   9.483 -11.396
  112    H3*    C  11           H3*        C  11   0.041  11.041  -8.803
  113    H2*    C  11           H2*        C  11  -2.029   9.838  -8.382
  114   2HO*    C  11          2HO*        C  11  -2.718   9.831 -10.635
  115    H1*    C  11           H1*        C  11  -0.992   7.419  -9.011
  116   1H4     C  11          1H4         C  11   0.113   8.292  -2.805
  117   2H4     C  11          2H4         C  11   1.720   8.892  -3.169
  118    H5     C  11           H5         C  11   2.507   9.241  -5.460
  119    H6     C  11           H6         C  11   1.890   9.107  -7.793
  120   1H5*    U  12          1H5*        U  12  -3.875  11.177 -10.489
  121   2H5*    U  12          2H5*        U  12  -4.513  12.831 -10.402
  122    H4*    U  12           H4*        U  12  -6.098  11.274  -9.381
  123    H3*    U  12           H3*        U  12  -4.657  13.074  -7.404
  124    H2*    U  12           H2*        U  12  -6.263  12.249  -5.787
  125   2HO*    U  12          2HO*        U  12  -7.942  10.859  -6.462
  126    H1*    U  12           H1*        U  12  -5.923   9.647  -6.507
  127    H3     U  12           H3         U  12  -3.732  10.352  -2.551
  128    H5     U  12           H5         U  12  -0.985  11.417  -5.543
  129    H6     U  12           H6         U  12  -2.758  11.215  -7.169
  130   1H5*    C  13          1H5*        C  13  -8.695  13.521  -6.637
  131   2H5*    C  13          2H5*        C  13  -9.122  15.233  -6.432
  132    H4*    C  13           H4*        C  13  -9.797  13.949  -4.440
  133    H3*    C  13           H3*        C  13  -7.445  15.829  -4.062
  134    H2*    C  13           H2*        C  13  -7.612  15.324  -1.713
  135   2HO*    C  13          2HO*        C  13  -9.986  15.321  -1.726
  136    H1*    C  13           H1*        C  13  -8.028  12.623  -2.089
  137   1H4     C  13          1H4         C  13  -1.900  13.596  -0.785
  138   2H4     C  13          2H4         C  13  -1.533  13.856  -2.481
  139    H5     C  13           H5         C  13  -3.286  13.924  -4.207
  140    H6     C  13           H6         C  13  -5.669  13.767  -4.596
  141   1H5*    U  14          1H5*        U  14  -9.190  16.878  -0.842
  142   2H5*    U  14          2H5*        U  14  -9.355  18.642  -0.720
  143    H4*    U  14           H4*        U  14  -7.949  17.818   1.111
  144    H3*    U  14           H3*        U  14  -6.460  19.340  -1.045
  145    H2*    U  14           H2*        U  14  -4.544  19.242   0.402
  146   2HO*    U  14          2HO*        U  14  -5.657  19.628   2.372
  147    H1*    U  14           H1*        U  14  -4.918  16.609   1.093
  148    H3     U  14           H3         U  14  -1.262  16.842  -1.648
  149    H5     U  14           H5         U  14  -4.551  17.081  -4.252
  150    H6     U  14           H6         U  14  -6.000  17.197  -2.318
  151   1H5*    U  15          1H5*        U  15  -6.650  23.482   2.900
  152   2H5*    U  15          2H5*        U  15  -4.913  23.228   2.688
  153    H4*    U  15           H4*        U  15  -5.454  23.500   5.040
  154    H3*    U  15           H3*        U  15  -3.873  21.431   4.148
  155    H2*    U  15           H2*        U  15  -5.596  19.824   4.108
  156   2HO*    U  15          2HO*        U  15  -4.528  19.780   6.746
  157    H1*    U  15           H1*        U  15  -6.598  20.916   6.747
  158    H3     U  15           H3         U  15 -10.263  18.308   6.943
  159    H5     U  15           H5         U  15  -9.329  18.294   2.845
  160    H6     U  15           H6         U  15  -7.521  19.832   3.312
  161   1H5*    C  16          1H5*        C  16  -2.028  19.997   6.419
  162   2H5*    C  16          2H5*        C  16  -0.919  20.956   7.411
  163    H4*    C  16           H4*        C  16   0.279  19.146   6.419
  164    H3*    C  16           H3*        C  16   1.218  21.708   6.291
  165    H2*    C  16           H2*        C  16   0.064  22.170   4.194
  166   2HO*    C  16          2HO*        C  16   2.289  22.778   3.980
  167    H1*    C  16           H1*        C  16   1.258  19.568   3.191
  168   1H4     C  16          1H4         C  16  -2.421  20.837  -1.847
  169   2H4     C  16          2H4         C  16  -3.738  21.367  -0.812
  170    H5     C  16           H5         C  16  -3.554  21.497   1.607
  171    H6     C  16           H6         C  16  -2.096  21.082   3.501
  172   1H5*    G  17          1H5*        G  17   3.496  16.304   6.741
  173   2H5*    G  17          2H5*        G  17   2.230  15.786   5.610
  174    H4*    G  17           H4*        G  17   1.909  16.756   8.454
  175    H3*    G  17           H3*        G  17   0.717  14.572   6.693
  176    H2*    G  17           H2*        G  17  -1.040  14.457   8.323
  177   2HO*    G  17          2HO*        G  17   0.437  14.604  10.165
  178    H1*    G  17           H1*        G  17  -1.034  17.224   8.767
  179    H8     G  17           H8         G  17  -3.457  16.272   8.596
  180    H1     G  17           H1         G  17  -3.007  16.315   2.203
  181   1H2     G  17          1H2         G  17  -0.932  16.615   1.600
  182   2H2     G  17          2H2         G  17   0.380  16.745   2.763
  183   1H5*    G  18          1H5*        G  18  -0.468  12.774   9.716
  184   2H5*    G  18          2H5*        G  18  -0.200  11.027   9.588
  185    H4*    G  18           H4*        G  18  -2.598  11.522   9.548
  186    H3*    G  18           H3*        G  18  -1.490  10.587   6.888
  187    H2*    G  18           H2*        G  18  -3.826  10.490   6.170
  188   2HO*    G  18          2HO*        G  18  -4.674   9.832   8.268
  189    H1*    G  18           H1*        G  18  -4.347  13.007   6.996
  190    H8     G  18           H8         G  18  -0.690  13.123   6.199
  191    H1     G  18           H1         G  18  -4.370  13.057   0.950
  192   1H2     G  18          1H2         G  18  -6.464  12.624   1.503
  193   2H2     G  18          2H2         G  18  -6.947  12.320   3.161
  194   1H5*    A  19          1H5*        A  19  -4.823   8.193   7.816
  195   2H5*    A  19          2H5*        A  19  -4.560   6.488   7.407
  196    H4*    A  19           H4*        A  19  -6.592   7.373   6.318
  197    H3*    A  19           H3*        A  19  -4.293   6.719   4.452
  198    H2*    A  19           H2*        A  19  -5.936   7.015   2.678
  199   2HO*    A  19          2HO*        A  19  -8.097   7.483   3.210
  200    H1*    A  19           H1*        A  19  -6.734   9.408   3.614
  201    H8     A  19           H8         A  19  -3.152   9.287   4.707
  202   1H6     A  19          1H6         A  19  -1.639  10.566  -1.174
  203   2H6     A  19          2H6         A  19  -1.028  10.420   0.462
  204    H2     A  19           H2         A  19  -5.976   9.623  -1.038
  205   1H5*    G  20          1H5*        G  20  -7.804   4.682   3.369
  206   2H5*    G  20          2H5*        G  20  -7.517   3.097   2.609
  207    H4*    G  20           H4*        G  20  -8.834   4.755   1.210
  208    H3*    G  20           H3*        G  20  -6.280   3.478   0.238
  209    H2*    G  20           H2*        G  20  -6.616   4.580  -1.878
  210   2HO*    G  20          2HO*        G  20  -8.938   4.259  -1.908
  211    H1*    G  20           H1*        G  20  -7.265   7.015  -0.811
  212    H8     G  20           H8         G  20  -4.696   5.920   1.614
  213    H1     G  20           H1         G  20  -2.145   7.399  -4.079
  214   1H2     G  20          1H2         G  20  -3.711   7.387  -5.643
  215   2H2     G  20          2H2         G  20  -5.395   7.077  -5.263
  216   1H5*    G  21          1H5*        G  21  -8.509   2.122  -2.789
  217   2H5*    G  21          2H5*        G  21  -8.206   0.397  -3.098
  218    H4*    G  21           H4*        G  21  -7.360   1.732  -4.976
  219    H3*    G  21           H3*        G  21  -5.186   0.627  -3.171
  220    H2*    G  21           H2*        G  21  -3.635   1.417  -4.838
  221   2HO*    G  21          2HO*        G  21  -4.898   0.939  -6.726
  222    H1*    G  21           H1*        G  21  -4.781   3.871  -5.010
  223    H8     G  21           H8         G  21  -5.075   2.550  -1.468
  224    H1     G  21           H1         G  21   0.779   4.684  -3.004
  225   1H2     G  21          1H2         G  21   0.865   5.085  -5.208
  226   2H2     G  21          2H2         G  21  -0.532   4.839  -6.229
  227   1H5*    A  22          1H5*        A  22  -4.659  -0.502  -7.400
  228   2H5*    A  22          2H5*        A  22  -3.988  -2.138  -7.496
  229    H4*    A  22           H4*        A  22  -2.737  -0.507  -8.891
  230    H3*    A  22           H3*        A  22  -1.186  -1.697  -6.565
  231    H2*    A  22           H2*        A  22   0.740  -0.696  -7.661
  232   2HO*    A  22          2HO*        A  22  -0.085  -1.080  -9.858
  233    H1*    A  22           H1*        A  22  -0.476   1.705  -7.939
  234    H8     A  22           H8         A  22  -1.908   0.386  -4.727
  235   1H6     A  22          1H6         A  22   3.479   2.033  -2.106
  236   2H6     A  22          2H6         A  22   1.834   1.516  -1.785
  237    H2     A  22           H2         A  22   3.942   2.307  -6.508
  238   1H5*    U  23          1H5*        U  23   1.291  -2.188  -9.560
  239   2H5*    U  23          2H5*        U  23   1.883  -3.856  -9.690
  240    H4*    U  23           H4*        U  23   3.769  -2.290  -9.479
  241    H3*    U  23           H3*        U  23   3.242  -4.063  -7.076
  242    H2*    U  23           H2*        U  23   5.398  -3.260  -6.260
  243   2HO*    U  23          2HO*        U  23   6.372  -3.185  -8.424
  244    H1*    U  23           H1*        U  23   4.827  -0.652  -6.810
  245    H3     U  23           H3         U  23   4.604  -1.511  -2.296
  246    H5     U  23           H5         U  23   0.724  -2.123  -3.787
  247    H6     U  23           H6         U  23   1.607  -1.916  -6.029
  248   1H5*    U  24          1H5*        U  24   7.252  -4.550  -8.037
  249   2H5*    U  24          2H5*        U  24   7.660  -6.274  -8.164
  250    H4*    U  24           H4*        U  24   9.205  -5.095  -6.626
  251    H3*    U  24           H3*        U  24   7.302  -7.088  -5.365
  252    H2*    U  24           H2*        U  24   8.633  -6.807  -3.358
  253   2HO*    U  24          2HO*        U  24  10.555  -5.581  -3.426
  254    H1*    U  24           H1*        U  24   8.761  -4.047  -3.624
  255    H3     U  24           H3         U  24   6.153  -5.249  -0.030
  256    H5     U  24           H5         U  24   3.564  -4.930  -3.324
  257    H6     U  24           H6         U  24   5.498  -4.827  -4.771
  258   1H5*    U  25          1H5*        U  25  11.028  -8.428  -4.067
  259   2H5*    U  25          2H5*        U  25  11.123 -10.195  -4.247
  260    H4*    U  25           H4*        U  25  11.519  -9.616  -1.911
  261    H3*    U  25           H3*        U  25   8.765 -10.805  -2.384
  262    H2*    U  25           H2*        U  25   8.642 -10.921   0.051
  263   2HO*    U  25          2HO*        U  25  10.889 -11.449   0.396
  264    H1*    U  25           H1*        U  25   9.512  -8.360   0.366
  265    H3     U  25           H3         U  25   5.070  -8.097   1.143
  266    H5     U  25           H5         U  25   5.313  -8.562  -3.021
  267    H6     U  25           H6         U  25   7.695  -8.869  -2.789
  268   1H5*    G  26          1H5*        G  26  10.874 -13.188   0.574
  269   2H5*    G  26          2H5*        G  26  10.447 -14.901   0.407
  270    H4*    G  26           H4*        G  26  10.108 -14.089   2.714
  271    H3*    G  26           H3*        G  26   7.559 -14.811   1.229
  272    H2*    G  26           H2*        G  26   6.521 -14.629   3.433
  273   2HO*    G  26          2HO*        G  26   8.333 -15.480   4.643
  274    H1*    G  26           H1*        G  26   7.649 -12.218   3.927
  275    H8     G  26           H8         G  26   7.183 -12.245   0.201
  276    H1     G  26           H1         G  26   1.706 -11.378   3.429
  277   1H2     G  26          1H2         G  26   2.015 -11.858   5.575
  278   2H2     G  26          2H2         G  26   3.577 -12.354   6.193
  279   1H5*    G  27          1H5*        G  27   7.812 -17.130   4.786
  280   2H5*    G  27          2H5*        G  27   7.181 -18.773   4.562
  281    H4*    G  27           H4*        G  27   6.030 -17.599   6.416
  282    H3*    G  27           H3*        G  27   4.341 -18.204   3.995
  283    H2*    G  27           H2*        G  27   2.468 -17.491   5.431
  284   2HO*    G  27          2HO*        G  27   2.872 -16.940   7.595
  285    H1*    G  27           H1*        G  27   3.698 -15.208   6.188
  286    H8     G  27           H8         G  27   5.036 -15.716   2.722
  287    H1     G  27           H1         G  27  -1.063 -13.722   2.791
  288   1H2     G  27          1H2         G  27  -1.905 -13.927   4.832
  289   2H2     G  27          2H2         G  27  -0.940 -14.514   6.173
  290   1H5*    C  28          1H5*        C  28   2.560 -19.765   7.369
  291   2H5*    C  28          2H5*        C  28   1.829 -21.371   7.152
  292    H4*    C  28           H4*        C  28   0.146 -19.730   7.917
  293    H3*    C  28           H3*        C  28  -0.174 -20.699   5.059
  294    H2*    C  28           H2*        C  28  -2.307 -19.517   5.103
  295   2HO*    C  28          2HO*        C  28  -2.795 -20.012   7.341
  296    H1*    C  28           H1*        C  28  -1.232 -17.255   6.143
  297   1H4     C  28          1H4         C  28  -0.791 -16.629  -0.155
  298   2H4     C  28          2H4         C  28   0.839 -17.272  -0.115
  299    H5     C  28           H5         C  28   1.849 -18.191   1.914
  300    H6     C  28           H6         C  28   1.490 -18.633   4.261
  301   1H5*    C  29          1H5*        C  29  -3.846 -21.430   6.927
  302   2H5*    C  29          2H5*        C  29  -4.547 -22.991   6.462
  303    H4*    C  29           H4*        C  29  -6.098 -21.153   5.944
  304    H3*    C  29           H3*        C  29  -4.845 -22.489   3.526
  305    H2*    C  29           H2*        C  29  -6.435 -21.210   2.222
  306   2HO*    C  29          2HO*        C  29  -8.203 -21.408   3.741
  307    H1*    C  29           H1*        C  29  -5.943 -18.877   3.558
  308   1H4     C  29          1H4         C  29  -2.075 -19.167  -1.484
  309   2H4     C  29          2H4         C  29  -0.836 -19.952  -0.521
  310    H5     C  29           H5         C  29  -1.206 -20.619   1.812
  311    H6     C  29           H6         C  29  -2.828 -20.683   3.602
  312    H3T    C  29           H3T        C  29  -6.878 -23.571   3.570
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -7.369 -15.192  -9.360
    2   2H5*    G   1          2H5*        G   1  -7.417 -13.515  -8.782
    3    H4*    G   1           H4*        G   1  -9.026 -14.814  -7.525
    4    H3*    G   1           H3*        G   1  -6.552 -14.121  -5.914
    5    H2*    G   1           H2*        G   1  -7.781 -14.989  -4.004
    6   2HO*    G   1          2HO*        G   1  -9.937 -15.702  -4.283
    7    H1*    G   1           H1*        G   1  -8.473 -17.277  -5.278
    8    H8     G   1           H8         G   1  -5.195 -16.508  -6.866
    9    H1     G   1           H1         G   1  -4.593 -18.517  -0.802
   10   1H2     G   1          1H2         G   1  -6.574 -18.484   0.202
   11   2H2     G   1          2H2         G   1  -8.030 -18.003  -0.646
   12    H5T    G   1           H5T        G   1  -5.272 -14.297  -9.014
   13   1H5*    G   2          1H5*        G   2  -9.871 -12.993  -3.716
   14   2H5*    G   2          2H5*        G   2  -9.710 -11.372  -3.015
   15    H4*    G   2           H4*        G   2 -10.281 -13.013  -1.277
   16    H3*    G   2           H3*        G   2  -7.474 -11.876  -1.143
   17    H2*    G   2           H2*        G   2  -7.337 -12.974   1.045
   18   2HO*    G   2          2HO*        G   2  -9.165 -14.029   1.882
   19    H1*    G   2           H1*        G   2  -8.272 -15.330   0.103
   20    H8     G   2           H8         G   2  -6.438 -14.004  -2.874
   21    H1     G   2           H1         G   2  -2.538 -16.153   1.750
   22   1H2     G   2          1H2         G   2  -3.683 -16.438   3.631
   23   2H2     G   2          2H2         G   2  -5.405 -16.122   3.720
   24   1H5*    C   3          1H5*        C   3  -9.257 -11.307   2.485
   25   2H5*    C   3          2H5*        C   3  -8.939  -9.730   3.235
   26    H4*    C   3           H4*        C   3  -8.230 -11.591   4.705
   27    H3*    C   3           H3*        C   3  -5.982  -9.918   3.539
   28    H2*    C   3           H2*        C   3  -4.545 -11.134   5.100
   29   2HO*    C   3          2HO*        C   3  -5.470 -12.580   6.581
   30    H1*    C   3           H1*        C   3  -5.610 -13.565   4.407
   31   1H4     C   3          1H4         C   3  -0.710 -12.644   0.483
   32   2H4     C   3          2H4         C   3  -1.789 -11.962  -0.717
   33    H5     C   3           H5         C   3  -4.153 -11.513  -0.264
   34    H6     C   3           H6         C   3  -5.895 -11.659   1.406
   35   1H5*    C   4          1H5*        C   4  -5.586  -9.859   7.623
   36   2H5*    C   4          2H5*        C   4  -5.113  -8.275   8.278
   37    H4*    C   4           H4*        C   4  -3.454  -9.998   8.887
   38    H3*    C   4           H3*        C   4  -2.490  -8.013   6.801
   39    H2*    C   4           H2*        C   4  -0.300  -9.009   7.207
   40   2HO*    C   4          2HO*        C   4  -0.053 -10.580   8.821
   41    H1*    C   4           H1*        C   4  -1.269 -11.554   7.012
   42   1H4     C   4          1H4         C   4   0.597  -9.959   1.187
   43   2H4     C   4          2H4         C   4  -0.952  -9.207   0.846
   44    H5     C   4           H5         C   4  -2.710  -8.985   2.549
   45    H6     C   4           H6         C   4  -3.275  -9.423   4.861
   46   1H5*    A   5          1H5*        A   5   0.193  -8.072  10.083
   47   2H5*    A   5          2H5*        A   5   0.936  -6.487  10.379
   48    H4*    A   5           H4*        A   5   2.630  -8.270   9.956
   49    H3*    A   5           H3*        A   5   2.421  -6.080   7.868
   50    H2*    A   5           H2*        A   5   4.423  -7.079   6.894
   51   2HO*    A   5          2HO*        A   5   5.421  -8.849   7.950
   52    H1*    A   5           H1*        A   5   3.403  -9.602   6.978
   53    H8     A   5           H8         A   5   0.416  -7.429   6.283
   54   1H6     A   5          1H6         A   5   2.507  -7.295   0.414
   55   2H6     A   5          2H6         A   5   1.133  -6.916   1.440
   56    H2     A   5           H2         A   5   5.712  -8.901   2.998
   57   1H5*    U   6          1H5*        U   6   6.356  -6.436   8.205
   58   2H5*    U   6          2H5*        U   6   7.118  -4.873   8.555
   59    H4*    U   6           H4*        U   6   8.123  -5.851   6.544
   60    H3*    U   6           H3*        U   6   6.340  -3.451   6.056
   61    H2*    U   6           H2*        U   6   7.190  -3.487   3.794
   62   2HO*    U   6          2HO*        U   6   9.370  -4.018   4.254
   63    H1*    U   6           H1*        U   6   6.955  -6.197   3.522
   64    H3     U   6           H3         U   6   3.650  -4.456   0.929
   65    H5     U   6           H5         U   6   2.187  -4.102   4.853
   66    H6     U   6           H6         U   6   4.339  -4.843   5.661
   67   1H5*    C   7          1H5*        C   7  10.656  -3.061   4.672
   68   2H5*    C   7          2H5*        C   7  11.129  -1.365   4.886
   69    H4*    C   7           H4*        C   7  11.743  -2.107   2.647
   70    H3*    C   7           H3*        C   7   9.382  -0.197   2.668
   71    H2*    C   7           H2*        C   7   9.762  -0.082   0.272
   72   2HO*    C   7          2HO*        C   7  11.533  -1.118  -0.653
   73    H1*    C   7           H1*        C   7   9.911  -2.785   0.013
   74   1H4     C   7          1H4         C   7   3.672  -1.754  -0.554
   75   2H4     C   7          2H4         C   7   3.514  -1.584   1.179
   76    H5     C   7           H5         C   7   5.414  -1.583   2.698
   77    H6     C   7           H6         C   7   7.825  -1.767   2.835
   78   1H5*    U   8          1H5*        U   8  12.860   1.089   0.388
   79   2H5*    U   8          2H5*        U   8  13.011   2.855   0.355
   80    H4*    U   8           H4*        U   8  13.081   1.976  -1.925
   81    H3*    U   8           H3*        U   8  10.482   3.407  -1.276
   82    H2*    U   8           H2*        U   8  10.077   3.269  -3.652
   83   2HO*    U   8          2HO*        U   8  11.682   2.498  -5.051
   84    H1*    U   8           H1*        U   8  10.813   0.637  -3.799
   85    H3     U   8           H3         U   8   6.325   0.329  -4.134
   86    H5     U   8           H5         U   8   6.925   1.479  -0.138
   87    H6     U   8           H6         U   8   9.283   1.670  -0.597
   88   1H5*    U   9          1H5*        U   9  12.868   5.171  -4.610
   89   2H5*    U   9          2H5*        U   9  12.594   6.926  -4.674
   90    H4*    U   9           H4*        U   9  12.265   5.983  -6.892
   91    H3*    U   9           H3*        U   9   9.646   6.748  -5.561
   92    H2*    U   9           H2*        U   9   8.676   6.392  -7.753
   93   2HO*    U   9          2HO*        U   9  10.389   7.226  -9.027
   94    H1*    U   9           H1*        U   9   9.947   4.003  -8.088
   95    H3     U   9           H3         U   9   5.686   2.858  -7.089
   96    H5     U   9           H5         U   9   7.250   4.151  -3.409
   97    H6     U   9           H6         U   9   9.265   4.807  -4.555
   98   1H5*    G  10          1H5*        G  10   7.180  10.421  -6.757
   99   2H5*    G  10          2H5*        G  10   6.567   9.361  -5.477
  100    H4*    G  10           H4*        G  10   7.060   8.493  -8.366
  101    H3*    G  10           H3*        G  10   4.562   9.200  -6.806
  102    H2*    G  10           H2*        G  10   3.417   7.699  -8.341
  103   2HO*    G  10          2HO*        G  10   4.712   8.360 -10.211
  104    H1*    G  10           H1*        G  10   5.378   5.781  -8.183
  105    H8     G  10           H8         G  10   2.602   5.303  -7.677
  106    H1     G  10           H1         G  10   4.076   6.200  -1.497
  107   1H2     G  10          1H2         G  10   6.032   7.264  -1.328
  108   2H2     G  10          2H2         G  10   6.943   7.734  -2.745
  109   1H5*    C  11          1H5*        C  11   2.861   9.075 -10.344
  110   2H5*    C  11          2H5*        C  11   2.055  10.621 -10.682
  111    H4*    C  11           H4*        C  11   0.403   8.856 -10.864
  112    H3*    C  11           H3*        C  11   0.172  10.528  -8.347
  113    H2*    C  11           H2*        C  11  -1.925   9.372  -7.953
  114   2HO*    C  11          2HO*        C  11  -2.728   7.920  -9.517
  115    H1*    C  11           H1*        C  11  -0.897   6.911  -8.454
  116   1H4     C  11          1H4         C  11  -0.058   7.986  -2.242
  117   2H4     C  11          2H4         C  11   1.575   8.548  -2.552
  118    H5     C  11           H5         C  11   2.460   8.832  -4.817
  119    H6     C  11           H6         C  11   1.945   8.626  -7.171
  120   1H5*    U  12          1H5*        U  12  -3.633  10.554 -10.161
  121   2H5*    U  12          2H5*        U  12  -4.282  12.204 -10.241
  122    H4*    U  12           H4*        U  12  -5.926  10.747  -9.195
  123    H3*    U  12           H3*        U  12  -4.559  12.643  -7.255
  124    H2*    U  12           H2*        U  12  -6.252  11.927  -5.669
  125   2HO*    U  12          2HO*        U  12  -7.976  11.765  -7.268
  126    H1*    U  12           H1*        U  12  -5.917   9.290  -6.223
  127    H3     U  12           H3         U  12  -3.864  10.146  -2.229
  128    H5     U  12           H5         U  12  -0.986  11.025  -5.159
  129    H6     U  12           H6         U  12  -2.704  10.788  -6.839
  130   1H5*    C  13          1H5*        C  13  -8.630  13.346  -6.645
  131   2H5*    C  13          2H5*        C  13  -8.920  15.098  -6.584
  132    H4*    C  13           H4*        C  13  -9.728  14.042  -4.515
  133    H3*    C  13           H3*        C  13  -7.210  15.713  -4.207
  134    H2*    C  13           H2*        C  13  -7.524  15.422  -1.829
  135   2HO*    C  13          2HO*        C  13  -9.888  15.626  -1.960
  136    H1*    C  13           H1*        C  13  -8.159  12.745  -2.031
  137   1H4     C  13          1H4         C  13  -2.019  13.351  -0.545
  138   2H4     C  13          2H4         C  13  -1.571  13.443  -2.240
  139    H5     C  13           H5         C  13  -3.252  13.508  -4.037
  140    H6     C  13           H6         C  13  -5.625  13.499  -4.513
  141   1H5*    U  14          1H5*        U  14  -9.005  17.146  -1.138
  142   2H5*    U  14          2H5*        U  14  -8.983  18.923  -1.125
  143    H4*    U  14           H4*        U  14  -7.792  18.073   0.839
  144    H3*    U  14           H3*        U  14  -5.991  19.265  -1.286
  145    H2*    U  14           H2*        U  14  -4.250  19.116   0.412
  146   2HO*    U  14          2HO*        U  14  -4.905  18.194   2.499
  147    H1*    U  14           H1*        U  14  -4.912  16.550   1.101
  148    H3     U  14           H3         U  14  -1.030  16.405  -1.324
  149    H5     U  14           H5         U  14  -4.075  16.752  -4.197
  150    H6     U  14           H6         U  14  -5.660  17.069  -2.397
  151   1H5*    U  15          1H5*        U  15  -3.947  22.267   1.700
  152   2H5*    U  15          2H5*        U  15  -4.936  20.893   2.218
  153    H4*    U  15           H4*        U  15  -4.627  23.598   3.571
  154    H3*    U  15           H3*        U  15  -3.110  21.345   3.776
  155    H2*    U  15           H2*        U  15  -4.956  19.862   4.024
  156   2HO*    U  15          2HO*        U  15  -4.880  19.154   6.202
  157    H1*    U  15           H1*        U  15  -6.012  21.753   6.122
  158    H3     U  15           H3         U  15  -9.572  19.146   7.023
  159    H5     U  15           H5         U  15  -9.086  18.649   2.879
  160    H6     U  15           H6         U  15  -7.162  20.111   2.984
  161   1H5*    C  16          1H5*        C  16  -1.807  20.483   6.289
  162   2H5*    C  16          2H5*        C  16  -0.580  21.446   7.129
  163    H4*    C  16           H4*        C  16   0.276  19.257   6.671
  164    H3*    C  16           H3*        C  16   1.779  21.448   6.063
  165    H2*    C  16           H2*        C  16   0.886  21.571   3.792
  166   2HO*    C  16          2HO*        C  16   3.334  20.099   3.755
  167    H1*    C  16           H1*        C  16   1.472  18.597   3.616
  168   1H4     C  16          1H4         C  16  -1.409  19.400  -2.017
  169   2H4     C  16          2H4         C  16  -2.660  20.389  -1.288
  170    H5     C  16           H5         C  16  -2.660  20.990   1.079
  171    H6     C  16           H6         C  16  -1.437  20.772   3.172
  172   1H5*    G  17          1H5*        G  17   3.090  15.681   6.913
  173   2H5*    G  17          2H5*        G  17   2.137  16.807   5.936
  174    H4*    G  17           H4*        G  17   1.718  16.712   8.934
  175    H3*    G  17           H3*        G  17   0.547  14.759   6.918
  176    H2*    G  17           H2*        G  17  -1.297  14.671   8.481
  177   2HO*    G  17          2HO*        G  17   0.124  14.648  10.379
  178    H1*    G  17           H1*        G  17  -1.137  17.404   9.055
  179    H8     G  17           H8         G  17  -3.645  16.867   8.743
  180    H1     G  17           H1         G  17  -2.922  16.368   2.400
  181   1H2     G  17          1H2         G  17  -0.841  16.284   1.867
  182   2H2     G  17          2H2         G  17   0.454  16.303   3.056
  183   1H5*    G  18          1H5*        G  18  -0.886  13.005   9.986
  184   2H5*    G  18          2H5*        G  18  -0.777  11.238   9.867
  185    H4*    G  18           H4*        G  18  -3.128  11.986   9.828
  186    H3*    G  18           H3*        G  18  -2.094  10.843   7.226
  187    H2*    G  18           H2*        G  18  -4.418  10.958   6.460
  188   2HO*    G  18          2HO*        G  18  -5.376  10.472   8.550
  189    H1*    G  18           H1*        G  18  -4.681  13.556   7.181
  190    H8     G  18           H8         G  18  -1.025  13.317   6.444
  191    H1     G  18           H1         G  18  -4.591  13.179   1.120
  192   1H2     G  18          1H2         G  18  -6.726  12.954   1.644
  193   2H2     G  18          2H2         G  18  -7.268  12.809   3.307
  194   1H5*    A  19          1H5*        A  19  -5.653   8.745   8.098
  195   2H5*    A  19          2H5*        A  19  -5.456   7.004   7.814
  196    H4*    A  19           H4*        A  19  -7.377   7.874   6.555
  197    H3*    A  19           H3*        A  19  -4.995   7.084   4.850
  198    H2*    A  19           H2*        A  19  -6.529   7.331   2.979
  199   2HO*    A  19          2HO*        A  19  -8.707   7.876   3.368
  200    H1*    A  19           H1*        A  19  -7.308   9.791   3.755
  201    H8     A  19           H8         A  19  -3.810   9.633   5.070
  202   1H6     A  19          1H6         A  19  -1.876  10.448  -0.770
  203   2H6     A  19          2H6         A  19  -1.377  10.389   0.910
  204    H2     A  19           H2         A  19  -6.248   9.691  -0.857
  205   1H5*    G  20          1H5*        G  20  -8.484   5.033   3.627
  206   2H5*    G  20          2H5*        G  20  -8.145   3.439   2.900
  207    H4*    G  20           H4*        G  20  -9.381   5.121   1.427
  208    H3*    G  20           H3*        G  20  -6.848   3.706   0.617
  209    H2*    G  20           H2*        G  20  -7.049   4.749  -1.552
  210   2HO*    G  20          2HO*        G  20  -9.386   4.533  -1.655
  211    H1*    G  20           H1*        G  20  -7.612   7.247  -0.597
  212    H8     G  20           H8         G  20  -5.238   6.187   2.009
  213    H1     G  20           H1         G  20  -2.307   7.098  -3.620
  214   1H2     G  20          1H2         G  20  -3.786   7.056  -5.264
  215   2H2     G  20          2H2         G  20  -5.502   6.871  -4.962
  216   1H5*    G  21          1H5*        G  21  -9.032   2.605  -2.510
  217   2H5*    G  21          2H5*        G  21  -8.886   0.867  -2.861
  218    H4*    G  21           H4*        G  21  -7.895   2.158  -4.698
  219    H3*    G  21           H3*        G  21  -5.875   0.792  -2.892
  220    H2*    G  21           H2*        G  21  -4.218   1.472  -4.502
  221   2HO*    G  21          2HO*        G  21  -5.457   1.169  -6.431
  222    H1*    G  21           H1*        G  21  -5.109   4.027  -4.643
  223    H8     G  21           H8         G  21  -5.612   2.687  -1.132
  224    H1     G  21           H1         G  21   0.445   4.326  -2.484
  225   1H2     G  21          1H2         G  21   0.637   4.714  -4.681
  226   2H2     G  21          2H2         G  21  -0.742   4.583  -5.750
  227   1H5*    A  22          1H5*        A  22  -5.436  -0.276  -7.133
  228   2H5*    A  22          2H5*        A  22  -4.863  -1.944  -7.298
  229    H4*    A  22           H4*        A  22  -3.493  -0.323  -8.592
  230    H3*    A  22           H3*        A  22  -2.050  -1.727  -6.313
  231    H2*    A  22           H2*        A  22  -0.052  -0.769  -7.301
  232   2HO*    A  22          2HO*        A  22  -0.822  -0.947  -9.535
  233    H1*    A  22           H1*        A  22  -1.113   1.707  -7.416
  234    H8     A  22           H8         A  22  -2.749   0.120  -4.404
  235   1H6     A  22          1H6         A  22   2.493   1.516  -1.371
  236   2H6     A  22          2H6         A  22   0.842   0.957  -1.177
  237    H2     A  22           H2         A  22   3.168   2.206  -5.695
  238   1H5*    U  23          1H5*        U  23   0.258  -2.259  -9.582
  239   2H5*    U  23          2H5*        U  23   0.847  -3.925  -9.735
  240    H4*    U  23           H4*        U  23   2.729  -2.321  -9.665
  241    H3*    U  23           H3*        U  23   2.421  -4.090  -7.222
  242    H2*    U  23           H2*        U  23   4.625  -3.255  -6.602
  243   2HO*    U  23          2HO*        U  23   5.752  -1.880  -8.032
  244    H1*    U  23           H1*        U  23   3.944  -0.653  -7.140
  245    H3     U  23           H3         U  23   4.249  -1.337  -2.630
  246    H5     U  23           H5         U  23   0.309  -2.379  -3.655
  247    H6     U  23           H6         U  23   0.907  -2.142  -5.988
  248   1H5*    U  24          1H5*        U  24   6.311  -4.459  -8.522
  249   2H5*    U  24          2H5*        U  24   6.780  -6.162  -8.689
  250    H4*    U  24           H4*        U  24   8.424  -4.921  -7.323
  251    H3*    U  24           H3*        U  24   6.739  -6.970  -5.857
  252    H2*    U  24           H2*        U  24   8.262  -6.615  -4.000
  253   2HO*    U  24          2HO*        U  24  10.174  -6.432  -5.356
  254    H1*    U  24           H1*        U  24   8.256  -3.864  -4.289
  255    H3     U  24           H3         U  24   6.017  -5.052  -0.451
  256    H5     U  24           H5         U  24   3.140  -4.940  -3.512
  257    H6     U  24           H6         U  24   4.936  -4.808  -5.126
  258   1H5*    U  25          1H5*        U  25  10.616  -8.226  -4.929
  259   2H5*    U  25          2H5*        U  25  10.704  -9.996  -5.067
  260    H4*    U  25           H4*        U  25  11.283  -9.330  -2.787
  261    H3*    U  25           H3*        U  25   8.533 -10.593  -3.005
  262    H2*    U  25           H2*        U  25   8.620 -10.644  -0.560
  263   2HO*    U  25          2HO*        U  25  10.912 -11.095  -0.404
  264    H1*    U  25           H1*        U  25   9.436  -8.053  -0.397
  265    H3     U  25           H3         U  25   5.066  -7.882   0.742
  266    H5     U  25           H5         U  25   4.974  -8.481  -3.410
  267    H6     U  25           H6         U  25   7.376  -8.712  -3.371
  268   1H5*    G  26          1H5*        G  26  10.937 -12.801  -0.150
  269   2H5*    G  26          2H5*        G  26  10.563 -14.532  -0.228
  270    H4*    G  26           H4*        G  26  10.371 -13.656   2.072
  271    H3*    G  26           H3*        G  26   7.748 -14.512   0.805
  272    H2*    G  26           H2*        G  26   6.863 -14.293   3.071
  273   2HO*    G  26          2HO*        G  26   8.798 -15.040   4.166
  274    H1*    G  26           H1*        G  26   7.938 -11.831   3.409
  275    H8     G  26           H8         G  26   7.200 -11.989  -0.267
  276    H1     G  26           H1         G  26   1.946 -11.209   3.331
  277   1H2     G  26          1H2         G  26   2.420 -11.638   5.456
  278   2H2     G  26          2H2         G  26   4.039 -12.068   5.973
  279   1H5*    G  27          1H5*        G  27   8.331 -16.703   4.401
  280   2H5*    G  27          2H5*        G  27   7.768 -18.379   4.263
  281    H4*    G  27           H4*        G  27   6.676 -17.217   6.159
  282    H3*    G  27           H3*        G  27   4.866 -17.936   3.856
  283    H2*    G  27           H2*        G  27   3.062 -17.274   5.402
  284   2HO*    G  27          2HO*        G  27   3.591 -16.663   7.527
  285    H1*    G  27           H1*        G  27   4.243 -14.930   6.039
  286    H8     G  27           H8         G  27   5.376 -15.452   2.504
  287    H1     G  27           H1         G  27  -0.776 -13.686   2.939
  288   1H2     G  27          1H2         G  27  -1.476 -13.877   5.036
  289   2H2     G  27          2H2         G  27  -0.403 -14.404   6.320
  290   1H5*    C  28          1H5*        C  28   3.364 -19.505   7.351
  291   2H5*    C  28          2H5*        C  28   2.687 -21.145   7.202
  292    H4*    C  28           H4*        C  28   0.989 -19.561   8.045
  293    H3*    C  28           H3*        C  28   0.536 -20.573   5.220
  294    H2*    C  28           H2*        C  28  -1.634 -19.492   5.383
  295   2HO*    C  28          2HO*        C  28  -2.269 -18.512   7.339
  296    H1*    C  28           H1*        C  28  -0.593 -17.167   6.334
  297   1H4     C  28          1H4         C  28  -0.589 -16.644   0.011
  298   2H4     C  28          2H4         C  28   1.064 -17.224  -0.049
  299    H5     C  28           H5         C  28   2.244 -18.058   1.930
  300    H6     C  28           H6         C  28   2.057 -18.466   4.301
  301   1H5*    C  29          1H5*        C  29  -2.923 -21.299   7.337
  302   2H5*    C  29          2H5*        C  29  -3.652 -22.886   7.014
  303    H4*    C  29           H4*        C  29  -5.270 -21.098   6.556
  304    H3*    C  29           H3*        C  29  -4.209 -22.495   4.076
  305    H2*    C  29           H2*        C  29  -5.916 -21.284   2.877
  306   2HO*    C  29          2HO*        C  29  -7.539 -21.462   4.565
  307    H1*    C  29           H1*        C  29  -5.355 -18.899   4.093
  308   1H4     C  29          1H4         C  29  -1.915 -19.263  -1.235
  309   2H4     C  29          2H4         C  29  -0.585 -20.000  -0.362
  310    H5     C  29           H5         C  29  -0.750 -20.622   2.007
  311    H6     C  29           H6         C  29  -2.217 -20.670   3.928
  312    H3T    C  29           H3T        C  29  -5.372 -23.806   5.555
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -7.209 -14.618  -9.272
    2   2H5*    G   1          2H5*        G   1  -7.312 -13.017  -8.518
    3    H4*    G   1           H4*        G   1  -8.926 -14.479  -7.460
    4    H3*    G   1           H3*        G   1  -6.515 -13.903  -5.709
    5    H2*    G   1           H2*        G   1  -7.772 -15.009  -3.941
    6   2HO*    G   1          2HO*        G   1  -9.877 -14.203  -4.649
    7    H1*    G   1           H1*        G   1  -8.366 -17.160  -5.466
    8    H8     G   1           H8         G   1  -5.081 -16.196  -6.911
    9    H1     G   1           H1         G   1  -4.535 -18.711  -1.032
   10   1H2     G   1          1H2         G   1  -6.524 -18.787  -0.058
   11   2H2     G   1          2H2         G   1  -7.979 -18.256  -0.882
   12    H5T    G   1           H5T        G   1  -5.147 -13.716  -8.766
   13   1H5*    G   2          1H5*        G   2  -9.907 -13.005  -3.425
   14   2H5*    G   2          2H5*        G   2  -9.733 -11.450  -2.593
   15    H4*    G   2           H4*        G   2 -10.307 -13.233  -0.996
   16    H3*    G   2           H3*        G   2  -7.507 -12.098  -0.780
   17    H2*    G   2           H2*        G   2  -7.361 -13.381   1.319
   18   2HO*    G   2          2HO*        G   2  -9.613 -13.043   1.917
   19    H1*    G   2           H1*        G   2  -8.296 -15.647   0.189
   20    H8     G   2           H8         G   2  -6.471 -14.103  -2.684
   21    H1     G   2           H1         G   2  -2.545 -16.584   1.749
   22   1H2     G   2          1H2         G   2  -3.676 -17.001   3.612
   23   2H2     G   2          2H2         G   2  -5.396 -16.686   3.735
   24   1H5*    C   3          1H5*        C   3  -9.263 -11.730   2.934
   25   2H5*    C   3          2H5*        C   3  -8.890 -10.200   3.752
   26    H4*    C   3           H4*        C   3  -8.178 -12.162   5.094
   27    H3*    C   3           H3*        C   3  -5.943 -10.436   3.981
   28    H2*    C   3           H2*        C   3  -4.483 -11.756   5.443
   29   2HO*    C   3          2HO*        C   3  -6.005 -11.952   7.199
   30    H1*    C   3           H1*        C   3  -5.585 -14.132   4.628
   31   1H4     C   3          1H4         C   3  -0.753 -13.031   0.663
   32   2H4     C   3          2H4         C   3  -1.850 -12.276  -0.478
   33    H5     C   3           H5         C   3  -4.203 -11.841   0.049
   34    H6     C   3           H6         C   3  -5.913 -12.067   1.741
   35   1H5*    C   4          1H5*        C   4  -5.452 -10.468   8.097
   36   2H5*    C   4          2H5*        C   4  -4.933  -8.895   8.742
   37    H4*    C   4           H4*        C   4  -3.272 -10.654   9.253
   38    H3*    C   4           H3*        C   4  -2.370  -8.628   7.179
   39    H2*    C   4           H2*        C   4  -0.172  -9.656   7.502
   40   2HO*    C   4          2HO*        C   4  -0.396 -10.053   9.790
   41    H1*    C   4           H1*        C   4  -1.169 -12.180   7.281
   42   1H4     C   4          1H4         C   4   0.567 -10.418   1.454
   43   2H4     C   4          2H4         C   4  -0.978  -9.633   1.182
   44    H5     C   4           H5         C   4  -2.692  -9.450   2.932
   45    H6     C   4           H6         C   4  -3.207  -9.964   5.239
   46   1H5*    A   5          1H5*        A   5   0.414  -8.655  10.451
   47   2H5*    A   5          2H5*        A   5   1.175  -7.067  10.677
   48    H4*    A   5           H4*        A   5   2.827  -8.903  10.236
   49    H3*    A   5           H3*        A   5   2.614  -6.714   8.151
   50    H2*    A   5           H2*        A   5   4.584  -7.761   7.147
   51   2HO*    A   5          2HO*        A   5   5.533  -8.377   9.237
   52    H1*    A   5           H1*        A   5   3.502 -10.246   7.230
   53    H8     A   5           H8         A   5   0.525  -8.040   6.620
   54   1H6     A   5          1H6         A   5   2.542  -7.776   0.726
   55   2H6     A   5          2H6         A   5   1.179  -7.418   1.776
   56    H2     A   5           H2         A   5   5.759  -9.487   3.221
   57   1H5*    U   6          1H5*        U   6   6.543  -7.112   8.379
   58   2H5*    U   6          2H5*        U   6   7.331  -5.560   8.711
   59    H4*    U   6           H4*        U   6   8.249  -6.561   6.661
   60    H3*    U   6           H3*        U   6   6.534  -4.096   6.259
   61    H2*    U   6           H2*        U   6   7.306  -4.140   3.964
   62   2HO*    U   6          2HO*        U   6   9.484  -4.755   4.371
   63    H1*    U   6           H1*        U   6   6.973  -6.837   3.677
   64    H3     U   6           H3         U   6   3.685  -4.891   1.201
   65    H5     U   6           H5         U   6   2.280  -4.712   5.157
   66    H6     U   6           H6         U   6   4.437  -5.493   5.903
   67   1H5*    C   7          1H5*        C   7  10.762  -3.832   4.654
   68   2H5*    C   7          2H5*        C   7  11.325  -2.173   4.929
   69    H4*    C   7           H4*        C   7  11.782  -2.822   2.614
   70    H3*    C   7           H3*        C   7   9.547  -0.797   2.933
   71    H2*    C   7           H2*        C   7   9.729  -0.540   0.523
   72   2HO*    C   7          2HO*        C   7  12.000  -0.732   0.311
   73    H1*    C   7           H1*        C   7   9.785  -3.222   0.061
   74   1H4     C   7          1H4         C   7   3.586  -1.898  -0.186
   75   2H4     C   7          2H4         C   7   3.485  -1.923   1.562
   76    H5     C   7           H5         C   7   5.438  -2.132   3.008
   77    H6     C   7           H6         C   7   7.849  -2.398   3.035
   78   1H5*    U   8          1H5*        U   8  13.041   0.578   0.520
   79   2H5*    U   8          2H5*        U   8  13.206   2.341   0.645
   80    H4*    U   8           H4*        U   8  13.126   1.615  -1.723
   81    H3*    U   8           H3*        U   8  10.701   3.161  -0.751
   82    H2*    U   8           H2*        U   8  10.068   3.223  -3.100
   83   2HO*    U   8          2HO*        U   8  11.493   2.456  -4.682
   84    H1*    U   8           H1*        U   8  10.658   0.597  -3.523
   85    H3     U   8           H3         U   8   6.171   0.551  -3.661
   86    H5     U   8           H5         U   8   7.011   1.125   0.416
   87    H6     U   8           H6         U   8   9.354   1.286  -0.141
   88   1H5*    U   9          1H5*        U   9  12.444   4.904  -4.307
   89   2H5*    U   9          2H5*        U   9  12.254   6.667  -4.326
   90    H4*    U   9           H4*        U   9  11.287   5.660  -6.354
   91    H3*    U   9           H3*        U   9   9.255   6.813  -4.424
   92    H2*    U   9           H2*        U   9   7.652   6.467  -6.217
   93   2HO*    U   9          2HO*        U   9   8.999   7.036  -7.982
   94    H1*    U   9           H1*        U   9   8.523   3.932  -6.750
   95    H3     U   9           H3         U   9   4.595   3.355  -4.534
   96    H5     U   9           H5         U   9   7.289   4.503  -1.526
   97    H6     U   9           H6         U   9   8.958   4.855  -3.237
   98   1H5*    G  10          1H5*        G  10   7.031  10.476  -7.606
   99   2H5*    G  10          2H5*        G  10   6.426   9.293  -6.430
  100    H4*    G  10           H4*        G  10   6.708   8.796  -9.430
  101    H3*    G  10           H3*        G  10   4.348   9.429  -7.635
  102    H2*    G  10           H2*        G  10   3.003   8.107  -9.168
  103   2HO*    G  10          2HO*        G  10   4.181   8.837 -11.094
  104    H1*    G  10           H1*        G  10   4.801   6.064  -9.275
  105    H8     G  10           H8         G  10   2.223   5.523  -8.411
  106    H1     G  10           H1         G  10   4.219   6.831  -2.454
  107   1H2     G  10          1H2         G  10   6.154   7.943  -2.525
  108   2H2     G  10          2H2         G  10   6.924   8.355  -4.044
  109   1H5*    C  11          1H5*        C  11   2.369   9.597 -10.997
  110   2H5*    C  11          2H5*        C  11   1.593  11.182 -11.187
  111    H4*    C  11           H4*        C  11  -0.119   9.462 -11.328
  112    H3*    C  11           H3*        C  11  -0.123  11.046  -8.746
  113    H2*    C  11           H2*        C  11  -2.218   9.928  -8.242
  114   2HO*    C  11          2HO*        C  11  -3.169   8.551  -9.789
  115    H1*    C  11           H1*        C  11  -1.300   7.464  -8.893
  116   1H4     C  11          1H4         C  11   0.004   8.387  -2.727
  117   2H4     C  11          2H4         C  11   1.628   8.902  -3.141
  118    H5     C  11           H5         C  11   2.366   9.190  -5.458
  119    H6     C  11           H6         C  11   1.681   9.044  -7.773
  120   1H5*    U  12          1H5*        U  12  -4.044  11.193 -10.344
  121   2H5*    U  12          2H5*        U  12  -4.662  12.856 -10.341
  122    H4*    U  12           H4*        U  12  -6.293  11.401  -9.277
  123    H3*    U  12           H3*        U  12  -4.802  13.201  -7.334
  124    H2*    U  12           H2*        U  12  -6.431  12.463  -5.696
  125   2HO*    U  12          2HO*        U  12  -8.231  12.402  -7.211
  126    H1*    U  12           H1*        U  12  -6.191   9.839  -6.353
  127    H3     U  12           H3         U  12  -3.903  10.466  -2.444
  128    H5     U  12           H5         U  12  -1.177  11.448  -5.485
  129    H6     U  12           H6         U  12  -2.986  11.308  -7.078
  130   1H5*    C  13          1H5*        C  13  -8.864  14.033  -6.548
  131   2H5*    C  13          2H5*        C  13  -9.062  15.798  -6.462
  132    H4*    C  13           H4*        C  13  -9.867  14.794  -4.379
  133    H3*    C  13           H3*        C  13  -7.225  16.272  -4.145
  134    H2*    C  13           H2*        C  13  -7.459  15.978  -1.760
  135   2HO*    C  13          2HO*        C  13  -9.785  16.370  -1.760
  136    H1*    C  13           H1*        C  13  -8.293  13.355  -1.955
  137   1H4     C  13          1H4         C  13  -2.060  13.550  -0.769
  138   2H4     C  13          2H4         C  13  -1.688  13.679  -2.479
  139    H5     C  13           H5         C  13  -3.445  13.868  -4.195
  140    H6     C  13           H6         C  13  -5.833  14.010  -4.554
  141   1H5*    U  14          1H5*        U  14  -8.724  18.026  -1.050
  142   2H5*    U  14          2H5*        U  14  -8.638  19.788  -1.239
  143    H4*    U  14           H4*        U  14  -7.372  19.139   0.760
  144    H3*    U  14           H3*        U  14  -5.587  19.811  -1.577
  145    H2*    U  14           H2*        U  14  -3.767  19.802  -0.062
  146   2HO*    U  14          2HO*        U  14  -4.907  20.738   1.752
  147    H1*    U  14           H1*        U  14  -4.578  17.442   1.061
  148    H3     U  14           H3         U  14  -0.909  16.689  -1.586
  149    H5     U  14           H5         U  14  -4.143  16.853  -4.261
  150    H6     U  14           H6         U  14  -5.560  17.521  -2.418
  151   1H5*    U  15          1H5*        U  15  -7.251  23.741   2.767
  152   2H5*    U  15          2H5*        U  15  -5.515  23.711   2.433
  153    H4*    U  15           H4*        U  15  -5.902  23.824   4.812
  154    H3*    U  15           H3*        U  15  -4.190  21.964   3.765
  155    H2*    U  15           H2*        U  15  -5.650  20.144   3.718
  156   2HO*    U  15          2HO*        U  15  -5.280  18.853   5.573
  157    H1*    U  15           H1*        U  15  -6.871  20.874   6.344
  158    H3     U  15           H3         U  15 -10.603  18.407   5.902
  159    H5     U  15           H5         U  15  -8.986  18.375   2.029
  160    H6     U  15           H6         U  15  -7.284  19.920   2.772
  161   1H5*    C  16          1H5*        C  16  -2.395  20.473   5.895
  162   2H5*    C  16          2H5*        C  16  -1.113  21.264   6.832
  163    H4*    C  16           H4*        C  16  -0.244  19.366   5.608
  164    H3*    C  16           H3*        C  16   1.065  21.775   5.596
  165    H2*    C  16           H2*        C  16  -0.138  22.583   3.651
  166   2HO*    C  16          2HO*        C  16   2.140  22.840   3.312
  167    H1*    C  16           H1*        C  16   0.537  19.927   2.347
  168   1H4     C  16          1H4         C  16  -3.115  22.441  -2.224
  169   2H4     C  16          2H4         C  16  -4.256  23.070  -1.051
  170    H5     C  16           H5         C  16  -3.937  22.830   1.375
  171    H6     C  16           H6         C  16  -2.453  21.937   3.079
  172   1H5*    G  17          1H5*        G  17   2.958  17.162   6.798
  173   2H5*    G  17          2H5*        G  17   1.626  17.588   5.690
  174    H4*    G  17           H4*        G  17   1.412  17.589   8.735
  175    H3*    G  17           H3*        G  17   0.411  15.598   6.669
  176    H2*    G  17           H2*        G  17  -1.362  15.192   8.276
  177   2HO*    G  17          2HO*        G  17   0.097  15.324  10.143
  178    H1*    G  17           H1*        G  17  -1.674  17.862   8.906
  179    H8     G  17           H8         G  17  -4.023  17.062   8.351
  180    H1     G  17           H1         G  17  -2.729  16.765   2.091
  181   1H2     G  17          1H2         G  17  -0.613  17.005   1.736
  182   2H2     G  17          2H2         G  17   0.559  17.173   3.035
  183   1H5*    G  18          1H5*        G  18  -0.645  13.544   9.725
  184   2H5*    G  18          2H5*        G  18  -0.287  11.815   9.552
  185    H4*    G  18           H4*        G  18  -2.722  12.219   9.615
  186    H3*    G  18           H3*        G  18  -1.626  11.270   6.960
  187    H2*    G  18           H2*        G  18  -3.964  11.084   6.258
  188   2HO*    G  18          2HO*        G  18  -4.783  10.436   8.364
  189    H1*    G  18           H1*        G  18  -4.571  13.595   7.034
  190    H8     G  18           H8         G  18  -0.938  13.915   6.205
  191    H1     G  18           H1         G  18  -4.612  13.378   0.984
  192   1H2     G  18          1H2         G  18  -6.688  12.904   1.565
  193   2H2     G  18          2H2         G  18  -7.152  12.636   3.236
  194   1H5*    A  19          1H5*        A  19  -4.869   8.789   8.012
  195   2H5*    A  19          2H5*        A  19  -4.566   7.082   7.644
  196    H4*    A  19           H4*        A  19  -6.641   7.891   6.573
  197    H3*    A  19           H3*        A  19  -4.366   7.210   4.686
  198    H2*    A  19           H2*        A  19  -6.033   7.429   2.930
  199   2HO*    A  19          2HO*        A  19  -8.195   7.881   3.471
  200    H1*    A  19           H1*        A  19  -6.851   9.844   3.794
  201    H8     A  19           H8         A  19  -3.266   9.839   4.864
  202   1H6     A  19          1H6         A  19  -1.783  10.823  -1.077
  203   2H6     A  19          2H6         A  19  -1.171  10.773   0.567
  204    H2     A  19           H2         A  19  -6.111   9.833  -0.881
  205   1H5*    G  20          1H5*        G  20  -7.872   5.117   3.713
  206   2H5*    G  20          2H5*        G  20  -7.588   3.515   2.986
  207    H4*    G  20           H4*        G  20  -8.935   5.141   1.573
  208    H3*    G  20           H3*        G  20  -6.409   3.821   0.593
  209    H2*    G  20           H2*        G  20  -6.786   4.860  -1.552
  210   2HO*    G  20          2HO*        G  20  -9.109   4.552  -1.524
  211    H1*    G  20           H1*        G  20  -7.392   7.329  -0.552
  212    H8     G  20           H8         G  20  -4.798   6.309   1.871
  213    H1     G  20           H1         G  20  -2.315   7.530  -3.913
  214   1H2     G  20          1H2         G  20  -3.902   7.488  -5.450
  215   2H2     G  20          2H2         G  20  -5.583   7.209  -5.038
  216   1H5*    G  21          1H5*        G  21  -8.736   2.410  -2.326
  217   2H5*    G  21          2H5*        G  21  -8.472   0.672  -2.601
  218    H4*    G  21           H4*        G  21  -7.670   1.933  -4.543
  219    H3*    G  21           H3*        G  21  -5.442   0.871  -2.776
  220    H2*    G  21           H2*        G  21  -3.957   1.568  -4.537
  221   2HO*    G  21          2HO*        G  21  -4.791   2.405  -6.489
  222    H1*    G  21           H1*        G  21  -5.071   4.036  -4.737
  223    H8     G  21           H8         G  21  -5.258   2.831  -1.146
  224    H1     G  21           H1         G  21   0.567   4.825  -2.957
  225   1H2     G  21          1H2         G  21   0.581   5.155  -5.172
  226   2H2     G  21          2H2         G  21  -0.856   4.901  -6.137
  227   1H5*    A  22          1H5*        A  22  -5.110  -0.289  -6.920
  228   2H5*    A  22          2H5*        A  22  -4.481  -1.936  -7.085
  229    H4*    A  22           H4*        A  22  -3.280  -0.323  -8.528
  230    H3*    A  22           H3*        A  22  -1.616  -1.530  -6.291
  231    H2*    A  22           H2*        A  22   0.257  -0.549  -7.495
  232   2HO*    A  22          2HO*        A  22  -0.700  -0.925  -9.643
  233    H1*    A  22           H1*        A  22  -0.952   1.863  -7.710
  234    H8     A  22           H8         A  22  -2.195   0.542  -4.420
  235   1H6     A  22          1H6         A  22   3.340   2.212  -2.132
  236   2H6     A  22          2H6         A  22   1.726   1.672  -1.705
  237    H2     A  22           H2         A  22   3.528   2.487  -6.549
  238   1H5*    U  23          1H5*        U  23   0.678  -2.035  -9.414
  239   2H5*    U  23          2H5*        U  23   1.263  -3.701  -9.570
  240    H4*    U  23           H4*        U  23   3.153  -2.130  -9.473
  241    H3*    U  23           H3*        U  23   2.780  -3.903  -7.043
  242    H2*    U  23           H2*        U  23   4.985  -3.099  -6.371
  243   2HO*    U  23          2HO*        U  23   5.809  -3.012  -8.597
  244    H1*    U  23           H1*        U  23   4.366  -0.493  -6.864
  245    H3     U  23           H3         U  23   4.430  -1.417  -2.358
  246    H5     U  23           H5         U  23   0.462  -2.011  -3.608
  247    H6     U  23           H6         U  23   1.198  -1.761  -5.899
  248   1H5*    U  24          1H5*        U  24   6.705  -4.363  -8.224
  249   2H5*    U  24          2H5*        U  24   7.125  -6.080  -8.387
  250    H4*    U  24           H4*        U  24   8.741  -4.881  -6.937
  251    H3*    U  24           H3*        U  24   6.966  -6.933  -5.584
  252    H2*    U  24           H2*        U  24   8.446  -6.653  -3.676
  253   2HO*    U  24          2HO*        U  24  10.396  -6.446  -4.961
  254    H1*    U  24           H1*        U  24   8.446  -3.895  -3.878
  255    H3     U  24           H3         U  24   6.064  -5.367  -0.201
  256    H5     U  24           H5         U  24   3.301  -4.872  -3.325
  257    H6     U  24           H6         U  24   5.153  -4.667  -4.865
  258   1H5*    U  25          1H5*        U  25  10.759  -8.320  -4.548
  259   2H5*    U  25          2H5*        U  25  10.820 -10.078  -4.802
  260    H4*    U  25           H4*        U  25  11.337  -9.580  -2.466
  261    H3*    U  25           H3*        U  25   8.565 -10.758  -2.851
  262    H2*    U  25           H2*        U  25   8.575 -10.979  -0.417
  263   2HO*    U  25          2HO*        U  25  10.828 -11.515  -0.198
  264    H1*    U  25           H1*        U  25   9.456  -8.432  -0.048
  265    H3     U  25           H3         U  25   5.062  -8.333   1.009
  266    H5     U  25           H5         U  25   5.065  -8.458  -3.186
  267    H6     U  25           H6         U  25   7.466  -8.742  -3.113
  268   1H5*    G  26          1H5*        G  26  10.907 -13.221  -0.125
  269   2H5*    G  26          2H5*        G  26  10.499 -14.935  -0.326
  270    H4*    G  26           H4*        G  26  10.340 -14.214   2.034
  271    H3*    G  26           H3*        G  26   7.695 -14.949   0.739
  272    H2*    G  26           H2*        G  26   6.841 -14.874   3.022
  273   2HO*    G  26          2HO*        G  26   8.767 -15.720   4.045
  274    H1*    G  26           H1*        G  26   7.951 -12.453   3.515
  275    H8     G  26           H8         G  26   7.177 -12.350  -0.157
  276    H1     G  26           H1         G  26   1.963 -11.758   3.537
  277   1H2     G  26          1H2         G  26   2.456 -12.316   5.628
  278   2H2     G  26          2H2         G  26   4.073 -12.791   6.103
  279   1H5*    G  27          1H5*        G  27   8.324 -17.390   4.163
  280   2H5*    G  27          2H5*        G  27   7.742 -19.048   3.921
  281    H4*    G  27           H4*        G  27   6.706 -18.013   5.916
  282    H3*    G  27           H3*        G  27   4.851 -18.570   3.607
  283    H2*    G  27           H2*        G  27   3.072 -17.997   5.215
  284   2HO*    G  27          2HO*        G  27   3.626 -17.541   7.371
  285    H1*    G  27           H1*        G  27   4.283 -15.710   5.999
  286    H8     G  27           H8         G  27   5.350 -15.997   2.417
  287    H1     G  27           H1         G  27  -0.773 -14.194   3.084
  288   1H2     G  27          1H2         G  27  -1.439 -14.527   5.171
  289   2H2     G  27          2H2         G  27  -0.357 -15.151   6.399
  290   1H5*    C  28          1H5*        C  28   3.384 -20.376   7.010
  291   2H5*    C  28          2H5*        C  28   2.702 -21.997   6.753
  292    H4*    C  28           H4*        C  28   1.009 -20.480   7.717
  293    H3*    C  28           H3*        C  28   0.542 -21.275   4.825
  294    H2*    C  28           H2*        C  28  -1.624 -20.203   5.076
  295   2HO*    C  28          2HO*        C  28  -2.255 -19.376   7.100
  296    H1*    C  28           H1*        C  28  -0.571 -17.957   6.200
  297   1H4     C  28          1H4         C  28  -0.594 -16.934  -0.058
  298   2H4     C  28          2H4         C  28   1.053 -17.528  -0.176
  299    H5     C  28           H5         C  28   2.231 -18.531   1.721
  300    H6     C  28           H6         C  28   2.057 -19.120   4.056
  301   1H5*    C  29          1H5*        C  29  -2.924 -22.149   6.879
  302   2H5*    C  29          2H5*        C  29  -3.663 -23.696   6.423
  303    H4*    C  29           H4*        C  29  -5.260 -21.855   6.112
  304    H3*    C  29           H3*        C  29  -4.214 -23.072   3.536
  305    H2*    C  29           H2*        C  29  -5.919 -21.754   2.433
  306   2HO*    C  29          2HO*        C  29  -7.549 -22.030   4.090
  307    H1*    C  29           H1*        C  29  -5.324 -19.476   3.823
  308   1H4     C  29          1H4         C  29  -1.883 -19.459  -1.520
  309   2H4     C  29          2H4         C  29  -0.564 -20.282  -0.707
  310    H5     C  29           H5         C  29  -0.736 -21.079   1.610
  311    H6     C  29           H6         C  29  -2.205 -21.256   3.522
  312    H3T    C  29           H3T        C  29  -6.222 -24.180   3.712