Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12418 | 1sy8 RC | 6186 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H5* T 1 1H5' T 1 3.175 -8.195 -4.113
2 2H5* T 1 2H5' T 1 1.554 -8.159 -3.265
3 H4* T 1 H4' T 1 4.037 -6.554 -2.522
4 H3* T 1 H3' T 1 2.595 -8.710 -1.051
5 1H2* T 1 2H2' T 1 1.159 -7.229 0.084
6 2H2* T 1 1H2' T 1 2.597 -6.807 0.848
7 H1* T 1 H1' T 1 3.122 -4.953 -0.257
8 H3 T 1 H3 T 1 0.363 -1.340 -0.130
9 1H5M T 1 1H5M T 1 -2.922 -5.224 0.396
10 2H5M T 1 2H5M T 1 -3.326 -4.230 -1.073
11 3H5M T 1 3H5M T 1 -2.469 -5.799 -1.251
12 H6 T 1 H6 T 1 -0.418 -6.056 -0.712
13 1H5* G 2 1H5' G 2 6.136 -5.848 -0.028
14 2H5* G 2 2H5' G 2 7.120 -6.574 1.234
15 H4* G 2 H4' G 2 7.181 -4.058 1.043
16 H3* G 2 H3' G 2 6.752 -5.714 3.261
17 H1* G 2 H1' G 2 5.419 -2.233 2.913
18 H8 G 2 H8 G 2 2.986 -5.058 2.988
19 H1 G 2 H1 G 2 0.248 0.730 3.454
20 1H2 G 2 1H2 G 2 3.599 1.853 3.483
21 2H2 G 2 2H2 G 2 1.904 2.382 3.493
22 2H2* G 2 1H2' G 2 5.811 -3.535 4.723
23 1H2* G 2 2H2' G 2 4.876 -4.849 4.215
24 1H5* A 3 1H5' A 3 8.022 -1.398 3.541
25 2H5* A 3 2H5' A 3 9.420 -1.214 4.646
26 H4* A 3 H4' A 3 8.268 0.708 4.364
27 H3* A 3 H3' A 3 8.848 -0.622 6.760
28 H1* A 3 H1' A 3 5.764 1.408 6.232
29 H8 A 3 H8 A 3 5.546 -2.154 6.300
30 1H6 A 3 1H6 A 3 -0.727 -1.663 6.733
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.528
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.880 0.692 7.947
34 1H2* A 3 2H2' A 3 6.831 -0.964 7.590
35 1H5* T 4 1H5' T 4 7.417 3.687 6.666
36 2H5* T 4 2H5' T 4 8.450 4.732 7.715
37 H4* T 4 H4' T 4 6.057 5.429 7.576
38 H3* T 4 H3' T 4 7.391 5.087 10.067
39 1H2* T 4 2H2' T 4 5.932 3.461 10.958
40 2H2* T 4 1H2' T 4 4.860 4.794 10.927
41 H1* T 4 H1' T 4 3.740 4.438 9.159
42 H3 T 4 H3 T 4 1.163 0.756 10.014
43 1H5M T 4 1H5M T 4 5.280 -1.596 10.601
44 2H5M T 4 2H5M T 4 5.229 -1.648 8.801
45 3H5M T 4 3H5M T 4 6.420 -0.579 9.647
46 H6 T 4 H6 T 4 5.865 1.594 9.752
47 1H5* C 5 1H5' C 5 3.347 7.481 9.964
48 2H5* C 5 2H5' C 5 3.733 8.924 10.974
49 H4* C 5 H4' C 5 1.449 8.222 11.573
50 H3* C 5 H3' C 5 3.492 8.443 13.505
51 H1* C 5 H1' C 5 0.490 5.936 13.349
52 1H4 C 5 1H4 C 5 3.785 0.016 13.196
53 2H4 C 5 2H4 C 5 2.097 -0.455 13.437
54 H5 C 5 H5 C 5 4.507 2.272 13.156
55 H6 C 5 H6 C 5 3.885 4.665 12.830
56 2H2* C 5 1H2' C 5 1.953 6.713 14.873
57 1H2* C 5 2H2' C 5 3.400 6.153 14.244
58 1H5* A 6 1H5' A 6 -1.007 8.227 14.323
59 2H5* A 6 2H5' A 6 -1.294 9.609 15.452
60 H4* A 6 H4' A 6 -3.125 8.199 15.703
61 H3* A 6 H3' A 6 -1.562 8.515 17.967
62 H1* A 6 H1' A 6 -3.118 5.025 16.816
63 H8 A 6 H8 A 6 0.440 5.861 16.662
64 1H6 A 6 1H6 A 6 1.801 -0.183 16.833
65 2H6 A 6 2H6 A 6 2.461 1.454 16.602
66 H2 A 6 H2 A 6 -2.695 0.411 16.940
67 2H2* A 6 1H2' A 6 -2.416 5.987 18.839
68 1H2* A 6 2H2' A 6 -0.848 6.342 18.312
69 1H5* T 1 1H5' T 1 -3.164 -8.088 21.102
70 2H5* T 1 2H5' T 1 -1.575 -8.141 20.196
71 H4* T 1 H4' T 1 -4.030 -6.488 19.488
72 H3* T 1 H3' T 1 -2.639 -8.681 18.030
73 1H2* T 1 2H2' T 1 -1.185 -7.237 16.863
74 2H2* T 1 1H2' T 1 -2.626 -6.813 16.100
75 H1* T 1 H1' T 1 -3.126 -4.940 17.175
76 H3 T 1 H3 T 1 -0.363 -1.340 17.030
77 1H5M T 1 1H5M T 1 2.512 -5.533 18.478
78 2H5M T 1 2H5M T 1 2.735 -5.585 16.691
79 3H5M T 1 3H5M T 1 3.404 -4.200 17.650
80 H6 T 1 H6 T 1 0.408 -6.056 17.628
81 1H5* G 2 1H5' G 2 -6.183 -5.801 16.955
82 2H5* G 2 2H5' G 2 -7.160 -6.540 15.694
83 H4* G 2 H4' G 2 -7.199 -4.022 15.839
84 H3* G 2 H3' G 2 -6.733 -5.721 13.653
85 H1* G 2 H1' G 2 -5.409 -2.229 13.988
86 H8 G 2 H8 G 2 -2.980 -5.060 13.922
87 H1 G 2 H1 G 2 -0.248 0.730 13.444
88 1H2 G 2 1H2 G 2 -3.599 1.851 13.403
89 2H2 G 2 2H2 G 2 -1.905 2.382 13.401
90 2H2* G 2 1H2' G 2 -5.800 -3.540 12.176
91 1H2* G 2 2H2' G 2 -4.871 -4.852 12.691
92 1H5* A 3 1H5' A 3 -8.009 -1.459 13.399
93 2H5* A 3 2H5' A 3 -9.387 -1.227 12.286
94 H4* A 3 H4' A 3 -8.193 0.666 12.701
95 H3* A 3 H3' A 3 -8.873 -0.503 10.256
96 H1* A 3 H1' A 3 -5.731 1.411 10.742
97 H8 A 3 H8 A 3 -5.553 -2.142 10.614
98 1H6 A 3 1H6 A 3 0.727 -1.662 10.167
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.373
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.907 0.761 9.041
102 1H2* A 3 2H2' A 3 -6.882 -0.905 9.363
103 1H5* T 4 1H5' T 4 -7.258 3.789 10.411
104 2H5* T 4 2H5' T 4 -8.304 4.883 9.429
105 H4* T 4 H4' T 4 -5.905 5.471 9.382
106 H3* T 4 H3' T 4 -7.374 5.074 6.954
107 1H2* T 4 2H2' T 4 -5.955 3.482 6.005
108 2H2* T 4 1H2' T 4 -4.871 4.801 6.003
109 H1* T 4 H1' T 4 -3.701 4.428 7.738
110 H3 T 4 H3 T 4 -1.163 0.756 6.886
111 1H5M T 4 1H5M T 4 -6.427 -0.553 7.313
112 2H5M T 4 2H5M T 4 -5.327 -1.595 6.340
113 3H5M T 4 3H5M T 4 -5.236 -1.629 8.139
114 H6 T 4 H6 T 4 -5.868 1.604 7.197
115 1H5* C 5 1H5' C 5 -3.402 7.478 6.984
116 2H5* C 5 2H5' C 5 -3.771 8.916 5.962
117 H4* C 5 H4' C 5 -1.479 8.191 5.410
118 H3* C 5 H3' C 5 -3.498 8.441 3.448
119 H1* C 5 H1' C 5 -0.490 5.930 3.626
120 1H4 C 5 1H4 C 5 -3.782 0.013 3.735
121 2H4 C 5 2H4 C 5 -2.095 -0.457 3.480
122 H5 C 5 H5 C 5 -4.509 2.272 3.761
123 H6 C 5 H6 C 5 -3.889 4.659 4.099
124 2H2* C 5 1H2' C 5 -1.927 6.740 2.079
125 1H2* C 5 2H2' C 5 -3.384 6.161 2.682
126 1H5* A 6 1H5' A 6 0.990 8.168 2.746
127 2H5* A 6 2H5' A 6 1.339 9.577 1.677
128 H4* A 6 H4' A 6 3.145 8.132 1.441
129 H3* A 6 H3' A 6 1.651 8.574 -0.852
130 H1* A 6 H1' A 6 3.129 5.020 0.179
131 H8 A 6 H8 A 6 -0.427 5.873 0.275
132 1H6 A 6 1H6 A 6 -1.801 -0.184 0.067
133 2H6 A 6 2H6 A 6 -2.461 1.454 0.297
134 H2 A 6 H2 A 6 2.695 0.411 -0.040
135 2H2* A 6 1H2' A 6 2.495 6.082 -1.815
136 1H2* A 6 2H2' A 6 0.917 6.434 -1.314
Start of MODEL 2
1 1H5* T 1 1H5' T 1 2.997 -8.524 -3.900
2 2H5* T 1 2H5' T 1 1.478 -8.621 -2.879
3 H4* T 1 H4' T 1 3.866 -6.800 -2.528
4 H3* T 1 H3' T 1 2.538 -8.780 -0.748
5 1H2* T 1 2H2' T 1 1.146 -7.165 0.282
6 2H2* T 1 1H2' T 1 2.632 -6.697 0.924
7 H1* T 1 H1' T 1 3.127 -4.961 -0.379
8 H3 T 1 H3 T 1 0.363 -1.340 -0.127
9 1H5M T 1 1H5M T 1 -2.478 -5.814 -1.206
10 2H5M T 1 2H5M T 1 -2.895 -5.223 0.445
11 3H5M T 1 3H5M T 1 -3.340 -4.246 -1.024
12 H6 T 1 H6 T 1 -0.412 -6.063 -0.684
13 1H5* G 2 1H5' G 2 6.099 -5.845 -0.008
14 2H5* G 2 2H5' G 2 7.132 -6.556 1.228
15 H4* G 2 H4' G 2 7.190 -4.046 1.049
16 H3* G 2 H3' G 2 6.755 -5.703 3.270
17 H1* G 2 H1' G 2 5.412 -2.224 2.912
18 H8 G 2 H8 G 2 2.988 -5.049 3.044
19 H1 G 2 H1 G 2 0.248 0.730 3.458
20 1H2 G 2 1H2 G 2 3.599 1.850 3.509
21 2H2 G 2 2H2 G 2 1.905 2.382 3.504
22 2H2* G 2 1H2' G 2 5.820 -3.521 4.728
23 1H2* G 2 2H2' G 2 4.889 -4.840 4.223
24 1H5* A 3 1H5' A 3 8.010 -1.425 3.511
25 2H5* A 3 2H5' A 3 9.405 -1.200 4.609
26 H4* A 3 H4' A 3 8.214 0.697 4.261
27 H3* A 3 H3' A 3 8.864 -0.545 6.684
28 H1* A 3 H1' A 3 5.740 1.411 6.184
29 H8 A 3 H8 A 3 5.552 -2.142 6.294
30 1H6 A 3 1H6 A 3 -0.728 -1.662 6.732
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.527
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.897 0.741 7.891
34 1H2* A 3 2H2' A 3 6.866 -0.922 7.558
35 1H5* T 4 1H5' T 4 7.323 3.737 6.532
36 2H5* T 4 2H5' T 4 8.346 4.830 7.539
37 H4* T 4 H4' T 4 5.932 5.422 7.468
38 H3* T 4 H3' T 4 7.342 5.152 9.938
39 1H2* T 4 2H2' T 4 5.948 3.507 10.885
40 2H2* T 4 1H2' T 4 4.849 4.816 10.866
41 H1* T 4 H1' T 4 3.700 4.413 9.123
42 H3 T 4 H3 T 4 1.163 0.756 10.013
43 1H5M T 4 1H5M T 4 5.312 -1.593 10.576
44 2H5M T 4 2H5M T 4 5.236 -1.634 8.776
45 3H5M T 4 3H5M T 4 6.425 -0.559 9.610
46 H6 T 4 H6 T 4 5.866 1.605 9.720
47 1H5* C 5 1H5' C 5 3.258 7.452 9.828
48 2H5* C 5 2H5' C 5 3.614 8.922 10.805
49 H4* C 5 H4' C 5 1.367 8.158 11.448
50 H3* C 5 H3' C 5 3.443 8.467 13.346
51 H1* C 5 H1' C 5 0.477 5.914 13.288
52 1H4 C 5 1H4 C 5 3.783 0.014 13.171
53 2H4 C 5 2H4 C 5 2.096 -0.456 13.423
54 H5 C 5 H5 C 5 4.510 2.275 13.129
55 H6 C 5 H6 C 5 3.883 4.663 12.797
56 2H2* C 5 1H2' C 5 1.933 6.769 14.787
57 1H2* C 5 2H2' C 5 3.384 6.208 14.160
58 1H5* A 6 1H5' A 6 -1.023 8.151 14.132
59 2H5* A 6 2H5' A 6 -1.369 9.571 15.189
60 H4* A 6 H4' A 6 -3.164 8.123 15.464
61 H3* A 6 H3' A 6 -1.639 8.581 17.735
62 H1* A 6 H1' A 6 -3.126 5.019 16.741
63 H8 A 6 H8 A 6 0.432 5.876 16.604
64 1H6 A 6 1H6 A 6 1.801 -0.184 16.830
65 2H6 A 6 2H6 A 6 2.461 1.454 16.599
66 H2 A 6 H2 A 6 -2.695 0.411 16.940
67 2H2* A 6 1H2' A 6 -2.470 6.093 18.722
68 1H2* A 6 2H2' A 6 -0.899 6.445 18.201
69 1H5* T 1 1H5' T 1 -3.109 -7.958 21.257
70 2H5* T 1 2H5' T 1 -1.520 -8.017 20.344
71 H4* T 1 H4' T 1 -3.983 -6.363 19.642
72 H3* T 1 H3' T 1 -2.692 -8.625 18.194
73 1H2* T 1 2H2' T 1 -1.238 -7.243 16.949
74 2H2* T 1 1H2' T 1 -2.697 -6.812 16.216
75 H1* T 1 H1' T 1 -3.133 -4.913 17.254
76 H3 T 1 H3 T 1 -0.363 -1.340 17.031
77 1H5M T 1 1H5M T 1 3.421 -4.240 17.401
78 2H5M T 1 2H5M T 1 2.597 -5.335 18.588
79 3H5M T 1 3H5M T 1 2.620 -5.759 16.837
80 H6 T 1 H6 T 1 0.400 -6.058 17.634
81 1H5* G 2 1H5' G 2 -6.209 -5.664 17.105
82 2H5* G 2 2H5' G 2 -7.222 -6.408 15.875
83 H4* G 2 H4' G 2 -7.167 -3.891 15.953
84 H3* G 2 H3' G 2 -6.782 -5.664 13.804
85 H1* G 2 H1' G 2 -5.392 -2.200 14.020
86 H8 G 2 H8 G 2 -2.990 -5.060 13.947
87 H1 G 2 H1 G 2 -0.248 0.730 13.443
88 1H2 G 2 1H2 G 2 -3.599 1.851 13.398
89 2H2 G 2 2H2 G 2 -1.905 2.382 13.398
90 2H2* G 2 1H2' G 2 -5.848 -3.526 12.247
91 1H2* G 2 2H2' G 2 -4.936 -4.852 12.761
92 1H5* A 3 1H5' A 3 -7.994 -1.353 13.421
93 2H5* A 3 2H5' A 3 -9.412 -1.162 12.344
94 H4* A 3 H4' A 3 -8.227 0.745 12.569
95 H3* A 3 H3' A 3 -8.848 -0.621 10.198
96 H1* A 3 H1' A 3 -5.756 1.410 10.682
97 H8 A 3 H8 A 3 -5.546 -2.155 10.632
98 1H6 A 3 1H6 A 3 0.727 -1.662 10.165
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.370
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.890 0.692 8.977
102 1H2* A 3 2H2' A 3 -6.843 -0.962 9.333
103 1H5* T 4 1H5' T 4 -7.410 3.684 10.265
104 2H5* T 4 2H5' T 4 -8.443 4.732 9.219
105 H4* T 4 H4' T 4 -6.046 5.412 9.351
106 H3* T 4 H3' T 4 -7.389 5.073 6.857
107 1H2* T 4 2H2' T 4 -5.926 3.468 5.956
108 2H2* T 4 1H2' T 4 -4.853 4.800 5.997
109 H1* T 4 H1' T 4 -3.735 4.426 7.766
110 H3 T 4 H3 T 4 -1.163 0.756 6.887
111 1H5M T 4 1H5M T 4 -6.420 -0.577 7.278
112 2H5M T 4 2H5M T 4 -5.290 -1.607 6.327
113 3H5M T 4 3H5M T 4 -5.226 -1.637 8.126
114 H6 T 4 H6 T 4 -5.867 1.595 7.164
115 1H5* C 5 1H5' C 5 -3.383 7.459 7.041
116 2H5* C 5 2H5' C 5 -3.721 8.909 6.028
117 H4* C 5 H4' C 5 -1.432 8.151 5.499
118 H3* C 5 H3' C 5 -3.427 8.473 3.523
119 H1* C 5 H1' C 5 -0.470 5.912 3.678
120 1H4 C 5 1H4 C 5 -3.784 0.015 3.716
121 2H4 C 5 2H4 C 5 -2.096 -0.456 3.470
122 H5 C 5 H5 C 5 -4.508 2.273 3.751
123 H6 C 5 H6 C 5 -3.883 4.669 4.074
124 2H2* C 5 1H2' C 5 -1.870 6.777 2.136
125 1H2* C 5 2H2' C 5 -3.347 6.211 2.710
126 1H5* A 6 1H5' A 6 1.055 8.100 2.820
127 2H5* A 6 2H5' A 6 1.438 9.542 1.808
128 H4* A 6 H4' A 6 3.209 8.079 1.499
129 H3* A 6 H3' A 6 1.691 8.592 -0.767
130 H1* A 6 H1' A 6 3.129 5.000 0.170
131 H8 A 6 H8 A 6 -0.423 5.878 0.294
132 1H6 A 6 1H6 A 6 -1.801 -0.184 0.070
133 2H6 A 6 2H6 A 6 -2.460 1.454 0.301
134 H2 A 6 H2 A 6 2.696 0.411 -0.039
135 2H2* A 6 1H2' A 6 2.495 6.112 -1.794
136 1H2* A 6 2H2' A 6 0.927 6.478 -1.273
Start of MODEL 3
1 1H5* T 1 1H5' T 1 2.969 -8.099 -4.310
2 2H5* T 1 2H5' T 1 1.477 -8.260 -3.257
3 H4* T 1 H4' T 1 3.873 -6.444 -2.826
4 H3* T 1 H3' T 1 2.725 -8.638 -1.183
5 1H2* T 1 2H2' T 1 1.280 -7.214 0.043
6 2H2* T 1 1H2' T 1 2.769 -6.735 0.684
7 H1* T 1 H1' T 1 3.142 -4.890 -0.458
8 H3 T 1 H3 T 1 0.363 -1.340 -0.129
9 1H5M T 1 1H5M T 1 -3.413 -4.229 -0.653
10 2H5M T 1 2H5M T 1 -2.541 -5.573 -1.491
11 3H5M T 1 3H5M T 1 -2.684 -5.584 0.306
12 H6 T 1 H6 T 1 -0.389 -6.068 -0.691
13 1H5* G 2 1H5' G 2 6.264 -5.582 -0.187
14 2H5* G 2 2H5' G 2 7.291 -6.346 1.027
15 H4* G 2 H4' G 2 7.231 -3.842 1.043
16 H3* G 2 H3' G 2 6.744 -5.678 3.128
17 H1* G 2 H1' G 2 5.387 -2.193 2.922
18 H8 G 2 H8 G 2 2.978 -5.062 2.972
19 H1 G 2 H1 G 2 0.248 0.730 3.455
20 1H2 G 2 1H2 G 2 3.599 1.852 3.487
21 2H2 G 2 2H2 G 2 1.905 2.382 3.496
22 2H2* G 2 1H2' G 2 5.814 -3.538 4.699
23 1H2* G 2 2H2' G 2 4.912 -4.855 4.161
24 1H5* A 3 1H5' A 3 8.016 -1.464 3.510
25 2H5* A 3 2H5' A 3 9.388 -1.232 4.632
26 H4* A 3 H4' A 3 8.194 0.662 4.198
27 H3* A 3 H3' A 3 8.873 -0.487 6.650
28 H1* A 3 H1' A 3 5.725 1.410 6.156
29 H8 A 3 H8 A 3 5.552 -2.146 6.284
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.733
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.528
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.898 0.762 7.859
34 1H2* A 3 2H2' A 3 6.881 -0.903 7.536
35 1H5* T 4 1H5' T 4 7.215 3.799 6.447
36 2H5* T 4 2H5' T 4 8.238 4.915 7.426
37 H4* T 4 H4' T 4 5.813 5.457 7.417
38 H3* T 4 H3' T 4 7.288 5.249 9.849
39 1H2* T 4 2H2' T 4 5.981 3.536 10.832
40 2H2* T 4 1H2' T 4 4.859 4.822 10.860
41 H1* T 4 H1' T 4 3.665 4.416 9.151
42 H3 T 4 H3 T 4 1.163 0.756 10.015
43 1H5M T 4 1H5M T 4 5.329 -1.594 10.560
44 2H5M T 4 2H5M T 4 5.237 -1.628 8.760
45 3H5M T 4 3H5M T 4 6.427 -0.550 9.587
46 H6 T 4 H6 T 4 5.866 1.611 9.701
47 1H5* C 5 1H5' C 5 3.130 7.529 9.890
48 2H5* C 5 2H5' C 5 3.528 8.982 10.881
49 H4* C 5 H4' C 5 1.315 8.215 11.606
50 H3* C 5 H3' C 5 3.464 8.446 13.432
51 H1* C 5 H1' C 5 0.482 5.916 13.391
52 1H4 C 5 1H4 C 5 3.783 0.014 13.173
53 2H4 C 5 2H4 C 5 2.096 -0.457 13.423
54 H5 C 5 H5 C 5 4.510 2.274 13.119
55 H6 C 5 H6 C 5 3.883 4.658 12.774
56 2H2* C 5 1H2' C 5 1.990 6.707 14.869
57 1H2* C 5 2H2' C 5 3.417 6.165 14.185
58 1H5* A 6 1H5' A 6 -1.003 8.274 14.374
59 2H5* A 6 2H5' A 6 -1.257 9.627 15.544
60 H4* A 6 H4' A 6 -3.104 8.223 15.761
61 H3* A 6 H3' A 6 -1.536 8.496 18.026
62 H1* A 6 H1' A 6 -3.115 5.032 16.827
63 H8 A 6 H8 A 6 0.445 5.859 16.664
64 1H6 A 6 1H6 A 6 1.801 -0.184 16.828
65 2H6 A 6 2H6 A 6 2.460 1.453 16.597
66 H2 A 6 H2 A 6 -2.695 0.411 16.939
67 2H2* A 6 1H2' A 6 -2.399 5.960 18.862
68 1H2* A 6 2H2' A 6 -0.831 6.313 18.334
69 1H5* T 1 1H5' T 1 -1.747 -7.578 21.063
70 2H5* T 1 2H5' T 1 -1.557 -8.843 19.798
71 H4* T 1 H4' T 1 -3.569 -7.016 19.599
72 H3* T 1 H3' T 1 -2.522 -8.800 17.728
73 1H2* T 1 2H2' T 1 -1.070 -7.174 16.637
74 2H2* T 1 1H2' T 1 -2.571 -6.780 15.990
75 H1* T 1 H1' T 1 -3.139 -5.019 17.236
76 H3 T 1 H3 T 1 -0.362 -1.340 17.027
77 1H5M T 1 1H5M T 1 2.558 -5.197 18.741
78 2H5M T 1 2H5M T 1 2.618 -5.825 17.056
79 3H5M T 1 3H5M T 1 3.420 -4.255 17.452
80 H6 T 1 H6 T 1 0.394 -6.052 17.688
81 1H5* G 2 1H5' G 2 -6.205 -5.852 16.877
82 2H5* G 2 2H5' G 2 -7.155 -6.589 15.594
83 H4* G 2 H4' G 2 -7.229 -4.075 15.758
84 H3* G 2 H3' G 2 -6.711 -5.748 13.567
85 H1* G 2 H1' G 2 -5.426 -2.244 13.950
86 H8 G 2 H8 G 2 -2.978 -5.056 13.887
87 H1 G 2 H1 G 2 -0.247 0.730 13.443
88 1H2 G 2 1H2 G 2 -3.599 1.852 13.400
89 2H2 G 2 2H2 G 2 -1.904 2.381 13.400
90 2H2* G 2 1H2' G 2 -5.775 -3.546 12.126
91 1H2* G 2 2H2' G 2 -4.838 -4.851 12.645
92 1H5* A 3 1H5' A 3 -8.050 -1.489 13.303
93 2H5* A 3 2H5' A 3 -9.411 -1.291 12.158
94 H4* A 3 H4' A 3 -8.281 0.635 12.579
95 H3* A 3 H3' A 3 -8.858 -0.571 10.127
96 H1* A 3 H1' A 3 -5.756 1.403 10.695
97 H8 A 3 H8 A 3 -5.545 -2.151 10.574
98 1H6 A 3 1H6 A 3 0.727 -1.663 10.166
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.372
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.879 0.723 8.971
102 1H2* A 3 2H2' A 3 -6.840 -0.939 9.310
103 1H5* T 4 1H5' T 4 -7.340 3.720 10.343
104 2H5* T 4 2H5' T 4 -8.348 4.814 9.323
105 H4* T 4 H4' T 4 -5.926 5.410 9.459
106 H3* T 4 H3' T 4 -7.306 5.223 6.975
107 1H2* T 4 2H2' T 4 -5.947 3.530 6.023
108 2H2* T 4 1H2' T 4 -4.832 4.825 6.044
109 H1* T 4 H1' T 4 -3.689 4.407 7.786
110 H3 T 4 H3 T 4 -1.163 0.757 6.887
111 1H5M T 4 1H5M T 4 -6.423 -0.565 7.256
112 2H5M T 4 2H5M T 4 -5.294 -1.582 6.289
113 3H5M T 4 3H5M T 4 -5.239 -1.648 8.091
114 H6 T 4 H6 T 4 -5.863 1.607 7.160
115 1H5* C 5 1H5' C 5 -3.139 7.435 7.128
116 2H5* C 5 2H5' C 5 -3.481 8.926 6.175
117 H4* C 5 H4' C 5 -1.259 8.129 5.487
118 H3* C 5 H3' C 5 -3.359 8.499 3.628
119 H1* C 5 H1' C 5 -0.456 5.897 3.599
120 1H4 C 5 1H4 C 5 -3.782 0.014 3.734
121 2H4 C 5 2H4 C 5 -2.095 -0.457 3.480
122 H5 C 5 H5 C 5 -4.511 2.276 3.774
123 H6 C 5 H6 C 5 -3.877 4.671 4.100
124 2H2* C 5 1H2' C 5 -1.915 6.791 2.139
125 1H2* C 5 2H2' C 5 -3.368 6.253 2.785
126 1H5* A 6 1H5' A 6 1.108 8.113 2.745
127 2H5* A 6 2H5' A 6 1.443 9.553 1.709
128 H4* A 6 H4' A 6 3.219 8.114 1.340
129 H3* A 6 H3' A 6 1.616 8.571 -0.876
130 H1* A 6 H1' A 6 3.116 5.006 0.076
131 H8 A 6 H8 A 6 -0.439 5.875 0.300
132 1H6 A 6 1H6 A 6 -1.801 -0.184 0.072
133 2H6 A 6 2H6 A 6 -2.460 1.453 0.303
134 H2 A 6 H2 A 6 2.695 0.411 -0.039
135 2H2* A 6 1H2' A 6 2.405 6.075 -1.885
136 1H2* A 6 2H2' A 6 0.854 6.441 -1.317
Start of MODEL 4
1 1H5* T 1 1H5' T 1 3.170 -7.627 -4.532
2 2H5* T 1 2H5' T 1 1.603 -7.805 -3.619
3 H4* T 1 H4' T 1 4.047 -6.187 -2.777
4 H3* T 1 H3' T 1 2.748 -8.544 -1.515
5 1H2* T 1 2H2' T 1 1.248 -7.268 -0.220
6 2H2* T 1 1H2' T 1 2.679 -6.880 0.594
7 H1* T 1 H1' T 1 3.129 -4.916 -0.292
8 H3 T 1 H3 T 1 0.363 -1.340 -0.134
9 1H5M T 1 1H5M T 1 -3.418 -4.258 -0.561
10 2H5M T 1 2H5M T 1 -2.546 -5.131 -1.893
11 3H5M T 1 3H5M T 1 -2.614 -5.843 -0.240
12 H6 T 1 H6 T 1 -0.391 -6.040 -0.817
13 1H5* G 2 1H5' G 2 6.236 -5.593 -0.261
14 2H5* G 2 2H5' G 2 7.238 -6.361 0.963
15 H4* G 2 H4' G 2 7.168 -3.844 0.936
16 H3* G 2 H3' G 2 6.768 -5.663 3.048
17 H1* G 2 H1' G 2 5.381 -2.192 2.873
18 H8 G 2 H8 G 2 2.986 -5.064 2.919
19 H1 G 2 H1 G 2 0.248 0.730 3.454
20 1H2 G 2 1H2 G 2 3.599 1.852 3.486
21 2H2 G 2 2H2 G 2 1.905 2.382 3.496
22 2H2* G 2 1H2' G 2 5.846 -3.536 4.638
23 1H2* G 2 2H2' G 2 4.938 -4.857 4.115
24 1H5* A 3 1H5' A 3 7.982 -1.397 3.436
25 2H5* A 3 2H5' A 3 9.386 -1.170 4.520
26 H4* A 3 H4' A 3 8.160 0.714 4.193
27 H3* A 3 H3' A 3 8.867 -0.524 6.603
28 H1* A 3 H1' A 3 5.728 1.411 6.154
29 H8 A 3 H8 A 3 5.551 -2.149 6.249
30 1H6 A 3 1H6 A 3 -0.728 -1.662 6.732
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.526
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.909 0.746 7.848
34 1H2* A 3 2H2' A 3 6.884 -0.916 7.520
35 1H5* T 4 1H5' T 4 7.262 3.767 6.468
36 2H5* T 4 2H5' T 4 8.293 4.864 7.459
37 H4* T 4 H4' T 4 5.878 5.434 7.442
38 H3* T 4 H3' T 4 7.333 5.162 9.888
39 1H2* T 4 2H2' T 4 5.965 3.511 10.856
40 2H2* T 4 1H2' T 4 4.864 4.817 10.859
41 H1* T 4 H1' T 4 3.687 4.416 9.134
42 H3 T 4 H3 T 4 1.163 0.756 10.014
43 1H5M T 4 1H5M T 4 5.330 -1.606 10.537
44 2H5M T 4 2H5M T 4 5.228 -1.622 8.740
45 3H5M T 4 3H5M T 4 6.426 -0.555 9.569
46 H6 T 4 H6 T 4 5.868 1.605 9.693
47 1H5* C 5 1H5' C 5 3.267 7.468 9.850
48 2H5* C 5 2H5' C 5 3.629 8.936 10.831
49 H4* C 5 H4' C 5 1.392 8.173 11.486
50 H3* C 5 H3' C 5 3.480 8.449 13.380
51 H1* C 5 H1' C 5 0.487 5.917 13.301
52 1H4 C 5 1H4 C 5 3.783 0.014 13.177
53 2H4 C 5 2H4 C 5 2.096 -0.456 13.426
54 H5 C 5 H5 C 5 4.510 2.274 13.122
55 H6 C 5 H6 C 5 3.886 4.657 12.782
56 2H2* C 5 1H2' C 5 1.956 6.751 14.810
57 1H2* C 5 2H2' C 5 3.398 6.183 14.173
58 1H5* A 6 1H5' A 6 -0.984 8.164 14.109
59 2H5* A 6 2H5' A 6 -1.341 9.569 15.180
60 H4* A 6 H4' A 6 -3.149 8.110 15.385
61 H3* A 6 H3' A 6 -1.685 8.586 17.691
62 H1* A 6 H1' A 6 -3.132 5.014 16.686
63 H8 A 6 H8 A 6 0.423 5.879 16.605
64 1H6 A 6 1H6 A 6 1.801 -0.184 16.830
65 2H6 A 6 2H6 A 6 2.460 1.454 16.599
66 H2 A 6 H2 A 6 -2.695 0.411 16.939
67 2H2* A 6 1H2' A 6 -2.520 6.101 18.673
68 1H2* A 6 2H2' A 6 -0.939 6.457 18.180
69 1H5* T 1 1H5' T 1 -1.722 -7.549 21.048
70 2H5* T 1 2H5' T 1 -1.578 -8.832 19.796
71 H4* T 1 H4' T 1 -3.580 -7.003 19.604
72 H3* T 1 H3' T 1 -2.552 -8.788 17.728
73 1H2* T 1 2H2' T 1 -1.090 -7.177 16.636
74 2H2* T 1 1H2' T 1 -2.588 -6.773 15.988
75 H1* T 1 H1' T 1 -3.143 -5.008 17.231
76 H3 T 1 H3 T 1 -0.362 -1.340 17.027
77 1H5M T 1 1H5M T 1 2.544 -5.348 18.633
78 2H5M T 1 2H5M T 1 2.649 -5.749 16.882
79 3H5M T 1 3H5M T 1 3.419 -4.234 17.502
80 H6 T 1 H6 T 1 0.393 -6.058 17.665
81 1H5* G 2 1H5' G 2 -6.220 -5.815 16.885
82 2H5* G 2 2H5' G 2 -7.183 -6.554 15.610
83 H4* G 2 H4' G 2 -7.244 -4.041 15.748
84 H3* G 2 H3' G 2 -6.714 -5.737 13.573
85 H1* G 2 H1' G 2 -5.420 -2.234 13.942
86 H8 G 2 H8 G 2 -2.979 -5.055 13.882
87 H1 G 2 H1 G 2 -0.248 0.730 13.444
88 1H2 G 2 1H2 G 2 -3.599 1.852 13.402
89 2H2 G 2 2H2 G 2 -1.904 2.382 13.400
90 2H2* G 2 1H2' G 2 -5.775 -3.542 12.122
91 1H2* G 2 2H2' G 2 -4.845 -4.849 12.647
92 1H5* A 3 1H5' A 3 -8.048 -1.495 13.305
93 2H5* A 3 2H5' A 3 -9.407 -1.287 12.160
94 H4* A 3 H4' A 3 -8.270 0.635 12.599
95 H3* A 3 H3' A 3 -8.861 -0.551 10.140
96 H1* A 3 H1' A 3 -5.747 1.404 10.704
97 H8 A 3 H8 A 3 -5.547 -2.148 10.572
98 1H6 A 3 1H6 A 3 0.727 -1.663 10.167
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.372
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.880 0.737 8.981
102 1H2* A 3 2H2' A 3 -6.848 -0.926 9.315
103 1H5* T 4 1H5' T 4 -7.316 3.722 10.387
104 2H5* T 4 2H5' T 4 -8.312 4.837 9.379
105 H4* T 4 H4' T 4 -5.881 5.391 9.517
106 H3* T 4 H3' T 4 -7.276 5.265 7.036
107 1H2* T 4 2H2' T 4 -5.953 3.558 6.057
108 2H2* T 4 1H2' T 4 -4.826 4.842 6.077
109 H1* T 4 H1' T 4 -3.672 4.395 7.807
110 H3 T 4 H3 T 4 -1.163 0.756 6.885
111 1H5M T 4 1H5M T 4 -6.425 -0.559 7.261
112 2H5M T 4 2H5M T 4 -5.301 -1.579 6.292
113 3H5M T 4 3H5M T 4 -5.242 -1.645 8.094
114 H6 T 4 H6 T 4 -5.863 1.613 7.165
115 1H5* C 5 1H5' C 5 -3.113 7.429 7.182
116 2H5* C 5 2H5' C 5 -3.428 8.937 6.250
117 H4* C 5 H4' C 5 -1.246 8.102 5.527
118 H3* C 5 H3' C 5 -3.368 8.495 3.685
119 H1* C 5 H1' C 5 -0.458 5.888 3.632
120 1H4 C 5 1H4 C 5 -3.783 0.014 3.726
121 2H4 C 5 2H4 C 5 -2.096 -0.456 3.475
122 H5 C 5 H5 C 5 -4.512 2.278 3.789
123 H6 C 5 H6 C 5 -3.877 4.668 4.118
124 2H2* C 5 1H2' C 5 -1.914 6.810 2.171
125 1H2* C 5 2H2' C 5 -3.366 6.263 2.812
126 1H5* A 6 1H5' A 6 1.074 8.086 2.876
127 2H5* A 6 2H5' A 6 1.458 9.531 1.869
128 H4* A 6 H4' A 6 3.222 8.055 1.555
129 H3* A 6 H3' A 6 1.704 8.607 -0.703
130 H1* A 6 H1' A 6 3.128 4.999 0.181
131 H8 A 6 H8 A 6 -0.425 5.885 0.333
132 1H6 A 6 1H6 A 6 -1.800 -0.184 0.069
133 2H6 A 6 2H6 A 6 -2.461 1.453 0.301
134 H2 A 6 H2 A 6 2.695 0.411 -0.040
135 2H2* A 6 1H2' A 6 2.492 6.139 -1.765
136 1H2* A 6 2H2' A 6 0.926 6.505 -1.232
Start of MODEL 5
1 1H5* T 1 1H5' T 1 3.245 -8.338 -3.998
2 2H5* T 1 2H5' T 1 1.570 -8.199 -3.264
3 H4* T 1 H4' T 1 4.055 -6.600 -2.461
4 H3* T 1 H3' T 1 2.591 -8.726 -0.950
5 1H2* T 1 2H2' T 1 1.169 -7.206 0.152
6 2H2* T 1 1H2' T 1 2.612 -6.765 0.893
7 H1* T 1 H1' T 1 3.125 -4.942 -0.275
8 H3 T 1 H3 T 1 0.378 -1.336 -0.142
9 1H5M T 1 1H7 T 1 -2.700 -5.592 0.266
10 2H5M T 1 2H7 T 1 -3.413 -4.211 -0.665
11 3H5M T 1 3H7 T 1 -2.547 -5.541 -1.529
12 H6 T 1 H6 T 1 -0.409 -6.060 -0.709
13 1H5* G 2 1H5' G 2 6.109 -5.835 -0.044
14 2H5* G 2 2H5' G 2 7.132 -6.538 1.201
15 H4* G 2 H4' G 2 7.164 -4.022 0.991
16 H3* G 2 H3' G 2 6.791 -5.670 3.228
17 H1* G 2 H1' G 2 5.405 -2.214 2.889
18 H8 G 2 H8 G 2 2.996 -5.053 3.010
19 H1 G 2 H1 G 2 0.248 0.731 3.441
20 1H2 G 2 1H2 G 2 1.900 2.383 3.471
21 2H2 G 2 2H2 G 2 3.596 1.858 3.448
22 2H2* G 2 1H2' G 2 5.840 -3.507 4.695
23 1H2* G 2 2H2' G 2 4.916 -4.836 4.197
24 1H5* A 3 1H5' A 3 7.987 -1.338 3.477
25 2H5* A 3 2H5' A 3 9.405 -1.121 4.549
26 H4* A 3 H4' A 3 8.198 0.771 4.296
27 H3* A 3 H3' A 3 8.856 -0.553 6.679
28 H1* A 3 H1' A 3 5.731 1.419 6.211
29 H8 A 3 H8 A 3 5.555 -2.140 6.278
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.734
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.528
32 H2 A 3 H2 A 3 1.228 2.436 6.826
33 2H2* A 3 1H2' A 3 6.889 0.728 7.910
34 1H2* A 3 2H2' A 3 6.863 -0.929 7.560
35 1H5* T 4 1H5' T 4 7.336 3.731 6.561
36 2H5* T 4 2H5' T 4 8.363 4.810 7.581
37 H4* T 4 H4' T 4 5.953 5.436 7.505
38 H3* T 4 H3' T 4 7.358 5.100 9.975
39 1H2* T 4 2H2' T 4 5.931 3.498 10.909
40 2H2* T 4 1H2' T 4 4.839 4.813 10.881
41 H1* T 4 H1' T 4 3.701 4.412 9.127
42 H3 T 4 H3 T 4 1.163 0.758 10.012
43 1H5M T 4 1H7 T 4 5.237 -1.630 8.770
44 2H5M T 4 2H7 T 4 6.424 -0.564 9.618
45 3H5M T 4 3H7 T 4 5.302 -1.603 10.570
46 H6 T 4 H6 T 4 5.865 1.603 9.733
47 1H5* C 5 1H5' C 5 3.366 7.432 9.735
48 2H5* C 5 2H5' C 5 3.652 8.892 10.745
49 H4* C 5 H4' C 5 1.364 8.065 11.222
50 H3* C 5 H3' C 5 3.326 8.518 13.212
51 H1* C 5 H1' C 5 0.445 5.882 13.126
52 1H4 C 5 1H4 C 5 2.094 -0.454 13.434
53 2H4 C 5 2H4 C 5 3.782 0.014 13.182
54 H5 C 5 H5 C 5 4.510 2.274 13.135
55 H6 C 5 H6 C 5 3.877 4.677 12.815
56 2H2* C 5 1H2' C 5 1.807 6.848 14.648
57 1H2* C 5 2H2' C 5 3.304 6.289 14.100
58 1H5* A 6 1H5' A 6 -1.141 8.000 13.873
59 2H5* A 6 2H5' A 6 -1.601 9.471 14.806
60 H4* A 6 H4' A 6 -3.291 7.952 15.189
61 H3* A 6 H3' A 6 -1.787 8.626 17.427
62 H1* A 6 H1' A 6 -3.131 4.968 16.677
63 H8 A 6 H8 A 6 0.410 5.908 16.489
64 1H6 A 6 1H6 A 6 1.781 -0.194 16.821
65 2H6 A 6 2H6 A 6 2.469 1.423 16.578
66 H2 A 6 H2 A 6 -2.696 0.411 16.937
67 H3T A 6 H3T A 6 -4.415 7.513 17.123
68 2H2* A 6 1H2' A 6 -2.515 6.184 18.578
69 1H2* A 6 2H2' A 6 -0.959 6.560 18.023
70 1H5* T 1 1H5' T 1 -3.390 -8.379 20.738
71 2H5* T 1 2H5' T 1 -1.689 -8.250 20.062
72 H4* T 1 H4' T 1 -4.142 -6.667 19.149
73 H3* T 1 H3' T 1 -2.544 -8.757 17.724
74 1H2* T 1 2H2' T 1 -1.099 -7.205 16.706
75 2H2* T 1 1H2' T 1 -2.501 -6.782 15.889
76 H1* T 1 H1' T 1 -3.107 -4.967 17.044
77 H3 T 1 H3 T 1 -0.363 -1.341 17.020
78 1H5M T 1 1H7 T 1 3.018 -4.551 18.536
79 2H5M T 1 2H7 T 1 2.471 -5.980 17.592
80 3H5M T 1 3H7 T 1 3.260 -4.616 16.732
81 H6 T 1 H6 T 1 0.414 -6.050 17.645
82 1H5* G 2 1H5' G 2 -6.121 -6.000 16.701
83 2H5* G 2 2H5' G 2 -7.052 -6.717 15.392
84 H4* G 2 H4' G 2 -7.237 -4.211 15.668
85 H3* G 2 H3' G 2 -6.690 -5.767 13.411
86 H1* G 2 H1' G 2 -5.441 -2.263 13.921
87 H8 G 2 H8 G 2 -2.977 -5.055 13.869
88 H1 G 2 H1 G 2 -0.252 0.732 13.440
89 1H2 G 2 1H2 G 2 -1.905 2.388 13.440
90 2H2 G 2 2H2 G 2 -3.597 1.856 13.410
91 2H2* G 2 1H2' G 2 -5.739 -3.541 12.064
92 1H2* G 2 2H2' G 2 -4.790 -4.838 12.579
93 1H5* A 3 1H5' A 3 -8.062 -1.513 13.270
94 2H5* A 3 2H5' A 3 -9.400 -1.288 12.107
95 H4* A 3 H4' A 3 -8.264 0.625 12.625
96 H3* A 3 H3' A 3 -8.872 -0.470 10.139
97 H1* A 3 H1' A 3 -5.732 1.415 10.707
98 H8 A 3 H8 A 3 -5.553 -2.135 10.551
99 1H6 A 3 1H6 A 3 0.726 -1.663 10.157
100 2H6 A 3 2H6 A 3 -0.632 -2.796 10.360
101 H2 A 3 H2 A 3 -1.228 2.436 10.076
102 2H2* A 3 1H2' A 3 -6.874 0.771 8.987
103 1H2* A 3 2H2' A 3 -6.861 -0.896 9.315
104 1H5* T 4 1H5' T 4 -7.242 3.826 10.367
105 2H5* T 4 2H5' T 4 -8.258 4.938 9.372
106 H4* T 4 H4' T 4 -5.834 5.501 9.412
107 H3* T 4 H3' T 4 -7.257 5.301 6.960
108 1H2* T 4 2H2' T 4 -5.951 3.542 6.014
109 2H2* T 4 1H2' T 4 -4.815 4.818 5.994
110 H1* T 4 H1' T 4 -3.657 4.421 7.725
111 H3 T 4 H3 T 4 -1.163 0.758 6.886
112 1H5M T 4 1H7 T 4 -6.428 -0.549 7.257
113 2H5M T 4 2H7 T 4 -5.309 -1.572 6.286
114 3H5M T 4 3H7 T 4 -5.253 -1.643 8.089
115 H6 T 4 H6 T 4 -5.861 1.617 7.157
116 1H5* C 5 1H5' C 5 -3.136 7.673 6.908
117 2H5* C 5 2H5' C 5 -3.468 9.057 5.805
118 H4* C 5 H4' C 5 -1.210 8.153 5.338
119 H3* C 5 H3' C 5 -3.136 8.487 3.300
120 H1* C 5 H1' C 5 -0.376 5.819 3.636
121 1H4 C 5 1H4 C 5 -2.092 -0.459 3.505
122 2H4 C 5 2H4 C 5 -3.776 0.012 3.775
123 H5 C 5 H5 C 5 -4.509 2.274 3.751
124 H6 C 5 H6 C 5 -3.864 4.698 4.056
125 2H2* C 5 1H2' C 5 -1.615 6.622 2.017
126 1H2* C 5 2H2' C 5 -3.163 6.196 2.552
127 1H5* A 6 1H5' A 6 1.499 7.656 2.706
128 2H5* A 6 2H5' A 6 1.897 9.167 1.818
129 H4* A 6 H4' A 6 3.663 7.698 1.437
130 H3* A 6 H3' A 6 2.261 8.538 -0.792
131 H1* A 6 H1' A 6 3.600 4.799 -0.300
132 H8 A 6 H8 A 6 0.067 5.802 -0.085
133 1H6 A 6 1H6 A 6 -1.646 -0.161 0.205
134 2H6 A 6 2H6 A 6 -2.154 1.542 0.318
135 H2 A 6 H2 A 6 2.963 0.016 -0.253
136 H3T A 6 H3T A 6 4.848 7.315 -0.594
137 2H2* A 6 1H2' A 6 3.030 6.196 -2.111
138 1H2* A 6 2H2' A 6 1.461 6.514 -1.573
Start of MODEL 6
1 1H5* T 1 1H5' T 1 2.072 -7.551 -4.367
2 2H5* T 1 2H5' T 1 1.470 -8.631 -3.058
3 H4* T 1 H4' T 1 3.659 -6.798 -2.801
4 H3* T 1 H3' T 1 2.582 -8.742 -1.060
5 1H2* T 1 2H2' T 1 1.128 -7.213 0.132
6 2H2* T 1 1H2' T 1 2.620 -6.821 0.800
7 H1* T 1 H1' T 1 3.147 -4.988 -0.343
8 H3 T 1 H3 T 1 0.360 -1.336 -0.141
9 1H5M T 1 1H7 T 1 -3.418 -4.263 -0.439
10 2H5M T 1 2H7 T 1 -2.623 -5.174 -1.794
11 3H5M T 1 3H7 T 1 -2.595 -5.836 -0.118
12 H6 T 1 H6 T 1 -0.403 -6.053 -0.766
13 1H5* G 2 1H5' G 2 6.146 -5.750 -0.166
14 2H5* G 2 2H5' G 2 7.173 -6.472 1.064
15 H4* G 2 H4' G 2 7.137 -3.957 0.926
16 H3* G 2 H3' G 2 6.791 -5.671 3.121
17 H1* G 2 H1' G 2 5.399 -2.212 2.862
18 H8 G 2 H8 G 2 2.995 -5.058 2.973
19 H1 G 2 H1 G 2 0.249 0.730 3.457
20 1H2 G 2 1H2 G 2 1.902 2.382 3.490
21 2H2 G 2 2H2 G 2 3.597 1.854 3.498
22 2H2* G 2 1H2' G 2 5.859 -3.519 4.647
23 1H2* G 2 2H2' G 2 4.935 -4.847 4.151
24 1H5* A 3 1H5' A 3 7.987 -1.337 3.458
25 2H5* A 3 2H5' A 3 9.413 -1.134 4.523
26 H4* A 3 H4' A 3 8.208 0.758 4.315
27 H3* A 3 H3' A 3 8.851 -0.607 6.682
28 H1* A 3 H1' A 3 5.750 1.411 6.209
29 H8 A 3 H8 A 3 5.549 -2.152 6.260
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.734
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.528
32 H2 A 3 H2 A 3 1.228 2.436 6.826
33 2H2* A 3 1H2' A 3 6.892 0.698 7.912
34 1H2* A 3 2H2' A 3 6.849 -0.957 7.559
35 1H5* T 4 1H5' T 4 7.377 3.700 6.608
36 2H5* T 4 2H5' T 4 8.412 4.753 7.646
37 H4* T 4 H4' T 4 6.011 5.425 7.529
38 H3* T 4 H3' T 4 7.379 5.110 10.007
39 1H2* T 4 2H2' T 4 5.947 3.475 10.924
40 2H2* T 4 1H2' T 4 4.869 4.803 10.904
41 H1* T 4 H1' T 4 3.727 4.434 9.152
42 H3 T 4 H3 T 4 1.163 0.758 10.013
43 1H5M T 4 1H7 T 4 5.225 -1.633 8.766
44 2H5M T 4 2H7 T 4 6.421 -0.574 9.613
45 3H5M T 4 3H7 T 4 5.296 -1.609 10.565
46 H6 T 4 H6 T 4 5.868 1.596 9.728
47 1H5* C 5 1H5' C 5 3.351 7.539 9.966
48 2H5* C 5 2H5' C 5 3.747 8.962 11.001
49 H4* C 5 H4' C 5 1.481 8.240 11.610
50 H3* C 5 H3' C 5 3.554 8.416 13.525
51 H1* C 5 H1' C 5 0.504 5.944 13.341
52 1H4 C 5 1H4 C 5 2.092 -0.457 13.409
53 2H4 C 5 2H4 C 5 3.776 0.010 13.136
54 H5 C 5 H5 C 5 4.508 2.270 13.136
55 H6 C 5 H6 C 5 3.888 4.657 12.803
56 2H2* C 5 1H2' C 5 1.990 6.700 14.883
57 1H2* C 5 2H2' C 5 3.424 6.124 14.244
58 1H5* A 6 1H5' A 6 -0.932 8.283 14.264
59 2H5* A 6 2H5' A 6 -1.238 9.622 15.436
60 H4* A 6 H4' A 6 -3.079 8.184 15.558
61 H3* A 6 H3' A 6 -1.614 8.522 17.886
62 H1* A 6 H1' A 6 -3.127 5.036 16.700
63 H8 A 6 H8 A 6 0.427 5.888 16.596
64 1H6 A 6 1H6 A 6 1.781 -0.194 16.819
65 2H6 A 6 2H6 A 6 2.469 1.424 16.577
66 H2 A 6 H2 A 6 -2.696 0.411 16.938
67 H3T A 6 H3T A 6 -3.862 9.004 17.678
68 2H2* A 6 1H2' A 6 -2.476 5.997 18.735
69 1H2* A 6 2H2' A 6 -0.891 6.344 18.245
70 1H5* T 1 1H5' T 1 -3.000 -8.016 21.202
71 2H5* T 1 2H5' T 1 -1.504 -8.216 20.170
72 H4* T 1 H4' T 1 -3.950 -6.489 19.589
73 H3* T 1 H3' T 1 -2.655 -8.675 18.062
74 1H2* T 1 2H2' T 1 -1.205 -7.236 16.860
75 2H2* T 1 1H2' T 1 -2.666 -6.802 16.141
76 H1* T 1 H1' T 1 -3.136 -4.935 17.229
77 H3 T 1 H3 T 1 -0.363 -1.340 17.021
78 1H5M T 1 1H7 T 1 2.784 -5.459 16.566
79 2H5M T 1 2H7 T 1 3.389 -4.208 17.734
80 3H5M T 1 3H7 T 1 2.500 -5.657 18.334
81 H6 T 1 H6 T 1 0.407 -6.062 17.602
82 1H5* G 2 1H5' G 2 -6.223 -5.779 16.957
83 2H5* G 2 2H5' G 2 -7.191 -6.531 15.693
84 H4* G 2 H4' G 2 -7.213 -4.019 15.807
85 H3* G 2 H3' G 2 -6.721 -5.737 13.643
86 H1* G 2 H1' G 2 -5.419 -2.236 13.968
87 H8 G 2 H8 G 2 -2.976 -5.063 13.924
88 H1 G 2 H1 G 2 -0.252 0.733 13.447
89 1H2 G 2 1H2 G 2 -1.903 2.389 13.471
90 2H2 G 2 2H2 G 2 -3.596 1.862 13.472
91 2H2* G 2 1H2' G 2 -5.788 -3.550 12.161
92 1H2* G 2 2H2' G 2 -4.856 -4.857 12.680
93 1H5* A 3 1H5' A 3 -8.043 -1.467 13.325
94 2H5* A 3 2H5' A 3 -9.412 -1.277 12.189
95 H4* A 3 H4' A 3 -8.275 0.649 12.576
96 H3* A 3 H3' A 3 -8.859 -0.584 10.138
97 H1* A 3 H1' A 3 -5.764 1.407 10.688
98 H8 A 3 H8 A 3 -5.546 -2.156 10.589
99 1H6 A 3 1H6 A 3 0.727 -1.663 10.161
100 2H6 A 3 2H6 A 3 -0.631 -2.796 10.366
101 H2 A 3 H2 A 3 -1.228 2.436 10.077
102 2H2* A 3 1H2' A 3 -6.883 0.711 8.970
103 1H2* A 3 2H2' A 3 -6.838 -0.948 9.314
104 1H5* T 4 1H5' T 4 -7.364 3.751 10.246
105 2H5* T 4 2H5' T 4 -8.417 4.794 9.215
106 H4* T 4 H4' T 4 -6.034 5.489 9.251
107 H3* T 4 H3' T 4 -7.399 5.034 6.785
108 1H2* T 4 2H2' T 4 -5.915 3.443 5.912
109 2H2* T 4 1H2' T 4 -4.848 4.779 5.930
110 H1* T 4 H1' T 4 -3.732 4.451 7.703
111 H3 T 4 H3 T 4 -1.163 0.758 6.887
112 1H5M T 4 1H7 T 4 -6.422 -0.572 7.260
113 2H5M T 4 2H7 T 4 -5.290 -1.589 6.297
114 3H5M T 4 3H7 T 4 -5.233 -1.648 8.098
115 H6 T 4 H6 T 4 -5.865 1.598 7.154
116 1H5* C 5 1H5' C 5 -3.491 7.525 6.852
117 2H5* C 5 2H5' C 5 -3.809 8.925 5.764
118 H4* C 5 H4' C 5 -1.468 8.152 5.436
119 H3* C 5 H3' C 5 -3.275 8.450 3.286
120 H1* C 5 H1' C 5 -0.404 5.856 3.759
121 1H4 C 5 1H4 C 5 -2.093 -0.459 3.500
122 2H4 C 5 2H4 C 5 -3.776 0.012 3.773
123 H5 C 5 H5 C 5 -4.504 2.271 3.712
124 H6 C 5 H6 C 5 -3.876 4.688 4.018
125 2H2* C 5 1H2' C 5 -1.574 6.680 2.076
126 1H2* C 5 2H2' C 5 -3.130 6.170 2.496
127 1H5* A 6 1H5' A 6 1.230 7.888 2.986
128 2H5* A 6 2H5' A 6 1.783 9.338 2.080
129 H4* A 6 H4' A 6 3.492 7.748 2.041
130 H3* A 6 H3' A 6 2.470 8.589 -0.399
131 H1* A 6 H1' A 6 3.568 4.820 0.388
132 H8 A 6 H8 A 6 0.098 5.962 0.029
133 1H6 A 6 1H6 A 6 -1.786 0.020 -0.306
134 2H6 A 6 2H6 A 6 -2.287 1.732 -0.282
135 H2 A 6 H2 A 6 2.812 0.088 0.115
136 H3T A 6 H3T A 6 4.949 7.533 0.507
137 2H2* A 6 1H2' A 6 3.363 6.189 -1.523
138 1H2* A 6 2H2' A 6 1.740 6.578 -1.255
Start of MODEL 7
1 1H5* T 1 1H5' T 1 3.178 -7.948 -4.319
2 2H5* T 1 2H5' T 1 1.574 -8.025 -3.437
3 H4* T 1 H4' T 1 4.039 -6.399 -2.637
4 H3* T 1 H3' T 1 2.658 -8.648 -1.253
5 1H2* T 1 2H2' T 1 1.202 -7.248 -0.033
6 2H2* T 1 1H2' T 1 2.642 -6.835 0.741
7 H1* T 1 H1' T 1 3.127 -4.933 -0.285
8 H3 T 1 H3 T 1 0.362 -1.340 -0.121
9 1H5M T 1 1H7 T 1 -3.420 -4.244 -0.512
10 2H5M T 1 2H7 T 1 -2.589 -5.237 -1.781
11 3H5M T 1 3H7 T 1 -2.621 -5.801 -0.070
12 H6 T 1 H6 T 1 -0.403 -6.052 -0.756
13 1H5* G 2 1H5' G 2 6.133 -5.725 -0.184
14 2H5* G 2 2H5' G 2 7.165 -6.454 1.037
15 H4* G 2 H4' G 2 7.134 -3.937 0.910
16 H3* G 2 H3' G 2 6.796 -5.662 3.098
17 H1* G 2 H1' G 2 5.397 -2.205 2.863
18 H8 G 2 H8 G 2 2.995 -5.059 2.960
19 H1 G 2 H1 G 2 0.248 0.729 3.460
20 1H2 G 2 1H2 G 2 1.903 2.382 3.500
21 2H2 G 2 2H2 G 2 3.598 1.853 3.499
22 2H2* G 2 1H2' G 2 5.865 -3.519 4.639
23 1H2* G 2 2H2' G 2 4.944 -4.848 4.139
24 1H5* A 3 1H5' A 3 7.993 -1.330 3.467
25 2H5* A 3 2H5' A 3 9.425 -1.138 4.528
26 H4* A 3 H4' A 3 8.230 0.759 4.360
27 H3* A 3 H3' A 3 8.841 -0.654 6.711
28 H1* A 3 H1' A 3 5.762 1.405 6.221
29 H8 A 3 H8 A 3 5.546 -2.158 6.262
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.736
31 2H6 A 3 2H6 A 3 0.631 -2.796 6.532
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.886 0.678 7.930
34 1H2* A 3 2H2' A 3 6.833 -0.975 7.573
35 1H5* T 4 1H5' T 4 7.437 3.636 6.625
36 2H5* T 4 2H5' T 4 8.445 4.697 7.679
37 H4* T 4 H4' T 4 6.035 5.350 7.454
38 H3* T 4 H3' T 4 7.348 5.168 9.970
39 1H2* T 4 2H2' T 4 5.939 3.505 10.900
40 2H2* T 4 1H2' T 4 4.848 4.822 10.849
41 H1* T 4 H1' T 4 3.726 4.406 9.090
42 H3 T 4 H3 T 4 1.163 0.758 10.011
43 1H5M T 4 1H7 T 4 5.222 -1.639 8.776
44 2H5M T 4 2H7 T 4 6.419 -0.580 9.626
45 3H5M T 4 3H7 T 4 5.285 -1.608 10.576
46 H6 T 4 H6 T 4 5.867 1.597 9.735
47 1H5* C 5 1H5' C 5 3.225 7.427 9.735
48 2H5* C 5 2H5' C 5 3.553 8.914 10.693
49 H4* C 5 H4' C 5 1.329 8.113 11.353
50 H3* C 5 H3' C 5 3.417 8.484 13.233
51 H1* C 5 H1' C 5 0.469 5.907 13.236
52 1H4 C 5 1H4 C 5 2.094 -0.456 13.423
53 2H4 C 5 2H4 C 5 3.780 0.012 13.163
54 H5 C 5 H5 C 5 4.511 2.274 13.119
55 H6 C 5 H6 C 5 3.879 4.665 12.789
56 2H2* C 5 1H2' C 5 1.923 6.814 14.717
57 1H2* C 5 2H2' C 5 3.377 6.249 14.101
58 1H5* A 6 1H5' A 6 -1.033 8.149 14.026
59 2H5* A 6 2H5' A 6 -1.406 9.566 15.076
60 H4* A 6 H4' A 6 -3.165 8.083 15.345
61 H3* A 6 H3' A 6 -1.667 8.600 17.622
62 H1* A 6 H1' A 6 -3.123 5.018 16.681
63 H8 A 6 H8 A 6 0.428 5.901 16.514
64 1H6 A 6 1H6 A 6 1.781 -0.193 16.823
65 2H6 A 6 2H6 A 6 2.469 1.424 16.581
66 H2 A 6 H2 A 6 -2.696 0.411 16.938
67 2H2* A 6 1H2' A 6 -2.474 6.123 18.646
68 1H2* A 6 2H2' A 6 -0.904 6.470 18.114
69 1H5* T 1 1H5' T 1 -3.024 -8.203 21.082
70 2H5* T 1 2H5' T 1 -1.514 -8.355 20.064
71 H4* T 1 H4' T 1 -3.929 -6.566 19.561
72 H3* T 1 H3' T 1 -2.659 -8.697 17.927
73 1H2* T 1 2H2' T 1 -1.211 -7.206 16.779
74 2H2* T 1 1H2' T 1 -2.685 -6.744 16.100
75 H1* T 1 H1' T 1 -3.139 -4.925 17.274
76 H3 T 1 H3 T 1 -0.363 -1.340 17.021
77 1H5M T 1 1H7 T 1 2.610 -5.814 16.985
78 2H5M T 1 2H7 T 1 3.419 -4.254 17.400
79 3H5M T 1 3H7 T 1 2.589 -5.225 18.687
80 H6 T 1 H6 T 1 0.396 -6.060 17.625
81 1H5* G 2 1H5' G 2 -6.227 -5.744 16.922
82 2H5* G 2 2H5' G 2 -7.216 -6.502 15.673
83 H4* G 2 H4' G 2 -7.255 -3.997 15.743
84 H3* G 2 H3' G 2 -6.708 -5.738 13.607
85 H1* G 2 H1' G 2 -5.422 -2.229 13.925
86 H8 G 2 H8 G 2 -2.972 -5.061 13.900
87 H1 G 2 H1 G 2 -0.251 0.732 13.442
88 1H2 G 2 1H2 G 2 -1.903 2.388 13.450
89 2H2 G 2 2H2 G 2 -3.596 1.859 13.432
90 2H2* G 2 1H2' G 2 -5.770 -3.554 12.122
91 1H2* G 2 2H2' G 2 -4.845 -4.857 12.659
92 1H5* A 3 1H5' A 3 -8.076 -1.498 13.244
93 2H5* A 3 2H5' A 3 -9.431 -1.337 12.083
94 H4* A 3 H4' A 3 -8.350 0.616 12.466
95 H3* A 3 H3' A 3 -8.839 -0.659 10.027
96 H1* A 3 H1' A 3 -5.786 1.396 10.650
97 H8 A 3 H8 A 3 -5.538 -2.166 10.552
98 1H6 A 3 1H6 A 3 0.727 -1.663 10.164
99 2H6 A 3 2H6 A 3 -0.631 -2.796 10.368
100 H2 A 3 H2 A 3 -1.228 2.436 10.076
101 2H2* A 3 1H2' A 3 -6.859 0.677 8.911
102 1H2* A 3 2H2' A 3 -6.798 -0.980 9.268
103 1H5* T 4 1H5' T 4 -7.448 3.652 10.209
104 2H5* T 4 2H5' T 4 -8.463 4.704 9.151
105 H4* T 4 H4' T 4 -6.066 5.399 9.358
106 H3* T 4 H3' T 4 -7.369 5.132 6.846
107 1H2* T 4 2H2' T 4 -5.925 3.485 5.948
108 2H2* T 4 1H2' T 4 -4.842 4.809 5.995
109 H1* T 4 H1' T 4 -3.735 4.426 7.767
110 H3 T 4 H3 T 4 -1.163 0.758 6.887
111 1H5M T 4 1H7 T 4 -6.417 -0.585 7.213
112 2H5M T 4 2H7 T 4 -5.263 -1.573 6.249
113 3H5M T 4 3H7 T 4 -5.230 -1.669 8.049
114 H6 T 4 H6 T 4 -5.861 1.597 7.126
115 1H5* C 5 1H5' C 5 -3.279 7.457 7.037
116 2H5* C 5 2H5' C 5 -3.633 8.922 6.052
117 H4* C 5 H4' C 5 -1.371 8.169 5.434
118 H3* C 5 H3' C 5 -3.428 8.473 3.519
119 H1* C 5 H1' C 5 -0.471 5.913 3.604
120 1H4 C 5 1H4 C 5 -2.094 -0.457 3.485
121 2H4 C 5 2H4 C 5 -3.780 0.014 3.745
122 H5 C 5 H5 C 5 -4.508 2.273 3.753
123 H6 C 5 H6 C 5 -3.880 4.671 4.074
124 2H2* C 5 1H2' C 5 -1.914 6.764 2.097
125 1H2* C 5 2H2' C 5 -3.373 6.210 2.715
126 1H5* A 6 1H5' A3 1 1.044 8.148 2.729
127 2H5* A 6 2H5' A3 1 1.386 9.570 1.672
128 H4* A 6 H4' A3 1 3.179 8.127 1.374
129 H3* A 6 H3' A3 1 1.626 8.561 -0.886
130 H1* A 6 H1' A3 1 3.124 5.013 0.130
131 H8 A 6 H8 A3 1 -0.432 5.872 0.278
132 1H6 A 6 1H6 A3 1 -1.802 -0.184 0.076
133 2H6 A 6 2H6 A3 1 -2.460 1.454 0.306
134 H2 A 6 H2 A3 1 2.696 0.411 -0.038
135 H3T A 6 HO3 A3 1 3.882 9.038 -0.725
136 2H2* A 6 1H2' A3 1 2.457 6.067 -1.855
137 1H2* A 6 2H2' A3 1 0.890 6.426 -1.327
Start of MODEL 8
1 1H5* T 1 1H5' T 1 3.321 -8.170 -4.067
2 2H5* T 1 2H5' T 1 1.654 -8.141 -3.303
3 H4* T 1 H4' T 1 4.109 -6.547 -2.413
4 H3* T 1 H3' T 1 2.588 -8.715 -1.030
5 1H2* T 1 2H2' T 1 1.136 -7.230 0.081
6 2H2* T 1 1H2' T 1 2.550 -6.820 0.892
7 H1* T 1 H1' T 1 3.113 -4.957 -0.193
8 H3 T 1 H3 T 1 0.362 -1.340 -0.120
9 1H5M T 1 1H7 T 1 -2.592 -5.153 -1.839
10 2H5M T 1 2H7 T 1 -2.612 -5.834 -0.171
11 3H5M T 1 3H7 T 1 -3.419 -4.254 -0.498
12 H6 T 1 H6 T 1 -0.409 -6.047 -0.771
13 1H5* G 2 1H5' G 2 6.096 -5.876 -0.008
14 2H5* G 2 2H5' G 2 7.089 -6.592 1.251
15 H4* G 2 H4' G 2 7.166 -4.076 1.026
16 H3* G 2 H3' G 2 6.766 -5.703 3.267
17 H1* G 2 H1' G 2 5.419 -2.231 2.905
18 H8 G 2 H8 G 2 2.991 -5.056 2.995
19 H1 G 2 H1 G 2 0.249 0.729 3.460
20 1H2 G 2 1H2 G 2 1.904 2.382 3.499
21 2H2 G 2 2H2 G 2 3.598 1.854 3.496
22 2H2* G 2 1H2' G 2 5.821 -3.526 4.717
23 1H2* G 2 2H2' G 2 4.885 -4.843 4.216
24 1H5* A 3 1H5' A 3 8.016 -1.377 3.525
25 2H5* A 3 2H5' A 3 9.422 -1.183 4.618
26 H4* A 3 H4' A 3 8.252 0.728 4.356
27 H3* A 3 H3' A 3 8.847 -0.612 6.746
28 H1* A 3 H1' A 3 5.754 1.409 6.225
29 H8 A 3 H8 A 3 5.549 -2.151 6.296
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.736
31 2H6 A 3 2H6 A 3 0.631 -2.796 6.531
32 H2 A 3 H2 A 3 1.228 2.436 6.825
33 2H2* A 3 1H2' A 3 6.879 0.700 7.940
34 1H2* A 3 2H2' A 3 6.836 -0.956 7.586
35 1H5* T 4 1H5' T 4 7.399 3.672 6.606
36 2H5* T 4 2H5' T 4 8.403 4.750 7.648
37 H4* T 4 H4' T 4 5.987 5.380 7.449
38 H3* T 4 H3' T 4 7.325 5.204 9.951
39 1H2* T 4 2H2' T 4 5.943 3.520 10.890
40 2H2* T 4 1H2' T 4 4.839 4.825 10.854
41 H1* T 4 H1' T 4 3.708 4.408 9.102
42 H3 T 4 H3 T 4 1.163 0.758 10.012
43 1H5M T 4 1H7 T 4 5.232 -1.643 8.795
44 2H5M T 4 2H7 T 4 6.421 -0.573 9.642
45 3H5M T 4 3H7 T 4 5.286 -1.595 10.596
46 H6 T 4 H6 T 4 5.864 1.602 9.745
47 1H5* C 5 1H5' C 5 3.167 7.437 9.763
48 2H5* C 5 2H5' C 5 3.514 8.927 10.714
49 H4* C 5 H4' C 5 1.299 8.140 11.418
50 H3* C 5 H3' C 5 3.423 8.476 13.265
51 H1* C 5 H1' C 5 0.468 5.906 13.280
52 1H4 C 5 1H4 C 5 2.093 -0.456 13.419
53 2H4 C 5 2H4 C 5 3.779 0.012 13.154
54 H5 C 5 H5 C 5 4.511 2.274 13.120
55 H6 C 5 H6 C 5 3.880 4.664 12.792
56 2H2* C 5 1H2' C 5 1.943 6.792 14.753
57 1H2* C 5 2H2' C 5 3.387 6.236 14.114
58 1H5* A 6 1H5' A 6 -1.009 8.186 14.084
59 2H5* A 6 2H5' A 6 -1.366 9.582 15.169
60 H4* A 6 H4' A 6 -3.146 8.105 15.386
61 H3* A 6 H3' A 6 -1.671 8.581 17.684
62 H1* A 6 H1' A 6 -3.124 5.017 16.678
63 H8 A 6 H8 A 6 0.427 5.899 16.537
64 1H6 A 6 1H6 A 6 1.781 -0.193 16.823
65 2H6 A 6 2H6 A 6 2.469 1.424 16.581
66 H2 A 6 H2 A 6 -2.696 0.411 16.938
67 H3T A 6 H3T A 6 -4.303 7.479 17.358
68 2H2* A 6 1H2' A 6 -2.484 6.089 18.662
69 1H2* A 6 2H2' A 6 -0.910 6.441 18.145
70 1H5* T 1 1H5' T 1 -2.859 -7.920 21.303
71 2H5* T 1 2H5' T 1 -1.478 -8.267 20.164
72 H4* T 1 H4' T 1 -3.879 -6.467 19.695
73 H3* T 1 H3' T 1 -2.678 -8.658 18.125
74 1H2* T 1 2H2' T 1 -1.218 -7.238 16.895
75 2H2* T 1 1H2' T 1 -2.692 -6.804 16.198
76 H1* T 1 H1' T 1 -3.141 -4.929 17.276
77 H3 T 1 H3 T 1 -0.363 -1.340 17.022
78 1H5M T 1 1H7 T 1 2.638 -5.163 18.685
79 2H5M T 1 2H7 T 1 2.584 -5.846 17.018
80 3H5M T 1 3H7 T 1 3.416 -4.272 17.308
81 H6 T 1 H6 T 1 0.401 -6.057 17.634
82 1H5* G 2 1H5' G 2 -6.249 -5.710 17.004
83 2H5* G 2 2H5' G 2 -7.222 -6.482 15.754
84 H4* G 2 H4' G 2 -7.223 -3.974 15.808
85 H3* G 2 H3' G 2 -6.713 -5.740 13.683
86 H1* G 2 H1' G 2 -5.420 -2.231 13.957
87 H8 G 2 H8 G 2 -2.972 -5.065 13.937
88 H1 G 2 H1 G 2 -0.251 0.732 13.442
89 1H2 G 2 1H2 G 2 -1.903 2.388 13.449
90 2H2 G 2 2H2 G 2 -3.596 1.859 13.430
91 2H2* G 2 1H2' G 2 -5.788 -3.564 12.165
92 1H2* G 2 2H2' G 2 -4.859 -4.866 12.697
93 1H5* A 3 1H5' A 3 -8.067 -1.483 13.281
94 2H5* A 3 2H5' A 3 -9.434 -1.328 12.132
95 H4* A 3 H4' A 3 -8.341 0.621 12.470
96 H3* A 3 H3' A 3 -8.835 -0.692 10.049
97 H1* A 3 H1' A 3 -5.792 1.390 10.659
98 H8 A 3 H8 A 3 -5.536 -2.174 10.576
99 1H6 A 3 1H6 A 3 0.727 -1.663 10.163
100 2H6 A 3 2H6 A 3 -0.631 -2.796 10.367
101 H2 A 3 H2 A 3 -1.228 2.436 10.076
102 2H2* A 3 1H2' A 3 -6.864 0.661 8.921
103 1H2* A 3 2H2' A 3 -6.794 -0.994 9.278
104 1H5* T 4 1H5' T 4 -7.468 3.613 10.226
105 2H5* T 4 2H5' T 4 -8.467 4.671 9.162
106 H4* T 4 H4' T 4 -6.062 5.344 9.433
107 H3* T 4 H3' T 4 -7.342 5.192 6.906
108 1H2* T 4 2H2' T 4 -5.935 3.509 5.984
109 2H2* T 4 1H2' T 4 -4.844 4.826 6.040
110 H1* T 4 H1' T 4 -3.731 4.411 7.803
111 H3 T 4 H3 T 4 -1.163 0.758 6.888
112 1H5M T 4 1H7 T 4 -6.416 -0.588 7.226
113 2H5M T 4 2H7 T 4 -5.264 -1.581 6.263
114 3H5M T 4 3H7 T 4 -5.224 -1.665 8.063
115 H6 T 4 H6 T 4 -5.863 1.598 7.137
116 1H5* C 5 1H5' C 5 -3.207 7.440 7.125
117 2H5* C 5 2H5' C 5 -3.538 8.933 6.175
118 H4* C 5 H4' C 5 -1.330 8.132 5.488
119 H3* C 5 H3' C 5 -3.431 8.472 3.612
120 H1* C 5 H1' C 5 -0.473 5.903 3.633
121 1H4 C 5 1H4 C 5 -2.095 -0.457 3.478
122 2H4 C 5 2H4 C 5 -3.782 0.015 3.729
123 H5 C 5 H5 C 5 -4.510 2.275 3.774
124 H6 C 5 H6 C 5 -3.879 4.666 4.100
125 2H2* C 5 1H2' C 5 -1.924 6.790 2.141
126 1H2* C 5 2H2' C 5 -3.377 6.230 2.763
127 1H5* A 6 1H5' A 6 1.005 8.133 2.871
128 2H5* A 6 2H5' A 6 1.401 9.550 1.830
129 H4* A 6 H4' A 6 3.178 8.059 1.619
130 H3* A 6 H3' A 6 1.746 8.602 -0.691
131 H1* A 6 H1' A 6 3.134 4.999 0.257
132 H8 A 6 H8 A 6 -0.416 5.886 0.322
133 1H6 A 6 1H6 A 6 -1.802 -0.184 0.075
134 2H6 A 6 2H6 A 6 -2.459 1.454 0.306
135 H2 A 6 H2 A 6 2.696 0.411 -0.037
136 H3T A 6 H3T A 6 3.842 8.121 -1.657
137 2H2* A 6 1H2' A 6 2.553 6.125 -1.713
138 1H2* A 6 2H2' A 6 0.972 6.497 -1.226
Start of MODEL 9
1 1H5* T 1 1H5' T 1 3.212 -8.127 -4.167
2 2H5* T 1 2H5' T 1 1.599 -8.197 -3.291
3 H4* T 1 H4' T 1 4.021 -6.498 -2.587
4 H3* T 1 H3' T 1 2.647 -8.683 -1.098
5 1H2* T 1 2H2' T 1 1.188 -7.227 0.052
6 2H2* T 1 1H2' T 1 2.632 -6.792 0.805
7 H1* T 1 H1' T 1 3.127 -4.934 -0.296
8 H3 T 1 H3 T 1 0.363 -1.340 -0.129
9 1H5M T 1 1H5M T 1 -2.595 -5.842 -0.145
10 2H5M T 1 2H5M T 1 -3.418 -4.266 -0.457
11 3H5M T 1 3H5M T 1 -2.610 -5.162 -1.814
12 H6 T 1 H6 T 1 -0.399 -6.052 -0.762
13 1H5* G 2 1H5' G 2 6.211 -5.788 -0.031
14 2H5* G 2 2H5' G 2 7.176 -6.532 1.237
15 H4* G 2 H4' G 2 7.225 -4.015 1.103
16 H3* G 2 H3' G 2 6.731 -5.722 3.276
17 H1* G 2 H1' G 2 5.418 -2.228 2.944
18 H8 G 2 H8 G 2 2.980 -5.060 2.986
19 H1 G 2 H1 G 2 0.248 0.730 3.457
20 1H2 G 2 1H2 G 2 3.599 1.852 3.497
21 2H2 G 2 2H2 G 2 1.904 2.382 3.500
22 2H2* G 2 1H2' G 2 5.788 -3.541 4.750
23 1H2* G 2 2H2' G 2 4.862 -4.852 4.226
24 1H5* A 3 1H5' A 3 8.045 -1.448 3.592
25 2H5* A 3 2H5' A 3 9.420 -1.270 4.725
26 H4* A 3 H4' A 3 8.297 0.666 4.375
27 H3* A 3 H3' A 3 8.849 -0.618 6.798
28 H1* A 3 H1' A 3 5.769 1.405 6.235
29 H8 A 3 H8 A 3 5.543 -2.156 6.322
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.734
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.529
32 H2 A 3 H2 A 3 1.228 2.436 6.826
33 2H2* A 3 1H2' A 3 6.875 0.698 7.958
34 1H2* A 3 2H2' A 3 6.825 -0.960 7.605
35 1H5* T 4 1H5' T 4 7.407 3.699 6.671
36 2H5* T 4 2H5' T 4 8.451 4.744 7.711
37 H4* T 4 H4' T 4 6.056 5.443 7.614
38 H3* T 4 H3' T 4 7.396 4.987 10.111
39 1H2* T 4 2H2' T 4 5.899 3.463 10.972
40 2H2* T 4 1H2' T 4 4.828 4.792 10.935
41 H1* T 4 H1' T 4 3.727 4.439 9.153
42 H3 T 4 H3 T 4 1.163 0.757 10.015
43 1H5M T 4 1H5M T 4 5.277 -1.586 10.619
44 2H5M T 4 2H5M T 4 5.233 -1.654 8.818
45 3H5M T 4 3H5M T 4 6.420 -0.577 9.660
46 H6 T 4 H6 T 4 5.863 1.598 9.760
47 1H5* C 5 1H5' C 5 2.123 7.665 9.339
48 2H5* C 5 2H5' C 5 3.012 8.890 10.281
49 H4* C 5 H4' C 5 0.880 7.961 11.305
50 H3* C 5 H3' C 5 3.285 8.483 12.755
51 H1* C 5 H1' C 5 0.442 5.843 13.291
52 1H4 C 5 1H4 C 5 3.783 0.015 13.182
53 2H4 C 5 2H4 C 5 2.096 -0.456 13.431
54 H5 C 5 H5 C 5 4.506 2.272 13.168
55 H6 C 5 H6 C 5 3.883 4.666 12.840
56 2H2* C 5 1H2' C 5 1.961 6.920 14.584
57 1H2* C 5 2H2' C 5 3.375 6.396 13.878
58 1H5* A 6 1H5' A 6 -1.069 8.045 13.878
59 2H5* A 6 2H5' A 6 -1.460 9.514 14.845
60 H4* A 6 H4' A 6 -3.191 8.028 15.212
61 H3* A 6 H3' A 6 -1.662 8.652 17.449
62 H1* A 6 H1' A 6 -3.125 5.026 16.677
63 H8 A 6 H8 A 6 0.441 5.892 16.503
64 1H6 A 6 1H6 A 6 1.801 -0.184 16.833
65 2H6 A 6 2H6 A 6 2.460 1.454 16.600
66 H2 A 6 H2 A 6 -2.695 0.411 16.940
67 2H2* A 6 1H2' A 6 -2.483 6.230 18.592
68 1H2* A 6 2H2' A 6 -0.913 6.558 18.052
69 1H5* T 1 1H5' T 1 -3.381 -7.722 21.263
70 2H5* T 1 2H5' T 1 -1.705 -7.637 20.534
71 H4* T 1 H4' T 1 -4.195 -6.239 19.438
72 H3* T 1 H3' T 1 -2.699 -8.575 18.327
73 1H2* T 1 2H2' T 1 -1.205 -7.274 17.080
74 2H2* T 1 1H2' T 1 -2.594 -6.912 16.193
75 H1* T 1 H1' T 1 -3.110 -4.942 17.059
76 H3 T 1 H3 T 1 -0.363 -1.340 17.034
77 1H5M T 1 1H5M T 1 3.419 -4.225 17.489
78 2H5M T 1 2H5M T 1 2.554 -5.295 18.668
79 3H5M T 1 3H5M T 1 2.650 -5.763 16.930
80 H6 T 1 H6 T 1 0.404 -6.043 17.692
81 1H5* G 2 1H5' G 2 -6.152 -5.728 17.070
82 2H5* G 2 2H5' G 2 -7.150 -6.475 15.832
83 H4* G 2 H4' G 2 -7.148 -3.953 15.959
84 H3* G 2 H3' G 2 -6.775 -5.679 13.779
85 H1* G 2 H1' G 2 -5.396 -2.210 14.028
86 H8 G 2 H8 G 2 -2.990 -5.061 13.964
87 H1 G 2 H1 G 2 -0.248 0.730 13.444
88 1H2 G 2 1H2 G 2 -3.599 1.851 13.396
89 2H2 G 2 2H2 G 2 -1.904 2.381 13.395
90 2H2* G 2 1H2' G 2 -5.843 -3.530 12.245
91 1H2* G 2 2H2' G 2 -4.922 -4.852 12.752
92 1H5* A 3 1H5' A 3 -7.985 -1.366 13.450
93 2H5* A 3 2H5' A 3 -9.399 -1.152 12.373
94 H4* A 3 H4' A 3 -8.186 0.739 12.644
95 H3* A 3 H3' A 3 -8.859 -0.563 10.254
96 H1* A 3 H1' A 3 -5.738 1.412 10.717
97 H8 A 3 H8 A 3 -5.550 -2.148 10.642
98 1H6 A 3 1H6 A 3 0.727 -1.662 10.168
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.373
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.900 0.725 9.018
102 1H2* A 3 2H2' A 3 -6.867 -0.934 9.358
103 1H5* T 4 1H5' T 4 -7.327 3.728 10.371
104 2H5* T 4 2H5' T 4 -8.345 4.815 9.353
105 H4* T 4 H4' T 4 -5.925 5.408 9.458
106 H3* T 4 H3' T 4 -7.320 5.194 6.981
107 1H2* T 4 2H2' T 4 -5.951 3.517 6.029
108 2H2* T 4 1H2' T 4 -4.844 4.818 6.047
109 H1* T 4 H1' T 4 -3.693 4.408 7.787
110 H3 T 4 H3 T 4 -1.163 0.757 6.888
111 1H5M T 4 1H5M T 4 -6.424 -0.562 7.307
112 2H5M T 4 2H5M T 4 -5.313 -1.606 6.347
113 3H5M T 4 3H5M T 4 -5.229 -1.627 8.146
114 H6 T 4 H6 T 4 -5.867 1.604 7.188
115 1H5* C 5 1H5' C 5 -3.179 7.439 7.115
116 2H5* C 5 2H5' C 5 -3.527 8.922 6.154
117 H4* C 5 H4' C 5 -1.296 8.136 5.482
118 H3* C 5 H3' C 5 -3.386 8.489 3.610
119 H1* C 5 H1' C 5 -0.463 5.903 3.606
120 1H4 C 5 1H4 C 5 -3.781 0.013 3.746
121 2H4 C 5 2H4 C 5 -2.095 -0.457 3.486
122 H5 C 5 H5 C 5 -4.510 2.275 3.774
123 H6 C 5 H6 C 5 -3.880 4.667 4.106
124 2H2* C 5 1H2' C 5 -1.923 6.785 2.135
125 1H2* C 5 2H2' C 5 -3.374 6.238 2.775
126 1H5* A 6 1H5' A 6 1.086 8.121 2.756
127 2H5* A 6 2H5' A 6 1.423 9.556 1.716
128 H4* A 6 H4' A 6 3.204 8.116 1.369
129 H3* A 6 H3' A 6 1.621 8.575 -0.861
130 H1* A 6 H1' A 6 3.119 5.010 0.097
131 H8 A 6 H8 A 6 -0.437 5.876 0.301
132 1H6 A 6 1H6 A 6 -1.801 -0.184 0.071
133 2H6 A 6 2H6 A 6 -2.460 1.454 0.302
134 H2 A 6 H2 A 6 2.695 0.411 -0.039
135 2H2* A 6 1H2' A 6 2.420 6.083 -1.868
136 1H2* A 6 2H2' A 6 0.864 6.444 -1.310
Start of MODEL 10
1 1H5* T 1 1H5' T 1 3.319 -7.756 -4.408
2 2H5* T 1 2H5' T 1 1.636 -7.683 -3.666
3 H4* T 1 H4' T 1 4.119 -6.205 -2.663
4 H3* T 1 H3' T 1 2.733 -8.559 -1.448
5 1H2* T 1 2H2' T 1 1.243 -7.266 -0.176
6 2H2* T 1 1H2' T 1 2.663 -6.869 0.651
7 H1* T 1 H1' T 1 3.124 -4.915 -0.259
8 H3 T 1 H3 T 1 0.364 -1.340 -0.131
9 1H5M T 1 1H5M T 1 -2.581 -5.278 -1.756
10 2H5M T 1 2H5M T 1 -2.624 -5.785 -0.027
11 3H5M T 1 3H5M T 1 -3.420 -4.242 -0.526
12 H6 T 1 H6 T 1 -0.395 -6.049 -0.779
13 1H5* G 2 1H5' G 2 6.251 -5.684 -0.170
14 2H5* G 2 2H5' G 2 7.213 -6.445 1.087
15 H4* G 2 H4' G 2 7.187 -3.921 0.996
16 H3* G 2 H3' G 2 6.763 -5.686 3.142
17 H1* G 2 H1' G 2 5.401 -2.210 2.901
18 H8 G 2 H8 G 2 2.986 -5.063 2.937
19 H1 G 2 H1 G 2 0.248 0.730 3.456
20 1H2 G 2 1H2 G 2 3.599 1.853 3.489
21 2H2 G 2 2H2 G 2 1.905 2.382 3.498
22 2H2* G 2 1H2' G 2 5.824 -3.538 4.680
23 1H2* G 2 2H2' G 2 4.908 -4.857 4.160
24 1H5* A 3 1H5' A 3 8.015 -1.377 3.524
25 2H5* A 3 2H5' A 3 9.417 -1.204 4.626
26 H4* A 3 H4' A 3 8.264 0.721 4.370
27 H3* A 3 H3' A 3 8.845 -0.634 6.753
28 H1* A 3 H1' A 3 5.766 1.409 6.237
29 H8 A 3 H8 A 3 5.544 -2.159 6.286
30 1H6 A 3 1H6 A 3 -0.727 -1.662 6.733
31 2H6 A 3 2H6 A 3 0.630 -2.796 6.528
32 H2 A 3 H2 A 3 1.228 2.436 6.826
33 2H2* A 3 1H2' A 3 6.880 0.682 7.949
34 1H2* A 3 2H2' A 3 6.829 -0.971 7.587
35 1H5* T 4 1H5' T 4 7.424 3.692 6.699
36 2H5* T 4 2H5' T 4 8.476 4.718 7.751
37 H4* T 4 H4' T 4 6.089 5.446 7.646
38 H3* T 4 H3' T 4 7.412 4.971 10.145
39 1H2* T 4 2H2' T 4 5.902 3.441 10.987
40 2H2* T 4 1H2' T 4 4.841 4.778 10.956
41 H1* T 4 H1' T 4 3.740 4.449 9.171
42 H3 T 4 H3 T 4 1.163 0.757 10.015
43 1H5M T 4 1H5M T 4 5.277 -1.602 10.593
44 2H5M T 4 2H5M T 4 5.226 -1.645 8.793
45 3H5M T 4 3H5M T 4 6.418 -0.583 9.644
46 H6 T 4 H6 T 4 5.865 1.592 9.753
47 1H5* C 5 1H5' C 5 2.173 7.702 9.411
48 2H5* C 5 2H5' C 5 3.070 8.905 10.375
49 H4* C 5 H4' C 5 0.907 8.006 11.369
50 H3* C 5 H3' C 5 3.294 8.491 12.848
51 H1* C 5 H1' C 5 0.443 5.859 13.333
52 1H4 C 5 1H4 C 5 3.780 0.013 13.151
53 2H4 C 5 2H4 C 5 2.095 -0.457 13.415
54 H5 C 5 H5 C 5 4.504 2.271 13.181
55 H6 C 5 H6 C 5 3.883 4.667 12.848
56 2H2* C 5 1H2' C 5 1.972 6.889 14.635
57 1H2* C 5 2H2' C 5 3.386 6.372 13.921
58 1H5* A 6 1H5' A 6 -1.097 8.104 14.065
59 2H5* A 6 2H5' A 6 -1.412 9.557 15.087
60 H4* A 6 H4' A 6 -3.168 8.125 15.501
61 H3* A 6 H3' A 6 -1.536 8.608 17.692
62 H1* A 6 H1' A 6 -3.109 5.043 16.815
63 H8 A 6 H8 A 6 0.460 5.880 16.548
64 1H6 A 6 1H6 A 6 1.801 -0.184 16.828
65 2H6 A 6 2H6 A 6 2.460 1.454 16.596
66 H2 A 6 H2 A 6 -2.695 0.411 16.939
67 2H2* A 6 1H2' A 6 -2.367 6.146 18.756
68 1H2* A 6 2H2' A 6 -0.815 6.468 18.172
69 1H5* T 1 1H5' T 1 -1.748 -7.639 21.063
70 2H5* T 1 2H5' T 1 -1.501 -8.862 19.765
71 H4* T 1 H4' T 1 -3.538 -7.028 19.618
72 H3* T 1 H3' T 1 -2.510 -8.806 17.722
73 1H2* T 1 2H2' T 1 -1.082 -7.170 16.620
74 2H2* T 1 1H2' T 1 -2.593 -6.771 15.999
75 H1* T 1 H1' T 1 -3.141 -5.017 17.266
76 H3 T 1 H3 T 1 -0.362 -1.340 17.027
77 1H5M T 1 1H5M T 1 2.561 -5.395 18.571
78 2H5M T 1 2H5M T 1 2.650 -5.718 16.802
79 3H5M T 1 3H5M T 1 3.420 -4.229 17.483
80 H6 T 1 H6 T 1 0.399 -6.058 17.657
81 1H5* G 2 1H5' G 2 -6.102 -5.780 17.010
82 2H5* G 2 2H5' G 2 -7.149 -6.497 15.790
83 H4* G 2 H4' G 2 -7.156 -3.987 15.935
84 H3* G 2 H3' G 2 -6.780 -5.681 13.731
85 H1* G 2 H1' G 2 -5.403 -2.214 14.019
86 H8 G 2 H8 G 2 -2.995 -5.051 13.888
87 H1 G 2 H1 G 2 -0.248 0.730 13.443
88 1H2 G 2 1H2 G 2 -3.599 1.853 13.408
89 2H2 G 2 2H2 G 2 -1.904 2.381 13.400
90 2H2* G 2 1H2' G 2 -5.850 -3.518 12.224
91 1H2* G 2 2H2' G 2 -4.923 -4.844 12.723
92 1H5* A 3 1H5' A 3 -7.995 -1.371 13.427
93 2H5* A 3 2H5' A 3 -9.410 -1.157 12.352
94 H4* A 3 H4' A 3 -8.206 0.736 12.612
95 H3* A 3 H3' A 3 -8.855 -0.583 10.223
96 H1* A 3 H1' A 3 -5.744 1.409 10.707
97 H8 A 3 H8 A 3 -5.550 -2.148 10.629
98 1H6 A 3 1H6 A 3 0.727 -1.662 10.167
99 2H6 A 3 2H6 A 3 -0.630 -2.796 10.373
100 H2 A 3 H2 A 3 -1.228 2.436 10.075
101 2H2* A 3 1H2' A 3 -6.894 0.718 9.001
102 1H2* A 3 2H2' A 3 -6.857 -0.941 9.343
103 1H5* T 4 1H5' T 4 -7.358 3.695 10.360
104 2H5* T 4 2H5' T 4 -8.361 4.788 9.334
105 H4* T 4 H4' T 4 -5.936 5.371 9.496
106 H3* T 4 H3' T 4 -7.305 5.225 7.002
107 1H2* T 4 2H2' T 4 -5.949 3.534 6.041
108 2H2* T 4 1H2' T 4 -4.836 4.831 6.072
109 H1* T 4 H1' T 4 -3.693 4.395 7.812
110 H3 T 4 H3 T 4 -1.163 0.757 6.888
111 1H5M T 4 1H5M T 4 -6.423 -0.564 7.291
112 2H5M T 4 2H5M T 4 -5.305 -1.602 6.333
113 3H5M T 4 3H5M T 4 -5.231 -1.632 8.132
114 H6 T 4 H6 T 4 -5.866 1.606 7.180
115 1H5* C 5 1H5' C 5 -3.138 7.412 7.215
116 2H5* C 5 2H5' C 5 -3.452 8.913 6.273
117 H4* C 5 H4' C 5 -1.246 8.076 5.589
118 H3* C 5 H3' C 5 -3.344 8.504 3.727
119 H1* C 5 H1' C 5 -0.452 5.880 3.671
120 1H4 C 5 1H4 C 5 -3.784 0.015 3.720
121 2H4 C 5 2H4 C 5 -2.096 -0.456 3.473
122 H5 C 5 H5 C 5 -4.511 2.277 3.785
123 H6 C 5 H6 C 5 -3.876 4.670 4.116
124 2H2* C 5 1H2' C 5 -1.888 6.831 2.208
125 1H2* C 5 2H2' C 5 -3.349 6.283 2.831
126 1H5* A 6 1H5' A 6 1.092 8.041 2.963
127 2H5* A 6 2H5' A 6 1.513 9.499 1.992
128 H4* A 6 H4' A 6 3.254 7.999 1.669
129 H3* A 6 H3' A 6 1.763 8.625 -0.590
130 H1* A 6 H1' A 6 3.133 4.984 0.220
131 H8 A 6 H8 A 6 -0.416 5.891 0.356
132 1H6 A 6 1H6 A 6 -1.801 -0.184 0.069
133 2H6 A 6 2H6 A 6 -2.460 1.454 0.301
134 H2 A 6 H2 A 6 2.695 0.411 -0.040
135 2H2* A 6 1H2' A 6 2.528 6.175 -1.704
136 1H2* A 6 2H2' A 6 0.962 6.550 -1.175