NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
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10204 |
1pdt   |
cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H5* G 1 H5'' G 1 -13.378 -10.841 -2.512
2 2H5* G 1 H5' G 1 -12.993 -12.392 -3.287
3 H4* G 1 H4' G 1 -12.127 -12.306 -0.982
4 H3* G 1 H3' G 1 -11.434 -9.632 -1.678
5 1H2* G 1 H2'' G 1 -8.895 -10.290 -0.718
6 2H2* G 1 H2' G 1 -9.306 -9.938 -2.420
7 H1* G 1 H1' G 1 -8.826 -12.540 -1.063
8 H8 G 1 H8 G 1 -9.493 -11.676 -4.795
9 H1 G 1 H1 G 1 -3.408 -12.987 -3.347
10 1H2 G 1 H21 G 1 -3.232 -13.458 -1.180
11 2H2 G 1 H22 G 1 -4.563 -13.207 -0.070
12 H5T G 1 H5T G 1 -11.050 -11.142 -4.071
13 1H5* A 2 H5'' A 2 -9.162 -10.780 3.030
14 2H5* A 2 H5' A 2 -8.934 -11.863 1.643
15 H4* A 2 H4' A 2 -6.953 -11.716 3.185
16 H3* A 2 H3' A 2 -7.357 -8.867 2.646
17 1H2* A 2 H2'' A 2 -4.511 -9.210 2.649
18 2H2* A 2 H2' A 2 -5.547 -8.478 1.391
19 H1* A 2 H1' A 2 -4.337 -11.152 1.520
20 H8 A 2 H8 A 2 -6.780 -9.400 -0.974
21 1H6 A 2 H61 A 2 -1.935 -9.323 -4.792
22 2H6 A 2 H62 A 2 -3.670 -9.134 -4.681
23 H2 A 2 H2 A 2 -0.647 -11.283 -0.945
24 1H5* C 3 H5'' C 3 -3.327 -9.134 6.227
25 2H5* C 3 H5' C 3 -3.480 -10.234 4.844
26 H4* C 3 H4' C 3 -1.125 -9.537 5.331
27 H3* C 3 H3' C 3 -2.366 -6.884 5.193
28 1H2* C 3 H2'' C 3 0.200 -6.592 3.938
29 2H2* C 3 H2' C 3 -1.408 -6.153 3.294
30 H1* C 3 H1' C 3 0.285 -8.490 2.726
31 1H4 C 3 H41 C 3 -1.591 -6.646 -3.043
32 2H4 C 3 H42 C 3 -3.267 -6.922 -2.621
33 H5 C 3 H5 C 3 -3.948 -6.846 -0.250
34 H6 C 3 H6 C 3 -3.239 -7.532 1.992
35 1H5* A 4 H5'' A 4 2.762 -6.108 6.626
36 2H5* A 4 H5' A 4 2.629 -7.166 5.206
37 H4* A 4 H4' A 4 4.538 -5.481 5.169
38 H3* A 4 H3' A 4 2.348 -3.685 5.689
39 1H2* A 4 H2'' A 4 3.471 -2.260 3.556
40 2H2* A 4 H2' A 4 1.878 -3.066 3.578
41 H1* A 4 H1' A 4 4.461 -3.969 2.392
42 H8 A 4 H8 A 4 0.684 -4.860 2.341
43 1H6 A 4 H61 A 4 0.896 -3.050 -3.553
44 2H6 A 4 H62 A 4 -0.082 -3.858 -2.348
45 H2 A 4 H2 A 4 5.008 -2.612 -1.818
46 1H5* T 5 H5'' T 5 6.695 -1.144 4.592
47 2H5* T 5 H5' T 5 6.006 -2.107 3.268
48 H4* T 5 H4' T 5 7.359 0.083 2.744
49 H3* T 5 H3' T 5 5.005 1.120 4.112
50 1H2* T 5 H2'' T 5 5.166 2.828 1.845
51 2H2* T 5 H2' T 5 3.814 1.757 2.308
52 H1* T 5 H1' T 5 5.967 1.368 0.304
53 H3 T 5 H3 T 5 2.880 1.133 -2.897
54 1H5M T 5 H51 T 5 -0.083 -1.227 -0.247
55 2H5M T 5 H52 T 5 0.289 -0.385 1.278
56 3H5M T 5 H53 T 5 0.994 -1.987 0.953
57 H6 T 5 H6 T 5 3.025 -0.519 1.615
58 1H5* A 6 H5'' A 6 8.362 4.390 1.772
59 2H5* A 6 H5' A 6 7.589 2.912 1.164
60 H4* A 6 H4' A 6 8.176 4.605 -0.611
61 H3* A 6 H3' A 6 6.534 6.266 1.169
62 1H2* A 6 H2'' A 6 5.910 7.082 -1.531
63 2H2* A 6 H2' A 6 4.803 6.631 -0.203
64 H1* A 6 H1' A 6 5.727 5.074 -2.502
65 H8 A 6 H8 A 6 3.673 3.903 0.581
66 1H6 A 6 H61 A 6 -1.266 4.685 -3.062
67 2H6 A 6 H62 A 6 -0.723 4.174 -1.478
68 H2 A 6 H2 A 6 2.376 5.791 -5.418
69 1H5* G 7 H5'' G 7 8.704 7.973 -3.026
70 2H5* G 7 H5' G 7 7.437 6.746 -3.238
71 H4* G 7 H4' G 7 7.945 8.342 -5.207
72 H3* G 7 H3' G 7 6.998 10.185 -3.129
73 1H2* G 7 H2'' G 7 5.856 10.939 -5.725
74 2H2* G 7 H2' G 7 5.105 10.941 -4.103
75 H1* G 7 H1' G 7 4.692 9.073 -6.185
76 H8 G 7 H8 G 7 4.640 8.461 -2.356
77 H1 G 7 H1 G 7 -1.088 9.225 -5.110
78 1H2 G 7 H21 G 7 -0.822 9.843 -7.217
79 2H2 G 7 H22 G 7 0.755 9.993 -7.960
80 1H5* C 8 H5'' C 8 8.175 13.224 -7.430
81 2H5* C 8 H5' C 8 7.510 11.583 -7.293
82 H4* C 8 H4' C 8 6.320 12.952 -8.989
83 H3* C 8 H3' C 8 6.256 14.842 -6.740
84 1H2* C 8 H2'' C 8 3.757 15.084 -8.200
85 2H2* C 8 H2' C 8 4.042 14.999 -6.439
86 H1* C 8 H1' C 8 3.097 12.937 -8.219
87 1H4 C 8 H41 C 8 0.156 11.581 -2.783
88 2H4 C 8 H42 C 8 1.631 11.757 -1.856
89 H5 C 8 H5 C 8 3.641 12.749 -2.815
90 H6 C 8 H6 C 8 4.821 13.191 -4.913
91 H3T C 8 H3T C 8 7.053 15.264 -8.875
92 1H1' GPN 9 HN1 PGU 9 -9.706 16.009 -5.974
93 2H1' GPN 9 HN2 PGU 9 -9.879 17.462 -5.018
94 1H2' GPN 9 HD1 PGU 9 -7.543 17.788 -5.580
95 2H2' GPN 9 HD2 PGU 9 -8.825 18.260 -6.719
96 1H3' GPN 9 HG1 PGU 9 -6.552 16.731 -7.308
97 2H3' GPN 9 HG2 PGU 9 -7.991 16.929 -8.335
98 1H5' GPN 9 HA21 PGU 9 -9.883 14.271 -7.262
99 2H5' GPN 9 HA22 PGU 9 -9.489 15.316 -8.624
100 1H8' GPN 9 HB1 PGU 9 -6.445 15.760 -4.927
101 2H8' GPN 9 HB2 PGU 9 -5.426 15.454 -6.332
102 H8 GPN 9 H8 PGU 9 -6.351 13.762 -2.981
103 HN1 GPN 9 H1 PGU 9 -0.672 12.182 -5.468
104 1HN2 GPN 9 H21 PGU 9 -0.495 12.992 -7.523
105 2HN2 GPN 9 H22 PGU 9 -1.787 13.889 -8.292
106 1H1' CPN 10 HN PCY 10 -9.055 12.064 -7.189
107 1H2' CPN 10 HD1 PCY 10 -9.325 10.602 -9.628
108 2H2' CPN 10 HD2 PCY 10 -8.267 10.079 -8.298
109 1H3' CPN 10 HG1 PCY 10 -6.593 11.850 -9.450
110 2H3' CPN 10 HG2 PCY 10 -7.562 11.436 -10.881
111 1H5' CPN 10 HA21 PCY 10 -7.519 9.417 -11.835
112 2H5' CPN 10 HA22 PCY 10 -7.341 8.021 -10.778
113 1H8' CPN 10 HB1 PCY 10 -6.086 11.022 -7.777
114 2H8' CPN 10 HB2 PCY 10 -4.426 11.077 -8.365
115 1HN4 CPN 10 H41 PCY 10 -2.403 8.438 -2.968
116 2HN4 CPN 10 H42 PCY 10 -4.030 7.949 -2.553
117 H5 CPN 10 H5 PCY 10 -5.898 8.142 -4.095
118 H6 CPN 10 H6 PCY 10 -6.658 9.116 -6.192
119 1H1' TPN 11 HN PTH 11 -4.339 9.698 -11.202
120 1H2' TPN 11 HD1 PTH 11 -3.519 7.387 -13.072
121 2H2' TPN 11 HD2 PTH 11 -3.254 9.038 -13.670
122 1H3' TPN 11 HG1 PTH 11 -2.189 9.007 -11.039
123 2H3' TPN 11 HG2 PTH 11 -1.279 9.052 -12.564
124 1H5' TPN 11 HA21 PTH 11 -1.547 6.704 -13.799
125 2H5' TPN 11 HA22 PTH 11 -2.159 5.399 -12.786
126 1H8' TPN 11 HB1 PTH 11 -1.952 8.442 -9.488
127 2H8' TPN 11 HB2 PTH 11 -0.230 8.157 -9.222
128 H6 TPN 11 H6 PTH 11 -3.595 7.092 -8.362
129 HN3 TPN 11 H3 PTH 11 -0.063 5.800 -5.382
130 1HM5 TPN 11 H51 PTH 11 -5.235 6.416 -6.868
131 2HM5 TPN 11 H52 PTH 11 -4.808 6.007 -5.189
132 3HM5 TPN 11 H53 PTH 11 -4.749 4.756 -6.453
133 1H1' APN 12 HN PAD 12 -0.546 4.037 -11.579
134 1H2' APN 12 HD1 PAD 12 2.278 4.274 -12.783
135 2H2' APN 12 HD2 PAD 12 1.392 2.758 -13.071
136 1H3' APN 12 HG1 PAD 12 1.860 2.019 -10.973
137 2H3' APN 12 HG2 PAD 12 1.243 3.520 -10.249
138 1H5' APN 12 HA21 PAD 12 5.100 3.912 -11.742
139 2H5' APN 12 HA22 PAD 12 4.012 2.767 -12.521
140 1H8' APN 12 HB1 PAD 12 1.729 5.383 -9.456
141 2H8' APN 12 HB2 PAD 12 2.852 5.619 -8.123
142 H8 APN 12 H8 PAD 12 -0.321 3.935 -8.890
143 1HN6 APN 12 H61 PAD 12 0.418 0.589 -3.785
144 2HN6 APN 12 H62 PAD 12 -0.735 1.202 -4.948
145 H2 APN 12 H2 PAD 12 4.300 2.715 -4.598
146 1H1' TPN 13 HN PTH 13 6.089 3.053 -9.539
147 1H2' TPN 13 HD1 PTH 13 7.695 0.736 -10.338
148 2H2' TPN 13 HD2 PTH 13 6.383 0.099 -9.325
149 1H3' TPN 13 HG1 PTH 13 7.156 2.158 -7.744
150 2H3' TPN 13 HG2 PTH 13 8.689 1.863 -8.593
151 1H5' TPN 13 HA21 PTH 13 9.992 -0.182 -6.962
152 2H5' TPN 13 HA22 PTH 13 9.602 -0.331 -8.669
153 1H8' TPN 13 HB1 PTH 13 5.631 1.248 -7.221
154 2H8' TPN 13 HB2 PTH 13 6.012 1.438 -5.512
155 H6 TPN 13 H6 PTH 13 3.545 0.692 -7.673
156 HN3 TPN 13 H3 PTH 13 3.345 -2.029 -3.732
157 1HM5 TPN 13 H51 PTH 13 1.515 0.036 -8.397
158 2HM5 TPN 13 H52 PTH 13 0.353 -0.174 -7.064
159 3HM5 TPN 13 H53 PTH 13 0.999 -1.597 -7.918
160 1H1' GPN 14 HN PGU 14 7.170 -2.224 -7.514
161 1H2' GPN 14 HD1 PGU 14 8.927 -4.679 -7.902
162 2H2' GPN 14 HD2 PGU 14 7.180 -4.669 -7.546
163 1H3' GPN 14 HG1 PGU 14 7.925 -3.763 -5.197
164 2H3' GPN 14 HG2 PGU 14 9.522 -4.413 -5.635
165 1H5' GPN 14 HA21 PGU 14 9.950 -6.619 -5.572
166 2H5' GPN 14 HA22 PGU 14 8.783 -7.424 -6.618
167 1H8' GPN 14 HB1 PGU 14 6.118 -4.079 -5.432
168 2H8' GPN 14 HB2 PGU 14 6.103 -4.468 -3.713
169 H8 GPN 14 H8 PGU 14 3.858 -4.024 -6.572
170 HN1 GPN 14 H1 PGU 14 1.032 -7.022 -1.689
171 1HN2 GPN 14 H21 PGU 14 2.533 -7.472 -0.119
172 2HN2 GPN 14 H22 PGU 14 4.246 -7.208 -0.356
173 1H1' TPN 15 HN PTH 15 7.869 -9.328 -6.028
174 1H2' TPN 15 HD1 PTH 15 9.115 -10.690 -3.658
175 2H2' TPN 15 HD2 PTH 15 7.778 -11.314 -4.655
176 1H3' TPN 15 HG1 PTH 15 6.689 -9.136 -3.228
177 2H3' TPN 15 HG2 PTH 15 7.670 -10.021 -2.034
178 1H5' TPN 15 HA21 PTH 15 7.507 -12.552 -2.200
179 2H5' TPN 15 HA22 PTH 15 6.458 -13.158 -3.484
180 1H8' TPN 15 HB1 PTH 15 5.163 -8.907 -3.983
181 2H8' TPN 15 HB2 PTH 15 4.400 -8.924 -2.394
182 H6 TPN 15 H6 PTH 15 3.973 -8.469 -5.782
183 HN3 TPN 15 H3 PTH 15 -0.069 -9.653 -3.467
184 1HM5 TPN 15 H51 PTH 15 1.010 -7.417 -7.497
185 2HM5 TPN 15 H52 PTH 15 1.735 -8.950 -8.039
186 3HM5 TPN 15 H53 PTH 15 2.780 -7.584 -7.580
187 1H1' CPN 16 HN PCY 16 4.672 -11.491 -1.096
188 1H2' CPN 16 HD1 PCY 16 4.288 -13.236 1.094
189 2H2' CPN 16 HD2 PCY 16 3.464 -14.126 -0.216
190 1H3' CPN 16 HG1 PCY 16 2.452 -11.696 -0.710
191 2H3' CPN 16 HG2 PCY 16 2.770 -11.495 1.029
192 1H5' CPN 16 HA21 PCY 16 1.665 -12.925 2.635
193 2H5' CPN 16 HA22 PCY 16 0.281 -13.897 2.131
194 1H8' CPN 16 HB1 PCY 16 1.333 -14.834 -2.107
195 2H8' CPN 16 HB2 PCY 16 2.252 -13.359 -1.842
196 1HN4 CPN 16 H41 PCY 16 -2.713 -12.090 -6.132
197 2HN4 CPN 16 H42 PCY 16 -1.236 -11.640 -6.956
198 H5 CPN 16 H5 PCY 16 0.944 -11.881 -5.964
199 H6 CPN 16 H6 PCY 16 2.180 -12.478 -3.950
200 1HN NH2 17 HN3 PCY 16 -1.511 -10.710 3.233
201 2HN NH2 17 HN4 PCY 16 -1.538 -12.424 3.574
Start of MODEL 2
1 1H5* G 1 H5'' G 1 -12.562 -13.940 -3.057
2 2H5* G 1 H5' G 1 -11.802 -12.456 -3.666
3 H4* G 1 H4' G 1 -11.806 -13.385 -0.769
4 H3* G 1 H3' G 1 -11.418 -10.788 -1.877
5 1H2* G 1 H2'' G 1 -8.857 -10.960 -0.780
6 2H2* G 1 H2' G 1 -9.244 -10.948 -2.524
7 H1* G 1 H1' G 1 -8.523 -13.212 -0.735
8 H8 G 1 H8 G 1 -9.087 -13.085 -4.575
9 H1 G 1 H1 G 1 -2.968 -13.084 -2.715
10 1H2 G 1 H21 G 1 -2.864 -13.091 -0.491
11 2H2 G 1 H22 G 1 -4.298 -12.984 0.508
12 H5T G 1 H5T G 1 -13.257 -11.577 -1.782
13 1H5* A 2 H5'' A 2 -9.313 -11.097 3.007
14 2H5* A 2 H5' A 2 -8.766 -12.301 1.825
15 H4* A 2 H4' A 2 -7.029 -11.680 3.524
16 H3* A 2 H3' A 2 -7.803 -9.012 2.682
17 1H2* A 2 H2'' A 2 -4.973 -8.773 2.772
18 2H2* A 2 H2' A 2 -6.055 -8.487 1.379
19 H1* A 2 H1' A 2 -4.343 -10.801 2.009
20 H8 A 2 H8 A 2 -6.822 -10.170 -0.921
21 1H6 A 2 H61 A 2 -1.727 -9.668 -4.375
22 2H6 A 2 H62 A 2 -3.466 -9.859 -4.402
23 H2 A 2 H2 A 2 -0.452 -10.115 -0.091
24 1H5* C 3 H5'' C 3 -3.893 -8.381 6.329
25 2H5* C 3 H5' C 3 -3.715 -9.551 5.007
26 H4* C 3 H4' C 3 -1.592 -8.358 5.614
27 H3* C 3 H3' C 3 -3.322 -6.032 5.243
28 1H2* C 3 H2'' C 3 -0.851 -5.236 4.061
29 2H2* C 3 H2' C 3 -2.470 -5.271 3.302
30 H1* C 3 H1' C 3 -0.215 -7.163 3.081
31 1H4 C 3 H41 C 3 -1.718 -6.484 -3.015
32 2H4 C 3 H42 C 3 -3.405 -6.832 -2.698
33 H5 C 3 H5 C 3 -4.329 -6.740 -0.433
34 H6 C 3 H6 C 3 -3.760 -7.037 1.928
35 1H5* A 4 H5'' A 4 1.704 -4.636 6.576
36 2H5* A 4 H5' A 4 1.371 -5.885 5.360
37 H4* A 4 H4' A 4 3.397 -4.488 4.868
38 H3* A 4 H3' A 4 1.535 -2.348 5.400
39 1H2* A 4 H2'' A 4 2.649 -1.332 3.026
40 2H2* A 4 H2' A 4 0.957 -1.832 3.291
41 H1* A 4 H1' A 4 3.185 -3.275 1.944
42 H8 A 4 H8 A 4 -0.651 -3.538 2.460
43 1H6 A 4 H61 A 4 -0.996 -2.457 -3.616
44 2H6 A 4 H62 A 4 -1.920 -2.853 -2.183
45 H2 A 4 H2 A 4 3.332 -2.492 -2.447
46 1H5* T 5 H5'' T 5 6.228 -1.219 3.734
47 2H5* T 5 H5' T 5 5.037 -2.185 2.839
48 H4* T 5 H4' T 5 6.933 -1.089 1.488
49 H3* T 5 H3' T 5 5.792 1.262 2.705
50 1H2* T 5 H2'' T 5 5.804 2.189 0.075
51 2H2* T 5 H2' T 5 4.352 1.814 1.047
52 H1* T 5 H1' T 5 5.747 0.162 -1.028
53 H3 T 5 H3 T 5 2.371 1.043 -3.788
54 1H5M T 5 H51 T 5 0.091 -0.827 0.618
55 2H5M T 5 H52 T 5 -0.824 0.152 -0.556
56 3H5M T 5 H53 T 5 0.025 0.942 0.795
57 H6 T 5 H6 T 5 2.572 -0.140 0.866
58 1H5* A 6 H5'' A 6 8.788 2.000 -1.754
59 2H5* A 6 H5' A 6 7.212 2.264 -0.989
60 H4* A 6 H4' A 6 9.038 4.304 -2.290
61 H3* A 6 H3' A 6 7.121 4.683 -0.081
62 1H2* A 6 H2'' A 6 6.783 6.830 -2.018
63 2H2* A 6 H2' A 6 5.552 5.857 -1.166
64 H1* A 6 H1' A 6 6.477 5.632 -3.882
65 H8 A 6 H8 A 6 4.590 3.261 -1.414
66 1H6 A 6 H61 A 6 -0.426 4.764 -4.691
67 2H6 A 6 H62 A 6 0.186 3.773 -3.384
68 H2 A 6 H2 A 6 3.104 6.755 -6.594
69 1H5* G 7 H5'' G 7 9.520 9.238 -1.887
70 2H5* G 7 H5' G 7 9.097 7.735 -2.728
71 H4* G 7 H4' G 7 8.770 9.775 -4.124
72 H3* G 7 H3' G 7 7.105 10.527 -1.782
73 1H2* G 7 H2'' G 7 6.085 11.670 -4.283
74 2H2* G 7 H2' G 7 5.204 10.939 -2.915
75 H1* G 7 H1' G 7 5.871 9.761 -5.455
76 H8 G 7 H8 G 7 5.012 8.179 -2.031
77 H1 G 7 H1 G 7 0.031 9.195 -5.907
78 1H2 G 7 H21 G 7 0.729 10.226 -7.747
79 2H2 G 7 H22 G 7 2.421 10.552 -8.052
80 1H5* C 8 H5'' C 8 7.752 13.976 -6.678
81 2H5* C 8 H5' C 8 7.028 12.393 -7.021
82 H4* C 8 H4' C 8 5.601 14.288 -7.759
83 H3* C 8 H3' C 8 6.029 15.117 -4.949
84 1H2* C 8 H2'' C 8 3.394 15.956 -5.871
85 2H2* C 8 H2' C 8 3.872 15.198 -4.326
86 H1* C 8 H1' C 8 2.644 13.984 -6.659
87 1H4 C 8 H41 C 8 0.144 10.468 -2.013
88 2H4 C 8 H42 C 8 1.643 10.481 -1.110
89 H5 C 8 H5 C 8 3.493 11.938 -1.704
90 H6 C 8 H6 C 8 4.524 13.174 -3.545
91 H3T C 8 H3T C 8 6.082 17.012 -5.906
92 1H1' GPN 9 HN1 PGU 9 -10.962 12.210 -2.887
93 2H1' GPN 9 HN2 PGU 9 -9.929 11.953 -4.275
94 1H2' GPN 9 HD1 PGU 9 -9.682 14.220 -2.669
95 2H2' GPN 9 HD2 PGU 9 -11.066 14.227 -3.786
96 1H3' GPN 9 HG1 PGU 9 -8.324 14.916 -4.321
97 2H3' GPN 9 HG2 PGU 9 -9.721 14.979 -5.420
98 1H5' GPN 9 HA21 PGU 9 -10.046 13.485 -7.014
99 2H5' GPN 9 HA22 PGU 9 -9.721 11.792 -6.640
100 1H8' GPN 9 HB1 PGU 9 -7.614 13.068 -3.002
101 2H8' GPN 9 HB2 PGU 9 -6.419 13.928 -3.969
102 H8 GPN 9 H8 PGU 9 -6.740 10.983 -1.640
103 HN1 GPN 9 H1 PGU 9 -0.909 11.692 -4.176
104 1HN2 GPN 9 H21 PGU 9 -0.996 13.057 -5.920
105 2HN2 GPN 9 H22 PGU 9 -2.501 13.737 -6.502
106 1H1' CPN 10 HN PCY 10 -6.953 13.872 -7.129
107 1H2' CPN 10 HD1 PCY 10 -5.275 13.567 -8.814
108 2H2' CPN 10 HD2 PCY 10 -6.600 13.834 -9.973
109 1H3' CPN 10 HG1 PCY 10 -7.003 11.475 -10.183
110 2H3' CPN 10 HG2 PCY 10 -5.971 11.100 -8.788
111 1H5' CPN 10 HA21 PCY 10 -4.821 12.556 -12.443
112 2H5' CPN 10 HA22 PCY 10 -6.241 11.546 -12.200
113 1H8' CPN 10 HB1 PCY 10 -4.190 12.314 -8.173
114 2H8' CPN 10 HB2 PCY 10 -2.473 12.250 -8.502
115 1HN4 CPN 10 H41 PCY 10 -1.739 8.167 -4.028
116 2HN4 CPN 10 H42 PCY 10 -3.470 8.005 -3.835
117 H5 CPN 10 H5 PCY 10 -5.027 9.403 -5.130
118 H6 CPN 10 H6 PCY 10 -5.348 10.485 -7.249
119 1H1' TPN 11 HN PTH 11 -4.575 9.162 -11.310
120 1H2' TPN 11 HD1 PTH 11 -3.972 8.324 -14.191
121 2H2' TPN 11 HD2 PTH 11 -3.959 7.274 -12.755
122 1H3' TPN 11 HG1 PTH 11 -1.901 9.144 -12.300
123 2H3' TPN 11 HG2 PTH 11 -1.752 8.725 -14.021
124 1H5' TPN 11 HA21 PTH 11 -1.692 6.429 -14.693
125 2H5' TPN 11 HA22 PTH 11 -2.413 5.347 -13.505
126 1H8' TPN 11 HB1 PTH 11 -1.601 8.764 -10.687
127 2H8' TPN 11 HB2 PTH 11 0.115 8.391 -10.483
128 H6 TPN 11 H6 PTH 11 -3.240 7.516 -9.376
129 HN3 TPN 11 H3 PTH 11 0.412 6.295 -6.517
130 1HM5 TPN 11 H51 PTH 11 -4.170 5.743 -6.239
131 2HM5 TPN 11 H52 PTH 11 -4.507 5.520 -7.972
132 3HM5 TPN 11 H53 PTH 11 -4.756 7.112 -7.215
133 1H1' APN 12 HN PAD 12 0.923 6.544 -13.064
134 1H2' APN 12 HD1 PAD 12 2.934 5.250 -13.646
135 2H2' APN 12 HD2 PAD 12 1.944 3.891 -14.228
136 1H3' APN 12 HG1 PAD 12 1.757 2.958 -12.137
137 2H3' APN 12 HG2 PAD 12 1.685 4.542 -11.330
138 1H5' APN 12 HA21 PAD 12 5.369 3.950 -12.946
139 2H5' APN 12 HA22 PAD 12 4.051 3.000 -13.630
140 1H8' APN 12 HB1 PAD 12 2.563 5.664 -10.046
141 2H8' APN 12 HB2 PAD 12 3.748 5.349 -8.786
142 H8 APN 12 H8 PAD 12 0.305 4.237 -9.923
143 1HN6 APN 12 H61 PAD 12 0.183 1.173 -4.581
144 2HN6 APN 12 H62 PAD 12 -0.731 1.579 -6.015
145 H2 APN 12 H2 PAD 12 4.482 2.174 -5.504
146 1H1' TPN 13 HN PTH 13 3.900 1.670 -10.804
147 1H2' TPN 13 HD1 PTH 13 6.071 -0.403 -11.583
148 2H2' TPN 13 HD2 PTH 13 4.593 -0.751 -10.658
149 1H3' TPN 13 HG1 PTH 13 5.629 0.924 -8.898
150 2H3' TPN 13 HG2 PTH 13 7.155 0.560 -9.741
151 1H5' TPN 13 HA21 PTH 13 8.182 -1.408 -9.562
152 2H5' TPN 13 HA22 PTH 13 7.097 -2.780 -9.778
153 1H8' TPN 13 HB1 PTH 13 3.927 0.056 -8.500
154 2H8' TPN 13 HB2 PTH 13 4.539 0.170 -6.857
155 H6 TPN 13 H6 PTH 13 1.784 -0.338 -8.756
156 HN3 TPN 13 H3 PTH 13 1.573 -2.256 -4.366
157 1HM5 TPN 13 H51 PTH 13 -1.561 -0.458 -7.257
158 2HM5 TPN 13 H52 PTH 13 -0.998 -1.276 -8.736
159 3HM5 TPN 13 H53 PTH 13 -0.538 0.415 -8.423
160 1H1' GPN 14 HN PGU 14 6.773 -4.306 -8.080
161 1H2' GPN 14 HD1 PGU 14 9.249 -4.978 -6.680
162 2H2' GPN 14 HD2 PGU 14 7.634 -5.552 -6.202
163 1H3' GPN 14 HG1 PGU 14 7.596 -2.978 -5.222
164 2H3' GPN 14 HG2 PGU 14 9.312 -3.405 -5.016
165 1H5' GPN 14 HA21 PGU 14 9.344 -4.547 -2.374
166 2H5' GPN 14 HA22 PGU 14 9.908 -5.432 -3.789
167 1H8' GPN 14 HB1 PGU 14 5.987 -3.895 -5.421
168 2H8' GPN 14 HB2 PGU 14 5.479 -3.113 -3.936
169 H8 GPN 14 H8 PGU 14 3.821 -4.258 -6.652
170 HN1 GPN 14 H1 PGU 14 0.780 -6.326 -1.425
171 1HN2 GPN 14 H21 PGU 14 2.113 -6.117 0.347
172 2HN2 GPN 14 H22 PGU 14 3.802 -5.681 0.197
173 1H1' TPN 15 HN PTH 15 8.662 -7.594 -4.221
174 1H2' TPN 15 HD1 PTH 15 9.049 -9.242 -1.780
175 2H2' TPN 15 HD2 PTH 15 8.158 -9.744 -3.239
176 1H3' TPN 15 HG1 PTH 15 6.351 -8.024 -2.213
177 2H3' TPN 15 HG2 PTH 15 7.129 -8.519 -0.692
178 1H5' TPN 15 HA21 PTH 15 7.763 -11.083 -0.807
179 2H5' TPN 15 HA22 PTH 15 7.057 -11.956 -2.167
180 1H8' TPN 15 HB1 PTH 15 4.911 -8.168 -3.093
181 2H8' TPN 15 HB2 PTH 15 3.942 -8.313 -1.627
182 H6 TPN 15 H6 PTH 15 4.023 -8.407 -5.147
183 HN3 TPN 15 H3 PTH 15 -0.142 -9.675 -3.130
184 1HM5 TPN 15 H51 PTH 15 2.931 -9.200 -7.401
185 2HM5 TPN 15 H52 PTH 15 2.305 -7.548 -7.189
186 3HM5 TPN 15 H53 PTH 15 1.180 -8.892 -7.498
187 1H1' CPN 16 HN PCY 16 4.498 -10.878 -0.094
188 1H2' CPN 16 HD1 PCY 16 3.150 -12.256 1.338
189 2H2' CPN 16 HD2 PCY 16 4.657 -12.926 2.014
190 1H3' CPN 16 HG1 PCY 16 4.530 -14.817 0.738
191 2H3' CPN 16 HG2 PCY 16 3.937 -13.935 -0.686
192 1H5' CPN 16 HA21 PCY 16 3.073 -16.330 1.566
193 2H5' CPN 16 HA22 PCY 16 1.332 -16.213 1.331
194 1H8' CPN 16 HB1 PCY 16 2.650 -12.727 -1.101
195 2H8' CPN 16 HB2 PCY 16 1.314 -11.886 -0.328
196 1HN4 CPN 16 H41 PCY 16 -2.192 -12.774 -5.643
197 2HN4 CPN 16 H42 PCY 16 -0.720 -12.389 -6.506
198 H5 CPN 16 H5 PCY 16 1.450 -12.359 -5.432
199 H6 CPN 16 H6 PCY 16 2.644 -12.574 -3.307
200 1HN NH2 17 HN3 PCY 16 2.810 -17.068 3.719
201 2HN NH2 17 HN4 PCY 16 2.760 -15.810 4.933
Start of MODEL 3
1 1H5* G 1 H5'' G 1 -13.349 -10.635 -2.491
2 2H5* G 1 H5' G 1 -12.991 -12.172 -3.304
3 H4* G 1 H4' G 1 -12.123 -12.167 -1.003
4 H3* G 1 H3' G 1 -11.398 -9.482 -1.612
5 1H2* G 1 H2'' G 1 -8.868 -10.195 -0.671
6 2H2* G 1 H2' G 1 -9.274 -9.792 -2.363
7 H1* G 1 H1' G 1 -8.832 -12.436 -1.076
8 H8 G 1 H8 G 1 -9.457 -11.457 -4.787
9 H1 G 1 H1 G 1 -3.409 -12.926 -3.327
10 1H2 G 1 H21 G 1 -3.254 -13.403 -1.157
11 2H2 G 1 H22 G 1 -4.601 -13.181 -0.060
12 H5T G 1 H5T G 1 -11.031 -10.945 -4.066
13 1H5* A 2 H5'' A 2 -9.144 -10.806 3.067
14 2H5* A 2 H5' A 2 -8.894 -11.871 1.669
15 H4* A 2 H4' A 2 -6.934 -11.735 3.242
16 H3* A 2 H3' A 2 -7.341 -8.883 2.728
17 1H2* A 2 H2'' A 2 -4.493 -9.216 2.751
18 2H2* A 2 H2' A 2 -5.521 -8.468 1.495
19 H1* A 2 H1' A 2 -4.295 -11.134 1.587
20 H8 A 2 H8 A 2 -6.758 -9.346 -0.862
21 1H6 A 2 H61 A 2 -1.969 -9.310 -4.756
22 2H6 A 2 H62 A 2 -3.701 -9.107 -4.620
23 H2 A 2 H2 A 2 -0.642 -11.289 -0.940
24 1H5* C 3 H5'' C 3 -3.289 -9.197 6.245
25 2H5* C 3 H5' C 3 -3.464 -10.252 4.829
26 H4* C 3 H4' C 3 -1.102 -9.535 5.305
27 H3* C 3 H3' C 3 -2.389 -6.897 5.195
28 1H2* C 3 H2'' C 3 0.186 -6.585 3.946
29 2H2* C 3 H2' C 3 -1.423 -6.130 3.315
30 H1* C 3 H1' C 3 0.260 -8.459 2.700
31 1H4 C 3 H41 C 3 -1.668 -6.539 -3.021
32 2H4 C 3 H42 C 3 -3.349 -6.726 -2.570
33 H5 C 3 H5 C 3 -4.003 -6.760 -0.201
34 H6 C 3 H6 C 3 -3.276 -7.498 2.016
35 1H5* A 4 H5'' A 4 2.719 -6.064 6.657
36 2H5* A 4 H5' A 4 2.547 -7.139 5.255
37 H4* A 4 H4' A 4 4.487 -5.498 5.164
38 H3* A 4 H3' A 4 2.350 -3.644 5.702
39 1H2* A 4 H2'' A 4 3.466 -2.268 3.535
40 2H2* A 4 H2' A 4 1.857 -3.043 3.588
41 H1* A 4 H1' A 4 4.408 -4.011 2.383
42 H8 A 4 H8 A 4 0.616 -4.825 2.373
43 1H6 A 4 H61 A 4 0.795 -2.980 -3.510
44 2H6 A 4 H62 A 4 -0.178 -3.805 -2.311
45 H2 A 4 H2 A 4 4.932 -2.628 -1.817
46 1H5* T 5 H5'' T 5 6.754 -1.313 4.436
47 2H5* T 5 H5' T 5 5.986 -2.265 3.148
48 H4* T 5 H4' T 5 7.431 -0.172 2.529
49 H3* T 5 H3' T 5 5.230 1.035 3.997
50 1H2* T 5 H2'' T 5 5.332 2.699 1.705
51 2H2* T 5 H2' T 5 3.965 1.682 2.245
52 H1* T 5 H1' T 5 6.011 1.193 0.149
53 H3 T 5 H3 T 5 2.776 1.185 -2.906
54 1H5M T 5 H51 T 5 -0.167 -1.116 -0.174
55 2H5M T 5 H52 T 5 0.291 -0.318 1.349
56 3H5M T 5 H53 T 5 0.933 -1.932 0.966
57 H6 T 5 H6 T 5 3.043 -0.568 1.561
58 1H5* A 6 H5'' A 6 8.586 4.179 1.443
59 2H5* A 6 H5' A 6 7.761 2.746 0.797
60 H4* A 6 H4' A 6 8.296 4.536 -0.908
61 H3* A 6 H3' A 6 6.726 6.091 1.029
62 1H2* A 6 H2'' A 6 6.002 7.056 -1.598
63 2H2* A 6 H2' A 6 4.946 6.537 -0.254
64 H1* A 6 H1' A 6 5.777 5.105 -2.665
65 H8 A 6 H8 A 6 3.821 3.819 0.444
66 1H6 A 6 H61 A 6 -1.218 4.725 -3.040
67 2H6 A 6 H62 A 6 -0.641 4.182 -1.479
68 H2 A 6 H2 A 6 2.362 5.888 -5.454
69 1H5* G 7 H5'' G 7 8.778 8.017 -3.135
70 2H5* G 7 H5' G 7 7.522 6.780 -3.339
71 H4* G 7 H4' G 7 7.956 8.423 -5.286
72 H3* G 7 H3' G 7 7.019 10.207 -3.146
73 1H2* G 7 H2'' G 7 5.852 10.996 -5.724
74 2H2* G 7 H2' G 7 5.117 10.974 -4.096
75 H1* G 7 H1' G 7 4.698 9.126 -6.197
76 H8 G 7 H8 G 7 4.678 8.470 -2.375
77 H1 G 7 H1 G 7 -1.077 9.229 -5.074
78 1H2 G 7 H21 G 7 -0.833 9.873 -7.176
79 2H2 G 7 H22 G 7 0.737 10.060 -7.925
80 1H5* C 8 H5'' C 8 8.158 13.293 -7.431
81 2H5* C 8 H5' C 8 7.512 11.645 -7.285
82 H4* C 8 H4' C 8 6.304 12.988 -8.987
83 H3* C 8 H3' C 8 6.212 14.888 -6.744
84 1H2* C 8 H2'' C 8 3.726 15.092 -8.243
85 2H2* C 8 H2' C 8 3.995 15.042 -6.478
86 H1* C 8 H1' C 8 3.080 12.945 -8.216
87 1H4 C 8 H41 C 8 0.187 11.576 -2.764
88 2H4 C 8 H42 C 8 1.654 11.798 -1.837
89 H5 C 8 H5 C 8 3.770 12.405 -2.858
90 H6 C 8 H6 C 8 4.856 13.110 -4.936
91 H3T C 8 H3T C 8 5.785 16.294 -8.526
92 1H1' GPN 9 HN1 PGU 9 -9.772 18.579 -6.159
93 2H1' GPN 9 HN2 PGU 9 -10.170 17.125 -7.045
94 1H2' GPN 9 HD1 PGU 9 -8.848 16.319 -5.250
95 2H2' GPN 9 HD2 PGU 9 -7.721 17.677 -5.485
96 1H3' GPN 9 HG1 PGU 9 -6.762 16.510 -7.128
97 2H3' GPN 9 HG2 PGU 9 -8.253 16.721 -8.077
98 1H5' GPN 9 HA21 PGU 9 -10.009 13.948 -7.150
99 2H5' GPN 9 HA22 PGU 9 -9.650 15.058 -8.471
100 1H8' GPN 9 HB1 PGU 9 -6.580 15.435 -4.801
101 2H8' GPN 9 HB2 PGU 9 -5.565 15.209 -6.223
102 H8 GPN 9 H8 PGU 9 -6.435 13.340 -2.948
103 HN1 GPN 9 H1 PGU 9 -0.656 12.172 -5.428
104 1HN2 GPN 9 H21 PGU 9 -0.523 13.021 -7.472
105 2HN2 GPN 9 H22 PGU 9 -1.830 13.936 -8.192
106 1H1' CPN 10 HN PCY 10 -9.103 11.770 -7.165
107 1H2' CPN 10 HD1 PCY 10 -9.350 10.392 -9.659
108 2H2' CPN 10 HD2 PCY 10 -8.270 9.854 -8.354
109 1H3' CPN 10 HG1 PCY 10 -6.666 11.731 -9.448
110 2H3' CPN 10 HG2 PCY 10 -7.620 11.318 -10.891
111 1H5' CPN 10 HA21 PCY 10 -7.468 9.346 -11.919
112 2H5' CPN 10 HA22 PCY 10 -7.281 7.928 -10.892
113 1H8' CPN 10 HB1 PCY 10 -6.123 10.854 -7.785
114 2H8' CPN 10 HB2 PCY 10 -4.475 11.006 -8.380
115 1HN4 CPN 10 H41 PCY 10 -2.355 8.410 -3.009
116 2HN4 CPN 10 H42 PCY 10 -3.968 7.878 -2.590
117 H5 CPN 10 H5 PCY 10 -5.903 8.276 -4.010
118 H6 CPN 10 H6 PCY 10 -6.630 8.961 -6.231
119 1H1' TPN 11 HN PTH 11 -4.304 9.688 -11.244
120 1H2' TPN 11 HD1 PTH 11 -3.414 7.427 -13.146
121 2H2' TPN 11 HD2 PTH 11 -3.172 9.096 -13.705
122 1H3' TPN 11 HG1 PTH 11 -2.143 9.037 -11.066
123 2H3' TPN 11 HG2 PTH 11 -1.210 9.113 -12.575
124 1H5' TPN 11 HA21 PTH 11 -1.419 6.777 -13.842
125 2H5' TPN 11 HA22 PTH 11 -2.055 5.462 -12.857
126 1H8' TPN 11 HB1 PTH 11 -1.920 8.459 -9.519
127 2H8' TPN 11 HB2 PTH 11 -0.194 8.208 -9.243
128 H6 TPN 11 H6 PTH 11 -3.540 7.053 -8.421
129 HN3 TPN 11 H3 PTH 11 -0.010 5.869 -5.397
130 1HM5 TPN 11 H51 PTH 11 -4.610 4.657 -6.409
131 2HM5 TPN 11 H52 PTH 11 -5.170 6.227 -7.031
132 3HM5 TPN 11 H53 PTH 11 -4.802 6.034 -5.299
133 1H1' APN 12 HN PAD 12 -0.467 4.083 -11.629
134 1H2' APN 12 HD1 PAD 12 2.379 4.325 -12.780
135 2H2' APN 12 HD2 PAD 12 1.496 2.814 -13.094
136 1H3' APN 12 HG1 PAD 12 1.928 2.058 -10.996
137 2H3' APN 12 HG2 PAD 12 1.300 3.552 -10.270
138 1H5' APN 12 HA21 PAD 12 5.182 3.948 -11.695
139 2H5' APN 12 HA22 PAD 12 4.108 2.804 -12.492
140 1H8' APN 12 HB1 PAD 12 1.775 5.417 -9.474
141 2H8' APN 12 HB2 PAD 12 2.870 5.654 -8.121
142 H8 APN 12 H8 PAD 12 -0.297 3.997 -8.928
143 1HN6 APN 12 H61 PAD 12 0.330 0.684 -3.781
144 2HN6 APN 12 H62 PAD 12 -0.768 1.201 -5.042
145 H2 APN 12 H2 PAD 12 4.263 2.702 -4.594
146 1H1' TPN 13 HN PTH 13 6.150 3.087 -9.481
147 1H2' TPN 13 HD1 PTH 13 7.759 0.768 -10.275
148 2H2' TPN 13 HD2 PTH 13 6.440 0.133 -9.269
149 1H3' TPN 13 HG1 PTH 13 7.214 2.191 -7.682
150 2H3' TPN 13 HG2 PTH 13 8.750 1.888 -8.524
151 1H5' TPN 13 HA21 PTH 13 10.031 -0.185 -6.897
152 2H5' TPN 13 HA22 PTH 13 9.644 -0.314 -8.607
153 1H8' TPN 13 HB1 PTH 13 5.688 1.301 -7.143
154 2H8' TPN 13 HB2 PTH 13 6.081 1.490 -5.437
155 H6 TPN 13 H6 PTH 13 3.614 0.733 -7.606
156 HN3 TPN 13 H3 PTH 13 3.364 -1.897 -3.606
157 1HM5 TPN 13 H51 PTH 13 1.306 -1.443 -8.093
158 2HM5 TPN 13 H52 PTH 13 1.415 0.333 -8.122
159 3HM5 TPN 13 H53 PTH 13 0.343 -0.474 -6.951
160 1H1' GPN 14 HN PGU 14 7.182 -2.166 -7.515
161 1H2' GPN 14 HD1 PGU 14 8.890 -4.659 -7.883
162 2H2' GPN 14 HD2 PGU 14 7.137 -4.609 -7.558
163 1H3' GPN 14 HG1 PGU 14 7.846 -3.744 -5.191
164 2H3' GPN 14 HG2 PGU 14 9.446 -4.406 -5.599
165 1H5' GPN 14 HA21 PGU 14 9.844 -6.618 -5.603
166 2H5' GPN 14 HA22 PGU 14 8.641 -7.460 -6.575
167 1H8' GPN 14 HB1 PGU 14 6.027 -4.048 -5.512
168 2H8' GPN 14 HB2 PGU 14 6.012 -4.401 -3.787
169 H8 GPN 14 H8 PGU 14 3.768 -4.005 -6.650
170 HN1 GPN 14 H1 PGU 14 0.945 -6.927 -1.717
171 1HN2 GPN 14 H21 PGU 14 2.455 -7.383 -0.156
172 2HN2 GPN 14 H22 PGU 14 4.150 -6.994 -0.349
173 1H1' TPN 15 HN PTH 15 7.813 -9.365 -5.898
174 1H2' TPN 15 HD1 PTH 15 9.073 -10.570 -3.449
175 2H2' TPN 15 HD2 PTH 15 7.773 -11.284 -4.434
176 1H3' TPN 15 HG1 PTH 15 6.619 -9.060 -3.106
177 2H3' TPN 15 HG2 PTH 15 7.578 -9.915 -1.871
178 1H5' TPN 15 HA21 PTH 15 7.451 -12.457 -2.034
179 2H5' TPN 15 HA22 PTH 15 6.427 -13.074 -3.330
180 1H8' TPN 15 HB1 PTH 15 5.092 -8.839 -3.830
181 2H8' TPN 15 HB2 PTH 15 4.286 -8.862 -2.263
182 H6 TPN 15 H6 PTH 15 3.947 -8.472 -5.686
183 HN3 TPN 15 H3 PTH 15 -0.135 -9.659 -3.446
184 1HM5 TPN 15 H51 PTH 15 1.518 -9.023 -7.970
185 2HM5 TPN 15 H52 PTH 15 2.872 -7.923 -7.624
186 3HM5 TPN 15 H53 PTH 15 1.196 -7.348 -7.461
187 1H1' CPN 16 HN PCY 16 4.493 -11.518 -0.951
188 1H2' CPN 16 HD1 PCY 16 4.266 -13.478 1.162
189 2H2' CPN 16 HD2 PCY 16 3.355 -14.192 -0.193
190 1H3' CPN 16 HG1 PCY 16 2.392 -11.644 -0.265
191 2H3' CPN 16 HG2 PCY 16 2.725 -11.813 1.472
192 1H5' CPN 16 HA21 PCY 16 1.478 -13.502 2.785
193 2H5' CPN 16 HA22 PCY 16 0.007 -14.162 2.073
194 1H8' CPN 16 HB1 PCY 16 1.564 -14.698 -2.065
195 2H8' CPN 16 HB2 PCY 16 2.205 -13.107 -1.687
196 1HN4 CPN 16 H41 PCY 16 -2.695 -12.270 -6.161
197 2HN4 CPN 16 H42 PCY 16 -1.212 -12.280 -7.090
198 H5 CPN 16 H5 PCY 16 0.900 -11.817 -5.918
199 H6 CPN 16 H6 PCY 16 2.167 -12.399 -3.916
200 1HN NH2 17 HN3 PCY 16 -1.286 -10.465 2.584
201 2HN NH2 17 HN4 PCY 16 -1.361 -11.465 1.153
Start of MODEL 4
1 1H5* G 1 H5'' G 1 -12.462 -12.518 -3.878
2 2H5* G 1 H5' G 1 -11.594 -11.031 -4.309
3 H4* G 1 H4' G 1 -11.850 -12.187 -1.506
4 H3* G 1 H3' G 1 -11.268 -9.532 -2.366
5 1H2* G 1 H2'' G 1 -8.806 -9.922 -1.105
6 2H2* G 1 H2' G 1 -9.060 -9.742 -2.864
7 H1* G 1 H1' G 1 -8.567 -12.182 -1.238
8 H8 G 1 H8 G 1 -8.867 -11.699 -5.080
9 H1 G 1 H1 G 1 -2.905 -12.394 -2.875
10 1H2 G 1 H21 G 1 -2.935 -12.507 -0.654
11 2H2 G 1 H22 G 1 -4.419 -12.391 0.269
12 H5T G 1 H5T G 1 -13.145 -10.240 -2.454
13 1H5* A 2 H5'' A 2 -9.487 -10.269 2.621
14 2H5* A 2 H5' A 2 -8.959 -11.424 1.381
15 H4* A 2 H4' A 2 -7.260 -10.997 3.182
16 H3* A 2 H3' A 2 -7.851 -8.249 2.452
17 1H2* A 2 H2'' A 2 -5.019 -8.182 2.671
18 2H2* A 2 H2' A 2 -6.021 -7.763 1.252
19 H1* A 2 H1' A 2 -4.478 -10.207 1.836
20 H8 A 2 H8 A 2 -6.754 -9.197 -1.160
21 1H6 A 2 H61 A 2 -1.467 -9.019 -4.352
22 2H6 A 2 H62 A 2 -3.210 -8.936 -4.458
23 H2 A 2 H2 A 2 -0.458 -9.773 -0.045
24 1H5* C 3 H5'' C 3 -4.060 -7.953 6.322
25 2H5* C 3 H5' C 3 -3.963 -9.147 5.012
26 H4* C 3 H4' C 3 -1.750 -8.168 5.635
27 H3* C 3 H3' C 3 -3.249 -5.683 5.302
28 1H2* C 3 H2'' C 3 -0.702 -5.113 4.141
29 2H2* C 3 H2' C 3 -2.317 -4.946 3.393
30 H1* C 3 H1' C 3 -0.277 -7.040 3.064
31 1H4 C 3 H41 C 3 -1.915 -6.070 -2.950
32 2H4 C 3 H42 C 3 -3.619 -5.982 -2.562
33 H5 C 3 H5 C 3 -4.433 -5.971 -0.264
34 H6 C 3 H6 C 3 -3.828 -6.456 2.060
35 1H5* A 4 H5'' A 4 1.850 -4.527 6.667
36 2H5* A 4 H5' A 4 1.501 -5.773 5.453
37 H4* A 4 H4' A 4 3.532 -4.384 4.950
38 H3* A 4 H3' A 4 1.684 -2.236 5.489
39 1H2* A 4 H2'' A 4 2.775 -1.233 3.099
40 2H2* A 4 H2' A 4 1.082 -1.724 3.385
41 H1* A 4 H1' A 4 3.285 -3.175 2.010
42 H8 A 4 H8 A 4 -0.546 -3.378 2.598
43 1H6 A 4 H61 A 4 -0.976 -2.664 -3.523
44 2H6 A 4 H62 A 4 -1.868 -3.085 -2.077
45 H2 A 4 H2 A 4 3.366 -2.573 -2.406
46 1H5* T 5 H5'' T 5 6.377 -1.105 3.779
47 2H5* T 5 H5' T 5 5.193 -2.092 2.897
48 H4* T 5 H4' T 5 7.079 -0.980 1.538
49 H3* T 5 H3' T 5 5.880 1.368 2.712
50 1H2* T 5 H2'' T 5 5.897 2.245 0.064
51 2H2* T 5 H2' T 5 4.444 1.863 1.032
52 H1* T 5 H1' T 5 5.886 0.198 -1.000
53 H3 T 5 H3 T 5 2.517 0.925 -3.812
54 1H5M T 5 H51 T 5 0.259 -0.779 0.688
55 2H5M T 5 H52 T 5 -0.685 0.061 -0.568
56 3H5M T 5 H53 T 5 0.110 0.994 0.724
57 H6 T 5 H6 T 5 2.700 -0.086 0.883
58 1H5* A 6 H5'' A 6 8.883 2.097 -1.770
59 2H5* A 6 H5' A 6 7.299 2.349 -1.018
60 H4* A 6 H4' A 6 9.118 4.417 -2.291
61 H3* A 6 H3' A 6 7.129 4.754 -0.143
62 1H2* A 6 H2'' A 6 6.774 6.874 -2.105
63 2H2* A 6 H2' A 6 5.552 5.873 -1.274
64 H1* A 6 H1' A 6 6.535 5.659 -3.965
65 H8 A 6 H8 A 6 4.714 3.232 -1.500
66 1H6 A 6 H61 A 6 -0.320 4.493 -4.828
67 2H6 A 6 H62 A 6 0.324 3.545 -3.507
68 H2 A 6 H2 A 6 3.157 6.546 -6.776
69 1H5* G 7 H5'' G 7 9.399 9.379 -1.903
70 2H5* G 7 H5' G 7 9.043 7.873 -2.772
71 H4* G 7 H4' G 7 8.671 9.932 -4.139
72 H3* G 7 H3' G 7 6.917 10.552 -1.821
73 1H2* G 7 H2'' G 7 5.914 11.694 -4.336
74 2H2* G 7 H2' G 7 5.029 10.924 -2.993
75 H1* G 7 H1' G 7 5.770 9.788 -5.523
76 H8 G 7 H8 G 7 4.986 8.138 -2.107
77 H1 G 7 H1 G 7 -0.027 8.904 -5.996
78 1H2 G 7 H21 G 7 0.619 9.982 -7.827
79 2H2 G 7 H22 G 7 2.293 10.394 -8.132
80 1H5* C 8 H5'' C 8 7.488 14.135 -6.619
81 2H5* C 8 H5' C 8 6.898 12.506 -7.003
82 H4* C 8 H4' C 8 5.328 14.242 -7.769
83 H3* C 8 H3' C 8 5.720 15.222 -5.011
84 1H2* C 8 H2'' C 8 2.999 15.795 -5.867
85 2H2* C 8 H2' C 8 3.586 15.130 -4.318
86 H1* C 8 H1' C 8 2.385 13.749 -6.566
87 1H4 C 8 H41 C 8 0.350 10.150 -1.775
88 2H4 C 8 H42 C 8 1.747 10.543 -0.796
89 H5 C 8 H5 C 8 3.423 12.142 -1.501
90 H6 C 8 H6 C 8 4.331 13.361 -3.417
91 H3T C 8 H3T C 8 4.573 16.374 -7.348
92 1H1' GPN 9 HN1 PGU 9 -10.078 11.306 -4.051
93 2H1' GPN 9 HN2 PGU 9 -10.899 11.483 -2.517
94 1H2' GPN 9 HD1 PGU 9 -9.466 13.447 -2.260
95 2H2' GPN 9 HD2 PGU 9 -10.930 13.543 -3.266
96 1H3' GPN 9 HG1 PGU 9 -8.242 14.167 -4.003
97 2H3' GPN 9 HG2 PGU 9 -9.700 14.210 -5.020
98 1H5' GPN 9 HA21 PGU 9 -10.147 12.659 -6.538
99 2H5' GPN 9 HA22 PGU 9 -9.705 10.982 -6.223
100 1H8' GPN 9 HB1 PGU 9 -7.477 12.295 -2.681
101 2H8' GPN 9 HB2 PGU 9 -6.349 13.173 -3.709
102 H8 GPN 9 H8 PGU 9 -6.510 10.196 -1.392
103 HN1 GPN 9 H1 PGU 9 -0.789 11.171 -4.079
104 1HN2 GPN 9 H21 PGU 9 -0.993 12.485 -5.851
105 2HN2 GPN 9 H22 PGU 9 -2.529 13.170 -6.338
106 1H1' CPN 10 HN PCY 10 -7.058 13.165 -6.850
107 1H2' CPN 10 HD1 PCY 10 -5.506 12.973 -8.669
108 2H2' CPN 10 HD2 PCY 10 -6.926 13.222 -9.715
109 1H3' CPN 10 HG1 PCY 10 -7.245 10.883 -10.018
110 2H3' CPN 10 HG2 PCY 10 -6.184 10.473 -8.656
111 1H5' CPN 10 HA21 PCY 10 -5.184 12.055 -12.287
112 2H5' CPN 10 HA22 PCY 10 -6.519 10.937 -12.043
113 1H8' CPN 10 HB1 PCY 10 -4.419 11.725 -8.040
114 2H8' CPN 10 HB2 PCY 10 -2.710 11.738 -8.406
115 1HN4 CPN 10 H41 PCY 10 -1.771 7.716 -3.939
116 2HN4 CPN 10 H42 PCY 10 -3.494 7.499 -3.720
117 H5 CPN 10 H5 PCY 10 -5.124 8.752 -5.063
118 H6 CPN 10 H6 PCY 10 -5.495 9.774 -7.205
119 1H1' TPN 11 HN PTH 11 -4.662 8.651 -11.266
120 1H2' TPN 11 HD1 PTH 11 -4.086 7.967 -14.200
121 2H2' TPN 11 HD2 PTH 11 -4.014 6.850 -12.817
122 1H3' TPN 11 HG1 PTH 11 -2.022 8.805 -12.326
123 2H3' TPN 11 HG2 PTH 11 -1.875 8.401 -14.050
124 1H5' TPN 11 HA21 PTH 11 -1.735 6.118 -14.741
125 2H5' TPN 11 HA22 PTH 11 -2.420 5.005 -13.559
126 1H8' TPN 11 HB1 PTH 11 -1.686 8.427 -10.725
127 2H8' TPN 11 HB2 PTH 11 0.038 8.098 -10.518
128 H6 TPN 11 H6 PTH 11 -3.291 7.068 -9.440
129 HN3 TPN 11 H3 PTH 11 0.394 6.047 -6.546
130 1HM5 TPN 11 H51 PTH 11 -4.320 5.875 -6.208
131 2HM5 TPN 11 H52 PTH 11 -4.270 4.704 -7.547
132 3HM5 TPN 11 H53 PTH 11 -4.848 6.362 -7.836
133 1H1' APN 12 HN PAD 12 0.901 6.266 -13.119
134 1H2' APN 12 HD1 PAD 12 2.932 5.020 -13.706
135 2H2' APN 12 HD2 PAD 12 1.969 3.674 -14.361
136 1H3' APN 12 HG1 PAD 12 1.754 2.653 -12.308
137 2H3' APN 12 HG2 PAD 12 1.695 4.200 -11.434
138 1H5' APN 12 HA21 PAD 12 5.354 3.554 -13.120
139 2H5' APN 12 HA22 PAD 12 4.013 2.596 -13.747
140 1H8' APN 12 HB1 PAD 12 2.598 5.359 -10.218
141 2H8' APN 12 HB2 PAD 12 3.812 5.098 -8.973
142 H8 APN 12 H8 PAD 12 0.357 3.904 -10.006
143 1HN6 APN 12 H61 PAD 12 0.340 1.018 -4.598
144 2HN6 APN 12 H62 PAD 12 -0.491 1.079 -6.136
145 H2 APN 12 H2 PAD 12 4.644 2.025 -5.609
146 1H1' TPN 13 HN PTH 13 3.857 1.327 -10.920
147 1H2' TPN 13 HD1 PTH 13 6.003 -0.783 -11.650
148 2H2' TPN 13 HD2 PTH 13 4.547 -1.075 -10.673
149 1H3' TPN 13 HG1 PTH 13 5.651 0.651 -9.008
150 2H3' TPN 13 HG2 PTH 13 7.148 0.233 -9.875
151 1H5' TPN 13 HA21 PTH 13 8.167 -1.733 -9.617
152 2H5' TPN 13 HA22 PTH 13 7.061 -3.092 -9.793
153 1H8' TPN 13 HB1 PTH 13 3.937 -0.185 -8.545
154 2H8' TPN 13 HB2 PTH 13 4.589 -0.011 -6.922
155 H6 TPN 13 H6 PTH 13 1.787 -0.560 -8.733
156 HN3 TPN 13 H3 PTH 13 1.663 -2.386 -4.301
157 1HM5 TPN 13 H51 PTH 13 -0.592 0.201 -8.272
158 2HM5 TPN 13 H52 PTH 13 -1.568 -0.870 -7.238
159 3HM5 TPN 13 H53 PTH 13 -0.886 -1.483 -8.765
160 1H1' GPN 14 HN PGU 14 6.743 -4.588 -8.070
161 1H2' GPN 14 HD1 PGU 14 9.194 -5.239 -6.616
162 2H2' GPN 14 HD2 PGU 14 7.567 -5.771 -6.132
163 1H3' GPN 14 HG1 PGU 14 7.540 -3.166 -5.257
164 2H3' GPN 14 HG2 PGU 14 9.257 -3.580 -5.036
165 1H5' GPN 14 HA21 PGU 14 9.283 -4.562 -2.333
166 2H5' GPN 14 HA22 PGU 14 9.872 -5.503 -3.699
167 1H8' GPN 14 HB1 PGU 14 5.941 -4.140 -5.431
168 2H8' GPN 14 HB2 PGU 14 5.409 -3.283 -3.999
169 H8 GPN 14 H8 PGU 14 3.756 -4.464 -6.636
170 HN1 GPN 14 H1 PGU 14 0.690 -6.329 -1.347
171 1HN2 GPN 14 H21 PGU 14 2.088 -6.324 0.378
172 2HN2 GPN 14 H22 PGU 14 3.798 -5.991 0.198
173 1H1' TPN 15 HN PTH 15 8.709 -7.727 -4.015
174 1H2' TPN 15 HD1 PTH 15 9.162 -9.252 -1.522
175 2H2' TPN 15 HD2 PTH 15 8.227 -9.829 -2.924
176 1H3' TPN 15 HG1 PTH 15 6.459 -8.049 -1.858
177 2H3' TPN 15 HG2 PTH 15 7.276 -8.590 -0.372
178 1H5' TPN 15 HA21 PTH 15 7.749 -11.114 -0.336
179 2H5' TPN 15 HA22 PTH 15 7.124 -12.022 -1.713
180 1H8' TPN 15 HB1 PTH 15 5.146 -8.230 -2.937
181 2H8' TPN 15 HB2 PTH 15 4.113 -8.278 -1.511
182 H6 TPN 15 H6 PTH 15 4.338 -8.514 -5.007
183 HN3 TPN 15 H3 PTH 15 0.020 -9.414 -3.117
184 1HM5 TPN 15 H51 PTH 15 1.598 -8.113 -7.350
185 2HM5 TPN 15 H52 PTH 15 2.610 -9.576 -7.410
186 3HM5 TPN 15 H53 PTH 15 3.357 -7.989 -7.108
187 1H1' CPN 16 HN PCY 16 4.472 -10.771 0.126
188 1H2' CPN 16 HD1 PCY 16 2.974 -12.009 1.527
189 2H2' CPN 16 HD2 PCY 16 4.391 -12.771 2.295
190 1H3' CPN 16 HG1 PCY 16 4.174 -14.681 1.064
191 2H3' CPN 16 HG2 PCY 16 3.758 -13.793 -0.418
192 1H5' CPN 16 HA21 PCY 16 2.060 -16.245 1.436
193 2H5' CPN 16 HA22 PCY 16 0.655 -15.302 1.928
194 1H8' CPN 16 HB1 PCY 16 2.604 -12.525 -0.980
195 2H8' CPN 16 HB2 PCY 16 1.308 -11.536 -0.323
196 1HN4 CPN 16 H41 PCY 16 -1.940 -12.227 -5.808
197 2HN4 CPN 16 H42 PCY 16 -0.380 -12.278 -6.603
198 H5 CPN 16 H5 PCY 16 1.709 -12.237 -5.382
199 H6 CPN 16 H6 PCY 16 2.746 -12.458 -3.175
200 1HN NH2 17 HN3 PCY 16 3.458 -15.802 4.777
201 2HN NH2 17 HN4 PCY 16 2.979 -17.027 3.626
Start of MODEL 5
1 1H5* G 1 H5'' G 1 -13.101 -11.706 -2.899
2 2H5* G 1 H5' G 1 -12.611 -13.192 -3.738
3 H4* G 1 H4' G 1 -11.803 -13.174 -1.411
4 H3* G 1 H3' G 1 -11.251 -10.434 -1.954
5 1H2* G 1 H2'' G 1 -8.700 -10.994 -0.965
6 2H2* G 1 H2' G 1 -9.093 -10.581 -2.658
7 H1* G 1 H1' G 1 -8.495 -13.217 -1.417
8 H8 G 1 H8 G 1 -9.122 -12.213 -5.120
9 H1 G 1 H1 G 1 -3.002 -13.210 -3.564
10 1H2 G 1 H21 G 1 -2.852 -13.779 -1.419
11 2H2 G 1 H22 G 1 -4.227 -13.678 -0.339
12 H5T G 1 H5T G 1 -10.723 -11.796 -4.408
13 1H5* A 2 H5'' A 2 -9.025 -11.667 2.768
14 2H5* A 2 H5' A 2 -8.687 -12.693 1.359
15 H4* A 2 H4' A 2 -6.766 -12.463 2.969
16 H3* A 2 H3' A 2 -7.337 -9.632 2.487
17 1H2* A 2 H2'' A 2 -4.475 -9.799 2.568
18 2H2* A 2 H2' A 2 -5.517 -9.090 1.303
19 H1* A 2 H1' A 2 -4.143 -11.682 1.379
20 H8 A 2 H8 A 2 -6.656 -10.022 -1.105
21 1H6 A 2 H61 A 2 -1.773 -9.512 -4.835
22 2H6 A 2 H62 A 2 -3.521 -9.514 -4.768
23 H2 A 2 H2 A 2 -0.406 -11.469 -1.009
24 1H5* C 3 H5'' C 3 -3.387 -9.697 6.164
25 2H5* C 3 H5' C 3 -3.426 -10.780 4.758
26 H4* C 3 H4' C 3 -1.143 -9.909 5.315
27 H3* C 3 H3' C 3 -2.586 -7.359 5.172
28 1H2* C 3 H2'' C 3 -0.021 -6.848 3.988
29 2H2* C 3 H2' C 3 -1.643 -6.536 3.305
30 H1* C 3 H1' C 3 0.249 -8.727 2.773
31 1H4 C 3 H41 C 3 -1.544 -6.864 -3.014
32 2H4 C 3 H42 C 3 -3.215 -7.255 -2.668
33 H5 C 3 H5 C 3 -3.978 -7.295 -0.316
34 H6 C 3 H6 C 3 -3.311 -8.019 1.924
35 1H5* A 4 H5'' A 4 2.425 -6.184 6.756
36 2H5* A 4 H5' A 4 2.377 -7.267 5.350
37 H4* A 4 H4' A 4 4.189 -5.489 5.309
38 H3* A 4 H3' A 4 1.906 -3.796 5.792
39 1H2* A 4 H2'' A 4 3.000 -2.333 3.666
40 2H2* A 4 H2' A 4 1.443 -3.210 3.666
41 H1* A 4 H1' A 4 4.089 -4.004 2.536
42 H8 A 4 H8 A 4 0.364 -5.074 2.412
43 1H6 A 4 H61 A 4 0.556 -3.101 -3.428
44 2H6 A 4 H62 A 4 -0.396 -3.993 -2.261
45 H2 A 4 H2 A 4 4.613 -2.492 -1.621
46 1H5* T 5 H5'' T 5 6.223 -1.302 4.638
47 2H5* T 5 H5' T 5 5.497 -2.307 3.367
48 H4* T 5 H4' T 5 6.936 -0.249 2.683
49 H3* T 5 H3' T 5 4.734 1.024 4.104
50 1H2* T 5 H2'' T 5 4.927 2.633 1.768
51 2H2* T 5 H2' T 5 3.519 1.685 2.325
52 H1* T 5 H1' T 5 5.552 1.062 0.255
53 H3 T 5 H3 T 5 2.221 1.213 -2.713
54 1H5M T 5 H51 T 5 -0.665 -1.152 0.017
55 2H5M T 5 H52 T 5 -0.125 -0.474 1.573
56 3H5M T 5 H53 T 5 0.470 -2.065 1.044
57 H6 T 5 H6 T 5 2.601 -0.697 1.679
58 1H5* A 6 H5'' A 6 8.220 3.917 1.525
59 2H5* A 6 H5' A 6 7.290 2.522 0.939
60 H4* A 6 H4' A 6 7.972 4.181 -0.843
61 H3* A 6 H3' A 6 6.534 5.944 1.010
62 1H2* A 6 H2'' A 6 5.874 6.844 -1.653
63 2H2* A 6 H2' A 6 4.786 6.464 -0.288
64 H1* A 6 H1' A 6 5.495 4.876 -2.638
65 H8 A 6 H8 A 6 3.469 3.682 0.453
66 1H6 A 6 H61 A 6 -1.530 5.194 -2.866
67 2H6 A 6 H62 A 6 -0.970 4.592 -1.321
68 H2 A 6 H2 A 6 2.092 6.032 -5.355
69 1H5* G 7 H5'' G 7 8.718 7.497 -3.222
70 2H5* G 7 H5' G 7 7.349 6.376 -3.377
71 H4* G 7 H4' G 7 7.937 7.885 -5.392
72 H3* G 7 H3' G 7 7.179 9.842 -3.334
73 1H2* G 7 H2'' G 7 6.083 10.618 -5.948
74 2H2* G 7 H2' G 7 5.358 10.748 -4.322
75 H1* G 7 H1' G 7 4.737 8.854 -6.323
76 H8 G 7 H8 G 7 4.723 8.370 -2.474
77 H1 G 7 H1 G 7 -0.980 9.591 -5.115
78 1H2 G 7 H21 G 7 -0.721 10.070 -7.259
79 2H2 G 7 H22 G 7 0.844 10.052 -8.042
80 1H5* C 8 H5'' C 8 8.628 12.614 -7.744
81 2H5* C 8 H5' C 8 7.832 11.042 -7.518
82 H4* C 8 H4' C 8 6.760 12.405 -9.296
83 H3* C 8 H3' C 8 6.831 14.412 -7.147
84 1H2* C 8 H2'' C 8 4.379 14.752 -8.685
85 2H2* C 8 H2' C 8 4.637 14.794 -6.917
86 H1* C 8 H1' C 8 3.525 12.686 -8.510
87 1H4 C 8 H41 C 8 0.634 11.920 -2.937
88 2H4 C 8 H42 C 8 2.133 12.080 -2.048
89 H5 C 8 H5 C 8 4.267 12.466 -3.135
90 H6 C 8 H6 C 8 5.366 12.944 -5.269
91 H3T C 8 H3T C 8 6.545 15.763 -8.997
92 1H1' GPN 9 HN1 PGU 9 -8.809 19.557 -6.579
93 2H1' GPN 9 HN2 PGU 9 -9.093 18.002 -7.327
94 1H2' GPN 9 HD1 PGU 9 -7.493 17.657 -5.564
95 2H2' GPN 9 HD2 PGU 9 -6.515 18.975 -6.253
96 1H3' GPN 9 HG1 PGU 9 -5.716 17.328 -7.589
97 2H3' GPN 9 HG2 PGU 9 -7.189 17.661 -8.530
98 1H5' GPN 9 HA21 PGU 9 -9.295 15.264 -7.259
99 2H5' GPN 9 HA22 PGU 9 -8.864 16.216 -8.679
100 1H8' GPN 9 HB1 PGU 9 -5.587 16.458 -5.177
101 2H8' GPN 9 HB2 PGU 9 -4.684 15.952 -6.602
102 H8 GPN 9 H8 PGU 9 -5.683 14.525 -3.145
103 HN1 GPN 9 H1 PGU 9 -0.212 12.353 -5.644
104 1HN2 GPN 9 H21 PGU 9 -0.034 12.997 -7.758
105 2HN2 GPN 9 H22 PGU 9 -1.250 13.982 -8.542
106 1H1' CPN 10 HN PCY 10 -8.659 12.982 -7.144
107 1H2' CPN 10 HD1 PCY 10 -9.228 11.488 -9.524
108 2H2' CPN 10 HD2 PCY 10 -8.174 10.891 -8.223
109 1H3' CPN 10 HG1 PCY 10 -6.377 12.447 -9.509
110 2H3' CPN 10 HG2 PCY 10 -7.445 12.077 -10.881
111 1H5' CPN 10 HA21 PCY 10 -7.593 10.045 -11.784
112 2H5' CPN 10 HA22 PCY 10 -7.593 8.691 -10.657
113 1H8' CPN 10 HB1 PCY 10 -5.887 11.615 -7.805
114 2H8' CPN 10 HB2 PCY 10 -4.264 11.492 -8.470
115 1HN4 CPN 10 H41 PCY 10 -2.285 9.035 -2.983
116 2HN4 CPN 10 H42 PCY 10 -3.934 8.731 -2.485
117 H5 CPN 10 H5 PCY 10 -5.854 9.287 -3.869
118 H6 CPN 10 H6 PCY 10 -6.576 9.884 -6.117
119 1H1' TPN 11 HN PTH 11 -4.401 9.975 -11.246
120 1H2' TPN 11 HD1 PTH 11 -3.889 7.423 -12.884
121 2H2' TPN 11 HD2 PTH 11 -3.515 8.957 -13.697
122 1H3' TPN 11 HG1 PTH 11 -2.331 9.111 -11.104
123 2H3' TPN 11 HG2 PTH 11 -1.502 8.971 -12.669
124 1H5' TPN 11 HA21 PTH 11 -1.911 6.578 -13.702
125 2H5' TPN 11 HA22 PTH 11 -2.636 5.416 -12.596
126 1H8' TPN 11 HB1 PTH 11 -2.080 8.647 -9.526
127 2H8' TPN 11 HB2 PTH 11 -0.376 8.261 -9.268
128 H6 TPN 11 H6 PTH 11 -3.792 7.498 -8.277
129 HN3 TPN 11 H3 PTH 11 -0.296 6.146 -5.283
130 1HM5 TPN 11 H51 PTH 11 -5.053 6.828 -5.085
131 2HM5 TPN 11 H52 PTH 11 -5.013 5.336 -6.054
132 3HM5 TPN 11 H53 PTH 11 -5.446 6.883 -6.820
133 1H1' APN 12 HN PAD 12 -1.134 4.013 -11.283
134 1H2' APN 12 HD1 PAD 12 1.658 3.832 -12.569
135 2H2' APN 12 HD2 PAD 12 0.609 2.401 -12.694
136 1H3' APN 12 HG1 PAD 12 1.179 1.789 -10.585
137 2H3' APN 12 HG2 PAD 12 0.571 3.333 -9.951
138 1H5' APN 12 HA21 PAD 12 4.366 3.625 -11.554
139 2H5' APN 12 HA22 PAD 12 3.327 2.322 -12.118
140 1H8' APN 12 HB1 PAD 12 1.080 5.265 -9.320
141 2H8' APN 12 HB2 PAD 12 2.177 5.565 -7.984
142 H8 APN 12 H8 PAD 12 -1.057 4.049 -8.625
143 1HN6 APN 12 H61 PAD 12 -0.528 1.002 -3.331
144 2HN6 APN 12 H62 PAD 12 -1.662 1.848 -4.362
145 H2 APN 12 H2 PAD 12 3.520 2.704 -4.325
146 1H1' TPN 13 HN PTH 13 5.642 3.192 -9.459
147 1H2' TPN 13 HD1 PTH 13 7.349 0.926 -9.938
148 2H2' TPN 13 HD2 PTH 13 6.101 0.272 -8.855
149 1H3' TPN 13 HG1 PTH 13 6.674 2.553 -7.505
150 2H3' TPN 13 HG2 PTH 13 8.231 2.308 -8.323
151 1H5' TPN 13 HA21 PTH 13 9.634 0.470 -6.291
152 2H5' TPN 13 HA22 PTH 13 9.473 0.425 -8.041
153 1H8' TPN 13 HB1 PTH 13 5.249 1.598 -6.864
154 2H8' TPN 13 HB2 PTH 13 5.511 1.845 -5.141
155 H6 TPN 13 H6 PTH 13 3.222 0.905 -7.374
156 HN3 TPN 13 H3 PTH 13 3.086 -1.844 -3.447
157 1HM5 TPN 13 H51 PTH 13 0.368 0.438 -7.122
158 2HM5 TPN 13 H52 PTH 13 0.335 -1.342 -7.161
159 3HM5 TPN 13 H53 PTH 13 1.371 -0.444 -8.297
160 1H1' GPN 14 HN PGU 14 7.086 -1.724 -6.851
161 1H2' GPN 14 HD1 PGU 14 9.039 -4.014 -7.464
162 2H2' GPN 14 HD2 PGU 14 7.282 -4.159 -7.207
163 1H3' GPN 14 HG1 PGU 14 7.856 -3.379 -4.751
164 2H3' GPN 14 HG2 PGU 14 9.504 -3.907 -5.159
165 1H5' GPN 14 HA21 PGU 14 10.050 -6.096 -5.336
166 2H5' GPN 14 HA22 PGU 14 8.914 -6.903 -6.415
167 1H8' GPN 14 HB1 PGU 14 6.080 -3.776 -4.999
168 2H8' GPN 14 HB2 PGU 14 6.040 -4.340 -3.332
169 H8 GPN 14 H8 PGU 14 3.869 -3.780 -6.237
170 HN1 GPN 14 H1 PGU 14 1.033 -7.176 -1.628
171 1HN2 GPN 14 H21 PGU 14 2.509 -7.662 -0.043
172 2HN2 GPN 14 H22 PGU 14 4.227 -7.398 -0.256
173 1H1' TPN 15 HN PTH 15 7.998 -8.853 -5.868
174 1H2' TPN 15 HD1 PTH 15 9.354 -10.267 -3.564
175 2H2' TPN 15 HD2 PTH 15 8.059 -10.917 -4.601
176 1H3' TPN 15 HG1 PTH 15 6.834 -8.857 -3.122
177 2H3' TPN 15 HG2 PTH 15 7.860 -9.704 -1.937
178 1H5' TPN 15 HA21 PTH 15 7.840 -12.232 -2.112
179 2H5' TPN 15 HA22 PTH 15 6.892 -12.869 -3.458
180 1H8' TPN 15 HB1 PTH 15 5.302 -8.706 -3.882
181 2H8' TPN 15 HB2 PTH 15 4.527 -8.809 -2.302
182 H6 TPN 15 H6 PTH 15 4.101 -8.255 -5.667
183 HN3 TPN 15 H3 PTH 15 0.119 -9.784 -3.453
184 1HM5 TPN 15 H51 PTH 15 1.843 -8.760 -7.969
185 2HM5 TPN 15 H52 PTH 15 2.906 -7.426 -7.461
186 3HM5 TPN 15 H53 PTH 15 1.138 -7.251 -7.343
187 1H1' CPN 16 HN PCY 16 4.968 -11.382 -1.027
188 1H2' CPN 16 HD1 PCY 16 4.579 -13.232 1.058
189 2H2' CPN 16 HD2 PCY 16 3.867 -14.124 -0.316
190 1H3' CPN 16 HG1 PCY 16 2.719 -11.763 -0.786
191 2H3' CPN 16 HG2 PCY 16 2.972 -11.567 0.965
192 1H5' CPN 16 HA21 PCY 16 1.932 -13.149 2.517
193 2H5' CPN 16 HA22 PCY 16 0.587 -14.137 1.947
194 1H8' CPN 16 HB1 PCY 16 1.785 -14.907 -2.288
195 2H8' CPN 16 HB2 PCY 16 2.643 -13.410 -1.951
196 1HN4 CPN 16 H41 PCY 16 -2.285 -12.160 -6.288
197 2HN4 CPN 16 H42 PCY 16 -0.818 -11.588 -7.052
198 H5 CPN 16 H5 PCY 16 1.365 -11.879 -6.067
199 H6 CPN 16 H6 PCY 16 2.587 -12.493 -4.050
200 1HN NH2 17 HN3 PCY 16 -1.292 -12.757 3.436
201 2HN NH2 17 HN4 PCY 16 -1.315 -11.036 3.130
Start of MODEL 6
1 1H5* G 1 H5'' G 1 -12.726 -13.043 -3.123
2 2H5* G 1 H5' G 1 -11.885 -11.572 -3.653
3 H4* G 1 H4' G 1 -11.984 -12.631 -0.801
4 H3* G 1 H3' G 1 -11.460 -10.006 -1.777
5 1H2* G 1 H2'' G 1 -8.925 -10.346 -0.662
6 2H2* G 1 H2' G 1 -9.286 -10.233 -2.406
7 H1* G 1 H1' G 1 -8.686 -12.609 -0.722
8 H8 G 1 H8 G 1 -9.210 -12.266 -4.558
9 H1 G 1 H1 G 1 -3.115 -12.672 -2.662
10 1H2 G 1 H21 G 1 -3.028 -12.772 -0.442
11 2H2 G 1 H22 G 1 -4.465 -12.671 0.554
12 H5T G 1 H5T G 1 -13.329 -10.709 -1.750
13 1H5* A 2 H5'' A 2 -9.410 -10.604 3.113
14 2H5* A 2 H5' A 2 -8.918 -11.787 1.885
15 H4* A 2 H4' A 2 -7.154 -11.303 3.604
16 H3* A 2 H3' A 2 -7.815 -8.580 2.865
17 1H2* A 2 H2'' A 2 -4.982 -8.448 2.913
18 2H2* A 2 H2' A 2 -6.070 -8.090 1.543
19 H1* A 2 H1' A 2 -4.436 -10.481 2.095
20 H8 A 2 H8 A 2 -6.910 -9.713 -0.800
21 1H6 A 2 H61 A 2 -1.825 -9.341 -4.281
22 2H6 A 2 H62 A 2 -3.568 -9.493 -4.299
23 H2 A 2 H2 A 2 -0.541 -9.818 -0.004
24 1H5* C 3 H5'' C 3 -3.826 -8.070 6.466
25 2H5* C 3 H5' C 3 -3.706 -9.252 5.148
26 H4* C 3 H4' C 3 -1.554 -8.066 5.688
27 H3* C 3 H3' C 3 -3.275 -5.731 5.287
28 1H2* C 3 H2'' C 3 -0.795 -4.997 4.076
29 2H2* C 3 H2' C 3 -2.419 -5.019 3.328
30 H1* C 3 H1' C 3 -0.201 -6.965 3.144
31 1H4 C 3 H41 C 3 -1.668 -6.323 -2.968
32 2H4 C 3 H42 C 3 -3.365 -6.610 -2.652
33 H5 C 3 H5 C 3 -4.290 -6.442 -0.390
34 H6 C 3 H6 C 3 -3.740 -6.741 1.977
35 1H5* A 4 H5'' A 4 1.771 -4.384 6.589
36 2H5* A 4 H5' A 4 1.420 -5.653 5.399
37 H4* A 4 H4' A 4 3.475 -4.310 4.884
38 H3* A 4 H3' A 4 1.667 -2.120 5.373
39 1H2* A 4 H2'' A 4 2.773 -1.173 2.970
40 2H2* A 4 H2' A 4 1.076 -1.650 3.254
41 H1* A 4 H1' A 4 3.286 -3.146 1.932
42 H8 A 4 H8 A 4 -0.555 -3.347 2.449
43 1H6 A 4 H61 A 4 -0.873 -2.478 -3.663
44 2H6 A 4 H62 A 4 -1.803 -2.853 -2.228
45 H2 A 4 H2 A 4 3.447 -2.467 -2.473
46 1H5* T 5 H5'' T 5 6.372 -1.116 3.634
47 2H5* T 5 H5' T 5 5.169 -2.087 2.760
48 H4* T 5 H4' T 5 7.067 -1.037 1.380
49 H3* T 5 H3' T 5 5.973 1.350 2.567
50 1H2* T 5 H2'' T 5 5.960 2.237 -0.073
51 2H2* T 5 H2' T 5 4.514 1.886 0.919
52 H1* T 5 H1' T 5 5.877 0.197 -1.147
53 H3 T 5 H3 T 5 2.493 1.076 -3.892
54 1H5M T 5 H51 T 5 -0.690 0.283 -0.624
55 2H5M T 5 H52 T 5 0.181 1.071 0.715
56 3H5M T 5 H53 T 5 0.220 -0.700 0.552
57 H6 T 5 H6 T 5 2.714 -0.033 0.777
58 1H5* A 6 H5'' A 6 8.927 2.069 -1.936
59 2H5* A 6 H5' A 6 7.362 2.343 -1.151
60 H4* A 6 H4' A 6 9.204 4.386 -2.428
61 H3* A 6 H3' A 6 7.310 4.740 -0.206
62 1H2* A 6 H2'' A 6 6.903 6.904 -2.101
63 2H2* A 6 H2' A 6 5.701 5.886 -1.260
64 H1* A 6 H1' A 6 6.609 5.743 -3.987
65 H8 A 6 H8 A 6 4.760 3.356 -1.502
66 1H6 A 6 H61 A 6 -0.262 4.670 -4.834
67 2H6 A 6 H62 A 6 0.367 3.734 -3.496
68 H2 A 6 H2 A 6 3.239 6.671 -6.791
69 1H5* G 7 H5'' G 7 9.523 9.423 -1.937
70 2H5* G 7 H5' G 7 9.151 7.946 -2.847
71 H4* G 7 H4' G 7 8.685 10.051 -4.113
72 H3* G 7 H3' G 7 7.009 10.546 -1.706
73 1H2* G 7 H2'' G 7 5.916 11.793 -4.130
74 2H2* G 7 H2' G 7 5.082 10.940 -2.802
75 H1* G 7 H1' G 7 5.792 9.946 -5.410
76 H8 G 7 H8 G 7 5.028 8.144 -2.067
77 H1 G 7 H1 G 7 0.011 9.005 -5.935
78 1H2 G 7 H21 G 7 0.649 10.166 -7.720
79 2H2 G 7 H22 G 7 2.310 10.654 -7.976
80 1H5* C 8 H5'' C 8 7.478 14.292 -6.386
81 2H5* C 8 H5' C 8 6.858 12.692 -6.838
82 H4* C 8 H4' C 8 5.323 14.528 -7.487
83 H3* C 8 H3' C 8 5.660 15.226 -4.626
84 1H2* C 8 H2'' C 8 3.002 15.958 -5.595
85 2H2* C 8 H2' C 8 3.486 15.196 -4.054
86 H1* C 8 H1' C 8 2.367 13.964 -6.419
87 1H4 C 8 H41 C 8 0.170 10.100 -1.901
88 2H4 C 8 H42 C 8 1.624 10.283 -0.945
89 H5 C 8 H5 C 8 3.343 11.902 -1.498
90 H6 C 8 H6 C 8 4.280 13.263 -3.300
91 H3T C 8 H3T C 8 6.228 16.619 -6.351
92 1H1' GPN 9 HN1 PGU 9 -11.035 11.144 -2.707
93 2H1' GPN 9 HN2 PGU 9 -10.008 10.980 -4.113
94 1H2' GPN 9 HD1 PGU 9 -9.830 13.211 -2.438
95 2H2' GPN 9 HD2 PGU 9 -11.241 13.168 -3.521
96 1H3' GPN 9 HG1 PGU 9 -8.566 14.040 -4.102
97 2H3' GPN 9 HG2 PGU 9 -9.988 14.034 -5.170
98 1H5' GPN 9 HA21 PGU 9 -10.258 12.545 -6.783
99 2H5' GPN 9 HA22 PGU 9 -9.786 10.876 -6.470
100 1H8' GPN 9 HB1 PGU 9 -7.712 12.227 -2.846
101 2H8' GPN 9 HB2 PGU 9 -6.579 13.164 -3.812
102 H8 GPN 9 H8 PGU 9 -6.719 10.150 -1.549
103 HN1 GPN 9 H1 PGU 9 -0.954 11.270 -4.082
104 1HN2 GPN 9 H21 PGU 9 -1.131 12.669 -5.794
105 2HN2 GPN 9 H22 PGU 9 -2.678 13.268 -6.355
106 1H1' CPN 10 HN PCY 10 -7.184 13.155 -6.960
107 1H2' CPN 10 HD1 PCY 10 -5.547 13.027 -8.709
108 2H2' CPN 10 HD2 PCY 10 -6.926 13.245 -9.814
109 1H3' CPN 10 HG1 PCY 10 -7.169 10.889 -10.129
110 2H3' CPN 10 HG2 PCY 10 -6.114 10.514 -8.751
111 1H5' CPN 10 HA21 PCY 10 -5.094 12.184 -12.341
112 2H5' CPN 10 HA22 PCY 10 -6.414 11.039 -12.143
113 1H8' CPN 10 HB1 PCY 10 -4.407 11.807 -8.094
114 2H8' CPN 10 HB2 PCY 10 -2.692 11.863 -8.425
115 1HN4 CPN 10 H41 PCY 10 -1.714 7.765 -4.026
116 2HN4 CPN 10 H42 PCY 10 -3.436 7.542 -3.812
117 H5 CPN 10 H5 PCY 10 -5.075 8.780 -5.147
118 H6 CPN 10 H6 PCY 10 -5.448 9.850 -7.265
119 1H1' TPN 11 HN PTH 11 -4.522 8.775 -11.372
120 1H2' TPN 11 HD1 PTH 11 -3.879 8.157 -14.307
121 2H2' TPN 11 HD2 PTH 11 -3.812 7.016 -12.945
122 1H3' TPN 11 HG1 PTH 11 -1.872 9.002 -12.375
123 2H3' TPN 11 HG2 PTH 11 -1.680 8.635 -14.103
124 1H5' TPN 11 HA21 PTH 11 -1.474 6.369 -14.832
125 2H5' TPN 11 HA22 PTH 11 -2.171 5.224 -13.689
126 1H8' TPN 11 HB1 PTH 11 -1.558 8.603 -10.774
127 2H8' TPN 11 HB2 PTH 11 0.167 8.305 -10.537
128 H6 TPN 11 H6 PTH 11 -3.161 7.181 -9.553
129 HN3 TPN 11 H3 PTH 11 0.479 6.200 -6.589
130 1HM5 TPN 11 H51 PTH 11 -4.702 6.676 -7.398
131 2HM5 TPN 11 H52 PTH 11 -4.055 5.304 -6.465
132 3HM5 TPN 11 H53 PTH 11 -4.354 5.132 -8.211
133 1H1' APN 12 HN PAD 12 1.124 6.531 -13.162
134 1H2' APN 12 HD1 PAD 12 3.187 5.323 -13.665
135 2H2' APN 12 HD2 PAD 12 2.277 4.007 -14.442
136 1H3' APN 12 HG1 PAD 12 1.948 2.878 -12.457
137 2H3' APN 12 HG2 PAD 12 1.875 4.377 -11.502
138 1H5' APN 12 HA21 PAD 12 5.555 3.731 -13.137
139 2H5' APN 12 HA22 PAD 12 4.227 2.759 -13.772
140 1H8' APN 12 HB1 PAD 12 2.768 5.524 -10.260
141 2H8' APN 12 HB2 PAD 12 3.940 5.226 -8.984
142 H8 APN 12 H8 PAD 12 0.496 4.103 -10.131
143 1HN6 APN 12 H61 PAD 12 0.290 1.210 -4.691
144 2HN6 APN 12 H62 PAD 12 -0.643 1.769 -6.062
145 H2 APN 12 H2 PAD 12 4.597 2.171 -5.588
146 1H1' TPN 13 HN PTH 13 4.048 1.506 -10.937
147 1H2' TPN 13 HD1 PTH 13 6.226 -0.586 -11.622
148 2H2' TPN 13 HD2 PTH 13 4.755 -0.889 -10.668
149 1H3' TPN 13 HG1 PTH 13 5.815 0.855 -8.990
150 2H3' TPN 13 HG2 PTH 13 7.330 0.449 -9.831
151 1H5' TPN 13 HA21 PTH 13 8.378 -1.492 -9.521
152 2H5' TPN 13 HA22 PTH 13 7.289 -2.854 -9.767
153 1H8' TPN 13 HB1 PTH 13 4.112 0.009 -8.557
154 2H8' TPN 13 HB2 PTH 13 4.719 0.176 -6.915
155 H6 TPN 13 H6 PTH 13 1.962 -0.351 -8.789
156 HN3 TPN 13 H3 PTH 13 1.743 -2.224 -4.381
157 1HM5 TPN 13 H51 PTH 13 -0.369 0.348 -8.509
158 2HM5 TPN 13 H52 PTH 13 -1.390 -0.504 -7.325
159 3HM5 TPN 13 H53 PTH 13 -0.807 -1.358 -8.776
160 1H1' GPN 14 HN PGU 14 6.905 -4.378 -8.074
161 1H2' GPN 14 HD1 PGU 14 9.344 -5.090 -6.639
162 2H2' GPN 14 HD2 PGU 14 7.714 -5.637 -6.181
163 1H3' GPN 14 HG1 PGU 14 7.713 -3.063 -5.197
164 2H3' GPN 14 HG2 PGU 14 9.418 -3.524 -4.973
165 1H5' GPN 14 HA21 PGU 14 9.409 -4.676 -2.339
166 2H5' GPN 14 HA22 PGU 14 9.954 -5.582 -3.748
167 1H8' GPN 14 HB1 PGU 14 6.084 -3.956 -5.413
168 2H8' GPN 14 HB2 PGU 14 5.590 -3.148 -3.937
169 H8 GPN 14 H8 PGU 14 3.916 -4.267 -6.652
170 HN1 GPN 14 H1 PGU 14 0.805 -6.251 -1.429
171 1HN2 GPN 14 H21 PGU 14 2.141 -6.085 0.343
172 2HN2 GPN 14 H22 PGU 14 3.841 -5.700 0.197
173 1H1' TPN 15 HN PTH 15 8.683 -7.716 -4.179
174 1H2' TPN 15 HD1 PTH 15 8.976 -9.363 -1.728
175 2H2' TPN 15 HD2 PTH 15 8.093 -9.844 -3.199
176 1H3' TPN 15 HG1 PTH 15 6.315 -8.078 -2.219
177 2H3' TPN 15 HG2 PTH 15 7.060 -8.561 -0.678
178 1H5' TPN 15 HA21 PTH 15 7.638 -11.154 -0.761
179 2H5' TPN 15 HA22 PTH 15 6.886 -12.040 -2.087
180 1H8' TPN 15 HB1 PTH 15 4.883 -8.206 -3.125
181 2H8' TPN 15 HB2 PTH 15 3.925 -8.281 -1.647
182 H6 TPN 15 H6 PTH 15 3.956 -8.423 -5.155
183 HN3 TPN 15 H3 PTH 15 -0.227 -9.513 -3.069
184 1HM5 TPN 15 H51 PTH 15 1.912 -7.484 -7.196
185 2HM5 TPN 15 H52 PTH 15 1.212 -9.093 -7.494
186 3HM5 TPN 15 H53 PTH 15 2.974 -8.905 -7.335
187 1H1' CPN 16 HN PCY 16 4.401 -10.773 -0.057
188 1H2' CPN 16 HD1 PCY 16 2.989 -12.006 1.435
189 2H2' CPN 16 HD2 PCY 16 4.457 -12.736 2.133
190 1H3' CPN 16 HG1 PCY 16 4.189 -14.673 0.961
191 2H3' CPN 16 HG2 PCY 16 3.676 -13.823 -0.513
192 1H5' CPN 16 HA21 PCY 16 0.843 -15.028 2.344
193 2H5' CPN 16 HA22 PCY 16 2.565 -15.173 2.688
194 1H8' CPN 16 HB1 PCY 16 2.481 -12.582 -1.035
195 2H8' CPN 16 HB2 PCY 16 1.203 -11.599 -0.337
196 1HN4 CPN 16 H41 PCY 16 -2.300 -12.332 -5.633
197 2HN4 CPN 16 H42 PCY 16 -0.787 -12.123 -6.486
198 H5 CPN 16 H5 PCY 16 1.365 -12.257 -5.382
199 H6 CPN 16 H6 PCY 16 2.510 -12.530 -3.234
200 1HN NH2 17 HN3 PCY 16 2.692 -18.375 2.203
201 2HN NH2 17 HN4 PCY 16 2.294 -17.147 3.383
Start of MODEL 7
1 1H5* G 1 H5'' G 1 -13.560 -10.462 -2.166
2 2H5* G 1 H5' G 1 -13.274 -11.946 -3.098
3 H4* G 1 H4' G 1 -12.292 -12.101 -0.842
4 H3* G 1 H3' G 1 -11.531 -9.404 -1.329
5 1H2* G 1 H2'' G 1 -8.969 -10.226 -0.591
6 2H2* G 1 H2' G 1 -9.465 -9.717 -2.229
7 H1* G 1 H1' G 1 -9.010 -12.441 -1.125
8 H8 G 1 H8 G 1 -9.856 -11.272 -4.728
9 H1 G 1 H1 G 1 -3.716 -12.745 -3.725
10 1H2 G 1 H21 G 1 -3.419 -13.338 -1.599
11 2H2 G 1 H22 G 1 -4.676 -13.119 -0.400
12 H5T G 1 H5T G 1 -11.314 -10.678 -3.849
13 1H5* A 2 H5'' A 2 -9.040 -11.053 3.107
14 2H5* A 2 H5' A 2 -8.826 -12.048 1.652
15 H4* A 2 H4' A 2 -6.816 -11.942 3.179
16 H3* A 2 H3' A 2 -7.261 -9.079 2.725
17 1H2* A 2 H2'' A 2 -4.404 -9.447 2.701
18 2H2* A 2 H2' A 2 -5.442 -8.614 1.510
19 H1* A 2 H1' A 2 -4.240 -11.274 1.402
20 H8 A 2 H8 A 2 -6.889 -9.478 -0.831
21 1H6 A 2 H61 A 2 -2.288 -8.885 -4.884
22 2H6 A 2 H62 A 2 -4.028 -8.899 -4.705
23 H2 A 2 H2 A 2 -0.677 -11.037 -1.260
24 1H5* C 3 H5'' C 3 -3.223 -9.385 6.276
25 2H5* C 3 H5' C 3 -3.390 -10.443 4.860
26 H4* C 3 H4' C 3 -1.032 -9.739 5.341
27 H3* C 3 H3' C 3 -2.302 -7.094 5.273
28 1H2* C 3 H2'' C 3 0.252 -6.751 4.004
29 2H2* C 3 H2' C 3 -1.367 -6.317 3.381
30 H1* C 3 H1' C 3 0.345 -8.630 2.767
31 1H4 C 3 H41 C 3 -1.482 -6.498 -2.916
32 2H4 C 3 H42 C 3 -3.161 -6.831 -2.547
33 H5 C 3 H5 C 3 -3.871 -6.881 -0.174
34 H6 C 3 H6 C 3 -3.182 -7.674 2.037
35 1H5* A 4 H5'' A 4 2.807 -6.167 6.766
36 2H5* A 4 H5' A 4 2.721 -7.256 5.366
37 H4* A 4 H4' A 4 4.571 -5.528 5.284
38 H3* A 4 H3' A 4 2.340 -3.773 5.813
39 1H2* A 4 H2'' A 4 3.465 -2.330 3.689
40 2H2* A 4 H2' A 4 1.876 -3.144 3.704
41 H1* A 4 H1' A 4 4.469 -4.032 2.526
42 H8 A 4 H8 A 4 0.704 -4.965 2.462
43 1H6 A 4 H61 A 4 0.840 -2.802 -3.313
44 2H6 A 4 H62 A 4 -0.133 -3.656 -2.136
45 H2 A 4 H2 A 4 4.989 -2.530 -1.632
46 1H5* T 5 H5'' T 5 6.653 -1.250 4.692
47 2H5* T 5 H5' T 5 5.908 -2.218 3.405
48 H4* T 5 H4' T 5 7.317 -0.108 2.780
49 H3* T 5 H3' T 5 5.093 1.077 4.236
50 1H2* T 5 H2'' T 5 5.209 2.736 1.936
51 2H2* T 5 H2' T 5 3.841 1.721 2.476
52 H1* T 5 H1' T 5 5.894 1.225 0.389
53 H3 T 5 H3 T 5 2.592 1.328 -2.601
54 1H5M T 5 H51 T 5 0.234 -0.390 1.673
55 2H5M T 5 H52 T 5 0.838 -1.974 1.130
56 3H5M T 5 H53 T 5 -0.300 -1.055 0.110
57 H6 T 5 H6 T 5 2.963 -0.608 1.780
58 1H5* A 6 H5'' A 6 8.530 4.089 1.694
59 2H5* A 6 H5' A 6 7.636 2.676 1.098
60 H4* A 6 H4' A 6 8.297 4.324 -0.689
61 H3* A 6 H3' A 6 6.895 6.112 1.157
62 1H2* A 6 H2'' A 6 6.169 7.008 -1.480
63 2H2* A 6 H2' A 6 5.108 6.591 -0.105
64 H1* A 6 H1' A 6 5.833 5.036 -2.480
65 H8 A 6 H8 A 6 3.807 3.739 0.546
66 1H6 A 6 H61 A 6 -1.175 4.936 -2.915
67 2H6 A 6 H62 A 6 -0.621 4.328 -1.370
68 H2 A 6 H2 A 6 2.432 6.355 -5.154
69 1H5* G 7 H5'' G 7 8.939 7.802 -3.185
70 2H5* G 7 H5' G 7 7.630 6.608 -3.291
71 H4* G 7 H4' G 7 8.000 8.190 -5.294
72 H3* G 7 H3' G 7 7.248 10.063 -3.148
73 1H2* G 7 H2'' G 7 6.029 10.833 -5.713
74 2H2* G 7 H2' G 7 5.357 10.912 -4.060
75 H1* G 7 H1' G 7 4.761 9.009 -6.068
76 H8 G 7 H8 G 7 4.864 8.482 -2.230
77 H1 G 7 H1 G 7 -0.962 9.342 -4.747
78 1H2 G 7 H21 G 7 -0.780 9.927 -6.871
79 2H2 G 7 H22 G 7 0.772 10.133 -7.654
80 1H5* C 8 H5'' C 8 8.433 12.968 -7.571
81 2H5* C 8 H5' C 8 7.715 11.355 -7.391
82 H4* C 8 H4' C 8 6.574 12.720 -9.126
83 H3* C 8 H3' C 8 6.530 14.657 -6.907
84 1H2* C 8 H2'' C 8 4.087 14.935 -8.463
85 2H2* C 8 H2' C 8 4.312 14.904 -6.692
86 H1* C 8 H1' C 8 3.366 12.808 -8.433
87 1H4 C 8 H41 C 8 0.187 11.874 -3.039
88 2H4 C 8 H42 C 8 1.641 12.006 -2.074
89 H5 C 8 H5 C 8 3.757 12.754 -3.014
90 H6 C 8 H6 C 8 5.021 13.015 -5.093
91 H3T C 8 H3T C 8 5.980 14.859 -9.695
92 1H1' GPN 9 HN1 PGU 9 -9.871 17.611 -6.595
93 2H1' GPN 9 HN2 PGU 9 -10.012 15.999 -7.254
94 1H2' GPN 9 HD1 PGU 9 -7.487 17.355 -7.043
95 2H2' GPN 9 HD2 PGU 9 -8.670 17.742 -8.314
96 1H3' GPN 9 HG1 PGU 9 -6.679 15.897 -8.597
97 2H3' GPN 9 HG2 PGU 9 -8.213 15.848 -9.498
98 1H5' GPN 9 HA21 PGU 9 -9.959 13.579 -7.452
99 2H5' GPN 9 HA22 PGU 9 -9.852 14.366 -9.026
100 1H8' GPN 9 HB1 PGU 9 -6.347 15.708 -6.045
101 2H8' GPN 9 HB2 PGU 9 -5.481 14.928 -7.369
102 H8 GPN 9 H8 PGU 9 -6.346 13.962 -3.698
103 HN1 GPN 9 H1 PGU 9 -0.553 12.239 -5.793
104 1HN2 GPN 9 H21 PGU 9 -0.313 12.832 -7.921
105 2HN2 GPN 9 H22 PGU 9 -1.640 13.478 -8.862
106 1H1' CPN 10 HN PCY 10 -8.801 11.481 -7.137
107 1H2' CPN 10 HD1 PCY 10 -9.405 9.632 -9.330
108 2H2' CPN 10 HD2 PCY 10 -8.269 9.308 -8.000
109 1H3' CPN 10 HG1 PCY 10 -6.721 10.957 -9.513
110 2H3' CPN 10 HG2 PCY 10 -7.724 10.239 -10.793
111 1H5' CPN 10 HA21 PCY 10 -7.557 8.094 -11.396
112 2H5' CPN 10 HA22 PCY 10 -7.293 6.919 -10.109
113 1H8' CPN 10 HB1 PCY 10 -6.077 10.471 -7.724
114 2H8' CPN 10 HB2 PCY 10 -4.438 10.459 -8.377
115 1HN4 CPN 10 H41 PCY 10 -2.094 8.377 -2.847
116 2HN4 CPN 10 H42 PCY 10 -3.682 7.856 -2.329
117 H5 CPN 10 H5 PCY 10 -5.559 7.719 -3.871
118 H6 CPN 10 H6 PCY 10 -6.464 8.544 -5.972
119 1H1' TPN 11 HN PTH 11 -4.590 8.889 -11.228
120 1H2' TPN 11 HD1 PTH 11 -3.212 6.317 -12.101
121 2H2' TPN 11 HD2 PTH 11 -3.595 7.404 -13.451
122 1H3' TPN 11 HG1 PTH 11 -2.343 8.797 -11.159
123 2H3' TPN 11 HG2 PTH 11 -1.972 8.883 -12.889
124 1H5' TPN 11 HA21 PTH 11 0.263 7.406 -13.580
125 2H5' TPN 11 HA22 PTH 11 -1.180 6.414 -13.738
126 1H8' TPN 11 HB1 PTH 11 -2.038 8.163 -9.658
127 2H8' TPN 11 HB2 PTH 11 -0.437 8.628 -9.092
128 H6 TPN 11 H6 PTH 11 -3.243 6.409 -8.711
129 HN3 TPN 11 H3 PTH 11 0.166 6.244 -5.342
130 1HM5 TPN 11 H51 PTH 11 -4.094 4.190 -6.284
131 2HM5 TPN 11 H52 PTH 11 -4.787 5.407 -7.383
132 3HM5 TPN 11 H53 PTH 11 -4.630 5.764 -5.646
133 1H1' APN 12 HN PAD 12 -0.519 4.724 -11.251
134 1H2' APN 12 HD1 PAD 12 2.049 3.425 -12.407
135 2H2' APN 12 HD2 PAD 12 0.591 2.428 -12.206
136 1H3' APN 12 HG1 PAD 12 1.259 2.037 -10.072
137 2H3' APN 12 HG2 PAD 12 0.918 3.747 -9.725
138 1H5' APN 12 HA21 PAD 12 4.581 3.290 -11.449
139 2H5' APN 12 HA22 PAD 12 3.416 1.996 -11.692
140 1H8' APN 12 HB1 PAD 12 1.739 5.564 -9.033
141 2H8' APN 12 HB2 PAD 12 2.901 5.618 -7.714
142 H8 APN 12 H8 PAD 12 -0.504 4.357 -8.500
143 1HN6 APN 12 H61 PAD 12 -0.235 1.125 -3.263
144 2HN6 APN 12 H62 PAD 12 -1.310 1.868 -4.429
145 H2 APN 12 H2 PAD 12 3.870 2.754 -4.091
146 1H1' TPN 13 HN PTH 13 6.108 3.096 -9.505
147 1H2' TPN 13 HD1 PTH 13 7.640 0.745 -9.722
148 2H2' TPN 13 HD2 PTH 13 6.416 0.206 -8.554
149 1H3' TPN 13 HG1 PTH 13 7.117 2.596 -7.433
150 2H3' TPN 13 HG2 PTH 13 8.638 2.178 -8.253
151 1H5' TPN 13 HA21 PTH 13 9.833 0.270 -5.844
152 2H5' TPN 13 HA22 PTH 13 9.958 0.554 -7.575
153 1H8' TPN 13 HB1 PTH 13 5.634 1.734 -6.734
154 2H8' TPN 13 HB2 PTH 13 5.841 2.039 -5.013
155 H6 TPN 13 H6 PTH 13 3.571 1.124 -7.250
156 HN3 TPN 13 H3 PTH 13 3.342 -1.655 -3.349
157 1HM5 TPN 13 H51 PTH 13 0.519 -0.929 -6.936
158 2HM5 TPN 13 H52 PTH 13 1.734 -0.614 -8.198
159 3HM5 TPN 13 H53 PTH 13 0.954 0.746 -7.356
160 1H1' GPN 14 HN PGU 14 7.467 -1.681 -6.325
161 1H2' GPN 14 HD1 PGU 14 9.193 -3.929 -7.579
162 2H2' GPN 14 HD2 PGU 14 7.434 -3.999 -7.304
163 1H3' GPN 14 HG1 PGU 14 8.144 -3.660 -4.761
164 2H3' GPN 14 HG2 PGU 14 9.703 -4.299 -5.326
165 1H5' GPN 14 HA21 PGU 14 9.955 -6.466 -6.014
166 2H5' GPN 14 HA22 PGU 14 8.617 -6.988 -7.038
167 1H8' GPN 14 HB1 PGU 14 6.332 -3.818 -4.862
168 2H8' GPN 14 HB2 PGU 14 6.325 -4.680 -3.325
169 H8 GPN 14 H8 PGU 14 4.086 -3.572 -6.087
170 HN1 GPN 14 H1 PGU 14 1.107 -6.998 -1.589
171 1HN2 GPN 14 H21 PGU 14 2.593 -7.675 -0.073
172 2HN2 GPN 14 H22 PGU 14 4.313 -7.633 -0.390
173 1H1' TPN 15 HN PTH 15 7.408 -8.829 -6.534
174 1H2' TPN 15 HD1 PTH 15 8.845 -10.691 -4.598
175 2H2' TPN 15 HD2 PTH 15 7.388 -11.060 -5.557
176 1H3' TPN 15 HG1 PTH 15 6.558 -9.052 -3.780
177 2H3' TPN 15 HG2 PTH 15 7.591 -10.098 -2.778
178 1H5' TPN 15 HA21 PTH 15 7.251 -12.585 -3.113
179 2H5' TPN 15 HA22 PTH 15 6.130 -13.000 -4.412
180 1H8' TPN 15 HB1 PTH 15 4.982 -8.671 -4.367
181 2H8' TPN 15 HB2 PTH 15 4.351 -8.818 -2.729
182 H6 TPN 15 H6 PTH 15 3.669 -7.978 -6.000
183 HN3 TPN 15 H3 PTH 15 -0.227 -9.252 -3.496
184 1HM5 TPN 15 H51 PTH 15 1.412 -6.277 -7.228
185 2HM5 TPN 15 H52 PTH 15 0.542 -7.702 -7.845
186 3HM5 TPN 15 H53 PTH 15 2.317 -7.629 -7.949
187 1H1' CPN 16 HN PCY 16 4.709 -11.503 -1.630
188 1H2' CPN 16 HD1 PCY 16 4.261 -13.547 0.271
189 2H2' CPN 16 HD2 PCY 16 3.224 -14.089 -1.076
190 1H3' CPN 16 HG1 PCY 16 2.494 -11.510 -1.054
191 2H3' CPN 16 HG2 PCY 16 2.990 -11.650 0.648
192 1H5' CPN 16 HA21 PCY 16 1.803 -12.984 2.150
193 2H5' CPN 16 HA22 PCY 16 0.361 -13.878 1.668
194 1H8' CPN 16 HB1 PCY 16 1.115 -14.395 -2.688
195 2H8' CPN 16 HB2 PCY 16 1.981 -12.896 -2.390
196 1HN4 CPN 16 H41 PCY 16 -3.163 -11.722 -6.458
197 2HN4 CPN 16 H42 PCY 16 -1.717 -11.279 -7.339
198 H5 CPN 16 H5 PCY 16 0.432 -11.099 -6.238
199 H6 CPN 16 H6 PCY 16 1.715 -11.652 -4.242
200 1HN NH2 17 HN3 PCY 16 -1.580 -12.548 2.972
201 2HN NH2 17 HN4 PCY 16 -1.378 -10.814 3.063
Start of MODEL 8
1 1H5* G 1 H5'' G 1 -12.423 -12.639 -3.774
2 2H5* G 1 H5' G 1 -11.579 -11.122 -4.148
3 H4* G 1 H4' G 1 -11.758 -12.423 -1.403
4 H3* G 1 H3' G 1 -11.219 -9.722 -2.137
5 1H2* G 1 H2'' G 1 -8.724 -10.151 -0.958
6 2H2* G 1 H2' G 1 -9.021 -9.887 -2.699
7 H1* G 1 H1' G 1 -8.473 -12.401 -1.206
8 H8 G 1 H8 G 1 -8.853 -11.726 -5.013
9 H1 G 1 H1 G 1 -2.844 -12.459 -2.948
10 1H2 G 1 H21 G 1 -2.834 -12.689 -0.737
11 2H2 G 1 H22 G 1 -4.302 -12.631 0.217
12 H5T G 1 H5T G 1 -13.091 -10.440 -2.223
13 1H5* A 2 H5'' A 2 -9.303 -10.670 2.768
14 2H5* A 2 H5' A 2 -8.771 -11.773 1.484
15 H4* A 2 H4' A 2 -7.050 -11.356 3.270
16 H3* A 2 H3' A 2 -7.714 -8.603 2.622
17 1H2* A 2 H2'' A 2 -4.881 -8.477 2.801
18 2H2* A 2 H2' A 2 -5.913 -8.047 1.407
19 H1* A 2 H1' A 2 -4.312 -10.473 1.911
20 H8 A 2 H8 A 2 -6.639 -9.448 -1.039
21 1H6 A 2 H61 A 2 -1.394 -9.099 -4.283
22 2H6 A 2 H62 A 2 -3.140 -9.136 -4.378
23 H2 A 2 H2 A 2 -0.321 -9.912 0.004
24 1H5* C 3 H5'' C 3 -3.867 -8.310 6.442
25 2H5* C 3 H5' C 3 -3.749 -9.480 5.114
26 H4* C 3 H4' C 3 -1.560 -8.438 5.733
27 H3* C 3 H3' C 3 -3.140 -6.001 5.427
28 1H2* C 3 H2'' C 3 -0.623 -5.343 4.249
29 2H2* C 3 H2' C 3 -2.249 -5.225 3.516
30 H1* C 3 H1' C 3 -0.144 -7.253 3.162
31 1H4 C 3 H41 C 3 -1.836 -6.193 -2.824
32 2H4 C 3 H42 C 3 -3.538 -6.114 -2.421
33 H5 C 3 H5 C 3 -4.337 -6.174 -0.119
34 H6 C 3 H6 C 3 -3.711 -6.708 2.189
35 1H5* A 4 H5'' A 4 1.924 -4.635 6.776
36 2H5* A 4 H5' A 4 1.614 -5.913 5.584
37 H4* A 4 H4' A 4 3.580 -4.462 5.031
38 H3* A 4 H3' A 4 1.661 -2.370 5.572
39 1H2* A 4 H2'' A 4 2.729 -1.356 3.171
40 2H2* A 4 H2' A 4 1.048 -1.883 3.466
41 H1* A 4 H1' A 4 3.280 -3.296 2.098
42 H8 A 4 H8 A 4 -0.540 -3.605 2.699
43 1H6 A 4 H61 A 4 -1.023 -2.684 -3.391
44 2H6 A 4 H62 A 4 -1.905 -3.146 -1.950
45 H2 A 4 H2 A 4 3.324 -2.601 -2.305
46 1H5* T 5 H5'' T 5 6.302 -1.166 3.823
47 2H5* T 5 H5' T 5 5.124 -2.174 2.959
48 H4* T 5 H4' T 5 6.975 -1.078 1.560
49 H3* T 5 H3' T 5 5.843 1.283 2.765
50 1H2* T 5 H2'' T 5 5.800 2.176 0.126
51 2H2* T 5 H2' T 5 4.367 1.802 1.127
52 H1* T 5 H1' T 5 5.739 0.137 -0.953
53 H3 T 5 H3 T 5 2.306 0.974 -3.657
54 1H5M T 5 H51 T 5 0.128 -0.930 0.782
55 2H5M T 5 H52 T 5 -0.822 0.043 -0.371
56 3H5M T 5 H53 T 5 0.038 0.837 0.971
57 H6 T 5 H6 T 5 2.603 -0.182 0.997
58 1H5* A 6 H5'' A 6 8.740 1.983 -1.773
59 2H5* A 6 H5' A 6 7.179 2.239 -0.976
60 H4* A 6 H4' A 6 8.959 4.286 -2.329
61 H3* A 6 H3' A 6 7.076 4.661 -0.090
62 1H2* A 6 H2'' A 6 6.695 6.796 -2.034
63 2H2* A 6 H2' A 6 5.483 5.823 -1.155
64 H1* A 6 H1' A 6 6.366 5.583 -3.885
65 H8 A 6 H8 A 6 4.511 3.262 -1.340
66 1H6 A 6 H61 A 6 -0.535 4.650 -4.614
67 2H6 A 6 H62 A 6 0.095 3.689 -3.294
68 H2 A 6 H2 A 6 2.979 6.550 -6.642
69 1H5* G 7 H5'' G 7 9.426 9.224 -1.946
70 2H5* G 7 H5' G 7 9.008 7.712 -2.775
71 H4* G 7 H4' G 7 8.651 9.750 -4.173
72 H3* G 7 H3' G 7 6.970 10.468 -1.827
73 1H2* G 7 H2'' G 7 5.963 11.604 -4.343
74 2H2* G 7 H2' G 7 5.075 10.881 -2.975
75 H1* G 7 H1' G 7 5.756 9.686 -5.500
76 H8 G 7 H8 G 7 4.906 8.135 -2.054
77 H1 G 7 H1 G 7 -0.069 9.026 -5.969
78 1H2 G 7 H21 G 7 0.630 10.014 -7.834
79 2H2 G 7 H22 G 7 2.320 10.348 -8.141
80 1H5* C 8 H5'' C 8 7.714 13.790 -6.771
81 2H5* C 8 H5' C 8 6.982 12.210 -7.105
82 H4* C 8 H4' C 8 5.599 14.100 -7.927
83 H3* C 8 H3' C 8 5.953 14.992 -5.124
84 1H2* C 8 H2'' C 8 3.361 15.828 -6.187
85 2H2* C 8 H2' C 8 3.776 15.163 -4.583
86 H1* C 8 H1' C 8 2.584 13.822 -6.846
87 1H4 C 8 H41 C 8 0.165 10.458 -2.047
88 2H4 C 8 H42 C 8 1.638 10.608 -1.115
89 H5 C 8 H5 C 8 3.441 12.092 -1.777
90 H6 C 8 H6 C 8 4.455 13.251 -3.676
91 H3T C 8 H3T C 8 6.634 16.208 -6.933
92 1H1' GPN 9 HN1 PGU 9 -10.060 12.217 -4.327
93 2H1' GPN 9 HN2 PGU 9 -10.900 12.559 -2.830
94 1H2' GPN 9 HD1 PGU 9 -9.427 14.469 -2.721
95 2H2' GPN 9 HD2 PGU 9 -10.857 14.568 -3.774
96 1H3' GPN 9 HG1 PGU 9 -8.113 14.994 -4.468
97 2H3' GPN 9 HG2 PGU 9 -9.544 15.068 -5.524
98 1H5' GPN 9 HA21 PGU 9 -10.034 13.478 -6.979
99 2H5' GPN 9 HA22 PGU 9 -9.727 11.795 -6.556
100 1H8' GPN 9 HB1 PGU 9 -7.519 13.120 -3.005
101 2H8' GPN 9 HB2 PGU 9 -6.328 13.903 -4.039
102 H8 GPN 9 H8 PGU 9 -6.674 11.044 -1.602
103 HN1 GPN 9 H1 PGU 9 -0.889 11.530 -4.289
104 1HN2 GPN 9 H21 PGU 9 -0.985 12.840 -6.075
105 2HN2 GPN 9 H22 PGU 9 -2.488 13.527 -6.651
106 1H1' CPN 10 HN PCY 10 -6.897 13.722 -7.184
107 1H2' CPN 10 HD1 PCY 10 -5.307 13.328 -8.933
108 2H2' CPN 10 HD2 PCY 10 -6.666 13.610 -10.048
109 1H3' CPN 10 HG1 PCY 10 -7.156 11.270 -10.185
110 2H3' CPN 10 HG2 PCY 10 -6.111 10.889 -8.801
111 1H5' CPN 10 HA21 PCY 10 -5.037 12.192 -12.523
112 2H5' CPN 10 HA22 PCY 10 -6.438 11.173 -12.214
113 1H8' CPN 10 HB1 PCY 10 -4.277 12.058 -8.263
114 2H8' CPN 10 HB2 PCY 10 -2.571 11.950 -8.631
115 1HN4 CPN 10 H41 PCY 10 -1.851 8.046 -3.998
116 2HN4 CPN 10 H42 PCY 10 -3.583 7.936 -3.771
117 H5 CPN 10 H5 PCY 10 -5.142 9.242 -5.146
118 H6 CPN 10 H6 PCY 10 -5.459 10.238 -7.308
119 1H1' TPN 11 HN PTH 11 -4.780 8.818 -11.309
120 1H2' TPN 11 HD1 PTH 11 -4.203 7.912 -14.172
121 2H2' TPN 11 HD2 PTH 11 -4.166 6.900 -12.710
122 1H3' TPN 11 HG1 PTH 11 -2.107 8.789 -12.336
123 2H3' TPN 11 HG2 PTH 11 -1.981 8.319 -14.046
124 1H5' TPN 11 HA21 PTH 11 -1.935 6.007 -14.650
125 2H5' TPN 11 HA22 PTH 11 -2.620 4.950 -13.418
126 1H8' TPN 11 HB1 PTH 11 -1.785 8.454 -10.717
127 2H8' TPN 11 HB2 PTH 11 -0.066 8.091 -10.525
128 H6 TPN 11 H6 PTH 11 -3.406 7.254 -9.344
129 HN3 TPN 11 H3 PTH 11 0.284 6.127 -6.495
130 1HM5 TPN 11 H51 PTH 11 -4.346 5.928 -6.035
131 2HM5 TPN 11 H52 PTH 11 -4.574 5.145 -7.617
132 3HM5 TPN 11 H53 PTH 11 -4.936 6.877 -7.422
133 1H1' APN 12 HN PAD 12 0.710 6.180 -13.052
134 1H2' APN 12 HD1 PAD 12 2.726 4.896 -13.623
135 2H2' APN 12 HD2 PAD 12 1.744 3.530 -14.204
136 1H3' APN 12 HG1 PAD 12 1.566 2.596 -12.112
137 2H3' APN 12 HG2 PAD 12 1.491 4.177 -11.305
138 1H5' APN 12 HA21 PAD 12 5.153 3.587 -12.963
139 2H5' APN 12 HA22 PAD 12 3.841 2.594 -13.593
140 1H8' APN 12 HB1 PAD 12 2.388 5.360 -10.110
141 2H8' APN 12 HB2 PAD 12 3.588 5.128 -8.847
142 H8 APN 12 H8 PAD 12 0.120 3.988 -9.839
143 1HN6 APN 12 H61 PAD 12 0.111 1.073 -4.411
144 2HN6 APN 12 H62 PAD 12 -0.842 1.490 -5.817
145 H2 APN 12 H2 PAD 12 4.385 2.078 -5.436
146 1H1' TPN 13 HN PTH 13 3.756 1.349 -10.734
147 1H2' TPN 13 HD1 PTH 13 5.935 -0.721 -11.484
148 2H2' TPN 13 HD2 PTH 13 4.498 -1.040 -10.486
149 1H3' TPN 13 HG1 PTH 13 5.591 0.737 -8.855
150 2H3' TPN 13 HG2 PTH 13 7.084 0.323 -9.733
151 1H5' TPN 13 HA21 PTH 13 8.132 -1.625 -9.453
152 2H5' TPN 13 HA22 PTH 13 7.033 -2.991 -9.623
153 1H8' TPN 13 HB1 PTH 13 3.925 -0.079 -8.331
154 2H8' TPN 13 HB2 PTH 13 4.568 0.066 -6.702
155 H6 TPN 13 H6 PTH 13 1.772 -0.437 -8.530
156 HN3 TPN 13 H3 PTH 13 1.633 -2.382 -4.151
157 1HM5 TPN 13 H51 PTH 13 -1.596 -0.853 -7.086
158 2HM5 TPN 13 H52 PTH 13 -0.868 -1.392 -8.620
159 3HM5 TPN 13 H53 PTH 13 -0.636 0.282 -8.064
160 1H1' GPN 14 HN PGU 14 6.745 -4.496 -7.912
161 1H2' GPN 14 HD1 PGU 14 9.226 -5.137 -6.516
162 2H2' GPN 14 HD2 PGU 14 7.616 -5.702 -6.013
163 1H3' GPN 14 HG1 PGU 14 7.586 -3.108 -5.080
164 2H3' GPN 14 HG2 PGU 14 9.306 -3.529 -4.889
165 1H5' GPN 14 HA21 PGU 14 9.332 -4.612 -2.190
166 2H5' GPN 14 HA22 PGU 14 9.943 -5.458 -3.608
167 1H8' GPN 14 HB1 PGU 14 5.984 -4.040 -5.247
168 2H8' GPN 14 HB2 PGU 14 5.471 -3.248 -3.771
169 H8 GPN 14 H8 PGU 14 3.793 -4.348 -6.453
170 HN1 GPN 14 H1 PGU 14 0.786 -6.454 -1.223
171 1HN2 GPN 14 H21 PGU 14 2.180 -6.451 0.504
172 2HN2 GPN 14 H22 PGU 14 3.859 -5.979 0.355
173 1H1' TPN 15 HN PTH 15 8.740 -7.661 -4.070
174 1H2' TPN 15 HD1 PTH 15 9.265 -9.363 -1.718
175 2H2' TPN 15 HD2 PTH 15 8.261 -9.828 -3.114
176 1H3' TPN 15 HG1 PTH 15 6.561 -8.116 -1.850
177 2H3' TPN 15 HG2 PTH 15 7.439 -8.758 -0.441
178 1H5' TPN 15 HA21 PTH 15 7.874 -11.269 -0.552
179 2H5' TPN 15 HA22 PTH 15 7.209 -12.098 -1.959
180 1H8' TPN 15 HB1 PTH 15 5.224 -8.230 -2.907
181 2H8' TPN 15 HB2 PTH 15 4.208 -8.364 -1.474
182 H6 TPN 15 H6 PTH 15 4.396 -8.432 -4.986
183 HN3 TPN 15 H3 PTH 15 0.097 -9.412 -3.091
184 1HM5 TPN 15 H51 PTH 15 1.602 -8.706 -7.421
185 2HM5 TPN 15 H52 PTH 15 3.345 -9.029 -7.270
186 3HM5 TPN 15 H53 PTH 15 2.725 -7.376 -7.049
187 1H1' CPN 16 HN PCY 16 4.615 -10.931 0.016
188 1H2' CPN 16 HD1 PCY 16 3.143 -12.232 1.385
189 2H2' CPN 16 HD2 PCY 16 4.574 -13.040 2.077
190 1H3' CPN 16 HG1 PCY 16 4.316 -14.880 0.752
191 2H3' CPN 16 HG2 PCY 16 3.867 -13.914 -0.670
192 1H5' CPN 16 HA21 PCY 16 0.960 -15.237 2.055
193 2H5' CPN 16 HA22 PCY 16 2.674 -15.526 2.343
194 1H8' CPN 16 HB1 PCY 16 2.702 -12.622 -1.143
195 2H8' CPN 16 HB2 PCY 16 1.412 -11.670 -0.423
196 1HN4 CPN 16 H41 PCY 16 -1.927 -12.080 -5.874
197 2HN4 CPN 16 H42 PCY 16 -0.380 -12.040 -6.692
198 H5 CPN 16 H5 PCY 16 1.729 -12.104 -5.510
199 H6 CPN 16 H6 PCY 16 2.804 -12.444 -3.335
200 1HN NH2 17 HN3 PCY 16 2.156 -17.453 2.920
201 2HN NH2 17 HN4 PCY 16 2.579 -18.626 1.695
No H/Q in entry = 201
No H/Q in entry = 201
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