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- .gitattributes +50 -0
- 5j6n_ligand_8_577_dock/MCpath1.xyz +43 -0
- 5j6n_ligand_8_577_dock/MCpath10.xyz +42 -0
- 5j6n_ligand_8_577_dock/MCpath11.xyz +35 -0
- 5j6n_ligand_8_577_dock/MCpath12.xyz +59 -0
- 5j6n_ligand_8_577_dock/MCpath13.xyz +31 -0
- 5j6n_ligand_8_577_dock/MCpath14.xyz +45 -0
- 5j6n_ligand_8_577_dock/MCpath15.xyz +45 -0
- 5j6n_ligand_8_577_dock/MCpath16.xyz +57 -0
- 5j6n_ligand_8_577_dock/MCpath17.xyz +38 -0
- 5j6n_ligand_8_577_dock/MCpath18.xyz +147 -0
- 5j6n_ligand_8_577_dock/MCpath19.xyz +44 -0
- 5j6n_ligand_8_577_dock/MCpath2.xyz +107 -0
- 5j6n_ligand_8_577_dock/MCpath20.xyz +36 -0
- 5j6n_ligand_8_577_dock/MCpath21.xyz +86 -0
- 5j6n_ligand_8_577_dock/MCpath22.xyz +31 -0
- 5j6n_ligand_8_577_dock/MCpath23.xyz +56 -0
- 5j6n_ligand_8_577_dock/MCpath24.xyz +35 -0
- 5j6n_ligand_8_577_dock/MCpath25.xyz +56 -0
- 5j6n_ligand_8_577_dock/MCpath26.xyz +67 -0
- 5j6n_ligand_8_577_dock/MCpath27.xyz +94 -0
- 5j6n_ligand_8_577_dock/MCpath28.xyz +52 -0
- 5j6n_ligand_8_577_dock/MCpath29.xyz +45 -0
- 5j6n_ligand_8_577_dock/MCpath3.xyz +36 -0
- 5j6n_ligand_8_577_dock/MCpath30.xyz +66 -0
- 5j6n_ligand_8_577_dock/MCpath31.xyz +45 -0
- 5j6n_ligand_8_577_dock/MCpath32.xyz +46 -0
- 5j6n_ligand_8_577_dock/MCpath33.xyz +45 -0
- 5j6n_ligand_8_577_dock/MCpath34.xyz +135 -0
- 5j6n_ligand_8_577_dock/MCpath35.xyz +63 -0
- 5j6n_ligand_8_577_dock/MCpath36.xyz +39 -0
- 5j6n_ligand_8_577_dock/MCpath37.xyz +34 -0
- 5j6n_ligand_8_577_dock/MCpath38.xyz +34 -0
- 5j6n_ligand_8_577_dock/MCpath39.xyz +49 -0
- 5j6n_ligand_8_577_dock/MCpath4.xyz +54 -0
- 5j6n_ligand_8_577_dock/MCpath40.xyz +53 -0
- 5j6n_ligand_8_577_dock/MCpath41.xyz +42 -0
- 5j6n_ligand_8_577_dock/MCpath42.xyz +85 -0
- 5j6n_ligand_8_577_dock/MCpath43.xyz +61 -0
- 5j6n_ligand_8_577_dock/MCpath44.xyz +64 -0
- 5j6n_ligand_8_577_dock/MCpath45.xyz +40 -0
- 5j6n_ligand_8_577_dock/MCpath46.xyz +57 -0
- 5j6n_ligand_8_577_dock/MCpath47.xyz +53 -0
- 5j6n_ligand_8_577_dock/MCpath48.xyz +70 -0
- 5j6n_ligand_8_577_dock/MCpath49.xyz +54 -0
- 5j6n_ligand_8_577_dock/MCpath5.xyz +51 -0
- 5j6n_ligand_8_577_dock/MCpath50.xyz +62 -0
- 5j6n_ligand_8_577_dock/MCpath6.xyz +41 -0
- 5j6n_ligand_8_577_dock/MCpath7.xyz +58 -0
- 5j6n_ligand_8_577_dock/MCpath8.xyz +75 -0
.gitattributes
CHANGED
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| 4520 |
5eqy_ligand_70_209_dock2/Pro_lig8.h5md filter=lfs diff=lfs merge=lfs -text
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5eqy_ligand_70_209_dock2/Pro_lig9.h5md filter=lfs diff=lfs merge=lfs -text
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5eqy_ligand_70_209_dock2/system.pdb filter=lfs diff=lfs merge=lfs -text
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5eqy_ligand_70_209_dock2/Pro_lig8.h5md filter=lfs diff=lfs merge=lfs -text
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5eqy_ligand_70_209_dock2/Pro_lig9.h5md filter=lfs diff=lfs merge=lfs -text
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5eqy_ligand_70_209_dock2/system.pdb filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig1.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig10.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig11.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig12.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig13.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig14.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig15.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig16.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig17.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig19.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig2.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig20.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig21.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig22.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig23.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig24.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig26.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig27.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig28.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig29.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig3.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig30.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig31.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig32.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig33.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig34.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig35.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig36.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig4.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig40.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig42.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig44.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig45.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig46.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig47.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig48.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig49.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig5.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig50.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig6.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig7.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig8.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/Pro_lig9.h5md filter=lfs diff=lfs merge=lfs -text
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5j6n_ligand_8_577_dock/MCpath1.xyz
ADDED
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5j6n_ligand_8_577_dock/MCpath10.xyz
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S 52.7918 72.5971 53.5464
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S 52.8121 72.6680 53.5077
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S 52.6671 72.7879 53.4708
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5j6n_ligand_8_577_dock/MCpath11.xyz
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S 52.5844 71.6682 53.0710
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| 10 |
+
S 52.4295 71.8828 53.2074
|
| 11 |
+
S 52.4341 71.9593 53.2712
|
| 12 |
+
S 52.4899 71.9629 53.2844
|
| 13 |
+
S 52.5371 71.9047 53.3275
|
| 14 |
+
S 52.5392 71.9041 53.3650
|
| 15 |
+
S 52.5705 71.9372 53.3756
|
| 16 |
+
S 52.5584 71.9726 53.3453
|
| 17 |
+
S 52.5933 72.0269 53.3061
|
| 18 |
+
S 52.5602 72.1456 53.2686
|
| 19 |
+
S 52.6370 72.2158 53.3181
|
| 20 |
+
S 52.6993 72.2462 53.4349
|
| 21 |
+
S 52.6868 72.2383 53.5572
|
| 22 |
+
S 52.6439 72.2824 53.6864
|
| 23 |
+
S 52.5768 72.3021 53.7915
|
| 24 |
+
S 52.5133 72.2862 53.8177
|
| 25 |
+
S 52.4796 72.3043 53.8542
|
| 26 |
+
S 52.4257 72.3418 53.8907
|
| 27 |
+
S 52.4528 72.4024 53.7977
|
| 28 |
+
S 52.4199 72.4837 53.6732
|
| 29 |
+
S 52.3593 72.4948 53.5042
|
| 30 |
+
S 52.3894 72.3928 53.3492
|
| 31 |
+
S 52.3960 72.3488 53.1808
|
| 32 |
+
S 52.4484 72.3662 53.1485
|
| 33 |
+
S 52.4971 72.3884 53.2592
|
| 34 |
+
S 52.6045 72.5290 53.3825
|
| 35 |
+
S 52.6552 72.7597 53.4677
|
5j6n_ligand_8_577_dock/MCpath12.xyz
ADDED
|
@@ -0,0 +1,59 @@
|
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|
| 1 |
+
57
|
| 2 |
+
57
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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S 52.4125 71.8525 53.3746
|
| 7 |
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S 52.4182 71.8735 53.4422
|
| 8 |
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S 52.4374 71.8708 53.5427
|
| 9 |
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S 52.5249 71.8910 53.6004
|
| 10 |
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S 52.5627 71.9275 53.5951
|
| 11 |
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S 52.5816 71.9647 53.5679
|
| 12 |
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S 52.6129 72.0379 53.5535
|
| 13 |
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S 52.6164 72.0719 53.5321
|
| 14 |
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S 52.6875 72.0737 53.4448
|
| 15 |
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S 52.8275 72.1252 53.3253
|
| 16 |
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S 52.8485 72.1441 53.2376
|
| 17 |
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S 52.7791 72.1830 53.1283
|
| 18 |
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S 52.7234 72.1704 53.0742
|
| 19 |
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S 52.7704 72.1761 53.1109
|
| 20 |
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S 52.7287 72.1873 53.2150
|
| 21 |
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S 52.6359 72.1744 53.4321
|
| 22 |
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S 52.4943 72.2142 53.6284
|
| 23 |
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S 52.3459 72.3070 53.8448
|
| 24 |
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S 52.2397 72.3397 53.9095
|
| 25 |
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S 52.2208 72.2980 53.8580
|
| 26 |
+
S 52.1912 72.2336 53.7601
|
| 27 |
+
S 52.2339 72.2469 53.6217
|
| 28 |
+
S 52.2983 72.3275 53.5120
|
| 29 |
+
S 52.2968 72.3436 53.4624
|
| 30 |
+
S 52.2582 72.3251 53.4500
|
| 31 |
+
S 52.2505 72.3119 53.3870
|
| 32 |
+
S 52.3390 72.2511 53.3880
|
| 33 |
+
S 52.4538 72.2208 53.3414
|
| 34 |
+
S 52.4894 72.1607 53.3576
|
| 35 |
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S 52.4347 72.1293 53.4216
|
| 36 |
+
S 52.4174 72.2297 53.4359
|
| 37 |
+
S 52.3978 72.3660 53.3727
|
| 38 |
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S 52.3607 72.4472 53.4635
|
| 39 |
+
S 52.3883 72.4904 53.4924
|
| 40 |
+
S 52.4127 72.6117 53.4648
|
| 41 |
+
S 52.3183 72.6218 53.4060
|
| 42 |
+
S 52.3457 72.5667 53.2721
|
| 43 |
+
S 52.4731 72.5100 53.1847
|
| 44 |
+
S 52.5400 72.5013 53.1797
|
| 45 |
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S 52.5285 72.4529 53.2904
|
| 46 |
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S 52.4773 72.4600 53.4227
|
| 47 |
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S 52.4238 72.4926 53.5942
|
| 48 |
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S 52.4749 72.4755 53.6594
|
| 49 |
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S 52.4666 72.4845 53.7169
|
| 50 |
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S 52.4815 72.5316 53.6795
|
| 51 |
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S 52.5211 72.5844 53.6596
|
| 52 |
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S 52.5251 72.5686 53.6164
|
| 53 |
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S 52.5732 72.5453 53.5650
|
| 54 |
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S 52.6167 72.5559 53.6178
|
| 55 |
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S 52.5637 72.6245 53.7221
|
| 56 |
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S 52.5009 72.6459 53.7181
|
| 57 |
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S 52.4669 72.6479 53.6192
|
| 58 |
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S 52.4426 72.6679 53.6098
|
| 59 |
+
S 52.4655 72.7631 53.5110
|
5j6n_ligand_8_577_dock/MCpath13.xyz
ADDED
|
@@ -0,0 +1,31 @@
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|
| 1 |
+
29
|
| 2 |
+
29
|
| 3 |
+
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|
| 4 |
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S 52.5418 71.9533 53.1934
|
| 5 |
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S 52.5999 71.9279 53.2339
|
| 6 |
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S 52.6141 71.9804 53.2744
|
| 7 |
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S 52.6012 72.0420 53.3680
|
| 8 |
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S 52.6324 72.0461 53.4096
|
| 9 |
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S 52.6583 72.0607 53.4011
|
| 10 |
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S 52.6698 72.0583 53.4269
|
| 11 |
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S 52.6550 72.0281 53.4516
|
| 12 |
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|
| 13 |
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S 52.4110 71.8398 53.3191
|
| 14 |
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S 52.3363 71.7689 53.2674
|
| 15 |
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S 52.2709 71.8100 53.2581
|
| 16 |
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S 52.2145 71.8872 53.3135
|
| 17 |
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S 52.1914 71.8689 53.3457
|
| 18 |
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S 52.2168 71.8180 53.3734
|
| 19 |
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S 52.2377 71.8433 53.4413
|
| 20 |
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S 52.1731 71.9582 53.4470
|
| 21 |
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S 52.2244 72.0864 53.4364
|
| 22 |
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S 52.3838 72.0889 53.3857
|
| 23 |
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S 52.5151 72.0389 53.3510
|
| 24 |
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S 52.5628 72.0399 53.3948
|
| 25 |
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S 52.6195 72.0885 53.4021
|
| 26 |
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S 52.6280 72.1674 53.4879
|
| 27 |
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S 52.5833 72.2617 53.5219
|
| 28 |
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S 52.5177 72.4270 53.5439
|
| 29 |
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S 52.4339 72.5798 53.5309
|
| 30 |
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S 52.5434 72.6516 53.4617
|
| 31 |
+
S 52.6333 72.7226 53.3518
|
5j6n_ligand_8_577_dock/MCpath14.xyz
ADDED
|
@@ -0,0 +1,45 @@
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|
| 1 |
+
43
|
| 2 |
+
43
|
| 3 |
+
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|
| 4 |
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|
| 5 |
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|
| 6 |
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S 52.3059 71.7227 53.3762
|
| 7 |
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|
| 8 |
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S 52.2970 71.8066 53.4143
|
| 9 |
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S 52.2690 71.8257 53.4604
|
| 10 |
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S 52.2204 71.8348 53.5156
|
| 11 |
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S 52.2608 71.8662 53.5043
|
| 12 |
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S 52.3757 71.8327 53.4160
|
| 13 |
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S 52.4416 71.8677 53.3788
|
| 14 |
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S 52.3785 71.9261 53.3272
|
| 15 |
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S 52.2791 72.0411 53.2674
|
| 16 |
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S 52.3037 72.0446 53.1565
|
| 17 |
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S 52.3694 72.0595 53.0971
|
| 18 |
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S 52.4218 72.1557 53.1189
|
| 19 |
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S 52.5167 72.2798 53.1433
|
| 20 |
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S 52.5671 72.3400 53.2454
|
| 21 |
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S 52.6482 72.4222 53.3188
|
| 22 |
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S 52.6500 72.4454 53.3918
|
| 23 |
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S 52.6835 72.4623 53.4593
|
| 24 |
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S 52.6758 72.4310 53.5104
|
| 25 |
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S 52.7007 72.4426 53.5001
|
| 26 |
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S 52.7794 72.4021 53.4690
|
| 27 |
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S 52.8289 72.3471 53.4358
|
| 28 |
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S 52.7739 72.4071 53.4598
|
| 29 |
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S 52.7466 72.4266 53.4725
|
| 30 |
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S 52.7112 72.3789 53.4679
|
| 31 |
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S 52.6339 72.2543 53.3773
|
| 32 |
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S 52.5619 72.1241 53.2782
|
| 33 |
+
S 52.5471 72.0935 53.2338
|
| 34 |
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S 52.4432 72.1086 53.2320
|
| 35 |
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S 52.4516 72.1738 53.1778
|
| 36 |
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S 52.4598 72.2652 53.1057
|
| 37 |
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S 52.4676 72.3187 53.0710
|
| 38 |
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S 52.5892 72.3891 53.0700
|
| 39 |
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S 52.6654 72.4486 53.1468
|
| 40 |
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S 52.6837 72.4786 53.3037
|
| 41 |
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S 52.7002 72.4849 53.4889
|
| 42 |
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S 52.7144 72.5405 53.5853
|
| 43 |
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S 52.7267 72.5603 53.5501
|
| 44 |
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S 52.7625 72.6365 53.5698
|
| 45 |
+
S 52.7260 72.7101 53.6282
|
5j6n_ligand_8_577_dock/MCpath15.xyz
ADDED
|
@@ -0,0 +1,45 @@
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|
| 1 |
+
43
|
| 2 |
+
43
|
| 3 |
+
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|
| 4 |
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|
| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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S 52.4806 71.5094 53.3460
|
| 9 |
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S 52.5986 71.4227 53.3915
|
| 10 |
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S 52.6843 71.3586 53.4194
|
| 11 |
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S 52.7101 71.4222 53.3848
|
| 12 |
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S 52.6454 71.6174 53.3837
|
| 13 |
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S 52.5671 71.7195 53.4292
|
| 14 |
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S 52.5300 71.8022 53.4385
|
| 15 |
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S 52.5124 71.8556 53.4710
|
| 16 |
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S 52.5110 71.9917 53.5545
|
| 17 |
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S 52.6135 72.1308 53.5992
|
| 18 |
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S 52.6593 72.1337 53.6058
|
| 19 |
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S 52.7298 72.1284 53.5540
|
| 20 |
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S 52.7286 72.2080 53.3621
|
| 21 |
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S 52.5926 72.2637 53.2560
|
| 22 |
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S 52.4432 72.3571 53.2902
|
| 23 |
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S 52.3331 72.4766 53.2856
|
| 24 |
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S 52.3894 72.5040 53.3724
|
| 25 |
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S 52.4059 72.4872 53.5372
|
| 26 |
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S 52.3560 72.4977 53.5776
|
| 27 |
+
S 52.3235 72.5445 53.5415
|
| 28 |
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S 52.2614 72.4467 53.5150
|
| 29 |
+
S 52.2836 72.3711 53.4718
|
| 30 |
+
S 52.3807 72.3274 53.4646
|
| 31 |
+
S 52.4461 72.2744 53.5028
|
| 32 |
+
S 52.4334 72.2608 53.4988
|
| 33 |
+
S 52.4104 72.2479 53.4943
|
| 34 |
+
S 52.3592 72.2540 53.5418
|
| 35 |
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S 52.2516 72.2607 53.5913
|
| 36 |
+
S 52.2508 72.3004 53.6001
|
| 37 |
+
S 52.2455 72.3452 53.4964
|
| 38 |
+
S 52.2500 72.3186 53.4550
|
| 39 |
+
S 52.2988 72.2675 53.4695
|
| 40 |
+
S 52.4345 72.2989 53.4665
|
| 41 |
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S 52.5527 72.3969 53.5111
|
| 42 |
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S 52.6864 72.4886 53.5477
|
| 43 |
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S 52.8284 72.5142 53.5565
|
| 44 |
+
S 52.8358 72.6299 53.5736
|
| 45 |
+
S 52.7945 72.7442 53.5741
|
5j6n_ligand_8_577_dock/MCpath16.xyz
ADDED
|
@@ -0,0 +1,57 @@
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|
| 1 |
+
55
|
| 2 |
+
55
|
| 3 |
+
S 52.5358 71.8867 53.3893
|
| 4 |
+
S 52.4311 71.8448 53.4453
|
| 5 |
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S 52.3458 71.7512 53.4905
|
| 6 |
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S 52.2776 71.6403 53.5352
|
| 7 |
+
S 52.2050 71.5413 53.5873
|
| 8 |
+
S 52.2143 71.4268 53.5535
|
| 9 |
+
S 52.2386 71.3497 53.5531
|
| 10 |
+
S 52.2899 71.3850 53.5656
|
| 11 |
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S 52.2970 71.3829 53.5922
|
| 12 |
+
S 52.2672 71.3409 53.5179
|
| 13 |
+
S 52.2822 71.3576 53.4763
|
| 14 |
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S 52.3183 71.4065 53.4245
|
| 15 |
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S 52.3418 71.4505 53.3718
|
| 16 |
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S 52.3557 71.4088 53.3680
|
| 17 |
+
S 52.4026 71.2717 53.3251
|
| 18 |
+
S 52.4483 71.2783 53.3301
|
| 19 |
+
S 52.4695 71.3241 53.3080
|
| 20 |
+
S 52.3946 71.3366 53.3295
|
| 21 |
+
S 52.3609 71.4240 53.4300
|
| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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| 30 |
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| 31 |
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| 32 |
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| 33 |
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| 34 |
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| 35 |
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| 36 |
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| 37 |
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| 38 |
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| 39 |
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| 48 |
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| 49 |
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| 50 |
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5j6n_ligand_8_577_dock/MCpath17.xyz
ADDED
|
@@ -0,0 +1,38 @@
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| 38 |
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5j6n_ligand_8_577_dock/MCpath18.xyz
ADDED
|
@@ -0,0 +1,147 @@
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| 1 |
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145
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| 2 |
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145
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| 147 |
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5j6n_ligand_8_577_dock/MCpath19.xyz
ADDED
|
@@ -0,0 +1,44 @@
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|
| 1 |
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42
|
| 2 |
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42
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| 3 |
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| 12 |
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S 52.5288 71.6406 53.3552
|
| 13 |
+
S 52.5166 71.7952 53.3766
|
| 14 |
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S 52.5381 71.9575 53.2729
|
| 15 |
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S 52.5565 72.0308 53.2450
|
| 16 |
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S 52.5777 71.9998 53.2778
|
| 17 |
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S 52.5617 71.9726 53.3412
|
| 18 |
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S 52.5414 72.0089 53.4225
|
| 19 |
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S 52.5981 72.0538 53.4747
|
| 20 |
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S 52.5832 72.1089 53.5200
|
| 21 |
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S 52.5694 72.1764 53.4402
|
| 22 |
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S 52.5704 72.2152 53.3708
|
| 23 |
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S 52.6607 72.2421 53.3783
|
| 24 |
+
S 52.7629 72.2083 53.3576
|
| 25 |
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S 52.7350 72.1745 53.3655
|
| 26 |
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S 52.7080 72.2398 53.3903
|
| 27 |
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S 52.6455 72.2760 53.4288
|
| 28 |
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S 52.5557 72.2734 53.3928
|
| 29 |
+
S 52.4753 72.2068 53.3745
|
| 30 |
+
S 52.3652 72.2076 53.3577
|
| 31 |
+
S 52.4243 72.3009 53.3638
|
| 32 |
+
S 52.4787 72.4095 53.3790
|
| 33 |
+
S 52.5216 72.3020 53.4122
|
| 34 |
+
S 52.5413 72.2863 53.4509
|
| 35 |
+
S 52.4445 72.2564 53.4358
|
| 36 |
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S 52.3672 72.1606 53.4524
|
| 37 |
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S 52.2911 72.0715 53.5079
|
| 38 |
+
S 52.1952 72.1312 53.5166
|
| 39 |
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S 52.2575 72.2081 53.5266
|
| 40 |
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S 52.3950 72.3222 53.5667
|
| 41 |
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S 52.5268 72.4682 53.5374
|
| 42 |
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S 52.5749 72.5345 53.5523
|
| 43 |
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S 52.7447 72.6493 53.5583
|
| 44 |
+
S 52.7682 72.7688 53.5524
|
5j6n_ligand_8_577_dock/MCpath2.xyz
ADDED
|
@@ -0,0 +1,107 @@
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| 1 |
+
105
|
| 2 |
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105
|
| 3 |
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| 4 |
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| 5 |
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| 6 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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|
| 11 |
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| 12 |
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|
| 13 |
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| 14 |
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| 15 |
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| 16 |
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| 17 |
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| 18 |
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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| 30 |
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| 31 |
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| 32 |
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| 33 |
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| 34 |
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| 35 |
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| 36 |
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| 37 |
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| 38 |
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| 39 |
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| 40 |
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| 41 |
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| 42 |
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| 43 |
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| 44 |
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| 45 |
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| 46 |
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| 47 |
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| 48 |
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| 49 |
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| 50 |
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| 51 |
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| 52 |
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| 53 |
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| 54 |
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| 55 |
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| 56 |
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| 57 |
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| 58 |
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| 59 |
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| 60 |
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| 61 |
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| 62 |
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| 63 |
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| 64 |
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| 65 |
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|
| 66 |
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| 67 |
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| 68 |
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| 69 |
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S 52.4222 72.4788 53.6911
|
| 70 |
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| 71 |
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| 72 |
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|
| 73 |
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|
| 74 |
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|
| 75 |
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|
| 76 |
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| 77 |
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| 78 |
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| 79 |
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| 80 |
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S 52.6587 72.6609 53.6579
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| 81 |
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S 52.6199 72.6246 53.6444
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| 82 |
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S 52.5639 72.5934 53.5883
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| 83 |
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S 52.4956 72.5970 53.5776
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| 84 |
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| 85 |
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S 52.4693 72.5724 53.4635
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| 86 |
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| 87 |
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S 52.4112 72.5563 53.5048
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| 88 |
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| 89 |
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| 90 |
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| 91 |
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| 92 |
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S 52.4156 72.3179 53.6468
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| 93 |
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| 94 |
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| 95 |
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| 96 |
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| 97 |
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| 98 |
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| 99 |
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| 100 |
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| 101 |
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| 102 |
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| 103 |
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| 104 |
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| 105 |
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| 106 |
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| 107 |
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5j6n_ligand_8_577_dock/MCpath20.xyz
ADDED
|
@@ -0,0 +1,36 @@
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| 1 |
+
34
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| 2 |
+
34
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| 3 |
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| 4 |
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| 5 |
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| 6 |
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| 7 |
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| 8 |
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|
| 9 |
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| 10 |
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| 11 |
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| 12 |
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| 13 |
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| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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| 24 |
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|
| 25 |
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|
| 26 |
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| 27 |
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|
| 28 |
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|
| 29 |
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| 30 |
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|
| 31 |
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|
| 32 |
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| 33 |
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| 34 |
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| 35 |
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|
| 36 |
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|
5j6n_ligand_8_577_dock/MCpath21.xyz
ADDED
|
@@ -0,0 +1,86 @@
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|
| 1 |
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84
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| 2 |
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84
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| 3 |
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| 4 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 12 |
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|
| 13 |
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| 14 |
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S 52.5140 71.9654 53.2768
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| 15 |
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| 16 |
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| 17 |
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S 52.3600 71.8676 53.3983
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| 18 |
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|
| 19 |
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S 52.2452 71.8921 53.5297
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| 20 |
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S 52.1521 71.7895 53.4938
|
| 21 |
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|
| 22 |
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S 52.2314 71.8571 53.4776
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| 23 |
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S 52.2913 71.9956 53.5215
|
| 24 |
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S 52.3301 72.0725 53.5727
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| 25 |
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S 52.3245 72.1557 53.6806
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| 26 |
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S 52.3687 72.2976 53.7926
|
| 27 |
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S 52.4499 72.4537 53.6945
|
| 28 |
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S 52.5976 72.5139 53.5371
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| 29 |
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S 52.7774 72.5590 53.4527
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| 30 |
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S 52.9211 72.6124 53.2829
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| 31 |
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S 53.0895 72.6277 53.0708
|
| 32 |
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S 53.1947 72.5161 52.8958
|
| 33 |
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S 53.2036 72.3612 52.7517
|
| 34 |
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S 53.1813 72.1515 52.5396
|
| 35 |
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S 53.0873 72.1108 52.4628
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| 36 |
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S 52.9819 72.1639 52.5146
|
| 37 |
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S 53.0294 72.2587 52.5530
|
| 38 |
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S 53.0627 72.3332 52.6055
|
| 39 |
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S 53.1055 72.3703 52.6404
|
| 40 |
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S 53.2366 72.3991 52.6276
|
| 41 |
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S 53.3107 72.4718 52.5182
|
| 42 |
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S 53.3716 72.5409 52.4102
|
| 43 |
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S 53.4846 72.5749 52.3023
|
| 44 |
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S 53.5795 72.5399 52.1129
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| 45 |
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S 53.6474 72.5545 51.9525
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| 46 |
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S 53.6812 72.5584 51.8025
|
| 47 |
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S 53.7039 72.4835 51.5930
|
| 48 |
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S 53.5847 72.4082 51.4284
|
| 49 |
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S 53.4692 72.3353 51.4271
|
| 50 |
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S 53.2905 72.3279 51.4686
|
| 51 |
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S 53.1333 72.4034 51.5057
|
| 52 |
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S 53.0143 72.4439 51.5351
|
| 53 |
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S 52.9634 72.4286 51.5298
|
| 54 |
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S 53.0062 72.3786 51.5093
|
| 55 |
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S 53.0253 72.3309 51.5387
|
| 56 |
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S 53.0547 72.3186 51.4937
|
| 57 |
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S 53.1007 72.3019 51.4590
|
| 58 |
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S 53.1076 72.2308 51.3931
|
| 59 |
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S 53.1149 72.2362 51.3711
|
| 60 |
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|
| 61 |
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|
| 62 |
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|
| 63 |
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|
| 64 |
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|
| 65 |
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|
| 66 |
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|
| 67 |
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|
| 68 |
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|
| 69 |
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S 53.9432 72.2776 51.0926
|
| 70 |
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|
| 71 |
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S 54.1655 72.1383 51.3700
|
| 72 |
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| 73 |
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| 74 |
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| 75 |
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| 76 |
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| 77 |
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| 78 |
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| 79 |
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|
| 80 |
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|
| 81 |
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| 82 |
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| 83 |
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|
| 84 |
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| 85 |
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|
| 86 |
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5j6n_ligand_8_577_dock/MCpath22.xyz
ADDED
|
@@ -0,0 +1,31 @@
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|
| 1 |
+
29
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| 2 |
+
29
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| 3 |
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| 4 |
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| 5 |
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|
| 7 |
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| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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|
| 12 |
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|
| 13 |
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|
| 14 |
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S 52.3666 71.4560 53.6072
|
| 15 |
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S 52.4283 71.4625 53.6349
|
| 16 |
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S 52.5116 71.4754 53.5934
|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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| 24 |
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| 25 |
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|
| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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|
| 31 |
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|
5j6n_ligand_8_577_dock/MCpath23.xyz
ADDED
|
@@ -0,0 +1,56 @@
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| 1 |
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54
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| 2 |
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| 8 |
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| 15 |
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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|
| 25 |
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|
| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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|
| 39 |
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|
| 40 |
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|
| 41 |
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|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
| 50 |
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|
| 51 |
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| 52 |
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| 53 |
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| 54 |
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| 55 |
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|
| 56 |
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|
5j6n_ligand_8_577_dock/MCpath24.xyz
ADDED
|
@@ -0,0 +1,35 @@
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|
| 1 |
+
33
|
| 2 |
+
33
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| 3 |
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| 4 |
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| 5 |
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| 6 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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|
| 13 |
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|
| 14 |
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|
| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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| 30 |
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| 31 |
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| 32 |
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| 33 |
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|
| 34 |
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|
| 35 |
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|
5j6n_ligand_8_577_dock/MCpath25.xyz
ADDED
|
@@ -0,0 +1,56 @@
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| 1 |
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54
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| 2 |
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54
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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S 52.7660 72.5435 53.2868
|
| 39 |
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S 52.6559 72.5618 53.2734
|
| 40 |
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|
| 41 |
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S 52.6619 72.6030 53.4935
|
| 42 |
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S 52.6430 72.5501 53.5980
|
| 43 |
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S 52.5269 72.5076 53.6703
|
| 44 |
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S 52.3496 72.4947 53.6785
|
| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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S 52.4146 72.3780 53.3693
|
| 50 |
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|
| 51 |
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|
| 52 |
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|
| 53 |
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|
| 54 |
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|
| 55 |
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|
| 56 |
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|
5j6n_ligand_8_577_dock/MCpath26.xyz
ADDED
|
@@ -0,0 +1,67 @@
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|
| 1 |
+
65
|
| 2 |
+
65
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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|
| 12 |
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|
| 13 |
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|
| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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S 52.2624 72.2723 53.2265
|
| 19 |
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S 52.2887 72.3048 53.2639
|
| 20 |
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S 52.3719 72.2753 53.3019
|
| 21 |
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S 52.5118 72.2398 53.3165
|
| 22 |
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S 52.5753 72.2881 53.3394
|
| 23 |
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S 52.5960 72.3447 53.3209
|
| 24 |
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S 52.6335 72.3736 53.3013
|
| 25 |
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S 52.6948 72.3919 53.3230
|
| 26 |
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S 52.7579 72.4083 53.2298
|
| 27 |
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S 52.7295 72.3922 53.1868
|
| 28 |
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S 52.7163 72.3531 53.2463
|
| 29 |
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S 52.7536 72.3236 53.3104
|
| 30 |
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S 52.6525 72.3833 53.3470
|
| 31 |
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S 52.5109 72.3342 53.4414
|
| 32 |
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S 52.3781 72.2071 53.5068
|
| 33 |
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S 52.3140 72.1440 53.4915
|
| 34 |
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S 52.2247 72.0472 53.5489
|
| 35 |
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S 52.1547 72.0825 53.6028
|
| 36 |
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S 52.0455 72.2048 53.5689
|
| 37 |
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S 52.0633 72.2298 53.4432
|
| 38 |
+
S 52.1947 72.1922 53.3089
|
| 39 |
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S 52.2885 72.1632 53.2639
|
| 40 |
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S 52.3914 72.3214 53.2018
|
| 41 |
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S 52.4724 72.4630 53.1347
|
| 42 |
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S 52.4900 72.5215 53.2038
|
| 43 |
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S 52.4311 72.5354 53.3940
|
| 44 |
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S 52.4102 72.5837 53.4649
|
| 45 |
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S 52.4584 72.6181 53.5562
|
| 46 |
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S 52.5381 72.6646 53.6553
|
| 47 |
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S 52.5525 72.6061 53.7175
|
| 48 |
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S 52.4392 72.4964 53.7767
|
| 49 |
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S 52.3877 72.3758 53.8896
|
| 50 |
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S 52.4201 72.3829 53.8527
|
| 51 |
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S 52.4521 72.4541 53.7012
|
| 52 |
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S 52.4836 72.5446 53.5359
|
| 53 |
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S 52.5218 72.5564 53.4466
|
| 54 |
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S 52.4748 72.5545 53.3723
|
| 55 |
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S 52.3962 72.5128 53.3080
|
| 56 |
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S 52.3627 72.4241 53.3194
|
| 57 |
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S 52.3582 72.3537 53.3297
|
| 58 |
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S 52.2909 72.2849 53.3502
|
| 59 |
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|
| 60 |
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|
| 61 |
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S 52.2964 72.1548 53.5379
|
| 62 |
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S 52.2100 72.1927 53.5104
|
| 63 |
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S 52.2405 72.2208 53.5215
|
| 64 |
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S 52.3336 72.2980 53.5640
|
| 65 |
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S 52.4535 72.4719 53.5678
|
| 66 |
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|
| 67 |
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S 52.6075 72.9792 53.5101
|
5j6n_ligand_8_577_dock/MCpath27.xyz
ADDED
|
@@ -0,0 +1,94 @@
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| 1 |
+
92
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| 2 |
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92
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| 3 |
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| 4 |
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| 5 |
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| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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| 12 |
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| 13 |
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|
| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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S 52.5267 71.3300 53.6421
|
| 24 |
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|
| 25 |
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| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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S 52.1992 71.4900 53.2342
|
| 31 |
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S 52.2764 71.5560 53.3891
|
| 32 |
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S 52.3977 71.5927 53.4840
|
| 33 |
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S 52.5273 71.6095 53.4832
|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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S 52.6225 71.5637 53.6012
|
| 38 |
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|
| 39 |
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|
| 40 |
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|
| 41 |
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|
| 42 |
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| 43 |
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|
| 44 |
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| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
| 50 |
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| 51 |
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| 52 |
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|
| 53 |
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|
| 54 |
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|
| 55 |
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| 56 |
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| 57 |
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|
| 58 |
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|
| 59 |
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|
| 60 |
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|
| 61 |
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|
| 62 |
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|
| 63 |
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|
| 64 |
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|
| 65 |
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|
| 66 |
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|
| 67 |
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|
| 68 |
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|
| 69 |
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|
| 70 |
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|
| 71 |
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|
| 72 |
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|
| 73 |
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|
| 74 |
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|
| 75 |
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|
| 76 |
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|
| 77 |
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|
| 78 |
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|
| 79 |
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|
| 80 |
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|
| 81 |
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|
| 82 |
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|
| 83 |
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|
| 84 |
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|
| 85 |
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| 86 |
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|
| 87 |
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|
| 88 |
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|
| 89 |
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|
| 90 |
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|
| 91 |
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|
| 92 |
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S 53.8052 74.2810 54.3767
|
| 93 |
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|
| 94 |
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S 53.5545 74.8931 54.1204
|
5j6n_ligand_8_577_dock/MCpath28.xyz
ADDED
|
@@ -0,0 +1,52 @@
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| 1 |
+
50
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| 2 |
+
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| 3 |
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| 4 |
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| 6 |
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| 7 |
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|
| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 13 |
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| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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| 21 |
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|
| 22 |
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|
| 23 |
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|
| 24 |
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| 25 |
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|
| 26 |
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|
| 27 |
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S 52.9572 72.2711 53.6975
|
| 28 |
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|
| 29 |
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S 53.4350 72.2469 53.5573
|
| 30 |
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|
| 31 |
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|
| 32 |
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S 53.9144 72.2273 53.6769
|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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S 53.8241 72.1885 53.6365
|
| 38 |
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S 53.7320 72.2211 53.5535
|
| 39 |
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S 53.7073 72.2422 53.4534
|
| 40 |
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|
| 41 |
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|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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|
| 46 |
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|
| 47 |
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S 53.6480 72.2849 53.2974
|
| 48 |
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|
| 49 |
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S 53.3771 72.4507 53.1139
|
| 50 |
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|
| 51 |
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|
| 52 |
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|
5j6n_ligand_8_577_dock/MCpath29.xyz
ADDED
|
@@ -0,0 +1,45 @@
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| 1 |
+
43
|
| 2 |
+
43
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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S 52.4302 71.8836 53.1374
|
| 12 |
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|
| 13 |
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S 52.5123 71.8788 53.2344
|
| 14 |
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S 52.4628 71.9639 53.3083
|
| 15 |
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S 52.3884 72.1289 53.3190
|
| 16 |
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S 52.3831 72.2197 53.2999
|
| 17 |
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S 52.3640 72.3089 53.3610
|
| 18 |
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S 52.3842 72.4052 53.4284
|
| 19 |
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S 52.3890 72.3415 53.5256
|
| 20 |
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S 52.4411 72.2604 53.5689
|
| 21 |
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S 52.4235 72.3020 53.6196
|
| 22 |
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S 52.3989 72.3814 53.6263
|
| 23 |
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S 52.4345 72.4115 53.6038
|
| 24 |
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S 52.5001 72.3185 53.6108
|
| 25 |
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S 52.6288 72.1808 53.5503
|
| 26 |
+
S 52.6992 72.0990 53.4785
|
| 27 |
+
S 52.6527 72.1182 53.3751
|
| 28 |
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S 52.5031 72.1381 53.1943
|
| 29 |
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S 52.5130 72.2349 53.1023
|
| 30 |
+
S 52.4892 72.2834 53.1279
|
| 31 |
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S 52.4781 72.2350 53.2454
|
| 32 |
+
S 52.5472 72.2172 53.2856
|
| 33 |
+
S 52.5815 72.2684 53.3025
|
| 34 |
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S 52.5141 72.3943 53.3927
|
| 35 |
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S 52.4160 72.4666 53.4269
|
| 36 |
+
S 52.3892 72.4837 53.4377
|
| 37 |
+
S 52.4181 72.4886 53.4357
|
| 38 |
+
S 52.4514 72.5814 53.4639
|
| 39 |
+
S 52.5272 72.6240 53.4972
|
| 40 |
+
S 52.5479 72.6373 53.5234
|
| 41 |
+
S 52.5268 72.6572 53.4933
|
| 42 |
+
S 52.4928 72.6302 53.4532
|
| 43 |
+
S 52.4180 72.6422 53.3420
|
| 44 |
+
S 52.3299 72.6791 53.2525
|
| 45 |
+
S 52.3178 72.7936 53.2350
|
5j6n_ligand_8_577_dock/MCpath3.xyz
ADDED
|
@@ -0,0 +1,36 @@
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| 1 |
+
34
|
| 2 |
+
34
|
| 3 |
+
S 52.3492 71.9770 53.5405
|
| 4 |
+
S 52.3469 72.0574 53.5366
|
| 5 |
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S 52.4186 72.0882 53.5325
|
| 6 |
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S 52.4969 72.0901 53.5329
|
| 7 |
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S 52.5685 72.0537 53.5266
|
| 8 |
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S 52.6193 72.0072 53.5415
|
| 9 |
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S 52.6371 71.9201 53.5514
|
| 10 |
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S 52.6542 71.8707 53.5845
|
| 11 |
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S 52.5502 71.9219 53.6270
|
| 12 |
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S 52.5085 72.0438 53.6618
|
| 13 |
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S 52.5200 72.1793 53.5658
|
| 14 |
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S 52.4493 72.1959 53.5217
|
| 15 |
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S 52.3935 72.2230 53.5091
|
| 16 |
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S 52.3573 72.2063 53.4883
|
| 17 |
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S 52.3202 72.1520 53.4917
|
| 18 |
+
S 52.3148 72.0455 53.4006
|
| 19 |
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S 52.3449 71.9068 53.1900
|
| 20 |
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S 52.3423 71.9603 53.0485
|
| 21 |
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S 52.3216 72.1696 53.0179
|
| 22 |
+
S 52.4228 72.2721 53.0728
|
| 23 |
+
S 52.5393 72.2397 53.1287
|
| 24 |
+
S 52.5761 72.2686 53.1970
|
| 25 |
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S 52.6569 72.3779 53.2009
|
| 26 |
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S 52.6662 72.4398 53.2091
|
| 27 |
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S 52.5017 72.4069 53.2424
|
| 28 |
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S 52.3720 72.4043 53.2586
|
| 29 |
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S 52.3039 72.3570 53.1456
|
| 30 |
+
S 52.3009 72.3064 53.1440
|
| 31 |
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S 52.2738 72.2426 53.2399
|
| 32 |
+
S 52.2706 72.2397 53.3272
|
| 33 |
+
S 52.3063 72.2876 53.3437
|
| 34 |
+
S 52.3086 72.3506 53.3520
|
| 35 |
+
S 52.4248 72.5268 53.4524
|
| 36 |
+
S 52.5513 72.7183 53.5051
|
5j6n_ligand_8_577_dock/MCpath30.xyz
ADDED
|
@@ -0,0 +1,66 @@
|
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|
| 1 |
+
64
|
| 2 |
+
64
|
| 3 |
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|
| 4 |
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S 52.3906 71.8443 53.1414
|
| 5 |
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S 52.4006 71.8693 53.1257
|
| 6 |
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S 52.4329 71.8872 53.1789
|
| 7 |
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|
| 8 |
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|
| 9 |
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| 10 |
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|
| 11 |
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|
| 12 |
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|
| 13 |
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S 52.4609 71.9935 53.2442
|
| 14 |
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S 52.5841 72.0492 53.2040
|
| 15 |
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S 52.6973 72.0081 53.1823
|
| 16 |
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S 52.7088 71.9335 53.2329
|
| 17 |
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S 52.6956 71.8579 53.2668
|
| 18 |
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S 52.6495 71.8548 53.3534
|
| 19 |
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S 52.5003 71.9595 53.4070
|
| 20 |
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S 52.4011 72.0010 53.5175
|
| 21 |
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S 52.3091 72.0155 53.4967
|
| 22 |
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S 52.3045 72.0365 53.5390
|
| 23 |
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S 52.2911 72.0512 53.5832
|
| 24 |
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S 52.2715 72.2304 53.6187
|
| 25 |
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S 52.3780 72.3925 53.5577
|
| 26 |
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S 52.4520 72.5061 53.4627
|
| 27 |
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S 52.5531 72.4925 53.3877
|
| 28 |
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S 52.6028 72.5159 53.3718
|
| 29 |
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S 52.6229 72.4829 53.3696
|
| 30 |
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S 52.5428 72.4813 53.3609
|
| 31 |
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S 52.5863 72.4782 53.4273
|
| 32 |
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S 52.6086 72.4903 53.5256
|
| 33 |
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S 52.6561 72.4283 53.5867
|
| 34 |
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S 52.6794 72.3130 53.6615
|
| 35 |
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S 52.6575 72.3320 53.6030
|
| 36 |
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S 52.5819 72.3778 53.6021
|
| 37 |
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S 52.4657 72.3811 53.5491
|
| 38 |
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S 52.3821 72.3718 53.5352
|
| 39 |
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S 52.3401 72.3995 53.5989
|
| 40 |
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S 52.3511 72.4542 53.6715
|
| 41 |
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S 52.3737 72.4804 53.6526
|
| 42 |
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S 52.4090 72.4545 53.6454
|
| 43 |
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S 52.4166 72.4919 53.7044
|
| 44 |
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S 52.4916 72.5192 53.6973
|
| 45 |
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S 52.6080 72.4965 53.6725
|
| 46 |
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S 52.7454 72.4895 53.5921
|
| 47 |
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S 52.7745 72.4839 53.4286
|
| 48 |
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S 52.7437 72.5313 53.3434
|
| 49 |
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S 52.6578 72.5532 53.3350
|
| 50 |
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S 52.4732 72.5450 53.3134
|
| 51 |
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S 52.3819 72.5436 53.3792
|
| 52 |
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S 52.3603 72.5468 53.4154
|
| 53 |
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S 52.3760 72.5293 53.4809
|
| 54 |
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S 52.4846 72.5045 53.4873
|
| 55 |
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|
| 56 |
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|
| 57 |
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|
| 58 |
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|
| 59 |
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|
| 60 |
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|
| 61 |
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|
| 62 |
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|
| 63 |
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|
| 64 |
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S 52.4154 72.6407 53.2579
|
| 65 |
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S 52.3903 72.6717 53.2701
|
| 66 |
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S 52.4224 72.7392 53.2730
|
5j6n_ligand_8_577_dock/MCpath31.xyz
ADDED
|
@@ -0,0 +1,45 @@
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|
| 1 |
+
43
|
| 2 |
+
43
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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S 52.3528 71.9068 53.2030
|
| 7 |
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|
| 8 |
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|
| 9 |
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S 52.2899 71.9102 53.3831
|
| 10 |
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S 52.3434 71.8424 53.4932
|
| 11 |
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S 52.4057 71.8291 53.5050
|
| 12 |
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S 52.4692 71.8110 53.4289
|
| 13 |
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S 52.5405 71.8562 53.3653
|
| 14 |
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S 52.5258 71.8718 53.2769
|
| 15 |
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S 52.4884 71.9527 53.2044
|
| 16 |
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S 52.4208 71.9745 53.2170
|
| 17 |
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S 52.3751 71.9690 53.2946
|
| 18 |
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S 52.4394 72.0618 53.3811
|
| 19 |
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S 52.5010 72.1947 53.4090
|
| 20 |
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S 52.5251 72.2701 53.3712
|
| 21 |
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S 52.6275 72.2931 53.3646
|
| 22 |
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S 52.5871 72.2519 53.4186
|
| 23 |
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S 52.4803 72.1666 53.4303
|
| 24 |
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S 52.3535 72.1174 53.3725
|
| 25 |
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S 52.1350 72.1688 53.3417
|
| 26 |
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S 52.0663 72.1968 53.3326
|
| 27 |
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S 52.1157 72.2242 53.3830
|
| 28 |
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S 52.1409 72.2570 53.4508
|
| 29 |
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S 52.1796 72.3007 53.4890
|
| 30 |
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S 52.3528 72.2530 53.5013
|
| 31 |
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S 52.4816 72.3130 53.4311
|
| 32 |
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S 52.4719 72.4284 53.5037
|
| 33 |
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S 52.5334 72.5622 53.5312
|
| 34 |
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S 52.6598 72.5702 53.5065
|
| 35 |
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S 52.7463 72.5459 53.4289
|
| 36 |
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S 52.8031 72.5376 53.3039
|
| 37 |
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S 52.7752 72.4682 53.2353
|
| 38 |
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S 52.6559 72.4230 53.2455
|
| 39 |
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S 52.6036 72.4899 53.3886
|
| 40 |
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S 52.5993 72.5410 53.5787
|
| 41 |
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S 52.6571 72.5977 53.7116
|
| 42 |
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|
| 43 |
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|
| 44 |
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S 52.5445 72.6800 53.5836
|
| 45 |
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S 52.3670 72.7599 53.6048
|
5j6n_ligand_8_577_dock/MCpath32.xyz
ADDED
|
@@ -0,0 +1,46 @@
|
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|
| 1 |
+
44
|
| 2 |
+
44
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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S 52.3759 71.5298 53.3310
|
| 12 |
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S 52.4724 71.5833 53.3407
|
| 13 |
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S 52.5835 71.6174 53.3210
|
| 14 |
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S 52.6451 71.5776 53.3065
|
| 15 |
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S 52.6440 71.5243 53.3713
|
| 16 |
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S 52.4967 71.5338 53.4486
|
| 17 |
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S 52.4445 71.5177 53.4128
|
| 18 |
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S 52.3869 71.3916 53.3072
|
| 19 |
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S 52.3766 71.3328 53.3469
|
| 20 |
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S 52.4092 71.3164 53.4428
|
| 21 |
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S 52.4225 71.2893 53.4302
|
| 22 |
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S 52.4587 71.3327 53.4267
|
| 23 |
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S 52.4739 71.4824 53.4160
|
| 24 |
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S 52.5479 71.6232 53.2887
|
| 25 |
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S 52.5409 71.7393 53.2697
|
| 26 |
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S 52.4992 71.8603 53.3278
|
| 27 |
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S 52.5059 71.9937 53.3317
|
| 28 |
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S 52.5795 72.1717 53.3477
|
| 29 |
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S 52.6296 72.3759 53.3596
|
| 30 |
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S 52.6900 72.6127 53.3697
|
| 31 |
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S 52.6300 72.7432 53.3037
|
| 32 |
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S 52.5331 72.6885 53.2258
|
| 33 |
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S 52.4391 72.6145 53.2652
|
| 34 |
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S 52.4218 72.5190 53.2970
|
| 35 |
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S 52.4318 72.4637 53.2458
|
| 36 |
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S 52.4412 72.4228 53.1971
|
| 37 |
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S 52.3568 72.4438 53.2039
|
| 38 |
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S 52.3512 72.4670 53.1503
|
| 39 |
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S 52.3702 72.5189 53.0502
|
| 40 |
+
S 52.4852 72.5947 52.9834
|
| 41 |
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S 52.5587 72.6344 53.0578
|
| 42 |
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|
| 43 |
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|
| 44 |
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S 52.5551 72.6686 53.1511
|
| 45 |
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S 52.5649 72.6545 53.2495
|
| 46 |
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S 52.5584 72.7365 53.3185
|
5j6n_ligand_8_577_dock/MCpath33.xyz
ADDED
|
@@ -0,0 +1,45 @@
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|
| 1 |
+
43
|
| 2 |
+
43
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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S 52.4284 71.8818 53.4290
|
| 7 |
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|
| 8 |
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S 52.3599 71.7831 53.2499
|
| 9 |
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S 52.3187 71.7663 53.1831
|
| 10 |
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S 52.3319 71.8029 53.2152
|
| 11 |
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S 52.3916 71.8175 53.2213
|
| 12 |
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S 52.5350 71.7988 53.2335
|
| 13 |
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S 52.6412 71.8304 53.2593
|
| 14 |
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S 52.6204 71.8968 53.3101
|
| 15 |
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S 52.6390 71.9760 53.3344
|
| 16 |
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S 52.6166 71.9687 53.3391
|
| 17 |
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S 52.5307 71.9960 53.3128
|
| 18 |
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S 52.4843 72.0765 53.3109
|
| 19 |
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S 52.4520 72.1100 53.2835
|
| 20 |
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S 52.5087 72.1106 53.3267
|
| 21 |
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S 52.5447 72.2140 53.3696
|
| 22 |
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S 52.5383 72.3705 53.4224
|
| 23 |
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S 52.4455 72.4366 53.4363
|
| 24 |
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S 52.3895 72.5048 53.4030
|
| 25 |
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S 52.4068 72.5286 53.3514
|
| 26 |
+
S 52.5093 72.5723 53.4372
|
| 27 |
+
S 52.5424 72.4877 53.5781
|
| 28 |
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S 52.5601 72.4376 53.6285
|
| 29 |
+
S 52.5423 72.4739 53.5827
|
| 30 |
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S 52.5494 72.5547 53.4803
|
| 31 |
+
S 52.4664 72.5355 53.3766
|
| 32 |
+
S 52.3617 72.4659 53.4170
|
| 33 |
+
S 52.3906 72.3869 53.5290
|
| 34 |
+
S 52.4330 72.2354 53.6246
|
| 35 |
+
S 52.3891 72.1229 53.7233
|
| 36 |
+
S 52.3916 72.0710 53.7556
|
| 37 |
+
S 52.3957 71.9851 53.6696
|
| 38 |
+
S 52.4254 71.9017 53.4806
|
| 39 |
+
S 52.5122 71.9192 53.3906
|
| 40 |
+
S 52.5499 72.0655 53.3079
|
| 41 |
+
S 52.5529 72.1917 53.2694
|
| 42 |
+
S 52.5453 72.3058 53.3472
|
| 43 |
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S 52.5623 72.4410 53.5026
|
| 44 |
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S 52.6066 72.6068 53.6750
|
| 45 |
+
S 52.6064 72.7507 53.7363
|
5j6n_ligand_8_577_dock/MCpath34.xyz
ADDED
|
@@ -0,0 +1,135 @@
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| 1 |
+
133
|
| 2 |
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133
|
| 3 |
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|
| 4 |
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| 5 |
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| 6 |
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| 7 |
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| 8 |
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| 9 |
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|
| 10 |
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| 11 |
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| 12 |
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| 13 |
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|
| 14 |
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| 15 |
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|
| 16 |
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|
| 17 |
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| 18 |
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| 19 |
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S 52.4961 71.8889 53.3757
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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|
| 26 |
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|
| 27 |
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|
| 28 |
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S 53.1347 72.1947 53.4399
|
| 29 |
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S 53.1232 72.2288 53.3489
|
| 30 |
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S 53.1806 72.3462 53.2985
|
| 31 |
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S 53.2139 72.4108 53.3046
|
| 32 |
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S 53.1754 72.3239 53.3827
|
| 33 |
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S 53.1770 72.2557 53.4255
|
| 34 |
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S 53.2548 72.2123 53.5125
|
| 35 |
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|
| 36 |
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|
| 37 |
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S 53.5548 72.3241 53.8443
|
| 38 |
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|
| 39 |
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|
| 40 |
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|
| 41 |
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| 42 |
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| 43 |
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|
| 44 |
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|
| 45 |
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| 46 |
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S 53.5040 72.4447 54.3753
|
| 47 |
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| 48 |
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| 49 |
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| 50 |
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| 51 |
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| 52 |
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|
| 53 |
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|
| 54 |
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|
| 55 |
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|
| 56 |
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|
| 57 |
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|
| 58 |
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|
| 59 |
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|
| 60 |
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| 61 |
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| 62 |
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|
| 63 |
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|
| 64 |
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|
| 65 |
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|
| 66 |
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|
| 67 |
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|
| 68 |
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| 69 |
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| 70 |
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|
| 71 |
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| 72 |
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| 73 |
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|
| 74 |
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| 75 |
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| 76 |
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|
| 77 |
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| 78 |
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|
| 79 |
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|
| 80 |
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| 81 |
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| 82 |
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| 83 |
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| 84 |
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| 85 |
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| 86 |
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|
| 87 |
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| 88 |
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| 89 |
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| 90 |
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| 91 |
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| 92 |
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| 93 |
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| 94 |
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| 95 |
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| 96 |
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| 97 |
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| 98 |
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| 99 |
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| 100 |
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|
| 101 |
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| 102 |
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| 103 |
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| 104 |
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| 105 |
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| 106 |
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|
| 107 |
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| 108 |
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| 109 |
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| 110 |
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| 111 |
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| 112 |
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| 113 |
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| 114 |
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| 115 |
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|
| 116 |
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| 117 |
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| 118 |
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| 120 |
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| 121 |
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| 122 |
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| 123 |
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| 124 |
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| 125 |
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|
| 126 |
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|
| 127 |
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|
| 128 |
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|
| 129 |
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|
| 130 |
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|
| 131 |
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| 132 |
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| 133 |
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| 134 |
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|
| 135 |
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|
5j6n_ligand_8_577_dock/MCpath35.xyz
ADDED
|
@@ -0,0 +1,63 @@
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| 1 |
+
61
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| 2 |
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61
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| 3 |
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| 4 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 12 |
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| 13 |
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| 14 |
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| 15 |
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| 16 |
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| 17 |
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| 18 |
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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|
| 28 |
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S 52.4902 72.3889 53.8144
|
| 29 |
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S 52.4581 72.4605 53.7796
|
| 30 |
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S 52.4681 72.4792 53.6809
|
| 31 |
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S 52.4614 72.4677 53.6075
|
| 32 |
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S 52.4922 72.5004 53.5546
|
| 33 |
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S 52.5758 72.5051 53.5063
|
| 34 |
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S 52.6630 72.4936 53.5294
|
| 35 |
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S 52.6055 72.4095 53.4514
|
| 36 |
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|
| 37 |
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|
| 38 |
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S 52.3858 72.3356 53.2498
|
| 39 |
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S 52.3571 72.3427 53.2993
|
| 40 |
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S 52.3751 72.3147 53.4190
|
| 41 |
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S 52.3540 72.3425 53.5121
|
| 42 |
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S 52.2172 72.4194 53.5648
|
| 43 |
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| 44 |
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S 52.0420 72.5978 53.4161
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| 45 |
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| 46 |
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| 47 |
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|
| 48 |
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|
| 49 |
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| 50 |
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S 52.4558 72.2149 53.5847
|
| 51 |
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|
| 52 |
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|
| 53 |
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|
| 54 |
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|
| 55 |
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|
| 56 |
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|
| 57 |
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|
| 58 |
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|
| 59 |
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|
| 60 |
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|
| 61 |
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|
| 62 |
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S 52.4539 72.6224 53.3172
|
| 63 |
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S 52.4850 72.7529 53.4134
|
5j6n_ligand_8_577_dock/MCpath36.xyz
ADDED
|
@@ -0,0 +1,39 @@
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| 1 |
+
37
|
| 2 |
+
37
|
| 3 |
+
S 52.2724 71.7136 53.1579
|
| 4 |
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S 52.3786 71.7331 53.1479
|
| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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S 52.3194 71.8693 53.4466
|
| 11 |
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|
| 12 |
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|
| 13 |
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S 52.2164 71.7120 53.2655
|
| 14 |
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S 52.2129 71.6907 53.2098
|
| 15 |
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S 52.2466 71.6055 53.2085
|
| 16 |
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|
| 17 |
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S 52.3408 71.5410 53.3682
|
| 18 |
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|
| 19 |
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S 52.4041 71.5438 53.4750
|
| 20 |
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S 52.4395 71.4868 53.5764
|
| 21 |
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S 52.4722 71.5035 53.6360
|
| 22 |
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S 52.4492 71.4988 53.6052
|
| 23 |
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S 52.4595 71.4819 53.5152
|
| 24 |
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S 52.5469 71.5440 53.4653
|
| 25 |
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S 52.5694 71.6428 53.3966
|
| 26 |
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S 52.5150 71.6538 53.2755
|
| 27 |
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|
| 28 |
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S 52.4255 71.5439 53.1638
|
| 29 |
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|
| 30 |
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S 52.5622 71.5135 53.3448
|
| 31 |
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S 52.5952 71.4701 53.4219
|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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S 52.4782 72.4443 53.3439
|
| 39 |
+
S 52.5428 72.7692 53.3122
|
5j6n_ligand_8_577_dock/MCpath37.xyz
ADDED
|
@@ -0,0 +1,34 @@
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| 1 |
+
32
|
| 2 |
+
32
|
| 3 |
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|
| 4 |
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|
| 5 |
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|
| 6 |
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| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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|
| 12 |
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| 13 |
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| 14 |
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|
| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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S 52.5505 72.0250 53.5146
|
| 20 |
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|
| 21 |
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|
| 22 |
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| 23 |
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| 24 |
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| 25 |
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|
| 26 |
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| 27 |
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| 28 |
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| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
5j6n_ligand_8_577_dock/MCpath38.xyz
ADDED
|
@@ -0,0 +1,34 @@
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|
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|
| 1 |
+
32
|
| 2 |
+
32
|
| 3 |
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|
| 4 |
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| 5 |
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| 6 |
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| 7 |
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|
| 8 |
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|
| 9 |
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| 10 |
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| 12 |
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|
| 13 |
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|
| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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|
| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
5j6n_ligand_8_577_dock/MCpath39.xyz
ADDED
|
@@ -0,0 +1,49 @@
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|
| 1 |
+
47
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| 2 |
+
47
|
| 3 |
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| 4 |
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| 5 |
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| 8 |
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| 13 |
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| 14 |
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| 15 |
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| 16 |
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| 17 |
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| 18 |
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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| 34 |
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|
| 35 |
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| 36 |
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|
| 37 |
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|
| 38 |
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| 39 |
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|
| 40 |
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|
| 41 |
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| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
5j6n_ligand_8_577_dock/MCpath4.xyz
ADDED
|
@@ -0,0 +1,54 @@
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| 1 |
+
52
|
| 2 |
+
52
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| 3 |
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| 4 |
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| 8 |
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| 9 |
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| 10 |
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| 15 |
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| 17 |
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| 18 |
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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| 30 |
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| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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S 52.5080 72.6494 53.6783
|
| 39 |
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|
| 40 |
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S 52.5475 72.5923 53.4611
|
| 41 |
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|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
| 50 |
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|
| 51 |
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|
| 52 |
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|
| 53 |
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|
| 54 |
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|
5j6n_ligand_8_577_dock/MCpath40.xyz
ADDED
|
@@ -0,0 +1,53 @@
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|
| 1 |
+
51
|
| 2 |
+
51
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| 3 |
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| 4 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 13 |
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| 14 |
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| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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S 52.3691 72.2677 53.2769
|
| 20 |
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|
| 21 |
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S 52.2203 72.2213 53.2431
|
| 22 |
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S 52.2941 72.2860 53.2199
|
| 23 |
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S 52.4237 72.4061 53.1875
|
| 24 |
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S 52.5751 72.4626 53.1212
|
| 25 |
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S 52.6591 72.4190 53.1719
|
| 26 |
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S 52.6661 72.3878 53.3371
|
| 27 |
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S 52.5749 72.3949 53.5069
|
| 28 |
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S 52.5033 72.4215 53.6096
|
| 29 |
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|
| 30 |
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S 52.4625 72.3559 53.7443
|
| 31 |
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|
| 32 |
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S 52.4284 72.5362 53.6225
|
| 33 |
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S 52.3372 72.6074 53.4349
|
| 34 |
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|
| 35 |
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S 52.5254 72.6537 53.1330
|
| 36 |
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S 52.6788 72.6453 53.0944
|
| 37 |
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S 52.7112 72.6289 53.2073
|
| 38 |
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S 52.6301 72.5486 53.3881
|
| 39 |
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S 52.5979 72.5056 53.5174
|
| 40 |
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S 52.4769 72.5165 53.6472
|
| 41 |
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|
| 42 |
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|
| 43 |
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S 52.2270 72.3384 53.5007
|
| 44 |
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S 52.2477 72.2540 53.4878
|
| 45 |
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S 52.2737 72.3123 53.4894
|
| 46 |
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S 52.4145 72.4166 53.5604
|
| 47 |
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S 52.5219 72.4918 53.5336
|
| 48 |
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S 52.5794 72.3999 53.4701
|
| 49 |
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S 52.6098 72.3599 53.4200
|
| 50 |
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| 51 |
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S 52.5432 72.5025 53.4269
|
| 52 |
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|
| 53 |
+
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|
5j6n_ligand_8_577_dock/MCpath41.xyz
ADDED
|
@@ -0,0 +1,42 @@
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| 1 |
+
40
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| 2 |
+
40
|
| 3 |
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| 4 |
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| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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S 52.5301 71.8748 53.4217
|
| 11 |
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|
| 12 |
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S 52.6515 71.8977 53.4660
|
| 13 |
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S 52.6301 72.0431 53.4665
|
| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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S 52.2961 72.2361 53.4414
|
| 18 |
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|
| 19 |
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S 52.4575 72.1377 53.4005
|
| 20 |
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|
| 21 |
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S 52.5066 71.9996 53.2530
|
| 22 |
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S 52.4575 72.0411 53.3061
|
| 23 |
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S 52.4282 72.1263 53.3769
|
| 24 |
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S 52.4786 72.1793 53.4031
|
| 25 |
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S 52.4842 72.2677 53.3918
|
| 26 |
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S 52.3792 72.3407 53.4427
|
| 27 |
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S 52.3091 72.3663 53.4882
|
| 28 |
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S 52.3068 72.4337 53.4689
|
| 29 |
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S 52.2573 72.3940 53.4683
|
| 30 |
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S 52.2976 72.4709 53.4866
|
| 31 |
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S 52.4454 72.3996 53.5154
|
| 32 |
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S 52.5725 72.3033 53.5320
|
| 33 |
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S 52.5860 72.2851 53.5016
|
| 34 |
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S 52.4853 72.2781 53.5305
|
| 35 |
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S 52.4091 72.3291 53.5546
|
| 36 |
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S 52.4607 72.3550 53.5759
|
| 37 |
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S 52.5497 72.3522 53.5890
|
| 38 |
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S 52.6649 72.3342 53.6057
|
| 39 |
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S 52.6746 72.3336 53.6057
|
| 40 |
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S 52.6684 72.4947 53.5629
|
| 41 |
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S 52.6728 72.6455 53.5496
|
| 42 |
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S 52.6324 72.8635 53.5435
|
5j6n_ligand_8_577_dock/MCpath42.xyz
ADDED
|
@@ -0,0 +1,85 @@
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|
| 1 |
+
83
|
| 2 |
+
83
|
| 3 |
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S 52.3287 71.8371 53.1830
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| 4 |
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S 52.2814 71.8263 53.1910
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| 5 |
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|
| 6 |
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S 52.2776 71.8291 53.2176
|
| 7 |
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S 52.2681 71.9017 53.1848
|
| 8 |
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S 52.2600 71.7995 53.1448
|
| 9 |
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S 52.2663 71.6678 53.2255
|
| 10 |
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S 52.2483 71.5933 53.2598
|
| 11 |
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|
| 12 |
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S 52.2787 71.6172 53.3629
|
| 13 |
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|
| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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S 52.6340 71.4891 53.5348
|
| 18 |
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S 52.6530 71.4639 53.5486
|
| 19 |
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S 52.6135 71.4450 53.5259
|
| 20 |
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S 52.6240 71.4828 53.4907
|
| 21 |
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S 52.5601 71.5351 53.4399
|
| 22 |
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S 52.5659 71.5795 53.3914
|
| 23 |
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S 52.4762 71.6509 53.4526
|
| 24 |
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S 52.4880 71.6891 53.4938
|
| 25 |
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S 52.5610 71.6199 53.4161
|
| 26 |
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S 52.6094 71.4428 53.3205
|
| 27 |
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S 52.5961 71.4032 53.3603
|
| 28 |
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S 52.5320 71.4691 53.4136
|
| 29 |
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S 52.4712 71.4640 53.4700
|
| 30 |
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S 52.4483 71.4264 53.5864
|
| 31 |
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S 52.4530 71.3913 53.5817
|
| 32 |
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S 52.4450 71.4744 53.4269
|
| 33 |
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S 52.4592 71.5266 53.3474
|
| 34 |
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S 52.4798 71.5556 53.3837
|
| 35 |
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S 52.5239 71.5412 53.4731
|
| 36 |
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S 52.5367 71.5060 53.5949
|
| 37 |
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S 52.6041 71.4708 53.6072
|
| 38 |
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S 52.6734 71.4815 53.5763
|
| 39 |
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S 52.7707 71.4844 53.6163
|
| 40 |
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S 52.9048 71.4460 53.7109
|
| 41 |
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S 53.0152 71.3636 53.6413
|
| 42 |
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S 53.4435 71.3337 53.4230
|
| 43 |
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S 53.8431 71.4297 53.2703
|
| 44 |
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S 54.0234 71.4978 53.1568
|
| 45 |
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S 53.8942 71.5974 53.1472
|
| 46 |
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S 53.7067 71.7617 53.2561
|
| 47 |
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S 53.5890 71.9849 53.2911
|
| 48 |
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|
| 49 |
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|
| 50 |
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S 53.5922 72.4346 53.3843
|
| 51 |
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S 53.5549 72.6437 53.5003
|
| 52 |
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S 53.4981 72.8750 53.5947
|
| 53 |
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S 53.3900 72.9834 53.6299
|
| 54 |
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|
| 55 |
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|
| 56 |
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S 53.0029 72.6579 53.7649
|
| 57 |
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|
| 58 |
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| 59 |
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|
| 60 |
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|
| 61 |
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|
| 62 |
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|
| 63 |
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S 53.4955 72.7822 53.4599
|
| 64 |
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S 53.6280 72.9657 53.4472
|
| 65 |
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S 53.6420 72.9575 53.4122
|
| 66 |
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S 53.6020 72.9594 53.4894
|
| 67 |
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S 53.5664 73.1059 53.5193
|
| 68 |
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S 53.6420 73.2254 53.4815
|
| 69 |
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S 53.8597 73.3712 53.4643
|
| 70 |
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S 53.9931 73.5076 53.4692
|
| 71 |
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S 54.2035 73.5578 53.4329
|
| 72 |
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|
| 73 |
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|
| 74 |
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| 75 |
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|
| 76 |
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|
| 77 |
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|
| 78 |
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|
| 79 |
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|
| 80 |
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S 54.2745 74.0992 53.3124
|
| 81 |
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|
| 82 |
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|
| 83 |
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|
| 84 |
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|
| 85 |
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S 54.5031 74.6792 53.4116
|
5j6n_ligand_8_577_dock/MCpath43.xyz
ADDED
|
@@ -0,0 +1,61 @@
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|
| 1 |
+
59
|
| 2 |
+
59
|
| 3 |
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|
| 4 |
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| 5 |
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|
| 6 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 12 |
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| 13 |
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| 14 |
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|
| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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S 52.2748 71.5537 53.2898
|
| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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|
| 26 |
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S 52.5242 72.6277 53.3641
|
| 27 |
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S 52.5412 72.5839 53.3715
|
| 28 |
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S 52.5946 72.5253 53.4441
|
| 29 |
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S 52.5340 72.4103 53.5945
|
| 30 |
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S 52.4667 72.3335 53.7041
|
| 31 |
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S 52.4867 72.3720 53.5953
|
| 32 |
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S 52.5193 72.4851 53.4192
|
| 33 |
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S 52.5646 72.5432 53.2969
|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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S 52.8700 72.5592 53.4447
|
| 39 |
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S 52.9047 72.5546 53.4614
|
| 40 |
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S 52.7977 72.4529 53.4040
|
| 41 |
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S 52.7493 72.4047 53.3666
|
| 42 |
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S 52.7552 72.3924 53.3347
|
| 43 |
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S 52.6201 72.3277 53.3613
|
| 44 |
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S 52.4232 72.3152 53.4975
|
| 45 |
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S 52.2564 72.2871 53.6235
|
| 46 |
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S 52.1682 72.2711 53.7535
|
| 47 |
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S 52.2045 72.2900 53.8579
|
| 48 |
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S 52.2389 72.2758 53.8705
|
| 49 |
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S 52.2921 72.2500 53.7667
|
| 50 |
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S 52.3658 72.2041 53.5785
|
| 51 |
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S 52.4523 72.3045 53.5324
|
| 52 |
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|
| 53 |
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|
| 54 |
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|
| 55 |
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|
| 56 |
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|
| 57 |
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|
| 58 |
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|
| 59 |
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|
| 60 |
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|
| 61 |
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|
5j6n_ligand_8_577_dock/MCpath44.xyz
ADDED
|
@@ -0,0 +1,64 @@
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|
| 1 |
+
62
|
| 2 |
+
62
|
| 3 |
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S 52.5716 71.7839 53.5067
|
| 4 |
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S 52.5134 71.8122 53.3848
|
| 5 |
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S 52.4963 71.8824 53.3314
|
| 6 |
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S 52.4281 71.9623 53.3327
|
| 7 |
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S 52.4210 72.0196 53.3263
|
| 8 |
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S 52.3928 72.0049 53.3378
|
| 9 |
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S 52.3809 72.0993 53.4068
|
| 10 |
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S 52.4387 72.1070 53.5362
|
| 11 |
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S 52.5286 72.0823 53.5833
|
| 12 |
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S 52.5779 72.0587 53.6033
|
| 13 |
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S 52.5210 72.0139 53.5922
|
| 14 |
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S 52.4742 71.9653 53.4893
|
| 15 |
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S 52.4556 71.9267 53.4656
|
| 16 |
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S 52.4849 72.0129 53.4721
|
| 17 |
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S 52.4588 72.0528 53.4578
|
| 18 |
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S 52.4551 72.0119 53.4654
|
| 19 |
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S 52.5866 71.9514 53.4707
|
| 20 |
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S 52.6873 71.9872 53.5046
|
| 21 |
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S 52.7390 72.1015 53.5650
|
| 22 |
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S 52.6461 72.1449 53.5135
|
| 23 |
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S 52.4480 72.2124 53.4322
|
| 24 |
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S 52.3897 72.2854 53.3563
|
| 25 |
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S 52.4001 72.3446 53.3755
|
| 26 |
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S 52.3642 72.4093 53.5550
|
| 27 |
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S 52.4166 72.4314 53.6938
|
| 28 |
+
S 52.4148 72.3856 53.8024
|
| 29 |
+
S 52.5066 72.2858 53.8197
|
| 30 |
+
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|
| 31 |
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|
| 32 |
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S 52.4043 72.2454 53.5192
|
| 33 |
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S 52.4138 72.4035 53.3861
|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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S 52.8712 72.6904 53.3720
|
| 38 |
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S 53.0433 72.6909 53.4335
|
| 39 |
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S 53.3444 72.6635 53.4186
|
| 40 |
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S 53.6762 72.5991 53.4362
|
| 41 |
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S 53.9361 72.5363 53.4736
|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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| 49 |
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| 50 |
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| 51 |
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| 52 |
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| 53 |
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| 54 |
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|
| 55 |
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|
| 56 |
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|
| 57 |
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| 58 |
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|
| 59 |
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| 60 |
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| 61 |
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| 62 |
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| 63 |
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| 64 |
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|
5j6n_ligand_8_577_dock/MCpath45.xyz
ADDED
|
@@ -0,0 +1,40 @@
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|
| 1 |
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38
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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| 30 |
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| 32 |
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| 33 |
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| 34 |
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| 35 |
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| 36 |
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| 37 |
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| 38 |
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| 39 |
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| 40 |
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5j6n_ligand_8_577_dock/MCpath46.xyz
ADDED
|
@@ -0,0 +1,57 @@
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| 1 |
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| 25 |
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| 26 |
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| 27 |
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| 28 |
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| 29 |
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| 30 |
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| 31 |
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| 32 |
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| 33 |
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| 34 |
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| 35 |
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| 36 |
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| 37 |
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| 38 |
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| 39 |
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| 40 |
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| 41 |
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| 42 |
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| 43 |
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| 44 |
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| 45 |
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| 46 |
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| 47 |
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| 48 |
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| 49 |
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| 50 |
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| 51 |
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| 52 |
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| 53 |
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| 54 |
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| 55 |
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| 56 |
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| 57 |
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5j6n_ligand_8_577_dock/MCpath47.xyz
ADDED
|
@@ -0,0 +1,53 @@
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| 1 |
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51
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| 19 |
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| 20 |
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| 21 |
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| 22 |
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| 23 |
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| 24 |
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| 25 |
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| 27 |
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| 28 |
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|
| 29 |
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| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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| 39 |
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| 40 |
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| 41 |
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| 42 |
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| 43 |
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| 44 |
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| 45 |
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| 46 |
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| 47 |
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|
| 48 |
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| 49 |
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| 53 |
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5j6n_ligand_8_577_dock/MCpath48.xyz
ADDED
|
@@ -0,0 +1,70 @@
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|
| 1 |
+
68
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| 2 |
+
68
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| 3 |
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| 4 |
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| 5 |
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| 8 |
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| 9 |
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| 12 |
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| 13 |
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|
| 14 |
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| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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S 52.6073 71.7747 53.2912
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| 19 |
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| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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|
| 24 |
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S 52.6393 72.5042 53.3035
|
| 25 |
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|
| 26 |
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S 52.7772 72.4856 53.5295
|
| 27 |
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S 52.8405 72.4576 53.6099
|
| 28 |
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|
| 29 |
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S 52.7316 72.4713 53.6293
|
| 30 |
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S 52.6228 72.4009 53.5317
|
| 31 |
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S 52.4812 72.3489 53.5012
|
| 32 |
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S 52.3074 72.3224 53.4930
|
| 33 |
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S 52.2559 72.3668 53.5276
|
| 34 |
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|
| 35 |
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|
| 36 |
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S 52.3908 72.4498 53.3704
|
| 37 |
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S 52.4404 72.4839 53.2984
|
| 38 |
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S 52.5917 72.4351 53.2664
|
| 39 |
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S 52.6902 72.3176 53.3446
|
| 40 |
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S 52.7272 72.2589 53.4678
|
| 41 |
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S 52.7998 72.2378 53.5117
|
| 42 |
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S 52.8740 72.2163 53.4217
|
| 43 |
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S 52.7935 72.2572 53.2583
|
| 44 |
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S 52.6451 72.4117 53.1476
|
| 45 |
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S 52.5076 72.5713 53.1757
|
| 46 |
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S 52.4863 72.6175 53.2281
|
| 47 |
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S 52.4544 72.5784 53.2812
|
| 48 |
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S 52.5238 72.4896 53.2962
|
| 49 |
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S 52.5221 72.4020 53.4066
|
| 50 |
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S 52.4737 72.3479 53.5804
|
| 51 |
+
S 52.4409 72.3710 53.7088
|
| 52 |
+
S 52.4266 72.4113 53.7761
|
| 53 |
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S 52.3556 72.4451 53.8130
|
| 54 |
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S 52.3290 72.5595 53.8385
|
| 55 |
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S 52.3608 72.5235 53.7458
|
| 56 |
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S 52.4101 72.4490 53.7063
|
| 57 |
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S 52.4238 72.4335 53.7982
|
| 58 |
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S 52.4937 72.5652 53.8344
|
| 59 |
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S 52.5222 72.6132 53.8430
|
| 60 |
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|
| 61 |
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S 52.5470 72.8298 54.0476
|
| 62 |
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|
| 63 |
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|
| 64 |
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S 52.7678 73.0694 54.5759
|
| 65 |
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|
| 66 |
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|
| 67 |
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|
| 68 |
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S 52.7782 73.4034 54.9071
|
| 69 |
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|
| 70 |
+
S 52.8496 73.8079 54.9262
|
5j6n_ligand_8_577_dock/MCpath49.xyz
ADDED
|
@@ -0,0 +1,54 @@
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|
| 1 |
+
52
|
| 2 |
+
52
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| 3 |
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| 4 |
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| 5 |
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| 6 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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| 11 |
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| 12 |
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| 13 |
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| 14 |
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| 15 |
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| 16 |
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| 17 |
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|
| 18 |
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|
| 19 |
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S 52.3734 72.1342 52.8423
|
| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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|
| 24 |
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S 52.4632 72.1394 52.8419
|
| 25 |
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S 52.4582 72.0610 52.7789
|
| 26 |
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S 52.3919 72.0540 52.8238
|
| 27 |
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S 52.3590 72.1357 52.9367
|
| 28 |
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S 52.3826 72.2428 53.0356
|
| 29 |
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S 52.4811 72.3118 53.2360
|
| 30 |
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|
| 31 |
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S 52.6893 72.2786 53.5938
|
| 32 |
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S 52.5972 72.3414 53.7726
|
| 33 |
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S 52.5237 72.3313 53.8754
|
| 34 |
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S 52.5355 72.3389 53.8223
|
| 35 |
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|
| 36 |
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S 52.4229 72.5714 53.6578
|
| 37 |
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S 52.4571 72.6638 53.6174
|
| 38 |
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S 52.5414 72.6934 53.6432
|
| 39 |
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S 52.6667 72.6350 53.7163
|
| 40 |
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S 52.7138 72.5342 53.7683
|
| 41 |
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S 52.8019 72.4355 53.8293
|
| 42 |
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S 52.8187 72.3169 53.8568
|
| 43 |
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S 52.7510 72.2957 53.8154
|
| 44 |
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S 52.7418 72.3719 53.7787
|
| 45 |
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S 52.6758 72.4059 53.7199
|
| 46 |
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S 52.6130 72.4173 53.6589
|
| 47 |
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S 52.6323 72.3835 53.5956
|
| 48 |
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S 52.6577 72.3983 53.4578
|
| 49 |
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S 52.6587 72.4105 53.3449
|
| 50 |
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|
| 51 |
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|
| 52 |
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|
| 53 |
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|
| 54 |
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|
5j6n_ligand_8_577_dock/MCpath5.xyz
ADDED
|
@@ -0,0 +1,51 @@
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|
| 1 |
+
49
|
| 2 |
+
49
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| 3 |
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| 4 |
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| 7 |
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| 8 |
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| 9 |
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| 10 |
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| 13 |
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| 14 |
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| 15 |
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| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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| 21 |
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|
| 22 |
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|
| 23 |
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|
| 24 |
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|
| 25 |
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|
| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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S 52.6971 72.3224 53.4773
|
| 30 |
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S 52.7280 72.2692 53.4861
|
| 31 |
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S 52.6966 72.2854 53.5468
|
| 32 |
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S 52.6121 72.3538 53.6248
|
| 33 |
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S 52.5021 72.4123 53.6435
|
| 34 |
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S 52.4093 72.4113 53.6791
|
| 35 |
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|
| 36 |
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S 52.3534 72.5495 53.7156
|
| 37 |
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S 52.4095 72.6326 53.7669
|
| 38 |
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S 52.5445 72.6087 53.8299
|
| 39 |
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S 52.5405 72.5579 53.7614
|
| 40 |
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|
| 41 |
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|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
| 50 |
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|
| 51 |
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S 52.5961 72.7699 53.4631
|
5j6n_ligand_8_577_dock/MCpath50.xyz
ADDED
|
@@ -0,0 +1,62 @@
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| 1 |
+
60
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| 2 |
+
60
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| 6 |
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| 7 |
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| 8 |
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| 9 |
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| 12 |
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| 13 |
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| 14 |
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|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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|
| 21 |
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|
| 22 |
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|
| 23 |
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| 24 |
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| 25 |
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| 26 |
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|
| 27 |
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|
| 28 |
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|
| 29 |
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|
| 30 |
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|
| 31 |
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|
| 32 |
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|
| 33 |
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|
| 34 |
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|
| 35 |
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|
| 36 |
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|
| 37 |
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|
| 38 |
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|
| 39 |
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|
| 40 |
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|
| 41 |
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|
| 42 |
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|
| 43 |
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|
| 44 |
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|
| 45 |
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|
| 46 |
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|
| 47 |
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|
| 48 |
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|
| 49 |
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|
| 50 |
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| 51 |
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| 52 |
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| 53 |
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|
| 54 |
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|
| 55 |
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|
| 56 |
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|
| 57 |
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|
| 58 |
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| 59 |
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|
| 60 |
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|
| 61 |
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|
| 62 |
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|
5j6n_ligand_8_577_dock/MCpath6.xyz
ADDED
|
@@ -0,0 +1,41 @@
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|
| 1 |
+
39
|
| 2 |
+
39
|
| 3 |
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| 4 |
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| 5 |
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|
| 6 |
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|
| 7 |
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|
| 8 |
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|
| 9 |
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|
| 10 |
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|
| 11 |
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|
| 12 |
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S 52.5660 71.6514 53.5656
|
| 13 |
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S 52.5275 71.6898 53.4511
|
| 14 |
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S 52.5520 71.7996 53.3320
|
| 15 |
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|
| 16 |
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|
| 17 |
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|
| 18 |
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|
| 19 |
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|
| 20 |
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S 52.5672 72.5381 53.2667
|
| 21 |
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S 52.6398 72.5791 53.3101
|
| 22 |
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S 52.6638 72.6317 53.2717
|
| 23 |
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S 52.6760 72.5358 53.3802
|
| 24 |
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S 52.6742 72.4617 53.5287
|
| 25 |
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S 52.6534 72.4328 53.5080
|
| 26 |
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S 52.5413 72.3851 53.4966
|
| 27 |
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S 52.4525 72.2597 53.5238
|
| 28 |
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S 52.3747 72.0962 53.5150
|
| 29 |
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S 52.2211 72.0729 53.4964
|
| 30 |
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S 52.1085 72.1924 53.3450
|
| 31 |
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|
| 32 |
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S 52.1108 72.2857 53.3034
|
| 33 |
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S 52.1628 72.2817 53.3714
|
| 34 |
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S 52.1296 72.3432 53.4326
|
| 35 |
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S 52.1521 72.4241 53.4756
|
| 36 |
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S 52.3173 72.4997 53.4971
|
| 37 |
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S 52.4016 72.5640 53.5420
|
| 38 |
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S 52.4500 72.6093 53.6585
|
| 39 |
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S 52.4744 72.6312 53.6952
|
| 40 |
+
S 52.4952 72.6288 53.7540
|
| 41 |
+
S 52.5778 72.7091 53.7414
|
5j6n_ligand_8_577_dock/MCpath7.xyz
ADDED
|
@@ -0,0 +1,58 @@
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|
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|
| 1 |
+
56
|
| 2 |
+
56
|
| 3 |
+
S 52.2330 71.6845 53.1717
|
| 4 |
+
S 52.2799 71.7241 53.1882
|
| 5 |
+
S 52.3639 71.7542 53.1642
|
| 6 |
+
S 52.4838 71.7689 53.2106
|
| 7 |
+
S 52.4778 71.7041 53.2165
|
| 8 |
+
S 52.4742 71.6199 53.2277
|
| 9 |
+
S 52.4662 71.5450 53.2419
|
| 10 |
+
S 52.3656 71.5131 53.2808
|
| 11 |
+
S 52.2265 71.5530 53.2916
|
| 12 |
+
S 52.1621 71.5635 53.2963
|
| 13 |
+
S 52.1723 71.6068 53.2349
|
| 14 |
+
S 52.2616 71.6847 53.3091
|
| 15 |
+
S 52.4007 71.6659 53.3558
|
| 16 |
+
S 52.6032 71.7719 53.4716
|
| 17 |
+
S 52.7837 71.8926 53.6198
|
| 18 |
+
S 52.8156 72.0166 53.6009
|
| 19 |
+
S 52.8158 72.2091 53.4141
|
| 20 |
+
S 52.7601 72.3309 53.2264
|
| 21 |
+
S 52.6982 72.3980 53.0797
|
| 22 |
+
S 52.6476 72.4283 53.0750
|
| 23 |
+
S 52.5816 72.4341 53.1901
|
| 24 |
+
S 52.4980 72.4060 53.2222
|
| 25 |
+
S 52.4388 72.4138 53.3423
|
| 26 |
+
S 52.4385 72.3738 53.5116
|
| 27 |
+
S 52.4535 72.3465 53.6049
|
| 28 |
+
S 52.4541 72.2658 53.5922
|
| 29 |
+
S 52.4413 72.3045 53.4581
|
| 30 |
+
S 52.4353 72.3773 53.3569
|
| 31 |
+
S 52.5025 72.4895 53.3833
|
| 32 |
+
S 52.4547 72.5067 53.4268
|
| 33 |
+
S 52.3816 72.5045 53.4418
|
| 34 |
+
S 52.2776 72.5175 53.4574
|
| 35 |
+
S 52.2816 72.4182 53.4669
|
| 36 |
+
S 52.3685 72.3385 53.5119
|
| 37 |
+
S 52.4359 72.2697 53.5359
|
| 38 |
+
S 52.4959 72.2582 53.6113
|
| 39 |
+
S 52.5320 72.3909 53.6141
|
| 40 |
+
S 52.6332 72.4340 53.6585
|
| 41 |
+
S 52.6533 72.5034 53.5669
|
| 42 |
+
S 52.6166 72.6037 53.4115
|
| 43 |
+
S 52.5873 72.5864 53.3394
|
| 44 |
+
S 52.5177 72.5497 53.2793
|
| 45 |
+
S 52.4469 72.4529 53.1628
|
| 46 |
+
S 52.3560 72.3415 53.2043
|
| 47 |
+
S 52.2995 72.2801 53.3862
|
| 48 |
+
S 52.2899 72.2718 53.5811
|
| 49 |
+
S 52.3193 72.2899 53.6573
|
| 50 |
+
S 52.3317 72.3270 53.6587
|
| 51 |
+
S 52.3202 72.3462 53.6463
|
| 52 |
+
S 52.3707 72.3936 53.5507
|
| 53 |
+
S 52.4023 72.4205 53.4237
|
| 54 |
+
S 52.3683 72.5259 53.3432
|
| 55 |
+
S 52.3097 72.5916 53.3415
|
| 56 |
+
S 52.2406 72.6105 53.2470
|
| 57 |
+
S 52.2219 72.6801 53.1480
|
| 58 |
+
S 52.2332 72.8157 53.1286
|
5j6n_ligand_8_577_dock/MCpath8.xyz
ADDED
|
@@ -0,0 +1,75 @@
|
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|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
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|
|
|
|
|
|
|
|
|
|
|
|
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|
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|
|
|
|
|
|
|
| 1 |
+
73
|
| 2 |
+
73
|
| 3 |
+
S 52.5130 71.8023 53.2799
|
| 4 |
+
S 52.4951 71.7154 53.2751
|
| 5 |
+
S 52.3985 71.6664 53.3069
|
| 6 |
+
S 52.3150 71.6987 53.3258
|
| 7 |
+
S 52.2784 71.6809 53.3039
|
| 8 |
+
S 52.3345 71.6512 53.2648
|
| 9 |
+
S 52.3927 71.5712 53.2465
|
| 10 |
+
S 52.3992 71.5679 53.2205
|
| 11 |
+
S 52.3703 71.6210 53.2016
|
| 12 |
+
S 52.3797 71.6410 53.2403
|
| 13 |
+
S 52.4876 71.6096 53.3016
|
| 14 |
+
S 52.5215 71.5941 53.3776
|
| 15 |
+
S 52.4616 71.6532 53.4307
|
| 16 |
+
S 52.4752 71.5880 53.5017
|
| 17 |
+
S 52.5408 71.5980 53.5375
|
| 18 |
+
S 52.5192 71.6375 53.5637
|
| 19 |
+
S 52.4523 71.5674 53.5513
|
| 20 |
+
S 52.4675 71.5380 53.4702
|
| 21 |
+
S 52.3862 71.5150 53.3472
|
| 22 |
+
S 52.2880 71.5040 53.2784
|
| 23 |
+
S 52.3611 71.5285 53.2702
|
| 24 |
+
S 52.3917 71.4942 53.2937
|
| 25 |
+
S 52.2438 71.3892 53.3679
|
| 26 |
+
S 52.1361 71.4401 53.4930
|
| 27 |
+
S 52.1566 71.4734 53.5242
|
| 28 |
+
S 52.2939 71.3824 53.4455
|
| 29 |
+
S 52.4309 71.2667 53.4515
|
| 30 |
+
S 52.5734 71.3022 53.5475
|
| 31 |
+
S 52.6803 71.4017 53.5100
|
| 32 |
+
S 52.7371 71.4769 53.4874
|
| 33 |
+
S 52.6294 71.5798 53.5272
|
| 34 |
+
S 52.5129 71.5529 53.5027
|
| 35 |
+
S 52.4266 71.3981 53.4917
|
| 36 |
+
S 52.3792 71.2923 53.4827
|
| 37 |
+
S 52.3801 71.3300 53.4556
|
| 38 |
+
S 52.3651 71.4065 53.5019
|
| 39 |
+
S 52.3428 71.4469 53.5644
|
| 40 |
+
S 52.3502 71.4895 53.4759
|
| 41 |
+
S 52.4024 71.3633 53.3818
|
| 42 |
+
S 52.5193 71.3500 53.3377
|
| 43 |
+
S 52.5425 71.5176 53.3822
|
| 44 |
+
S 52.5189 71.6242 53.4862
|
| 45 |
+
S 52.5282 71.6607 53.4992
|
| 46 |
+
S 52.6398 71.5555 53.5324
|
| 47 |
+
S 52.6958 71.4574 53.4841
|
| 48 |
+
S 52.7349 71.5026 53.3354
|
| 49 |
+
S 52.7921 71.5640 53.2473
|
| 50 |
+
S 52.8114 71.6083 53.2345
|
| 51 |
+
S 52.8022 71.5595 53.2822
|
| 52 |
+
S 52.8223 71.4530 53.3383
|
| 53 |
+
S 52.7232 71.3680 53.3307
|
| 54 |
+
S 52.6227 71.3033 53.3898
|
| 55 |
+
S 52.5767 71.3247 53.4636
|
| 56 |
+
S 52.4937 71.4219 53.6071
|
| 57 |
+
S 52.3097 71.4573 53.7893
|
| 58 |
+
S 52.2977 71.4495 53.8488
|
| 59 |
+
S 52.4844 71.5144 53.7800
|
| 60 |
+
S 52.6867 71.6700 53.7383
|
| 61 |
+
S 52.8692 71.9699 53.7173
|
| 62 |
+
S 53.0256 72.4291 53.6300
|
| 63 |
+
S 53.3207 72.7932 53.5723
|
| 64 |
+
S 53.5468 72.8634 53.4553
|
| 65 |
+
S 53.6136 72.7818 53.2786
|
| 66 |
+
S 53.5882 72.6528 53.1269
|
| 67 |
+
S 53.7538 72.7348 53.0545
|
| 68 |
+
S 53.9251 72.9175 53.0304
|
| 69 |
+
S 53.9538 72.9886 52.9835
|
| 70 |
+
S 53.9586 72.9700 52.9656
|
| 71 |
+
S 53.8640 72.8097 52.9319
|
| 72 |
+
S 53.7445 72.6443 52.8716
|
| 73 |
+
S 53.7256 72.5983 52.6525
|
| 74 |
+
S 53.7739 72.6863 52.3000
|
| 75 |
+
S 53.8102 72.7909 52.0071
|