| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN1512 | MAT-POS-b3e365b9-1_1 |  | EN300-47606_1_2 |  | −1.2 ± 0.3 |   |   | ||||
| RUN1591 | MAT-POS-b3e365b9-1_1 |  | EN300-331828_1_1 |  | −1.2 ± 0.2 |   |   | ||||
| RUN587 | MAT-POS-b3e365b9-1_1 |  | EN300-90225_4_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN1167 | MAT-POS-b3e365b9-1_1 |  | EN300-6487407_4_1 |  | −1.2 ± 0.6 |   |   | ||||
| RUN1707 | MAT-POS-b3e365b9-1_1 |  | EN300-302058_3_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN651 | MAT-POS-b3e365b9-1_1 |  | EN300-77092_4_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN853 | MAT-POS-b3e365b9-1_1 |  | EN300-224741_1_2 |  | −1.2 ± 0.3 |   |   | ||||
| RUN319 | MAT-POS-b3e365b9-1_1 |  | EN300-98018_3_1 |  | −1.2 ± 0.4 |   |   | ||||
| RUN852 | MAT-POS-b3e365b9-1_1 |  | EN300-22880_3_2 |  | −1.2 ± 0.4 |   |   | ||||
| RUN966 | MAT-POS-b3e365b9-1_1 |  | EN300-107267_2_2 |  | −1.2 ± 0.3 |   |   | ||||
| RUN1148 | MAT-POS-b3e365b9-1_1 |  | EN300-23223_3_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN125 | MAT-POS-b3e365b9-1_1 |  | VLA-UCB-34f3ed0c-10_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN1013 | MAT-POS-b3e365b9-1_1 |  | EN300-1071940_1_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN936 | MAT-POS-b3e365b9-1_1 |  | EN300-1724771_1_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN1320 | MAT-POS-b3e365b9-1_1 |  | EN300-23317_1_2 |  | −1.2 ± 0.4 |   |   | ||||
| RUN1454 | MAT-POS-b3e365b9-1_1 |  | EN300-1253122_2_1 |  | −1.2 ± 0.2 |   |   | ||||
| RUN1458 | MAT-POS-b3e365b9-1_1 |  | EN300-256053_1_1 |  | −1.2 ± 0.2 |   |   | ||||
| RUN951 | MAT-POS-b3e365b9-1_1 |  | EN300-6238494_4_1 |  | −1.2 ± 0.4 |   |   | ||||
| RUN632 | MAT-POS-b3e365b9-1_1 |  | EN300-103187_3_1 |  | −1.2 ± 0.5 |   |   | ||||
| RUN18 | MAT-POS-b3e365b9-1_1 |  | DAR-DIA-0d514e7d-8_1 |  | −1.16 ± 0.07 |   |   | ||||
| RUN975 | MAT-POS-b3e365b9-1_1 |  | EN300-6736413_4_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN14 | MAT-POS-b3e365b9-1_1 |  | BEN-BAS-5c03e89e-1_2 |  | −1.2 ± 0.1 |   |   | ||||
| RUN1210 | MAT-POS-b3e365b9-1_1 |  | EN300-173903_1_1 |  | −1.2 ± 0.3 |   |   | ||||
| RUN884 | MAT-POS-b3e365b9-1_1 |  | EN300-10414_3_1 |  | −1.1 ± 0.4 |   |   | ||||
| RUN888 | MAT-POS-b3e365b9-1_1 |  | EN300-197715_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1388 | MAT-POS-b3e365b9-1_1 |  | EN300-28340_3_1 |  | −1.1 ± 0.5 |   |   | ||||
| RUN361 | MAT-POS-b3e365b9-1_1 |  | EN300-1915260_3_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1389 | MAT-POS-b3e365b9-1_1 |  | EN300-19542_1_2 |  | −1.1 ± 0.2 |   |   | ||||
| RUN736 | MAT-POS-b3e365b9-1_1 |  | EN300-143449_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1683 | MAT-POS-b3e365b9-1_1 |  | EN300-1253178_3_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN793 | MAT-POS-b3e365b9-1_1 |  | EN300-216063_1_1 |  | −1.1 ± 0.2 |   |   | ||||
| RUN1731 | MAT-POS-b3e365b9-1_1 |  | EN300-65978_3_1 |  | −1.1 ± 0.5 |   |   | ||||
| RUN1030 | MAT-POS-b3e365b9-1_1 |  | EN300-1915260_2_2 |  | −1.1 ± 0.4 |   |   | ||||
| RUN242 | MAT-POS-b3e365b9-1_1 |  | VLA-UCB-34f3ed0c-20_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1385 | MAT-POS-b3e365b9-1_1 |  | EN300-14767_2_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1274 | MAT-POS-b3e365b9-1_1 |  | EN300-6739235_3_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1086 | MAT-POS-b3e365b9-1_1 |  | EN300-1253178_2_1 |  | −1.1 ± 0.2 |   |   | ||||
| RUN467 | MAT-POS-b3e365b9-1_1 |  | EN300-05512_2_2 |  | −1.1 ± 0.5 |   |   | ||||
| RUN709 | MAT-POS-b3e365b9-1_1 |  | EN300-208191_3_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN393 | MAT-POS-b3e365b9-1_1 |  | EN300-02015_3_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1721 | MAT-POS-b3e365b9-1_1 |  | EN300-220194_3_3 |  | −1.1 ± 0.4 |   |   | ||||
| RUN1673 | MAT-POS-b3e365b9-1_1 |  | EN300-1667046_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN343 | MAT-POS-b3e365b9-1_1 |  | EN300-95639_1_2 |  | −1.1 ± 0.4 |   |   | ||||
| RUN429 | MAT-POS-b3e365b9-1_1 |  | EN300-120586_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1599 | MAT-POS-b3e365b9-1_1 |  | EN300-6482967_1_1 |  | −1.1 ± 0.2 |   |   | ||||
| RUN281 | MAT-POS-b3e365b9-1_1 |  | EN300-11300_3_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1493 | MAT-POS-b3e365b9-1_1 |  | EN300-55072_1_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN988 | MAT-POS-b3e365b9-1_1 |  | EN300-10414_3_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1452 | MAT-POS-b3e365b9-1_1 |  | EN300-68875_3_1 |  | −1.1 ± 0.4 |   |   | ||||
| RUN1082 | MAT-POS-b3e365b9-1_1 |  | EN300-349304_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1297 | MAT-POS-b3e365b9-1_1 |  | EN300-6494859_2_3 |  | −1.1 ± 0.4 |   |   | ||||
| RUN839 | MAT-POS-b3e365b9-1_1 |  | EN300-7436306_4_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1204 | MAT-POS-b3e365b9-1_1 |  | EN300-22880_3_1 |  | −1.1 ± 0.4 |   |   | ||||
| RUN73 | MAT-POS-b3e365b9-1_1 |  | DAR-DIA-0d514e7d-25_1 |  | −1.1 ± 0.1 |   |   | ||||
| RUN867 | MAT-POS-b3e365b9-1_1 |  | EN300-6491682_2_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN920 | MAT-POS-b3e365b9-1_1 |  | EN300-52467_1_1 |  | −1.1 ± 0.3 |   |   | ||||
| RUN325 | MAT-POS-b3e365b9-1_1 |  | EN300-22879_1_2 |  | −1.1 ± 0.3 |   |   | ||||
| RUN1462 | MAT-POS-b3e365b9-1_1 |  | EN300-317082_2_1 |  | −1.1 ± 0.2 |   |   | ||||
| RUN744 | MAT-POS-b3e365b9-1_1 |  | EN300-18249_2_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN577 | MAT-POS-b3e365b9-1_1 |  | EN300-05620_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1536 | MAT-POS-b3e365b9-1_1 |  | EN300-204935_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN109 | MAT-POS-b3e365b9-1_1 |  | DAR-DIA-0d514e7d-24_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN1617 | MAT-POS-b3e365b9-1_1 |  | EN300-6505003_3_2 |  | −1.0 ± 0.4 |   |   | ||||
| RUN84 | MAT-POS-b3e365b9-1_1 |  | DAR-DIA-23e5a6a0-5_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1737 | MAT-POS-b3e365b9-1_1 |  | EN300-203118_1_1 |  | −1.0 ± 0.5 |   |   | ||||
| RUN1551 | MAT-POS-b3e365b9-1_1 |  | EN300-23317_4_2 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1272 | MAT-POS-b3e365b9-1_1 |  | EN300-174603_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1326 | MAT-POS-b3e365b9-1_1 |  | EN300-211482_2_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1577 | MAT-POS-b3e365b9-1_1 |  | EN300-89418_3_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1684 | MAT-POS-b3e365b9-1_1 |  | EN300-68203_1_2 |  | −1.0 ± 0.3 |   |   | ||||
| RUN516 | MAT-POS-b3e365b9-1_1 |  | EN300-261986_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1450 | MAT-POS-b3e365b9-1_1 |  | EN300-256053_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN827 | MAT-POS-b3e365b9-1_1 |  | EN300-303908_1_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1070 | MAT-POS-b3e365b9-1_1 |  | EN300-2977549_2_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN131 | MAT-POS-b3e365b9-1_1 |  | DAR-DIA-23e5a6a0-8_2 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1785 | MAT-POS-b3e365b9-1_1 |  | EN300-260696_1_8 |  | −1.0 ± 0.6 |   |   | ||||
| RUN323 | MAT-POS-b3e365b9-1_1 |  | EN300-246248_2_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN451 | MAT-POS-b3e365b9-1_1 |  | EN300-94900_2_1 |  | −1.0 ± 0.5 |   |   | ||||
| RUN823 | MAT-POS-b3e365b9-1_1 |  | EN300-221518_2_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN613 | MAT-POS-b3e365b9-1_1 |  | EN300-189495_2_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1522 | MAT-POS-b3e365b9-1_1 |  | EN300-1270211_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN763 | MAT-POS-b3e365b9-1_1 |  | EN300-248888_3_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN592 | MAT-POS-b3e365b9-1_1 |  | EN300-25572_3_2 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1472 | MAT-POS-b3e365b9-1_1 |  | EN300-46832_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1134 | MAT-POS-b3e365b9-1_1 |  | EN300-1600517_2_2 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1777 | MAT-POS-b3e365b9-1_1 |  | EN300-299920_1_1 |  | −1.0 ± 0.5 |   |   | ||||
| RUN413 | MAT-POS-b3e365b9-1_1 |  | EN300-02015_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN51 | MAT-POS-b3e365b9-1_1 |  | ADA-UCB-dc2b944c-10_1 |  | −0.97 ± 0.09 |   |   | ||||
| RUN1653 | MAT-POS-b3e365b9-1_1 |  | EN300-87334_2_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1 | MAT-POS-b3e365b9-1_1 |  | JAG-UCB-706446eb-4_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN12 | MAT-POS-b3e365b9-1_1 |  | EDJ-MED-e4b030d8-11_1 |  | −0.96 ± 0.05 |   |   | ||||
| RUN1218 | MAT-POS-b3e365b9-1_1 |  | EN300-100700_1_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN707 | MAT-POS-b3e365b9-1_1 |  | EN300-22884_1_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN780 | MAT-POS-b3e365b9-1_1 |  | EN300-157897_2_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN557 | MAT-POS-b3e365b9-1_1 |  | EN300-123205_2_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN1422 | MAT-POS-b3e365b9-1_1 |  | EN300-19700_2_1 |  | −1.0 ± 0.2 |   |   | ||||
| RUN1183 | MAT-POS-b3e365b9-1_1 |  | EN300-1241327_4_1 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1249 | MAT-POS-b3e365b9-1_1 |  | EN300-82457_2_1 |  | −1.0 ± 0.4 |   |   | ||||
| RUN866 | MAT-POS-b3e365b9-1_1 |  | EN300-60862_1_2 |  | −1.0 ± 0.3 |   |   | ||||
| RUN1763 | MAT-POS-b3e365b9-1_1 |  | EN300-260816_3_1 |  | −1.0 ± 0.5 |   |   | ||||