| Project | RUN | System | Guest | Microstate | CLONE | Person | dG1 (kT) | dG1 sigma (kT) | dG3 (kT) | dG3 sigma (kT) | dG_binding (RT) | dG_binding sigma (RT) | log10Kd | log10Kd sigma | RL WL-increment | ns of RL simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 18433 | 24 | RL_10 | G1 | 2 | 0 | Matt | 6.42 | 0.0 | 15.32 | 5.04 | -5.78 | 5.95 | -2.51 | 2.58 | 0.0242 | 310.1 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 1 | Matt | 6.42 | 0.0 | 17.29 | 6.34 | -1.55 | 7.45 | -0.67 | 3.23 | 0.0242 | 310.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 2 | Matt | 6.42 | 0.0 | 15.72 | 5.91 | -4.51 | 6.28 | -1.96 | 2.73 | 0.0242 | 420.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 3 | Matt | 6.42 | 0.0 | 15.41 | 5.56 | -1.69 | 6.22 | -0.74 | 2.70 | 0.0302 | 260.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 4 | Matt | 6.42 | 0.0 | 16.81 | 5.36 | -2.73 | 6.92 | -1.19 | 3.01 | 0.0242 | 330.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 5 | Matt | 6.42 | 0.0 | 17.29 | 5.76 | -1.71 | 7.29 | -0.74 | 3.17 | 0.0242 | 440.2 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 6 | Matt | 6.42 | 0.0 | 18.34 | 5.96 | -1.05 | 7.28 | -0.46 | 3.16 | 0.0193 | 450.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 7 | Matt | 6.42 | 0.0 | 15.48 | 6.05 | -1.76 | 6.97 | -0.76 | 3.03 | 0.0242 | 440.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 8 | Matt | 6.42 | 0.0 | 16.48 | 5.46 | -1.24 | 6.06 | -0.54 | 2.63 | 0.0302 | 350.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 9 | Matt | 6.42 | 0.0 | 17.49 | 4.98 | -1.03 | 6.16 | -0.45 | 2.67 | 0.0302 | 360.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 10 | Matt | 6.42 | 0.0 | 17.62 | 6.60 | -1.29 | 6.99 | -0.56 | 3.03 | 0.0242 | 360.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 11 | Matt | 6.42 | 0.0 | 16.94 | 7.10 | -2.07 | 8.92 | -0.90 | 3.88 | 0.0242 | 340.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 12 | Matt | 6.42 | 0.0 | 17.01 | 5.44 | -0.47 | 6.50 | -0.20 | 2.82 | 0.0193 | 350.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 13 | Matt | 6.42 | 0.0 | 17.70 | 6.82 | -0.64 | 7.87 | -0.28 | 3.42 | 0.0302 | 430.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 14 | Matt | 6.42 | 0.0 | 16.65 | 6.38 | 0.18 | 7.67 | 0.08 | 3.33 | 0.0242 | 220.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 15 | Matt | 6.42 | 0.0 | 16.34 | 5.17 | -2.39 | 6.88 | -1.04 | 2.99 | 0.0302 | 290.1 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 16 | Matt | 6.42 | 0.0 | 19.45 | 4.02 | -0.11 | 5.70 | -0.05 | 2.48 | 0.0738 | 60.35 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 17 | Matt | 6.42 | 0.0 | 15.19 | 6.76 | -3.55 | 7.80 | -1.54 | 3.39 | 0.0242 | 360.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 18 | Matt | 6.42 | 0.0 | 17.31 | 5.88 | -0.44 | 7.04 | -0.19 | 3.06 | 0.0378 | 310.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 19 | Matt | 6.42 | 0.0 | 17.91 | 6.34 | 1.39 | 7.32 | 0.60 | 3.18 | 0.0302 | 330.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 20 | Matt | 6.42 | 0.0 | 15.79 | 5.64 | -3.16 | 7.22 | -1.37 | 3.13 | 0.0302 | 370.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 21 | Matt | 6.42 | 0.0 | 16.43 | 6.55 | -2.32 | 8.10 | -1.01 | 3.52 | 0.0242 | 350.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 22 | Matt | 6.42 | 0.0 | 15.89 | 5.33 | -2.37 | 6.52 | -1.03 | 2.83 | 0.0155 | 380.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 23 | Matt | 6.42 | 0.0 | 15.85 | 7.84 | -2.62 | 8.77 | -1.14 | 3.81 | 0.0378 | 250.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 24 | Matt | 6.42 | 0.0 | 17.85 | 7.06 | -2.68 | 7.68 | -1.16 | 3.34 | 0.0378 | 350.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 25 | Matt | 6.42 | 0.0 | 17.06 | 6.07 | -2.89 | 7.66 | -1.26 | 3.33 | 0.0302 | 270.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 26 | Matt | 6.42 | 0.0 | 16.39 | 6.35 | -4.80 | 7.98 | -2.09 | 3.47 | 0.0193 | 390.1 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 27 | Matt | 6.42 | 0.0 | 17.74 | 7.43 | 0.09 | 8.53 | 0.04 | 3.71 | 0.0378 | 300.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 28 | Matt | 6.42 | 0.0 | 18.74 | 8.10 | -0.32 | 8.66 | -0.14 | 3.76 | 0.0193 | 430.5 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 29 | Matt | 6.42 | 0.0 | 17.76 | 5.42 | -0.86 | 6.68 | -0.37 | 2.90 | 0.0242 | 430.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 30 | Matt | 6.42 | 0.0 | 16.06 | 5.95 | -3.32 | 6.63 | -1.44 | 2.88 | 0.0242 | 330.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 31 | Matt | 6.42 | 0.0 | 17.95 | 5.17 | 2.16 | 6.20 | 0.94 | 2.69 | 0.0302 | 310.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 32 | Matt | 6.42 | 0.0 | 17.48 | 7.12 | -1.16 | 8.25 | -0.50 | 3.58 | 0.0378 | 320.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 33 | Matt | 6.42 | 0.0 | 16.69 | 6.41 | -0.53 | 7.61 | -0.23 | 3.31 | 0.0302 | 430.15 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 34 | Matt | 6.42 | 0.0 | 16.39 | 5.18 | -0.79 | 7.36 | -0.34 | 3.20 | 0.0242 | 410.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 35 | Matt | 6.42 | 0.0 | 17.43 | 5.14 | -1.40 | 6.65 | -0.61 | 2.89 | 0.0242 | 340.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 36 | Matt | 6.42 | 0.0 | 16.46 | 5.67 | -1.79 | 6.97 | -0.78 | 3.03 | 0.0242 | 310.3 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 37 | Matt | 6.42 | 0.0 | 15.80 | 4.98 | -1.73 | 6.22 | -0.75 | 2.70 | 0.0193 | 380.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 38 | Matt | 6.42 | 0.0 | 15.89 | 5.91 | -3.31 | 6.93 | -1.44 | 3.01 | 0.0302 | 280.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 39 | Matt | 6.42 | 0.0 | 16.78 | 6.10 | -3.50 | 7.21 | -1.52 | 3.13 | 0.0242 | 260.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 40 | Matt | 6.42 | 0.0 | 20.96 | 5.87 | 3.73 | 7.00 | 1.62 | 3.04 | 0.0193 | 360.4 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 41 | Matt | 6.42 | 0.0 | 17.78 | 5.78 | -1.78 | 6.36 | -0.77 | 2.76 | 0.0378 | 180.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 42 | Matt | 6.42 | 0.0 | 19.98 | 8.73 | 1.48 | 9.47 | 0.64 | 4.11 | 0.0378 | 230.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 43 | Matt | 6.42 | 0.0 | 21.15 | 8.03 | 2.74 | 8.80 | 1.19 | 3.82 | 0.0302 | 210.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 44 | Matt | 6.42 | 0.0 | 18.22 | 5.86 | 1.09 | 7.35 | 0.47 | 3.19 | 0.0242 | 380.1 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 45 | Matt | 6.42 | 0.0 | 15.61 | 5.74 | -2.33 | 7.23 | -1.01 | 3.14 | 0.0302 | 240.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 46 | Matt | 6.42 | 0.0 | 15.39 | 5.51 | -4.11 | 6.28 | -1.78 | 2.73 | 0.0242 | 260.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 47 | Matt | 6.42 | 0.0 | 18.40 | 7.57 | -0.19 | 9.11 | -0.08 | 3.96 | 0.0242 | 270.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 48 | Matt | 6.42 | 0.0 | 17.84 | 5.48 | -1.60 | 6.66 | -0.70 | 2.89 | 0.0155 | 390.0 | True |
| 18433 | 24 | RL_10 | G1 | 2 | 49 | Matt | 6.42 | 0.0 | 16.56 | 6.60 | -0.82 | 7.64 | -0.35 | 3.32 | 0.0302 | 200.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 2 | L | G1 | 2 | 0 | Matt | -27.25 | 3.25 | 0.0124 | 190.0 | True |
| 18434 | 2 | L | G1 | 2 | 1 | Matt | -25.07 | 3.82 | 0.0193 | 140.0 | True |
| 18434 | 2 | L | G1 | 2 | 2 | Matt | -26.64 | 2.11 | 0.0155 | 180.05 | True |
| 18434 | 2 | L | G1 | 2 | 3 | Matt | -23.52 | 2.78 | 0.0063 | 230.0 | True |
| 18434 | 2 | L | G1 | 2 | 4 | Matt | -25.96 | 4.37 | 0.0099 | 220.0 | True |
| 18434 | 2 | L | G1 | 2 | 5 | Matt | -25.42 | 4.47 | 0.0099 | 290.2 | True |
| 18434 | 2 | L | G1 | 2 | 6 | Matt | -25.80 | 4.18 | 0.0193 | 210.0 | True |
| 18434 | 2 | L | G1 | 2 | 7 | Matt | -23.66 | 3.47 | 0.0051 | 410.1 | True |
| 18434 | 2 | L | G1 | 2 | 8 | Matt | -24.13 | 2.62 | 0.0124 | 230.05 | True |
| 18434 | 2 | L | G1 | 2 | 9 | Matt | -24.94 | 3.62 | 0.0155 | 130.0 | True |
| 18434 | 2 | L | G1 | 2 | 10 | Matt | -25.32 | 2.28 | 0.0124 | 180.0 | True |
| 18434 | 2 | L | G1 | 2 | 11 | Matt | -25.43 | 5.40 | 0.0155 | 180.0 | True |
| 18434 | 2 | L | G1 | 2 | 12 | Matt | -23.89 | 3.56 | 0.0124 | 270.0 | True |
| 18434 | 2 | L | G1 | 2 | 13 | Matt | -24.75 | 3.92 | 0.0193 | 200.0 | True |
| 18434 | 2 | L | G1 | 2 | 14 | Matt | -22.89 | 4.25 | 0.0193 | 150.0 | True |
| 18434 | 2 | L | G1 | 2 | 15 | Matt | -25.14 | 4.53 | 0.0079 | 370.1 | True |
| 18434 | 2 | L | G1 | 2 | 16 | Matt | -25.98 | 4.05 | 0.0155 | 140.0 | True |
| 18434 | 2 | L | G1 | 2 | 17 | Matt | -25.15 | 3.88 | 0.0155 | 230.15 | True |
| 18434 | 2 | L | G1 | 2 | 18 | Matt | -24.17 | 3.86 | 0.0099 | 210.05 | True |
| 18434 | 2 | L | G1 | 2 | 19 | Matt | -23.09 | 3.69 | 0.0124 | 290.0 | True |
| 18434 | 2 | L | G1 | 2 | 20 | Matt | -25.36 | 4.50 | 0.0155 | 230.1 | True |
| 18434 | 2 | L | G1 | 2 | 21 | Matt | -25.16 | 4.77 | 0.0193 | 140.0 | True |
| 18434 | 2 | L | G1 | 2 | 22 | Matt | -24.75 | 3.71 | 0.0124 | 230.0 | True |
| 18434 | 2 | L | G1 | 2 | 23 | Matt | -24.88 | 3.93 | 0.0193 | 180.0 | True |
| 18434 | 2 | L | G1 | 2 | 24 | Matt | -26.95 | 3.03 | 0.0124 | 230.0 | True |
| 18434 | 2 | L | G1 | 2 | 25 | Matt | -26.37 | 4.68 | 0.0124 | 190.0 | True |
| 18434 | 2 | L | G1 | 2 | 26 | Matt | -27.61 | 4.84 | 0.0155 | 130.05 | True |
| 18434 | 2 | L | G1 | 2 | 27 | Matt | -24.07 | 4.19 | 0.0124 | 170.0 | True |
| 18434 | 2 | L | G1 | 2 | 28 | Matt | -25.48 | 3.08 | 0.0155 | 170.0 | True |
| 18434 | 2 | L | G1 | 2 | 29 | Matt | -25.04 | 3.90 | 0.0155 | 180.4 | True |
| 18434 | 2 | L | G1 | 2 | 30 | Matt | -25.79 | 2.92 | 0.0063 | 220.0 | True |
| 18434 | 2 | L | G1 | 2 | 31 | Matt | -22.20 | 3.43 | 0.0079 | 210.0 | True |
| 18434 | 2 | L | G1 | 2 | 32 | Matt | -25.05 | 4.18 | 0.0099 | 150.15 | True |
| 18434 | 2 | L | G1 | 2 | 33 | Matt | -23.63 | 4.11 | 0.0079 | 160.15 | True |
| 18434 | 2 | L | G1 | 2 | 34 | Matt | -23.60 | 5.23 | 0.0124 | 200.0 | True |
| 18434 | 2 | L | G1 | 2 | 35 | Matt | -25.25 | 4.21 | 0.0155 | 180.0 | True |
| 18434 | 2 | L | G1 | 2 | 36 | Matt | -24.67 | 4.05 | 0.0155 | 140.25 | True |
| 18434 | 2 | L | G1 | 2 | 37 | Matt | -23.95 | 3.74 | 0.0155 | 320.1 | True |
| 18434 | 2 | L | G1 | 2 | 38 | Matt | -25.61 | 3.62 | 0.0242 | 210.15 | True |
| 18434 | 2 | L | G1 | 2 | 39 | Matt | -26.69 | 3.83 | 0.0124 | 210.0 | True |
| 18434 | 2 | L | G1 | 2 | 40 | Matt | -23.65 | 3.80 | 0.0124 | 220.0 | True |
| 18434 | 2 | L | G1 | 2 | 41 | Matt | -25.97 | 2.65 | 0.0124 | 260.0 | True |
| 18434 | 2 | L | G1 | 2 | 42 | Matt | -24.92 | 3.67 | 0.0124 | 220.45 | True |
| 18434 | 2 | L | G1 | 2 | 43 | Matt | -24.83 | 3.60 | 0.0124 | 170.0 | True |
| 18434 | 2 | L | G1 | 2 | 44 | Matt | -23.54 | 4.43 | 0.0242 | 170.0 | True |
| 18434 | 2 | L | G1 | 2 | 45 | Matt | -24.35 | 4.41 | 0.0302 | 160.0 | True |
| 18434 | 2 | L | G1 | 2 | 46 | Matt | -25.91 | 3.00 | 0.0099 | 170.0 | True |
| 18434 | 2 | L | G1 | 2 | 47 | Matt | -25.00 | 5.07 | 0.0193 | 190.0 | True |
| 18434 | 2 | L | G1 | 2 | 48 | Matt | -25.86 | 3.79 | 0.0124 | 170.15 | True |
| 18434 | 2 | L | G1 | 2 | 49 | Matt | -23.79 | 3.85 | 0.0242 | 160.05 | True |