| 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 | 67 | RL_12 | G13 | 1 | 0 | Steven | 6.42 | 0.0 | -65.97 | 3.71 | -14.37 | 3.73 | -6.24 | 1.62 | 0.0155 | 340.2 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 1 | Steven | 6.42 | 0.0 | -65.85 | 4.09 | -14.44 | 4.10 | -6.27 | 1.78 | 0.0124 | 290.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 2 | Steven | 6.42 | 0.0 | -65.04 | 3.67 | -13.76 | 3.69 | -5.98 | 1.60 | 0.0193 | 290.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 3 | Steven | 6.42 | 0.0 | -66.16 | 3.08 | -14.74 | 3.10 | -6.40 | 1.35 | 0.0099 | 450.1 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 4 | Steven | 6.42 | 0.0 | -66.08 | 3.63 | -14.61 | 3.66 | -6.34 | 1.59 | 0.0099 | 410.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 5 | Steven | 6.42 | 0.0 | -66.88 | 3.56 | -15.48 | 3.59 | -6.72 | 1.56 | 0.0099 | 250.2 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 6 | Steven | 6.42 | 0.0 | -65.70 | 3.45 | -14.35 | 3.45 | -6.23 | 1.50 | 0.0124 | 440.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 7 | Steven | 6.42 | 0.0 | -65.71 | 3.48 | -14.27 | 3.50 | -6.20 | 1.52 | 0.0124 | 310.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 8 | Steven | 6.42 | 0.0 | -66.23 | 2.82 | -14.81 | 2.86 | -6.43 | 1.24 | 0.0099 | 370.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 9 | Steven | 6.42 | 0.0 | -65.07 | 4.26 | -13.78 | 4.28 | -5.98 | 1.86 | 0.0155 | 260.15 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 10 | Steven | 6.42 | 0.0 | -66.09 | 3.35 | -14.65 | 3.38 | -6.36 | 1.47 | 0.0099 | 470.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 11 | Steven | 6.42 | 0.0 | -65.19 | 4.35 | -13.71 | 4.36 | -5.96 | 1.90 | 0.0124 | 350.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 12 | Steven | 6.42 | 0.0 | -65.30 | 5.10 | -13.82 | 5.12 | -6.00 | 2.22 | 0.0193 | 300.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 13 | Steven | 6.42 | 0.0 | -66.38 | 3.28 | -14.76 | 3.29 | -6.41 | 1.43 | 0.0124 | 450.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 14 | Steven | 6.42 | 0.0 | -66.75 | 3.61 | -15.34 | 3.63 | -6.66 | 1.58 | 0.0193 | 180.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 15 | Steven | 6.42 | 0.0 | -65.85 | 3.26 | -14.39 | 3.27 | -6.25 | 1.42 | 0.0155 | 360.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 16 | Steven | 6.42 | 0.0 | -66.20 | 4.37 | -14.72 | 4.39 | -6.39 | 1.90 | 0.0124 | 330.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 17 | Steven | 6.42 | 0.0 | -64.58 | 4.92 | -13.12 | 4.93 | -5.70 | 2.14 | 0.0155 | 230.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 18 | Steven | 6.42 | 0.0 | -66.83 | 3.43 | -15.40 | 3.44 | -6.69 | 1.49 | 0.0124 | 310.1 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 19 | Steven | 6.42 | 0.0 | -65.50 | 3.51 | -14.03 | 3.53 | -6.09 | 1.53 | 0.0155 | 260.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 20 | Steven | 6.42 | 0.0 | -65.01 | 3.91 | -13.65 | 3.94 | -5.93 | 1.71 | 0.0124 | 410.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 21 | Steven | 6.42 | 0.0 | -65.87 | 3.89 | -14.37 | 3.91 | -6.24 | 1.70 | 0.0079 | 380.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 22 | Steven | 6.42 | 0.0 | -65.99 | 4.59 | -14.51 | 4.60 | -6.30 | 2.00 | 0.0155 | 290.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 23 | Steven | 6.42 | 0.0 | -66.66 | 3.10 | -15.02 | 3.13 | -6.52 | 1.36 | 0.0155 | 360.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 24 | Steven | 6.42 | 0.0 | -66.50 | 3.38 | -15.14 | 3.41 | -6.58 | 1.48 | 0.0124 | 350.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 25 | Steven | 6.42 | 0.0 | -65.61 | 4.74 | -14.21 | 4.76 | -6.17 | 2.07 | 0.0079 | 340.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 26 | Steven | 6.42 | 0.0 | -65.85 | 3.57 | -14.47 | 3.59 | -6.29 | 1.56 | 0.0193 | 220.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 27 | Steven | 6.42 | 0.0 | -66.22 | 3.98 | -14.67 | 4.00 | -6.37 | 1.74 | 0.0124 | 250.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 28 | Steven | 6.42 | 0.0 | -66.26 | 3.11 | -14.82 | 3.13 | -6.44 | 1.36 | 0.0099 | 420.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 29 | Steven | 6.42 | 0.0 | -66.43 | 3.88 | -14.96 | 3.89 | -6.50 | 1.69 | 0.0124 | 260.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 30 | Steven | 6.42 | 0.0 | -65.06 | 4.40 | -13.74 | 4.42 | -5.97 | 1.92 | 0.0124 | 300.1 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 31 | Steven | 6.42 | 0.0 | -65.61 | 4.46 | -14.16 | 4.47 | -6.15 | 1.94 | 0.0124 | 350.2 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 32 | Steven | 6.42 | 0.0 | -65.79 | 3.64 | -14.38 | 3.66 | -6.25 | 1.59 | 0.0124 | 260.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 33 | Steven | 6.42 | 0.0 | -66.00 | 3.70 | -14.52 | 3.72 | -6.30 | 1.61 | 0.0155 | 310.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 34 | Steven | 6.42 | 0.0 | -66.60 | 3.61 | -15.15 | 3.62 | -6.58 | 1.57 | 0.0124 | 350.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 35 | Steven | 6.42 | 0.0 | -65.63 | 3.07 | -14.21 | 3.09 | -6.17 | 1.34 | 0.0063 | 520.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 36 | Steven | 6.42 | 0.0 | -65.21 | 4.91 | -13.75 | 4.93 | -5.97 | 2.14 | 0.0193 | 150.1 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 37 | Steven | 6.42 | 0.0 | -65.37 | 3.35 | -13.85 | 3.38 | -6.01 | 1.47 | 0.0124 | 450.2 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 38 | Steven | 6.42 | 0.0 | -66.25 | 2.84 | -14.77 | 2.88 | -6.41 | 1.25 | 0.0079 | 310.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 39 | Steven | 6.42 | 0.0 | -65.49 | 3.57 | -14.04 | 3.58 | -6.10 | 1.55 | 0.0155 | 390.2 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 40 | Steven | 6.42 | 0.0 | -65.52 | 3.98 | -14.14 | 3.99 | -6.14 | 1.73 | 0.0193 | 250.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 41 | Steven | 6.42 | 0.0 | -66.22 | 4.06 | -14.79 | 4.08 | -6.42 | 1.77 | 0.0242 | 210.0 | False |
| 18433 | 67 | RL_12 | G13 | 1 | 42 | Steven | 6.42 | 0.0 | -66.37 | 2.91 | -14.82 | 2.94 | -6.44 | 1.28 | 0.0124 | 330.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 43 | Steven | 6.42 | 0.0 | -65.44 | 3.29 | -14.02 | 3.32 | -6.09 | 1.44 | 0.0124 | 400.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 44 | Steven | 6.42 | 0.0 | -64.41 | 5.61 | -13.05 | 5.61 | -5.67 | 2.44 | 0.0193 | 220.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 45 | Steven | 6.42 | 0.0 | -66.01 | 4.13 | -14.53 | 4.14 | -6.31 | 1.80 | 0.0155 | 310.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 46 | Steven | 6.42 | 0.0 | -65.86 | 3.73 | -14.35 | 3.74 | -6.23 | 1.62 | 0.0099 | 380.7 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 47 | Steven | 6.42 | 0.0 | -66.04 | 3.31 | -14.55 | 3.32 | -6.32 | 1.44 | 0.0155 | 290.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 48 | Steven | 6.42 | 0.0 | -66.75 | 3.16 | -15.34 | 3.17 | -6.66 | 1.38 | 0.0099 | 330.0 | True |
| 18433 | 67 | RL_12 | G13 | 1 | 49 | Steven | 6.42 | 0.0 | -66.04 | 3.71 | -14.46 | 3.72 | -6.28 | 1.62 | 0.0193 | 250.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 23 | L | G13 | 1 | 0 | Steven | 45.19 | 0.40 | 0.0004 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 1 | Steven | 45.00 | 0.29 | 0.0002 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 2 | Steven | 44.86 | 0.36 | 0.0002 | 220.0 | True |
| 18434 | 23 | L | G13 | 1 | 3 | Steven | 45.00 | 0.33 | 0.0002 | 250.0 | True |
| 18434 | 23 | L | G13 | 1 | 4 | Steven | 45.06 | 0.44 | 0.0013 | 130.0 | True |
| 18434 | 23 | L | G13 | 1 | 5 | Steven | 44.98 | 0.50 | 0.0026 | 110.0 | True |
| 18434 | 23 | L | G13 | 1 | 6 | Steven | 44.94 | 0.24 | 0.0000 | 280.0 | True |
| 18434 | 23 | L | G13 | 1 | 7 | Steven | 45.02 | 0.40 | 0.0021 | 160.0 | True |
| 18434 | 23 | L | G13 | 1 | 8 | Steven | 45.00 | 0.46 | 0.0004 | 170.4 | True |
| 18434 | 23 | L | G13 | 1 | 9 | Steven | 44.88 | 0.39 | 0.0004 | 150.0 | True |
| 18434 | 23 | L | G13 | 1 | 10 | Steven | 45.03 | 0.46 | 0.0009 | 160.0 | True |
| 18434 | 23 | L | G13 | 1 | 11 | Steven | 45.06 | 0.34 | 0.0003 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 12 | Steven | 45.06 | 0.34 | 0.0001 | 250.0 | True |
| 18434 | 23 | L | G13 | 1 | 13 | Steven | 45.20 | 0.27 | 0.0001 | 280.0 | True |
| 18434 | 23 | L | G13 | 1 | 14 | Steven | 44.99 | 0.34 | 0.0003 | 190.0 | True |
| 18434 | 23 | L | G13 | 1 | 15 | Steven | 45.04 | 0.28 | 0.0005 | 180.0 | True |
| 18434 | 23 | L | G13 | 1 | 16 | Steven | 45.07 | 0.38 | 0.0007 | 170.1 | True |
| 18434 | 23 | L | G13 | 1 | 17 | Steven | 45.04 | 0.30 | 0.0001 | 260.0 | True |
| 18434 | 23 | L | G13 | 1 | 18 | Steven | 45.01 | 0.24 | 0.0002 | 240.15 | True |
| 18434 | 23 | L | G13 | 1 | 19 | Steven | 45.06 | 0.32 | 0.0002 | 210.15 | True |
| 18434 | 23 | L | G13 | 1 | 20 | Steven | 44.95 | 0.46 | 0.0041 | 100.0 | True |
| 18434 | 23 | L | G13 | 1 | 21 | Steven | 45.09 | 0.37 | 0.0026 | 120.0 | True |
| 18434 | 23 | L | G13 | 1 | 22 | Steven | 45.07 | 0.35 | 0.0004 | 210.0 | True |
| 18434 | 23 | L | G13 | 1 | 23 | Steven | 45.22 | 0.40 | 0.0013 | 140.35 | True |
| 18434 | 23 | L | G13 | 1 | 24 | Steven | 44.94 | 0.43 | 0.0009 | 160.0 | True |
| 18434 | 23 | L | G13 | 1 | 25 | Steven | 44.99 | 0.39 | 0.0005 | 170.25 | True |
| 18434 | 23 | L | G13 | 1 | 26 | Steven | 44.96 | 0.39 | 0.0005 | 210.0 | True |
| 18434 | 23 | L | G13 | 1 | 27 | Steven | 45.13 | 0.39 | 0.0003 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 28 | Steven | 45.02 | 0.33 | 0.0001 | 230.2 | True |
| 18434 | 23 | L | G13 | 1 | 29 | Steven | 45.06 | 0.27 | 0.0002 | 220.0 | True |
| 18434 | 23 | L | G13 | 1 | 30 | Steven | 44.90 | 0.41 | 0.0013 | 120.0 | True |
| 18434 | 23 | L | G13 | 1 | 31 | Steven | 45.03 | 0.30 | 0.0001 | 230.0 | True |
| 18434 | 23 | L | G13 | 1 | 32 | Steven | 44.99 | 0.34 | 0.0004 | 190.0 | True |
| 18434 | 23 | L | G13 | 1 | 33 | Steven | 45.07 | 0.28 | 0.0001 | 270.25 | True |
| 18434 | 23 | L | G13 | 1 | 34 | Steven | 45.04 | 0.28 | 0.0000 | 270.2 | True |
| 18434 | 23 | L | G13 | 1 | 35 | Steven | 45.01 | 0.37 | 0.0009 | 150.0 | True |
| 18434 | 23 | L | G13 | 1 | 36 | Steven | 45.04 | 0.39 | 0.0002 | 220.65 | True |
| 18434 | 23 | L | G13 | 1 | 37 | Steven | 45.11 | 0.42 | 0.0007 | 180.7 | True |
| 18434 | 23 | L | G13 | 1 | 38 | Steven | 45.07 | 0.46 | 0.0003 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 39 | Steven | 45.04 | 0.27 | 0.0001 | 280.0 | True |
| 18434 | 23 | L | G13 | 1 | 40 | Steven | 44.97 | 0.35 | 0.0004 | 200.0 | True |
| 18434 | 23 | L | G13 | 1 | 41 | Steven | 45.01 | 0.43 | 0.0003 | 150.0 | True |
| 18434 | 23 | L | G13 | 1 | 42 | Steven | 45.13 | 0.37 | 0.0002 | 190.0 | True |
| 18434 | 23 | L | G13 | 1 | 43 | Steven | 45.00 | 0.42 | 0.0005 | 170.0 | True |
| 18434 | 23 | L | G13 | 1 | 44 | Steven | 44.94 | 0.29 | 0.0000 | 270.0 | True |
| 18434 | 23 | L | G13 | 1 | 45 | Steven | 45.07 | 0.25 | 0.0004 | 200.15 | True |
| 18434 | 23 | L | G13 | 1 | 46 | Steven | 45.09 | 0.30 | 0.0001 | 240.0 | True |
| 18434 | 23 | L | G13 | 1 | 47 | Steven | 45.07 | 0.26 | 0.0000 | 344.65 | True |
| 18434 | 23 | L | G13 | 1 | 48 | Steven | 44.99 | 0.27 | 0.0001 | 250.0 | True |
| 18434 | 23 | L | G13 | 1 | 49 | Steven | 45.16 | 0.33 | 0.0003 | 160.05 | True |