Table 5 Hydrogen bond analysis between those interacting residues and UQ with water within 5Ã… of the interacting atom
No. of hydrogen bond (HB) | 5Ã… around SER27@OG | 5Ã… around UQ@O3 | 5Ã… around ARG31@NH1 | 5Ã… around UQ@O2 | ||||
|---|---|---|---|---|---|---|---|---|
| Â | No. of trajectory | (%) | No of trajectory | (%) | No. of trajectory | (%) | No. of trajectory | (%) |
0-HB | 133 | 0.74 | 122 | 0.68 | 3025 | 16.81 | 12388 | 68.82 |
1-HB | 2673 | 14.85 | 4881 | 27.12 | 4092 | 22.73 | 5333 | 29.63 |
2-HB | 7090 | 39.40 | 10065 | 55.93 | 4632 | 25.74 | 270 | 1.50 |
3-HB | 6048 | 33.61 | 2682 | 14.90 | 3627 | 20.15 | 9 | 0.05 |
4-HB | 1611 | 8.95 | 240 | 1.33 | 1871 | 10.39 | 0 | 0 |
5-HB | 357 | 1.98 | 10 | 0.05 | 570 | 3.17 | 0 | 0 |
6-HB | 78 | 0.43 | 0 | 0 | 153 | 0.85 | 0 | 0 |
7-HB | 10 | 0.05 | 0 | 0 | 24 | 0.13 | 0 | 0 |
8-HB | 0 | 0 | 0 | 0 | 4 | 0.02 | 0 | 0 |
Total | 18000 | 100 | 18000 | 100 | 18000 | 100 | 18000 | 0 |