TABLE 2.
The occupancy of H-bonds between the template peptide and ACE2 chain A.
| Pair ID | Donor-acceptor | Occupancy (%) |
|---|---|---|
| 1 | 505TYR (HH)—37 GLU(OE2) | 31.3 |
| 2 | 505TYR (HH)—37 GLU(OE1) | 41.8 |
| 3 | 501ASN(H)—353LYS(O) | 14.6 |
| 4 | 500THR (HG1)—355ASP(OD2) | 46.3 |
| 5 | 500THR (HG1)—355ASP(OD1) | 46.2 |
| 6 | 500THR (H)—353LYS(O) | 76.4 |
| 7 | 497PHE(H)—38 ASP(OD2) | 16.6 |
| 8 | 497PHE(H)—38 ASP(OD1) | 69.9 |
| 9 | 496GLY (H)—38 ASP(OD2) | 29.3 |
| 10 | 496GLY (H)—38 ASP(OD1) | 68.3 |
| 11 | 495TYR (H)—38 ASP(OD2) | 71.1 |
| 12 | 495TYR (H)—38 ASP(OD1) | 15.6 |
| 13 | 494SER(HG)—35 GLU(OE2) | 56.8 |
| 14 | 494SER(HG)—35 GLU(OE1) | 52.9 |
| 15 | 494SER(H)—35 GLU(OE2) | 40 |
| 16 | 494SER(H)—35 GLU(OE1) | 34 |
| 17 | 490PHE(H)—75 GLU(OE2) | 33.2 |
| 18 | 490PHE(H)—75 GLU(OE1) | 40.6 |
| 19 | 487ASN(D21)—24 GLN (O) | 10.6 |
| 20 | 487ASN(H)—83 TYR (OH) | 16 |
| 21 | 393ARG (H11)—505TYR (OH) | 11.2 |
| 22 | 353LYS(HZ1)—497PHE(O) | 33.2 |
| 23 | 353LYS(H)—505TYR (OH) | 12.9 |
| 24 | 83TYR (HH)—487ASN(OD1) | 14.5 |