Table 2. Results from Monte Carlo/MM Conformational Analysisa.
| compound | β-turn (%) | α-helix (%) | 310-helix | global minimum |
|---|---|---|---|---|
| 8a | 23 | 52 | 11 | α-helix |
| 8b | 7 | 66 | 19 | α-helix |
| 8c | 9 | 63 | 11 | α-helix |
| 8d | 18 | 50 | 19 | α-helix |
| 8e | 44 | 54 | 35 | β-turn |
| 8f | 10 | 51 | 10 | α-helix |
| 8g | 23 | 0 | 0 | n.d. |
| 8h | 14 | 52 | 5 | α-helix |
| 8i | 15 | 48 | 7 | n.d. |
| 8j | 14 | 61 | 10 | α-helix |
| 8k | 1 | 60 | 1 | α-helix |
| 8l | 46 | 30 | 4 | β-turn |
| 8m | 23 | 46 | 10 | α-helix |
| 8n | 11 | 43 | 15 | α-helix |
| 8o | 18 | 34 | 9 | β-turn |
| 8p | 39 | 23 | 5 | β-turn |
| 8q | 21 | 34 | 13 | β-turn |
| 8r | 12 | 44 | 11 | α-helix |
a
Results are reported as a percentage of conformers meeting the geometrical requirements for β-turn, α-helix, and 310-helix.