TABLE 2.
NMR restraints and structural statistics for the best 30 structures
| Restraints and statistics | |
|---|---|
| Total number of restraints | 885 |
| NOE restraints | 779 |
| Intraresidue (i-j = 0) | 249 |
| Sequential (|i-j| = 1) | 183 |
| Medium range (|i-j| ≤ 4) | 200 |
| Long range (|i-j| ≥ 4) | 147 |
| Dihedral angle restraints | 66 (for the φ- and ψ-angles) |
| Hydrogen-bond restraints | 20 × 2 |
| Average number of NOE violations > 0.3 Å | 0.23 |
| RMSD from average structure (residues Leu7 to Gln75) | |
| Backbone (Å) | 1.2 ± 0.1 |
| Heavy atoms (Å) | 1.8 ± 0.4 |
| Ramachandran statistics | |
| Most favored region (%) | 60.0 |
| Additionally allowed (%) | 35.3 |
| Generously allowed (%) | 4.3 |
| Disallowed (%) | 0.4 |