Table 1.
Parameter | Value |
---|---|
NOE distance restraints (Total) | 1,628 |
Intraresidue | 707 |
Interresidue | 912 |
Medium | 211 |
i, i + 2 | 88 |
i, i + 3 | 65 |
i, i + 4 | 58 |
Long (|i − j| > 4) | 247 |
Hydrogen bonds | 76 |
Dihedral angle restraints, deg | |
φ (C′(i−1)–Ni–Cαi–C′i) | 60 |
ψ (Ni–Cαi–C′i–Ni+1) | 39 |
χ1 (Ni–Cαi–Cβi–Cγi) | 30 |
Ramachandran plot | |
Most favorable region, % | 60.6 |
Additionally allowed region, % | 32.7 |
Generously allowed region, % | 5.8 |
Disallowed region, % | 1.0 |
Average rmsd for distance restraints, Å | 3.97 × 10−2 |
Average rmsd for dihedral restraints, deg | 0.93 |
Average rmsd from idealized covalent geometry | |
Bonds, Å | 2.8 × 10−3 |
Angles, deg | 0.43 |
Improper angles | 0.29 |
Average rmsd to average structure, Å | 0.45 |
rmsd, rms deviation.