| no. of restraints |
|
|
|
| all distance restraints,
including hydrogen bonds |
224 |
106 |
68 |
| all NOE restraints |
192 |
87 |
59 |
| intraresidue |
89 |
50 |
33 |
| sequential residues |
65 |
26 |
20 |
| long range |
38 |
11 |
6 |
| hydrogen bond |
32 |
19 |
9 |
| dihedral restraints |
176 |
93 |
24 |
| rmsd of experimental
restraints |
|
|
|
| distances (Å) |
6.4 × 10–4
|
6.0 × 10–4
|
7.7 × 10–4
|
| dihedral angles (deg) |
1.5 |
1.1 |
0.0 |
| rmsd of structures for heavy atoms
(Å) |
|
|
|
| all residues (except
1 and 2 in the 39-mer) |
2.90 ± 0.57 |
1.23 ± 0.43 |
0.75 ± 0.21 |
| internal loop (residues
10, 11, 31, and 32) |
1.65 ± 0.28 |
0.62 ± 0.23 |
– |
| base triple (residues
16, 25, and 26) |
1.14 ± 0.18 |
– |
– |
| hairpin loop and AC
pair (residues 18–23) |
0.83 ± 0.16 |
– |
0.67 ± 0.24 |
| helix 12/30–15/27
(excluding C16-G25 and C17-G24 base pairs) |
0.47 ± 0.13 |
0.39 ± 0.20 |
– |
