Table 1.
Dataset for the test on accuracy and robustness in encoding structural ensembles.
| PDB ID | Chain | SCOP superfamily classification | H+E/L | size |
|---|---|---|---|---|
| 1a4p | A | a.39.1 | 3.18 | 92 |
| 2dn2 | C | a.1.1 | 2.92 | 141 |
| 2ilk | A | a.26.1 | 2.16 | 155 |
| 1v74 | B | a.24.20 | 1.81 | 87 |
| 2hue | C | a.22.1 | 1.34 | 82 |
| 1mz4 | A | a.3.1 | 1.30 | 131 |
| 1z5y | D | b.1.17 | 2.11 | 118 |
| 1n9r | G | b.38.1 | 2.09 | 68 |
| 2f3g | B | b.84.3 | 1.21 | 150 |
| 2z6k | D | b.40.4 | 1.09 | 117 |
| 2rac | A | b.6.1 | 0.91 | 105 |
| 1beh | B | b.17.1 | 0.69 | 183 |
| 1ay7 | B | c.9.1 | 2.30 | 89 |
| 1qjc | B | c.26.1 | 1.85 | 157 |
| 2vrw | A | c.37.1 | 1.49 | 177 |
| 2d1p | B | c.114.1 | 1.43 | 119 |
| 2trx | B | c.47.1 | 1.30 | 108 |
| 1uex | C | c.62.1 | 1.22 | 202 |
| 1gy6 | B | d.17.4 | 3.10 | 123 |
| 1oo0 | A | d.232.1 | 2.06 | 144 |
| 1gd0 | C | d.80.1 | 1.74 | 118 |
| 3eze | B | d.94.1 | 1.58 | 85 |
| 2uyz | A | d.20.1 | 1.20 | 156 |
| 2inc | C | d.15.12 | 1.07 | 83 |
H+E/L: ratio between regular (H+E) and irregular (L) secondary structure elements according to DSSP [55] (H+E = H+G+I+E and L = T+S+unassigned in the DSSP dictionary); size: number of residues.