| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42 | Very low | 77.1 | Confident | 241 Ų | 241 | 112.6 Ų | 112.6 | 100% | 1.187 | 63% | 0.631 | S | S | * | * | 0 | 112.4 | 0 | -68.1 | 170.9 | 175 | 0 | 0 | 106.4 | A3 | M1-A3 PolarHBondContact O-N 3.36Š| |||
| 2 | A | 55.2 | Low | 78.6 | Confident | 94 Ų | 94 | 113.2 Ų | 113.2 | 78% | 0.777 | 62% | 0.621 | S | S | * | * | trans | -59.4 | 112.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 105.3 | Q4 | A2-Q4 VanDerWaalsContact C-N 3.31Å; A2-Q4 PolarHBondContact O-N 3.34Å | ||
| 3 | A | 66.8 | Low | 79.9 | Confident | 91 Ų | 91 | 112.5 Ų | 112.5 | 75% | 0.752 | 61% | 0.611 | S | S | * | * | trans | -56.1 | 106.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 105.2 | M1 I5 | M1-A3 PolarHBondContact O-N 3.36Å; A3-I5 VanDerWaalsContact C-N 3.29Å; A3-I5 PolarHBondContact O-N 3.04Å | ||
| 4 | Q | 68.8 | Low | 81 | Confident | 187 Ų | 187 | 113.1 Ų | 113.1 | 87% | 0.874 | 61% | 0.605 | S | S | * | * | trans | -61.1 | 106.3 | 171 | -70.5 | 178.2 | 25.1 | 0 | 0 | 103.8 | A2 P6 | A2-Q4 VanDerWaalsContact C-N 3.31Å; A2-Q4 PolarHBondContact O-N 3.34Å; Q4-P6 VanDerWaalsContact O-N 3.09Å | ||
| 5 | I | 72.5 | Confident | 82.1 | Confident | 74 Ų | 74 | 115 Ų | 115 | 38% | 0.379 | 61% | 0.606 | S | S | . | * | trans | -49.8 | 121.6 | 170.6 | -61.5 | 176.2 | 0 | 0 | 0 | 104.2 | A3 E7 D9 Q10 | A3-I5 VanDerWaalsContact C-N 3.29Å; A3-I5 PolarHBondContact O-N 3.04Å; I5-E7 PolarHBondContact O-N 3.31Å; I5-D9 HydrophobicContact CG2-CB 3.29Å; I5-Q10 HydrophobicContact CB-CG 3.95Å; I5-Q10 HydrophobicContact CG2-CG 3.76Å; I5-Q10 PolarHBondContact O-OE1 3.3Å | ||
| 6 | P | 83.5 | Confident | 82.9 | Confident | 71 Ų | 71 | 114.8 Ų | 114.8 | 46% | 0.461 | 60% | 0.601 | S | S | . | * | trans | -56.2 | 143.5 | -178 | 25.7 | -34.7 | 0 | 0 | 0 | 108.2 | Q4 S8 D9 Q10 | Q4-P6 VanDerWaalsContact O-N 3.09Å; P6-S8 PolarHBondContact O-N 3.13Å; P6-D9 HydrophobicContact CG-CB 3.99Å; P6-D9 WeakPolarHBondContact CG-OD2 3.37Å; P6-D9 WeakPolarHBondContact O-CA 3.27Å; P6-D9 WeakPolarHBondContact O-CB 3.45Å; P6-D9 PolarHBondContact O-N 2.92Å; P6-Q10 PolarHBondContact O-N 3.39Å | ||
| 7 | E | 88.1 | Confident | 83.7 | Confident | 146 Ų | 146 | 115.3 Ų | 115.3 | 68% | 0.682 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -51.2 | -33.8 | -173 | -167.5 | -179.6 | 90.7 | 0 | 0 | 112.2 | I5 D9 Q10 I11 | I5-E7 PolarHBondContact O-N 3.31Å; E7-D9 PolarHBondContact O-N 3.3Å; E7-Q10 PolarHBondContact O-N 3.07Å; E7-I11 HydrophobicContact CG-CD1 4.28Å; E7-I11 VanDerWaalsContact O-CG1 3.32Å; E7-I11 WeakPolarHBondContact O-CG1 3.31Å; E7-I11 PolarHBondContact O-N 2.85Å |
| 8 | S | 91.4 | Very high | 84.5 | Confident | 76 Ų | 76 | 112.7 Ų | 112.7 | 53% | 0.531 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -57.1 | -42.4 | 172.3 | 52.6 | 0 | 0 | 0 | 0 | 114.5 | P6 K12 | P6-S8 PolarHBondContact O-N 3.13Å; S8-K12 WeakPolarHBondContact O-CB 3.39Å; S8-K12 PolarHBondContact O-N 3.34Å |
| 9 | D | 92.8 | Very high | 85.1 | Confident | 69 Ų | 69 | 108.9 Ų | 108.9 | 37% | 0.369 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -72.8 | -34.9 | 178.2 | -86.2 | -90.9 | 0 | 0 | 0 | 111.1 | I5 P6 E7 K12 Q13 | I5-D9 HydrophobicContact CG2-CB 3.29Å; P6-D9 HydrophobicContact CG-CB 3.99Å; P6-D9 WeakPolarHBondContact CG-OD2 3.37Å; P6-D9 WeakPolarHBondContact O-CA 3.27Å; P6-D9 WeakPolarHBondContact O-CB 3.45Å; P6-D9 PolarHBondContact O-N 2.92Å; E7-D9 PolarHBondContact O-N 3.3Å; D9-K12 PolarHBondContact O-N 3.41Å; D9-Q13 VanDerWaalsContact O-CG 3.3Å; D9-Q13 WeakPolarHBondContact O-CG 3.43Å; D9-Q13 PolarHBondContact O-N 3.39Å |
| 10 | Q | 93.4 | Very high | 85.7 | Confident | 108 Ų | 108 | 106.9 Ų | 106.9 | 51% | 0.505 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.4 | -45.4 | 172.9 | -61.9 | -178.2 | -92.6 | 0 | 0 | 111.3 | I5 P6 E7 K12 Q13 F14 | I5-Q10 HydrophobicContact CB-CG 3.95Å; I5-Q10 HydrophobicContact CG2-CG 3.76Å; I5-Q10 PolarHBondContact O-OE1 3.3Å; P6-Q10 PolarHBondContact O-N 3.39Å; E7-Q10 PolarHBondContact O-N 3.07Å; Q10-K12 VanDerWaalsContact C-N 3.29Å; Q10-K12 PolarHBondContact O-N 3.36Å; Q10-Q13 PolarHBondContact O-N 3Å; Q10-F14 PolarHBondContact O-N 3.31Å |
| 11 | I | 93.9 | Very high | 86.2 | Confident | 82 Ų | 82 | 108.1 Ų | 108.1 | 42% | 0.421 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.4 | -40.7 | 176 | -67.9 | 165.6 | 0 | 0 | 0 | 110.5 | E7 F14 K15 | E7-I11 HydrophobicContact CG-CD1 4.28Å; E7-I11 VanDerWaalsContact O-CG1 3.32Å; E7-I11 WeakPolarHBondContact O-CG1 3.31Å; E7-I11 PolarHBondContact O-N 2.85Å; I11-F14 PolarHBondContact O-N 3.22Å; I11-K15 HydrophobicContact CG2-CD 4.37Å; I11-K15 WeakPolarHBondContact O-CG 3.37Å; I11-K15 PolarHBondContact O-N 2.92Å |
| 12 | K | 95.4 | Very high | 88.8 | Confident | 119 Ų | 119 | 101.4 Ų | 101.4 | 52% | 0.517 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.3 | -50 | 176.7 | -175.1 | -171.9 | 168.2 | -168.7 | 0 | 111.5 | S8 D9 Q10 F14 K15 E16 | S8-K12 WeakPolarHBondContact O-CB 3.39Å; S8-K12 PolarHBondContact O-N 3.34Å; D9-K12 PolarHBondContact O-N 3.41Å; Q10-K12 VanDerWaalsContact C-N 3.29Å; Q10-K12 PolarHBondContact O-N 3.36Å; K12-F14 VanDerWaalsContact C-N 3.27Å; K12-F14 PolarHBondContact O-N 2.94Å; K12-K15 WeakPolarHBondContact O-CB 3.45Å; K12-K15 PolarHBondContact O-N 3.06Å; K12-K15 VanDerWaalsContact O-N 3.09Å; K12-E16 WeakPolarHBondContact O-CG 3.42Å; K12-E16 PolarHBondContact O-N 2.91Å |
| 13 | Q | 95.3 | Very high | 90.8 | Very high | 105 Ų | 105 | 103.2 Ų | 103.2 | 49% | 0.491 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.5 | -41.1 | 177 | -72.9 | 175.5 | 10.1 | 0 | 0 | 111.9 | D9 Q10 E16 F17 | D9-Q13 VanDerWaalsContact O-CG 3.3Å; D9-Q13 WeakPolarHBondContact O-CG 3.43Å; D9-Q13 PolarHBondContact O-N 3.39Å; Q10-Q13 PolarHBondContact O-N 3Å; Q13-E16 PolarHBondContact O-N 3.49Å; Q13-F17 WeakPolarHBondContact O-CB 3.24Å; Q13-F17 PolarHBondContact O-N 2.91Å |
| 14 | F | 95.1 | Very high | 92.3 | Very high | 120 Ų | 120 | 99.5 Ų | 99.5 | 53% | 0.526 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.7 | -40.6 | 176.4 | -172.6 | -113.1 | 0 | 0 | 0 | 112.3 | Q10 I11 K12 F17 L18 | Q10-F14 PolarHBondContact O-N 3.31Å; I11-F14 PolarHBondContact O-N 3.22Å; K12-F14 VanDerWaalsContact C-N 3.27Å; K12-F14 PolarHBondContact O-N 2.94Å; F14-F17 HydrophobicContact CD2-CD1 4.41Å; F14-F17 HydrophobicContact CE2-CD1 4.34Å; F14-F17 WeakPolarHBondContact O-CB 3.46Å; F14-F17 PolarHBondContact O-N 3.07Å; F14-L18 HydrophobicContact CD1-CD1 3.91Å; F14-L18 HydrophobicContact CD1-CG 4.33Å; F14-L18 HydrophobicContact CE1-CD1 3.51Å; F14-L18 HydrophobicContact CE1-CD2 4.41Å; F14-L18 HydrophobicContact CE1-CG 4.02Å; F14-L18 HydrophobicContact CE2-CD2 4.49Å; F14-L18 HydrophobicContact CE2-CG 4.49Å; F14-L18 HydrophobicContact CZ-CD1 4.02Å; F14-L18 HydrophobicContact CZ-CD2 4.06Å; F14-L18 HydrophobicContact CZ-CG 4.09Å; F14-L18 WeakPolarHBondContact O-CG 3.04Å; F14-L18 PolarHBondContact O-N 3.09Å |
| 15 | K | 96.8 | Very high | 93.6 | Very high | 142 Ų | 142 | 94 Ų | 94 | 62% | 0.617 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.5 | -41.9 | 173.9 | -73.7 | 176.3 | 179.2 | -179.7 | 0 | 112.2 | I11 K12 F17 L18 G19 | I11-K15 HydrophobicContact CG2-CD 4.37Å; I11-K15 WeakPolarHBondContact O-CG 3.37Å; I11-K15 PolarHBondContact O-N 2.92Å; K12-K15 WeakPolarHBondContact O-CB 3.45Å; K12-K15 PolarHBondContact O-N 3.06Å; K12-K15 VanDerWaalsContact O-N 3.09Å; K15-F17 VanDerWaalsContact C-N 3.33Å; K15-L18 PolarHBondContact O-N 2.94Å; K15-G19 PolarHBondContact O-N 3.48Å |
| 16 | E | 96.2 | Very high | 94.9 | Very high | 111 Ų | 111 | 96.6 Ų | 96.6 | 52% | 0.519 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.9 | -40.3 | 176.2 | -68.8 | -178.6 | 94 | 0 | 0 | 111.6 | K12 Q13 G19 T20 | K12-E16 WeakPolarHBondContact O-CG 3.42Å; K12-E16 PolarHBondContact O-N 2.91Å; Q13-E16 PolarHBondContact O-N 3.49Å; E16-G19 PolarHBondContact O-N 3.34Å; E16-T20 PolarHBondContact O-N 3.33Å; E16-T20 PolarHBondContact O-OG1 3.34Å |
| 17 | F | 95.9 | Very high | 95.6 | Very high | 124 Ų | 124 | 95.9 Ų | 95.9 | 54% | 0.544 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.4 | -49.5 | 172.5 | 171.5 | -98.9 | 0 | 0 | 0 | 111.8 | Q13 F14 K15 G19 T20 Y21 | Q13-F17 WeakPolarHBondContact O-CB 3.24Å; Q13-F17 PolarHBondContact O-N 2.91Å; F14-F17 HydrophobicContact CD2-CD1 4.41Å; F14-F17 HydrophobicContact CE2-CD1 4.34Å; F14-F17 WeakPolarHBondContact O-CB 3.46Å; F14-F17 PolarHBondContact O-N 3.07Å; K15-F17 VanDerWaalsContact C-N 3.33Å; F17-G19 VanDerWaalsContact C-N 3.32Å; F17-G19 PolarHBondContact O-N 3.02Å; F17-T20 WeakPolarHBondContact O-CB 3.36Å; F17-T20 PolarHBondContact O-N 3.49Å; F17-T20 VanDerWaalsContact O-N 3.17Å; F17-Y21 WeakPolarHBondContact O-CB 3.45Å; F17-Y21 PolarHBondContact O-N 3.21Å |
| 18 | L | 97.2 | Very high | 96.1 | Very high | 68 Ų | 68 | 89.4 Ų | 89.4 | 36% | 0.356 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.1 | -40 | 177.7 | -71.3 | 179.2 | 0 | 0 | 0 | 112.2 | F14 K15 T20 Y21 N22 | F14-L18 HydrophobicContact CD1-CD1 3.91Å; F14-L18 HydrophobicContact CD1-CG 4.33Å; F14-L18 HydrophobicContact CE1-CD1 3.51Å; F14-L18 HydrophobicContact CE1-CD2 4.41Å; F14-L18 HydrophobicContact CE1-CG 4.02Å; F14-L18 HydrophobicContact CE2-CD2 4.49Å; F14-L18 HydrophobicContact CE2-CG 4.49Å; F14-L18 HydrophobicContact CZ-CD1 4.02Å; F14-L18 HydrophobicContact CZ-CD2 4.06Å; F14-L18 HydrophobicContact CZ-CG 4.09Å; F14-L18 WeakPolarHBondContact O-CG 3.04Å; F14-L18 PolarHBondContact O-N 3.09Å; K15-L18 PolarHBondContact O-N 2.94Å; L18-T20 VanDerWaalsContact C-N 3.33Å; L18-T20 PolarHBondContact O-N 2.96Å; L18-Y21 PolarHBondContact O-N 3.48Å; L18-N22 PolarHBondContact O-N 3.42Å |
| 19 | G | 97.1 | Very high | 96.4 | Very high | 42 Ų | 42 | 90.8 Ų | 90.8 | 43% | 0.433 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61 | -43 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | K15 E16 F17 K23 | K15-G19 PolarHBondContact O-N 3.48Å; E16-G19 PolarHBondContact O-N 3.34Å; F17-G19 VanDerWaalsContact C-N 3.32Å; F17-G19 PolarHBondContact O-N 3.02Å; G19-K23 WeakPolarHBondContact O-CB 3.38Å; G19-K23 PolarHBondContact O-N 2.89Å; G19-K23 VanDerWaalsContact O-N 3.11Å |
| 20 | T | 95.7 | Very high | 96.6 | Very high | 67 Ų | 67 | 93.2 Ų | 93.2 | 41% | 0.411 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.8 | -42.8 | 175.6 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | E16 F17 L18 K23 L24 Y56 | E16-T20 PolarHBondContact O-N 3.33Å; E16-T20 PolarHBondContact O-OG1 3.34Å; F17-T20 WeakPolarHBondContact O-CB 3.36Å; F17-T20 PolarHBondContact O-N 3.49Å; F17-T20 VanDerWaalsContact O-N 3.17Å; L18-T20 VanDerWaalsContact C-N 3.33Å; L18-T20 PolarHBondContact O-N 2.96Å; T20-K23 PolarHBondContact O-N 3.25Å; T20-L24 VanDerWaalsContact O-CB 3.28Å; T20-L24 WeakPolarHBondContact O-CB 3.47Å; T20-L24 PolarHBondContact O-N 3.48Å; T20-Y56 HydrophobicContact CG2-CE1 4.16Å |
| 21 | Y | 96.6 | Very high | 96.8 | Very high | 133 Ų | 133 | 93.7 Ų | 93.7 | 52% | 0.522 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.7 | -46.1 | 177.7 | 179.7 | -93 | 0 | 0 | 0 | 112.2 | F17 L18 L24 T25 | F17-Y21 WeakPolarHBondContact O-CB 3.45Å; F17-Y21 PolarHBondContact O-N 3.21Å; L18-Y21 PolarHBondContact O-N 3.48Å; Y21-L24 PolarHBondContact O-N 3.45Å; Y21-T25 WeakPolarHBondContact O-CB 3.41Å; Y21-T25 PolarHBondContact O-N 2.67Å; Y21-T25 PolarHBondContact O-OG1 3.03Å |
| 22 | N | 97.6 | Very high | 97.1 | Very high | 100 Ų | 100 | 90 Ų | 90 | 54% | 0.535 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.6 | -48.1 | 178.5 | -72.2 | -12.7 | 0 | 0 | 0 | 111.4 | L18 L24 T25 E26 | L18-N22 PolarHBondContact O-N 3.42Å; N22-L24 VanDerWaalsContact C-N 3.29Å; N22-L24 PolarHBondContact O-N 2.96Å; N22-T25 PolarHBondContact O-N 3.02Å; N22-E26 WeakPolarHBondContact O-CB 3.33Å; N22-E26 PolarHBondContact O-N 3.3Å |
| 23 | K | 97.3 | Very high | 97.2 | Very high | 133 Ų | 133 | 85.7 Ų | 85.7 | 58% | 0.578 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -58.6 | -42.5 | 178.2 | 179.6 | 175.2 | -179.7 | 176 | 0 | 112 | G19 T20 T27 | G19-K23 WeakPolarHBondContact O-CB 3.38Å; G19-K23 PolarHBondContact O-N 2.89Å; G19-K23 VanDerWaalsContact O-N 3.11Å; T20-K23 PolarHBondContact O-N 3.25Å; K23-T27 WeakPolarHBondContact O-CB 3.31Å; K23-T27 PolarHBondContact O-N 3.21Å; K23-T27 PolarHBondContact O-OG1 2.97Å |
| 24 | L | 97.7 | Very high | 97.2 | Very high | 13 Ų | 13 | 87.8 Ų | 87.8 | 7% | 0.068 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -68.2 | -46.1 | 179.7 | -179.6 | 51.4 | 0 | 0 | 0 | 111.7 | T20 Y21 N22 E26 T27 C28 L53 Y56 | T20-L24 VanDerWaalsContact O-CB 3.28Å; T20-L24 WeakPolarHBondContact O-CB 3.47Å; T20-L24 PolarHBondContact O-N 3.48Å; Y21-L24 PolarHBondContact O-N 3.45Å; N22-L24 VanDerWaalsContact C-N 3.29Å; N22-L24 PolarHBondContact O-N 2.96Å; L24-E26 VanDerWaalsContact C-N 3.32Å; L24-E26 PolarHBondContact O-N 3.41Å; L24-T27 PolarHBondContact O-N 3Å; L24-C28 PolarHBondContact O-N 3.44Å; L24-C28 PolarHBondContact O-SG 2.88Å; L24-L53 HydrophobicContact CD2-CD1 3.31Å; L24-L53 HydrophobicContact CG-CD1 4.24Å; L24-Y56 VanDerWaalsContact CD1-CB 3.5Å; L24-Y56 HydrophobicContact CD1-CD1 3.75Å; L24-Y56 HydrophobicContact CD1-CD2 3.67Å; L24-Y56 HydrophobicContact CD1-CE1 4.37Å; L24-Y56 HydrophobicContact CD1-CE2 4.3Å; L24-Y56 HydrophobicContact CD1-CG 3.35Å; L24-Y56 HydrophobicContact CD2-CD1 3.47Å; L24-Y56 VanDerWaalsContact CD2-CD1 3.47Å; L24-Y56 HydrophobicContact CD2-CE1 3.96Å; L24-Y56 HydrophobicContact CD2-CG 3.98Å; L24-Y56 HydrophobicContact CG-CD1 4.16Å; L24-Y56 HydrophobicContact CG-CG 4.26Å |
| 25 | T | 97.1 | Very high | 97.2 | Very high | 70 Ų | 70 | 83.8 Ų | 83.8 | 43% | 0.429 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -59.2 | -44.1 | 176.8 | -57.4 | 0 | 0 | 0 | 0 | 111.1 | Y21 N22 C28 F29 | Y21-T25 WeakPolarHBondContact O-CB 3.41Å; Y21-T25 PolarHBondContact O-N 2.67Å; Y21-T25 PolarHBondContact O-OG1 3.03Å; N22-T25 PolarHBondContact O-N 3.02Å; T25-C28 PolarHBondContact O-N 3.22Å; T25-F29 VanDerWaalsContact O-CB 3.24Å; T25-F29 WeakPolarHBondContact O-CB 3.42Å; T25-F29 PolarHBondContact O-N 3.4Å |
| 26 | E | 98.2 | Very high | 97.2 | Very high | 130 Ų | 130 | 84.3 Ų | 84.3 | 61% | 0.607 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -60.9 | -47.5 | 175.7 | -175.5 | -175.1 | 134 | 0 | 0 | 111.7 | N22 L24 C28 F29 L30 | N22-E26 WeakPolarHBondContact O-CB 3.33Å; N22-E26 PolarHBondContact O-N 3.3Å; L24-E26 VanDerWaalsContact C-N 3.32Å; L24-E26 PolarHBondContact O-N 3.41Å; E26-C28 PolarHBondContact O-N 3.41Å; E26-F29 PolarHBondContact O-N 3.1Å; E26-L30 HydrophobicContact CG-CD1 4.24Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.18Å |
| 27 | T | 98.2 | Very high | 97.2 | Very high | 55 Ų | 55 | 84.7 Ų | 84.7 | 34% | 0.337 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.9 | -50.6 | 179.1 | -55.3 | 0 | 0 | 0 | 0 | 110.9 | K23 L24 F29 L30 D31 | K23-T27 WeakPolarHBondContact O-CB 3.31Å; K23-T27 PolarHBondContact O-N 3.21Å; K23-T27 PolarHBondContact O-OG1 2.97Å; L24-T27 PolarHBondContact O-N 3Å; T27-F29 VanDerWaalsContact C-N 3.32Å; T27-F29 PolarHBondContact O-N 3.45Å; T27-L30 PolarHBondContact O-N 3.44Å; T27-D31 PolarHBondContact O-N 3Å |
| 28 | C | 98.5 | Very high | 97.2 | Very high | 10 Ų | 10 | 81.9 Ų | 81.9 | 7% | 0.068 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -66.8 | -33.7 | -179.7 | -65.1 | 0 | 0 | 0 | 0 | 112.3 | L24 T25 E26 D31 C32 C52 | L24-C28 PolarHBondContact O-N 3.44Å; L24-C28 PolarHBondContact O-SG 2.88Å; T25-C28 PolarHBondContact O-N 3.22Å; E26-C28 PolarHBondContact O-N 3.41Å; C28-D31 PolarHBondContact O-N 3.33Å; C28-C32 WeakPolarHBondContact O-CB 3.31Å; C28-C32 PolarHBondContact O-N 3.49Å; C28-C52 WeakPolarHBondContact CA-SG 3.48Å; C28-C52 HydrophobicContact CB-CB 3.79Å; C28-C52 WeakPolarHBondContact CB-SG 3.06Å; C28-C52 WeakPolarHBondContact SG-CB 3.37Å; C28-C52 CovalentContact SG-SG 2.05Å; C28-C52 PolarHBondContact SG-SG 2.88Å |
| 29 | F | 98.1 | Very high | 97.1 | Very high | 106 Ų | 106 | 90.9 Ų | 90.9 | 47% | 0.465 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61 | -49.6 | 173.6 | 178.5 | -92.6 | 0 | 0 | 0 | 111.1 | T25 E26 T27 D31 C32 V33 F36 | T25-F29 VanDerWaalsContact O-CB 3.24Å; T25-F29 WeakPolarHBondContact O-CB 3.42Å; T25-F29 PolarHBondContact O-N 3.4Å; E26-F29 PolarHBondContact O-N 3.1Å; T27-F29 VanDerWaalsContact C-N 3.32Å; T27-F29 PolarHBondContact O-N 3.45Å; F29-D31 VanDerWaalsContact C-N 3.33Å; F29-D31 PolarHBondContact O-N 2.91Å; F29-C32 PolarHBondContact O-N 2.97Å; F29-V33 HydrophobicContact CD2-CB 3.99Å; F29-V33 HydrophobicContact CD2-CG2 3.57Å; F29-V33 HydrophobicContact CE2-CB 3.88Å; F29-V33 HydrophobicContact CE2-CG1 3.92Å; F29-V33 HydrophobicContact CE2-CG2 3.81Å; F29-V33 HydrophobicContact CG-CB 4.49Å; F29-V33 HydrophobicContact CG-CG2 4.28Å; F29-V33 HydrophobicContact CZ-CB 4.29Å; F29-V33 HydrophobicContact CZ-CG1 4.22Å; F29-V33 WeakPolarHBondContact O-CB 3.35Å; F29-V33 PolarHBondContact O-N 2.89Å; F29-F36 HydrophobicContact CZ-CE1 4.25Å; F29-F36 HydrophobicContact CZ-CZ 4.41Å |
| 30 | L | 97.8 | Very high | 97.1 | Very high | 120 Ų | 120 | 96.6 Ų | 96.6 | 63% | 0.628 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.5 | -34.8 | -179.9 | -68 | 173.9 | 0 | 0 | 0 | 113.1 | E26 T27 | E26-L30 HydrophobicContact CG-CD1 4.24Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.18Å; T27-L30 PolarHBondContact O-N 3.44Å |
| 31 | D | 98.1 | Very high | 97.1 | Very high | 117 Ų | 117 | 97.9 Ų | 97.9 | 63% | 0.626 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -80.6 | -31.1 | -179.7 | -75 | -27.9 | 0 | 0 | 0 | 113.2 | T27 C28 F29 | T27-D31 PolarHBondContact O-N 3Å; C28-D31 PolarHBondContact O-N 3.33Å; F29-D31 VanDerWaalsContact C-N 3.33Å; F29-D31 PolarHBondContact O-N 2.91Å |
| 32 | C | 98.4 | Very high | 97 | Very high | 4 Ų | 4 | 94.6 Ų | 94.6 | 3% | 0.027 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -110.3 | -32.7 | -168.5 | -66.4 | 0 | 0 | 0 | 0 | 115.1 | C28 F29 K34 E45 C48 S49 | C28-C32 WeakPolarHBondContact O-CB 3.31Å; C28-C32 PolarHBondContact O-N 3.49Å; F29-C32 PolarHBondContact O-N 2.97Å; C32-K34 PolarHBondContact O-N 3.02Å; C32-E45 WeakPolarHBondContact O-CG 3.3Å; C32-C48 WeakPolarHBondContact CA-SG 3.2Å; C32-C48 HydrophobicContact CB-CB 3.57Å; C32-C48 WeakPolarHBondContact CB-SG 3.49Å; C32-C48 WeakPolarHBondContact SG-CB 3.45Å; C32-C48 PolarHBondContact SG-O 2.91Å; C32-C48 VanDerWaalsContact SG-O 3.33Å; C32-C48 CovalentContact SG-SG 2.05Å; C32-C48 PolarHBondContact SG-SG 2.95Å; C32-S49 PolarHBondContact SG-N 3.34Å; C32-S49 VanDerWaalsContact SG-N 3.39Å |
| 33 | V | 97.5 | Very high | 97 | Very high | 29 Ų | 29 | 94.6 Ų | 94.6 | 18% | 0.176 | 47% | 0.47 | C | S | . | . | trans | -88.9 | 110.4 | -178.4 | -175.3 | 0 | 0 | 0 | 0 | 108.8 | F29 F36 | F29-V33 HydrophobicContact CD2-CB 3.99Å; F29-V33 HydrophobicContact CD2-CG2 3.57Å; F29-V33 HydrophobicContact CE2-CB 3.88Å; F29-V33 HydrophobicContact CE2-CG1 3.92Å; F29-V33 HydrophobicContact CE2-CG2 3.81Å; F29-V33 HydrophobicContact CG-CB 4.49Å; F29-V33 HydrophobicContact CG-CG2 4.28Å; F29-V33 HydrophobicContact CZ-CB 4.29Å; F29-V33 HydrophobicContact CZ-CG1 4.22Å; F29-V33 WeakPolarHBondContact O-CB 3.35Å; F29-V33 PolarHBondContact O-N 2.89Å; V33-F36 HydrophobicContact CG1-CE1 3.86Å; V33-F36 HydrophobicContact CG1-CZ 3.88Å | ||
| 34 | K | 95.6 | Very high | 97 | Very high | 150 Ų | 150 | 94.3 Ų | 94.3 | 65% | 0.652 | 47% | 0.471 | S | S | * | . | trans | -128.6 | -21.5 | -170.3 | 62.8 | -176.2 | 177.3 | -177.7 | 0 | 113 | C32 E45 | C32-K34 PolarHBondContact O-N 3.02Å; K34-E45 PolarHBondContact N-OE1 2.94Å | ||
| 35 | D | 95.8 | Very high | 97.1 | Very high | 36 Ų | 36 | 93.9 Ų | 93.9 | 19% | 0.193 | 47% | 0.469 | C | S | . | . | trans | -105.1 | 114.4 | -179.7 | -163.8 | -77.6 | 0 | 0 | 0 | 111.5 | T37 K42 E45 | D35-T37 WeakPolarHBondContact OD1-CB 3.43Å; D35-T37 PolarHBondContact OD1-N 2.87Å; D35-T37 PolarHBondContact OD1-OG1 3.45Å; D35-T37 PolarHBondContact OD2-OG1 3.29Å; D35-K42 HydrophobicContact CB-CD 3.92Å; D35-K42 IonicContact OD1-NZ 3.51Å; D35-K42 WeakPolarHBondContact OD2-CE 3.45Å; D35-K42 IonicContact OD2-NZ 2.65Å; D35-K42 PolarHBondContact OD2-NZ 3.33Å; D35-E45 PolarHBondContact N-OE1 3.5Å | ||
| 36 | F | 96.4 | Very high | 97.1 | Very high | 153 Ų | 153 | 93.5 Ų | 93.5 | 67% | 0.671 | 47% | 0.467 | S | S | * | . | trans | -109.8 | 20 | 176.9 | -59 | -80.9 | 0 | 0 | 0 | 112 | F29 V33 | F29-F36 HydrophobicContact CZ-CE1 4.25Å; F29-F36 HydrophobicContact CZ-CZ 4.41Å; V33-F36 HydrophobicContact CG1-CE1 3.86Å; V33-F36 HydrophobicContact CG1-CZ 3.88Å | ||
| 37 | T | 96.7 | Very high | 97.1 | Very high | 118 Ų | 118 | 90.3 Ų | 90.3 | 72% | 0.724 | 46% | 0.456 | S | S | * | . | S | Bend | trans | -91.4 | -21.6 | -178.6 | 71.1 | 0 | 0 | 0 | 0 | 112.5 | D35 | D35-T37 WeakPolarHBondContact OD1-CB 3.43Å; D35-T37 PolarHBondContact OD1-N 2.87Å; D35-T37 PolarHBondContact OD1-OG1 3.45Å; D35-T37 PolarHBondContact OD2-OG1 3.29Å |
| 38 | T | 95.3 | Very high | 97.1 | Very high | 66 Ų | 66 | 89.9 Ų | 89.9 | 41% | 0.405 | 46% | 0.455 | S | S | . | . | S | Bend | trans | -113.8 | 156.5 | 177.1 | 55.9 | 0 | 0 | 0 | 0 | 111.5 | E40 | T38-E40 VanDerWaalsContact C-N 3.28Å; T38-E40 PolarHBondContact OG1-O 3.49Å; T38-E40 VanDerWaalsContact OG1-O 3.07Å |
| 39 | R | 95.8 | Very high | 97.1 | Very high | 257 Ų | 257 | 91.3 Ų | 91.3 | 97% | 0.97 | 47% | 0.465 | S | S | * | . | S | Bend | trans | -79.3 | -14.2 | 172.6 | -69.4 | -177 | 174.5 | -178.5 | -1.5 | 113.2 | ||
| 40 | E | 96 | Very high | 97.1 | Very high | 162 Ų | 162 | 91.7 Ų | 91.7 | 76% | 0.757 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -99.3 | 141.2 | -177 | -63 | 174.4 | 97.7 | 0 | 0 | 109.9 | T38 | T38-E40 VanDerWaalsContact C-N 3.28Å; T38-E40 PolarHBondContact OG1-O 3.49Å; T38-E40 VanDerWaalsContact OG1-O 3.07Å |
| 41 | V | 95.7 | Very high | 97.1 | Very high | 93 Ų | 93 | 91.9 Ų | 91.9 | 56% | 0.564 | 47% | 0.465 | S | S | * | . | P | Polyproline II helix | trans | -73.3 | 123.9 | 171.6 | -178.9 | 0 | 0 | 0 | 0 | 108.1 | E45 | V41-E45 HydrophobicContact CG1-CB 3.85Š|
| 42 | K | 96.4 | Very high | 97.2 | Very high | 64 Ų | 64 | 87.4 Ų | 87.4 | 28% | 0.278 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -68.6 | 147.4 | -177.8 | -67.2 | -178.7 | 176.6 | -176.3 | 0 | 109.9 | D35 E44 E45 T46 | D35-K42 HydrophobicContact CB-CD 3.92Å; D35-K42 IonicContact OD1-NZ 3.51Å; D35-K42 WeakPolarHBondContact OD2-CE 3.45Å; D35-K42 IonicContact OD2-NZ 2.65Å; D35-K42 PolarHBondContact OD2-NZ 3.33Å; K42-E44 PolarHBondContact O-N 3.07Å; K42-E44 VanDerWaalsContact O-N 3.1Å; K42-E45 HydrophobicContact CB-CG 4.09Å; K42-E45 PolarHBondContact N-OE2 3.43Å; K42-E45 WeakPolarHBondContact O-CB 3.45Å; K42-E45 PolarHBondContact O-N 3Å; K42-T46 PolarHBondContact O-N 2.94Å; K42-T46 VanDerWaalsContact O-N 3.11Å; K42-T46 PolarHBondContact O-OG1 3.45Å |
| 43 | P | 97.3 | Very high | 97.1 | Very high | 101 Ų | 101 | 90.7 Ų | 90.7 | 66% | 0.656 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -55.8 | -33.7 | 180 | 22 | -33.6 | 0 | 0 | 0 | 112.6 | E45 T46 T47 | P43-E45 PolarHBondContact O-N 2.75Å; P43-T46 PolarHBondContact O-N 2.94Å; P43-T47 PolarHBondContact O-N 3.48Å; P43-T47 PolarHBondContact O-OG1 3.41Å; P43-T47 VanDerWaalsContact O-OG1 3.14Å |
| 44 | E | 97.4 | Very high | 97.1 | Very high | 127 Ų | 127 | 93.9 Ų | 93.9 | 59% | 0.593 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.4 | -38.2 | 175.3 | -57.7 | 176.6 | 103.3 | 0 | 0 | 113 | K42 C48 | K42-E44 PolarHBondContact O-N 3.07Å; K42-E44 VanDerWaalsContact O-N 3.1Å; E44-C48 VanDerWaalsContact O-CB 3.25Å; E44-C48 WeakPolarHBondContact O-CB 3.19Å; E44-C48 PolarHBondContact O-N 2.77Å |
| 45 | E | 98.1 | Very high | 97.3 | Very high | 3 Ų | 3 | 94.3 Ų | 94.3 | 1% | 0.014 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -71.8 | -38.3 | 178.5 | -58.3 | 178.4 | 129.3 | 0 | 0 | 110.6 | C32 K34 D35 V41 K42 P43 C48 S49 | C32-E45 WeakPolarHBondContact O-CG 3.3Å; K34-E45 PolarHBondContact N-OE1 2.94Å; D35-E45 PolarHBondContact N-OE1 3.5Å; V41-E45 HydrophobicContact CG1-CB 3.85Å; K42-E45 HydrophobicContact CB-CG 4.09Å; K42-E45 PolarHBondContact N-OE2 3.43Å; K42-E45 WeakPolarHBondContact O-CB 3.45Å; K42-E45 PolarHBondContact O-N 3Å; P43-E45 PolarHBondContact O-N 2.75Å; E45-C48 PolarHBondContact O-N 3.01Å; E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 2.9Å; E45-S49 PolarHBondContact O-OG 3.26Å |
| 46 | T | 97.8 | Very high | 97.4 | Very high | 63 Ų | 63 | 95.1 Ų | 95.1 | 39% | 0.387 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.5 | -53.9 | 172.4 | -57.9 | 0 | 0 | 0 | 0 | 111 | K42 P43 C48 S49 E50 | K42-T46 PolarHBondContact O-N 2.94Å; K42-T46 VanDerWaalsContact O-N 3.11Å; K42-T46 PolarHBondContact O-OG1 3.45Å; P43-T46 PolarHBondContact O-N 2.94Å; T46-C48 VanDerWaalsContact C-N 3.31Å; T46-C48 PolarHBondContact O-N 3Å; T46-S49 WeakPolarHBondContact O-CB 3.49Å; T46-S49 PolarHBondContact O-N 3.32Å; T46-S49 VanDerWaalsContact O-N 3.1Å; T46-E50 PolarHBondContact O-N 3.26Å |
| 47 | T | 98.4 | Very high | 97.4 | Very high | 63 Ų | 63 | 91.3 Ų | 91.3 | 39% | 0.387 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.2 | -39.4 | 178.5 | -60.6 | 0 | 0 | 0 | 0 | 112 | P43 S49 E50 H51 | P43-T47 PolarHBondContact O-N 3.48Å; P43-T47 PolarHBondContact O-OG1 3.41Å; P43-T47 VanDerWaalsContact O-OG1 3.14Å; T47-S49 VanDerWaalsContact C-N 3.34Å; T47-S49 PolarHBondContact O-N 3.09Å; T47-E50 PolarHBondContact O-N 3.41Å; T47-H51 VanDerWaalsContact CG2-CE1 3.46Å; T47-H51 WeakPolarHBondContact CG2-CE1 3.46Å; T47-H51 WeakPolarHBondContact O-CB 3.46Å; T47-H51 VanDerWaalsContact O-CG 3.25Å; T47-H51 PolarHBondContact O-N 3.17Å |
| 48 | C | 98.7 | Very high | 97.4 | Very high | 46 Ų | 46 | 92 Ų | 92 | 31% | 0.311 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 173.7 | 179.2 | 0 | 0 | 0 | 0 | 111.4 | C32 E44 E45 T46 E50 H51 C52 | C32-C48 WeakPolarHBondContact CA-SG 3.2Å; C32-C48 HydrophobicContact CB-CB 3.57Å; C32-C48 WeakPolarHBondContact CB-SG 3.49Å; C32-C48 WeakPolarHBondContact SG-CB 3.45Å; C32-C48 PolarHBondContact SG-O 2.91Å; C32-C48 VanDerWaalsContact SG-O 3.33Å; C32-C48 CovalentContact SG-SG 2.05Å; C32-C48 PolarHBondContact SG-SG 2.95Å; E44-C48 VanDerWaalsContact O-CB 3.25Å; E44-C48 WeakPolarHBondContact O-CB 3.19Å; E44-C48 PolarHBondContact O-N 2.77Å; E45-C48 PolarHBondContact O-N 3.01Å; T46-C48 VanDerWaalsContact C-N 3.31Å; T46-C48 PolarHBondContact O-N 3Å; C48-E50 PolarHBondContact O-N 3.31Å; C48-H51 PolarHBondContact O-N 3.33Å; C48-C52 VanDerWaalsContact O-CB 3.31Å; C48-C52 WeakPolarHBondContact O-CB 3.3Å; C48-C52 PolarHBondContact O-N 3.41Å |
| 49 | S | 98.1 | Very high | 97.5 | Very high | 39 Ų | 39 | 93.1 Ų | 93.1 | 27% | 0.273 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.8 | -42 | -178 | -59.1 | 0 | 0 | 0 | 0 | 111.9 | C32 E45 T46 T47 C52 L53 | C32-S49 PolarHBondContact SG-N 3.34Å; C32-S49 VanDerWaalsContact SG-N 3.39Å; E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 2.9Å; E45-S49 PolarHBondContact O-OG 3.26Å; T46-S49 WeakPolarHBondContact O-CB 3.49Å; T46-S49 PolarHBondContact O-N 3.32Å; T46-S49 VanDerWaalsContact O-N 3.1Å; T47-S49 VanDerWaalsContact C-N 3.34Å; T47-S49 PolarHBondContact O-N 3.09Å; S49-C52 PolarHBondContact O-N 2.05Å; S49-L53 PolarHBondContact O-N 2.84Å |
| 50 | E | 97.9 | Very high | 97.5 | Very high | 114 Ų | 114 | 83.8 Ų | 83.8 | 53% | 0.533 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.3 | -46 | 174.4 | -67.9 | 177.8 | 145 | 0 | 0 | 111.8 | T46 T47 C48 L53 Q54 | T46-E50 PolarHBondContact O-N 3.26Å; T47-E50 PolarHBondContact O-N 3.41Å; C48-E50 PolarHBondContact O-N 3.31Å; E50-L53 PolarHBondContact O-N 3.02Å; E50-Q54 WeakPolarHBondContact O-CG 3.35Å; E50-Q54 PolarHBondContact O-N 2.91Å |
| 51 | H | 98.5 | Very high | 97.6 | Very high | 125 Ų | 125 | 82 Ų | 82 | 58% | 0.579 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -64.8 | -38.8 | 176.9 | -70 | 172.1 | 0 | 0 | 0 | 112.4 | T47 C48 Q54 K55 | T47-H51 VanDerWaalsContact CG2-CE1 3.46Å; T47-H51 WeakPolarHBondContact CG2-CE1 3.46Å; T47-H51 WeakPolarHBondContact O-CB 3.46Å; T47-H51 VanDerWaalsContact O-CG 3.25Å; T47-H51 PolarHBondContact O-N 3.17Å; C48-H51 PolarHBondContact O-N 3.33Å; H51-Q54 PolarHBondContact O-N 3.26Å; H51-K55 WeakPolarHBondContact O-CB 3.21Å; H51-K55 PolarHBondContact O-N 2.84Å |
| 52 | C | 98.6 | Very high | 97.7 | Very high | 22 Ų | 22 | 85.5 Ų | 85.5 | 15% | 0.149 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -59.3 | -50.8 | 175.9 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | C28 C48 S49 Q54 K55 Y56 | C28-C52 WeakPolarHBondContact CA-SG 3.48Å; C28-C52 HydrophobicContact CB-CB 3.79Å; C28-C52 WeakPolarHBondContact CB-SG 3.06Å; C28-C52 WeakPolarHBondContact SG-CB 3.37Å; C28-C52 CovalentContact SG-SG 2.05Å; C28-C52 PolarHBondContact SG-SG 2.88Å; C48-C52 VanDerWaalsContact O-CB 3.31Å; C48-C52 WeakPolarHBondContact O-CB 3.3Å; C48-C52 PolarHBondContact O-N 3.41Å; S49-C52 PolarHBondContact O-N 2.05Å; C52-Q54 PolarHBondContact O-N 3.31Å; C52-K55 PolarHBondContact O-N 3.4Å; C52-Y56 WeakPolarHBondContact O-CB 3.48Å; C52-Y56 PolarHBondContact O-N 3.03Å |
| 53 | L | 97.5 | Very high | 97.7 | Very high | 74 Ų | 74 | 87.3 Ų | 87.3 | 39% | 0.387 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -56.8 | -51.2 | 175.2 | 172.2 | 59.6 | 0 | 0 | 0 | 111.6 | L24 S49 E50 K55 Y56 L57 | L24-L53 HydrophobicContact CD2-CD1 3.31Å; L24-L53 HydrophobicContact CG-CD1 4.24Å; S49-L53 PolarHBondContact O-N 2.84Å; E50-L53 PolarHBondContact O-N 3.02Å; L53-K55 VanDerWaalsContact C-N 3.33Å; L53-K55 PolarHBondContact O-N 3.48Å; L53-Y56 PolarHBondContact O-N 3.44Å; L53-L57 HydrophobicContact CD1-CD1 3.93Å; L53-L57 HydrophobicContact CD1-CG 4.11Å; L53-L57 HydrophobicContact CG-CD1 4.26Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å; L53-L57 PolarHBondContact O-N 3.38Å |
| 54 | Q | 97.9 | Very high | 97.7 | Very high | 95 Ų | 95 | 85.4 Ų | 85.4 | 44% | 0.444 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.5 | -41.1 | -179.8 | -72.4 | -61.8 | -42.8 | 0 | 0 | 112.4 | E50 H51 C52 K58 | E50-Q54 WeakPolarHBondContact O-CG 3.35Å; E50-Q54 PolarHBondContact O-N 2.91Å; H51-Q54 PolarHBondContact O-N 3.26Å; C52-Q54 PolarHBondContact O-N 3.31Å; Q54-K58 WeakPolarHBondContact O-CB 3.33Å; Q54-K58 VanDerWaalsContact O-CG 3.3Å; Q54-K58 WeakPolarHBondContact O-CG 3.39Å; Q54-K58 PolarHBondContact O-N 2.99Å |
| 55 | K | 98.3 | Very high | 97.7 | Very high | 160 Ų | 160 | 84.1 Ų | 84.1 | 70% | 0.696 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -64 | -44.8 | 177 | -176.8 | 179.2 | 177.8 | -174.8 | 0 | 110.9 | H51 C52 L53 K58 M59 | H51-K55 WeakPolarHBondContact O-CB 3.21Å; H51-K55 PolarHBondContact O-N 2.84Å; C52-K55 PolarHBondContact O-N 3.4Å; L53-K55 VanDerWaalsContact C-N 3.33Å; L53-K55 PolarHBondContact O-N 3.48Å; K55-K58 PolarHBondContact O-N 3.41Å; K55-M59 WeakPolarHBondContact O-CB 3.46Å; K55-M59 PolarHBondContact O-N 3Å |
| 56 | Y | 97.8 | Very high | 97.7 | Very high | 52 Ų | 52 | 90.7 Ų | 90.7 | 20% | 0.204 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 177.5 | -178.8 | -90.1 | 0 | 0 | 0 | 111.7 | T20 L24 C52 L53 K58 M59 T60 | T20-Y56 HydrophobicContact CG2-CE1 4.16Å; L24-Y56 VanDerWaalsContact CD1-CB 3.5Å; L24-Y56 HydrophobicContact CD1-CD1 3.75Å; L24-Y56 HydrophobicContact CD1-CD2 3.67Å; L24-Y56 HydrophobicContact CD1-CE1 4.37Å; L24-Y56 HydrophobicContact CD1-CE2 4.3Å; L24-Y56 HydrophobicContact CD1-CG 3.35Å; L24-Y56 HydrophobicContact CD2-CD1 3.47Å; L24-Y56 VanDerWaalsContact CD2-CD1 3.47Å; L24-Y56 HydrophobicContact CD2-CE1 3.96Å; L24-Y56 HydrophobicContact CD2-CG 3.98Å; L24-Y56 HydrophobicContact CG-CD1 4.16Å; L24-Y56 HydrophobicContact CG-CG 4.26Å; C52-Y56 WeakPolarHBondContact O-CB 3.48Å; C52-Y56 PolarHBondContact O-N 3.03Å; L53-Y56 PolarHBondContact O-N 3.44Å; Y56-K58 PolarHBondContact O-N 3.42Å; Y56-M59 HydrophobicContact CD2-CE 3.91Å; Y56-M59 HydrophobicContact CE2-CE 4.23Å; Y56-M59 PolarHBondContact O-N 3.31Å; Y56-T60 WeakPolarHBondContact O-CB 3.45Å; Y56-T60 PolarHBondContact O-N 3.29Å; Y56-T60 PolarHBondContact O-OG1 3.25Å |
| 57 | L | 96.3 | Very high | 97.7 | Very high | 74 Ų | 74 | 94.5 Ų | 94.5 | 39% | 0.387 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | -179.8 | -67 | 176.1 | 0 | 0 | 0 | 111.9 | L53 M59 T60 Q61 | L53-L57 HydrophobicContact CD1-CD1 3.93Å; L53-L57 HydrophobicContact CD1-CG 4.11Å; L53-L57 HydrophobicContact CG-CD1 4.26Å; L53-L57 WeakPolarHBondContact O-CG 3.46Å; L53-L57 PolarHBondContact O-N 3.38Å; L57-M59 VanDerWaalsContact C-N 3.33Å; L57-M59 PolarHBondContact O-N 3.41Å; L57-T60 PolarHBondContact O-N 3.01Å; L57-Q61 WeakPolarHBondContact O-CB 3.31Å; L57-Q61 VanDerWaalsContact O-CG 3.31Å; L57-Q61 WeakPolarHBondContact O-CG 3.38Å; L57-Q61 PolarHBondContact O-N 2.78Å |
| 58 | K | 98.1 | Very high | 97.6 | Very high | 133 Ų | 133 | 96.8 Ų | 96.8 | 58% | 0.578 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -62.2 | -40.7 | 176.6 | -71.8 | 174 | -177.2 | 177.4 | 0 | 112.1 | Q54 K55 Y56 R62 | Q54-K58 WeakPolarHBondContact O-CB 3.33Å; Q54-K58 VanDerWaalsContact O-CG 3.3Å; Q54-K58 WeakPolarHBondContact O-CG 3.39Å; Q54-K58 PolarHBondContact O-N 2.99Å; K55-K58 PolarHBondContact O-N 3.41Å; Y56-K58 PolarHBondContact O-N 3.42Å; K58-R62 WeakPolarHBondContact O-CB 3.32Å; K58-R62 PolarHBondContact O-N 3.5Å |
| 59 | M | 97.3 | Very high | 97.4 | Very high | 88 Ų | 88 | 98.4 Ų | 98.4 | 43% | 0.433 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.7 | -50 | 175.8 | 178.3 | -171.7 | 71.9 | 0 | 0 | 110.9 | K55 Y56 L57 Q61 R62 I63 | K55-M59 WeakPolarHBondContact O-CB 3.46Å; K55-M59 PolarHBondContact O-N 3Å; Y56-M59 HydrophobicContact CD2-CE 3.91Å; Y56-M59 HydrophobicContact CE2-CE 4.23Å; Y56-M59 PolarHBondContact O-N 3.31Å; L57-M59 VanDerWaalsContact C-N 3.33Å; L57-M59 PolarHBondContact O-N 3.41Å; M59-Q61 PolarHBondContact O-N 3Å; M59-R62 PolarHBondContact O-N 2.96Å; M59-I63 HydrophobicContact CG-CD1 3.73Å; M59-I63 HydrophobicContact CG-CG1 4.43Å; M59-I63 VanDerWaalsContact O-CG1 3.31Å; M59-I63 WeakPolarHBondContact O-CG1 3.35Å; M59-I63 PolarHBondContact O-N 3.43Å; M59-I63 HydrophobicContact SD-CD1 4.43Å |
| 60 | T | 95.9 | Very high | 97.3 | Very high | 61 Ų | 61 | 102.6 Ų | 102.6 | 37% | 0.374 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 179.4 | -62.2 | 0 | 0 | 0 | 0 | 111.6 | Y56 L57 R62 I63 S64 | Y56-T60 WeakPolarHBondContact O-CB 3.45Å; Y56-T60 PolarHBondContact O-N 3.29Å; Y56-T60 PolarHBondContact O-OG1 3.25Å; L57-T60 PolarHBondContact O-N 3.01Å; T60-R62 PolarHBondContact O-N 3.31Å; T60-I63 PolarHBondContact O-N 2.91Å; T60-S64 WeakPolarHBondContact O-CB 3.43Å; T60-S64 PolarHBondContact O-N 3.11Å |
| 61 | Q | 97 | Very high | 97.2 | Very high | 125 Ų | 125 | 101.5 Ų | 101.5 | 58% | 0.584 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.8 | -46.2 | 174 | -73.4 | 172.1 | -9.1 | 0 | 0 | 111.9 | L57 M59 S64 M65 | L57-Q61 WeakPolarHBondContact O-CB 3.31Å; L57-Q61 VanDerWaalsContact O-CG 3.31Å; L57-Q61 WeakPolarHBondContact O-CG 3.38Å; L57-Q61 PolarHBondContact O-N 2.78Å; M59-Q61 PolarHBondContact O-N 3Å; Q61-S64 PolarHBondContact O-N 3.3Å; Q61-M65 WeakPolarHBondContact O-CG 3.37Å; Q61-M65 PolarHBondContact O-N 2.93Å |
| 62 | R | 98.1 | Very high | 97 | Very high | 167 Ų | 167 | 100.1 Ų | 100.1 | 63% | 0.63 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.9 | -45 | 178.3 | -174.9 | -179.9 | 179.1 | -178.6 | 0.5 | 112.1 | K58 M59 T60 S64 M65 R66 | K58-R62 WeakPolarHBondContact O-CB 3.32Å; K58-R62 PolarHBondContact O-N 3.5Å; M59-R62 PolarHBondContact O-N 2.96Å; T60-R62 PolarHBondContact O-N 3.31Å; R62-S64 VanDerWaalsContact C-N 3.35Å; R62-M65 PolarHBondContact O-N 2.82Å; R62-R66 WeakPolarHBondContact O-CG 3.42Å; R62-R66 PolarHBondContact O-N 3.31Å; R62-R66 VanDerWaalsContact O-N 3.1Å |
| 63 | I | 97.4 | Very high | 96.7 | Very high | 102 Ų | 102 | 104.6 Ų | 104.6 | 52% | 0.523 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 177.7 | -68.1 | 168.5 | 0 | 0 | 0 | 110.1 | M59 T60 M65 R66 F67 | M59-I63 HydrophobicContact CG-CD1 3.73Å; M59-I63 HydrophobicContact CG-CG1 4.43Å; M59-I63 VanDerWaalsContact O-CG1 3.31Å; M59-I63 WeakPolarHBondContact O-CG1 3.35Å; M59-I63 PolarHBondContact O-N 3.43Å; M59-I63 HydrophobicContact SD-CD1 4.43Å; T60-I63 PolarHBondContact O-N 2.91Å; I63-M65 PolarHBondContact O-N 3.35Å; I63-R66 PolarHBondContact O-N 3.44Å; I63-F67 WeakPolarHBondContact O-CB 3.38Å; I63-F67 PolarHBondContact O-N 3.41Å |
| 64 | S | 96.6 | Very high | 96.5 | Very high | 60 Ų | 60 | 104.9 Ų | 104.9 | 42% | 0.42 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.1 | -48.2 | 177.5 | -173.8 | 0 | 0 | 0 | 0 | 111.7 | T60 Q61 R62 R66 F67 Q68 | T60-S64 WeakPolarHBondContact O-CB 3.43Å; T60-S64 PolarHBondContact O-N 3.11Å; Q61-S64 PolarHBondContact O-N 3.3Å; R62-S64 VanDerWaalsContact C-N 3.35Å; S64-R66 PolarHBondContact O-N 2.82Å; S64-F67 PolarHBondContact O-N 2.91Å; S64-Q68 WeakPolarHBondContact O-CG 3.44Å; S64-Q68 PolarHBondContact O-N 2.97Å |
| 65 | M | 97.4 | Very high | 96.2 | Very high | 101 Ų | 101 | 104.1 Ų | 104.1 | 50% | 0.498 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.4 | -44.6 | 176.7 | -70.6 | -175.1 | -68.2 | 0 | 0 | 112.3 | Q61 R62 I63 F67 Q68 E69 | Q61-M65 WeakPolarHBondContact O-CG 3.37Å; Q61-M65 PolarHBondContact O-N 2.93Å; R62-M65 PolarHBondContact O-N 2.82Å; I63-M65 PolarHBondContact O-N 3.35Å; M65-F67 VanDerWaalsContact C-N 3.33Å; M65-F67 PolarHBondContact O-N 3.35Å; M65-Q68 PolarHBondContact O-N 2.96Å; M65-E69 WeakPolarHBondContact O-CG 3.38Å; M65-E69 PolarHBondContact O-N 2.92Å |
| 66 | R | 97.8 | Very high | 95.8 | Very high | 140 Ų | 140 | 101.9 Ų | 101.9 | 53% | 0.528 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.5 | -36.4 | 177.7 | -65.6 | -50.9 | 180 | -168.1 | -7.6 | 112.8 | R62 I63 S64 E69 Y70 | R62-R66 WeakPolarHBondContact O-CG 3.42Å; R62-R66 PolarHBondContact O-N 3.31Å; R62-R66 VanDerWaalsContact O-N 3.1Å; I63-R66 PolarHBondContact O-N 3.44Å; S64-R66 PolarHBondContact O-N 2.82Å; R66-E69 WeakPolarHBondContact CD-OE2 3.15Å; R66-E69 IonicContact CZ-OE1 2.67Å; R66-E69 IonicContact CZ-OE2 3.93Å; R66-E69 IonicContact NE-OE2 3.57Å; R66-E69 IonicContact NH1-OE1 2.97Å; R66-E69 PolarHBondContact NH1-OE1 2.92Å; R66-E69 IonicContact NH1-OE2 3.74Å; R66-E69 PolarHBondContact NH1-OE2 3.47Å; R66-Y70 WeakPolarHBondContact O-CB 3.02Å; R66-Y70 PolarHBondContact O-N 3.45Å |
| 67 | F | 97 | Very high | 95.5 | Very high | 143 Ų | 143 | 101.7 Ų | 101.7 | 63% | 0.627 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -66.3 | -40.5 | 175.7 | -171.3 | -99.2 | 0 | 0 | 0 | 111.7 | I63 S64 M65 Y70 H71 | I63-F67 WeakPolarHBondContact O-CB 3.38Å; I63-F67 PolarHBondContact O-N 3.41Å; S64-F67 PolarHBondContact O-N 2.91Å; M65-F67 VanDerWaalsContact C-N 3.33Å; M65-F67 PolarHBondContact O-N 3.35Å; F67-Y70 PolarHBondContact O-N 2.9Å; F67-H71 WeakPolarHBondContact O-CB 3.47Å; F67-H71 PolarHBondContact O-N 3.02Å |
| 68 | Q | 96.3 | Very high | 95.2 | Very high | 112 Ų | 112 | 103.3 Ų | 103.3 | 52% | 0.523 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -47.6 | 174.7 | -70.8 | 172.1 | -33.5 | 0 | 0 | 112 | S64 M65 Y70 H71 I72 | S64-Q68 WeakPolarHBondContact O-CG 3.44Å; S64-Q68 PolarHBondContact O-N 2.97Å; M65-Q68 PolarHBondContact O-N 2.96Å; Q68-Y70 VanDerWaalsContact C-N 3.33Å; Q68-Y70 PolarHBondContact O-N 2.94Å; Q68-H71 PolarHBondContact O-N 3.42Å; Q68-I72 WeakPolarHBondContact O-CG1 3.04Å; Q68-I72 PolarHBondContact O-N 3.5Å |
| 69 | E | 96 | Very high | 94.8 | Very high | 79 Ų | 79 | 98.3 Ų | 98.3 | 37% | 0.369 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -57.2 | -45.8 | 175.6 | -71.8 | 170.8 | 169.1 | 0 | 0 | 111.7 | M65 R66 H71 I72 Q73 | M65-E69 WeakPolarHBondContact O-CG 3.38Å; M65-E69 PolarHBondContact O-N 2.92Å; R66-E69 WeakPolarHBondContact CD-OE2 3.15Å; R66-E69 IonicContact CZ-OE1 2.67Å; R66-E69 IonicContact CZ-OE2 3.93Å; R66-E69 IonicContact NE-OE2 3.57Å; R66-E69 IonicContact NH1-OE1 2.97Å; R66-E69 PolarHBondContact NH1-OE1 2.92Å; R66-E69 IonicContact NH1-OE2 3.74Å; R66-E69 PolarHBondContact NH1-OE2 3.47Å; E69-H71 VanDerWaalsContact C-N 3.35Å; E69-H71 PolarHBondContact O-N 2.88Å; E69-I72 PolarHBondContact O-N 2.89Å; E69-Q73 WeakPolarHBondContact O-CG 3.25Å; E69-Q73 PolarHBondContact O-N 3.39Å |
| 70 | Y | 96.1 | Very high | 94.4 | Very high | 128 Ų | 128 | 96.6 Ų | 96.6 | 50% | 0.502 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.5 | -42 | 178.3 | -179.7 | -103.3 | 0 | 0 | 0 | 112.1 | R66 F67 Q68 I72 Q73 Q74 | R66-Y70 WeakPolarHBondContact O-CB 3.02Å; R66-Y70 PolarHBondContact O-N 3.45Å; F67-Y70 PolarHBondContact O-N 2.9Å; Q68-Y70 VanDerWaalsContact C-N 3.33Å; Q68-Y70 PolarHBondContact O-N 2.94Å; Y70-I72 PolarHBondContact O-N 2.92Å; Y70-Q73 PolarHBondContact O-N 3.42Å; Y70-Q74 HydrophobicContact CD1-CG 4.36Å; Y70-Q74 HydrophobicContact CE1-CG 3.98Å; Y70-Q74 HydrophobicContact CE2-CG 4.48Å; Y70-Q74 WeakPolarHBondContact O-CG 3.07Å; Y70-Q74 PolarHBondContact O-N 3.49Å; Y70-Q74 PolarHBondContact OH-NE2 3.49Å |
| 71 | H | 94.6 | Very high | 94 | Very high | 91 Ų | 91 | 102.5 Ų | 102.5 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.4 | -40.4 | 177.5 | -172 | 70.1 | 0 | 0 | 0 | 112.3 | F67 Q68 E69 Q74 N75 | F67-H71 WeakPolarHBondContact O-CB 3.47Å; F67-H71 PolarHBondContact O-N 3.02Å; Q68-H71 PolarHBondContact O-N 3.42Å; E69-H71 VanDerWaalsContact C-N 3.35Å; E69-H71 PolarHBondContact O-N 2.88Å; H71-Q74 PolarHBondContact O-N 2.05Å; H71-N75 PolarHBondContact CD2-ND2 3.05Å; H71-N75 PolarHBondContact NE2-ND2 3.48Å; H71-N75 PolarHBondContact O-N 3.24Å; H71-N75 VanDerWaalsContact O-N 3.09Å; H71-N75 PolarHBondContact O-ND2 3.45Å |
| 72 | I | 94.3 | Very high | 93.6 | Very high | 96 Ų | 96 | 99.7 Ų | 99.7 | 49% | 0.492 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.1 | -48.2 | 175.1 | -66.6 | 164.4 | 0 | 0 | 0 | 110.3 | Q68 E69 Y70 Q74 N75 E76 | Q68-I72 WeakPolarHBondContact O-CG1 3.04Å; Q68-I72 PolarHBondContact O-N 3.5Å; E69-I72 PolarHBondContact O-N 2.89Å; Y70-I72 PolarHBondContact O-N 2.92Å; I72-Q74 VanDerWaalsContact C-N 3.29Å; I72-Q74 PolarHBondContact O-N 3.33Å; I72-N75 PolarHBondContact O-N 3.45Å; I72-N75 VanDerWaalsContact O-N 3.07Å; I72-E76 HydrophobicContact CG2-CG 4.35Å; I72-E76 WeakPolarHBondContact O-CG 3.39Å; I72-E76 PolarHBondContact O-N 3.04Å |
| 73 | Q | 93.2 | Very high | 92.5 | Very high | 115 Ų | 115 | 94.5 Ų | 94.5 | 54% | 0.537 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.9 | -39.4 | 178.3 | -71.3 | 172.6 | 30.6 | 0 | 0 | 112.5 | E69 Y70 E76 A77 | E69-Q73 WeakPolarHBondContact O-CG 3.25Å; E69-Q73 PolarHBondContact O-N 3.39Å; Y70-Q73 PolarHBondContact O-N 3.42Å; Q73-E76 PolarHBondContact O-N 3.1Å; Q73-A77 VanDerWaalsContact O-CB 3.31Å; Q73-A77 WeakPolarHBondContact O-CB 3.4Å; Q73-A77 PolarHBondContact O-N 2.94Å |
| 74 | Q | 92.6 | Very high | 91.3 | Very high | 81 Ų | 81 | 96 Ų | 96 | 38% | 0.379 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 174.7 | -74.2 | -168.4 | -31.5 | 0 | 0 | 111.7 | Y70 H71 I72 A77 L78 | Y70-Q74 HydrophobicContact CD1-CG 4.36Å; Y70-Q74 HydrophobicContact CE1-CG 3.98Å; Y70-Q74 HydrophobicContact CE2-CG 4.48Å; Y70-Q74 WeakPolarHBondContact O-CG 3.07Å; Y70-Q74 PolarHBondContact O-N 3.49Å; Y70-Q74 PolarHBondContact OH-NE2 3.49Å; H71-Q74 PolarHBondContact O-N 2.05Å; I72-Q74 VanDerWaalsContact C-N 3.29Å; I72-Q74 PolarHBondContact O-N 3.33Å; Q74-A77 PolarHBondContact O-N 2.91Å; Q74-L78 VanDerWaalsContact O-CG 3.24Å; Q74-L78 WeakPolarHBondContact O-CG 3.24Å; Q74-L78 PolarHBondContact O-N 2.83Å |
| 75 | N | 91.7 | Very high | 89.7 | Confident | 79 Ų | 79 | 98.9 Ų | 98.9 | 42% | 0.422 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65 | -39.8 | 178.9 | -68.6 | -16.7 | 0 | 0 | 0 | 111.9 | H71 I72 L78 A79 | H71-N75 PolarHBondContact CD2-ND2 3.05Å; H71-N75 PolarHBondContact NE2-ND2 3.48Å; H71-N75 PolarHBondContact O-N 3.24Å; H71-N75 VanDerWaalsContact O-N 3.09Å; H71-N75 PolarHBondContact O-ND2 3.45Å; I72-N75 PolarHBondContact O-N 3.45Å; I72-N75 VanDerWaalsContact O-N 3.07Å; N75-L78 PolarHBondContact O-N 2.93Å; N75-A79 WeakPolarHBondContact O-CB 3.46Å; N75-A79 PolarHBondContact O-N 3.49Å |
| 76 | E | 90.8 | Very high | 87.8 | Confident | 112 Ų | 112 | 97 Ų | 97 | 52% | 0.523 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.4 | -43.7 | 174.1 | -70.1 | 178.8 | 117.1 | 0 | 0 | 111.9 | I72 Q73 L78 A79 A80 | I72-E76 HydrophobicContact CG2-CG 4.35Å; I72-E76 WeakPolarHBondContact O-CG 3.39Å; I72-E76 PolarHBondContact O-N 3.04Å; Q73-E76 PolarHBondContact O-N 3.1Å; E76-L78 VanDerWaalsContact C-N 3.29Å; E76-L78 PolarHBondContact O-N 2.91Å; E76-A79 PolarHBondContact O-N 3.11Å; E76-A80 WeakPolarHBondContact O-CB 3.44Å; E76-A80 PolarHBondContact O-N 2.76Å |
| 77 | A | 89.9 | Confident | 85.6 | Confident | 48 Ų | 48 | 99.1 Ų | 99.1 | 40% | 0.397 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.9 | -36.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q73 Q74 K81 | Q73-A77 VanDerWaalsContact O-CB 3.31Å; Q73-A77 WeakPolarHBondContact O-CB 3.4Å; Q73-A77 PolarHBondContact O-N 2.94Å; Q74-A77 PolarHBondContact O-N 2.91Å; A77-K81 WeakPolarHBondContact O-CB 3.43Å; A77-K81 VanDerWaalsContact O-CG 3.27Å; A77-K81 WeakPolarHBondContact O-CG 3.49Å; A77-K81 PolarHBondContact O-N 3.39Å |
| 78 | L | 90.2 | Very high | 83.5 | Confident | 109 Ų | 109 | 98 Ų | 98 | 57% | 0.571 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -67.7 | -43 | 173.4 | -69.8 | 170.9 | 0 | 0 | 0 | 111.6 | Q74 N75 E76 K81 A82 | Q74-L78 VanDerWaalsContact O-CG 3.24Å; Q74-L78 WeakPolarHBondContact O-CG 3.24Å; Q74-L78 PolarHBondContact O-N 2.83Å; N75-L78 PolarHBondContact O-N 2.93Å; E76-L78 VanDerWaalsContact C-N 3.29Å; E76-L78 PolarHBondContact O-N 2.91Å; L78-K81 PolarHBondContact O-N 3.5Å; L78-A82 WeakPolarHBondContact O-CB 3.46Å; L78-A82 PolarHBondContact O-N 3.1Å |
| 79 | A | 89.8 | Confident | 81.2 | Confident | 28 Ų | 28 | 107.9 Ų | 107.9 | 23% | 0.231 | 57% | 0.572 | C | S | . | * | H | α-helix | trans | -64.5 | -39.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | N75 E76 A82 G83 L84 | N75-A79 WeakPolarHBondContact O-CB 3.46Å; N75-A79 PolarHBondContact O-N 3.49Å; E76-A79 PolarHBondContact O-N 3.11Å; A79-A82 PolarHBondContact O-N 3.14Å; A79-G83 PolarHBondContact O-N 2.62Å; A79-L84 PolarHBondContact O-N 2.95Å |
| 80 | A | 88.7 | Confident | 80.5 | Confident | 52 Ų | 52 | 109.3 Ų | 109.3 | 43% | 0.43 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -61.9 | -46.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | E76 A82 G83 L85 | E76-A80 WeakPolarHBondContact O-CB 3.44Å; E76-A80 PolarHBondContact O-N 2.76Å; A80-A82 VanDerWaalsContact C-N 3.27Å; A80-A82 PolarHBondContact O-N 2.95Å; A80-G83 PolarHBondContact O-N 3.37Å; A80-L85 HydrophobicContact CB-CD1 3.86Å |
| 81 | K | 88 | Confident | 79.6 | Confident | 184 Ų | 184 | 108.3 Ų | 108.3 | 80% | 0.8 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63 | -32.8 | 175.6 | -75.4 | 176 | 179.5 | -177.4 | 0 | 112.8 | A77 L78 G83 | A77-K81 WeakPolarHBondContact O-CB 3.43Å; A77-K81 VanDerWaalsContact O-CG 3.27Å; A77-K81 WeakPolarHBondContact O-CG 3.49Å; A77-K81 PolarHBondContact O-N 3.39Å; L78-K81 PolarHBondContact O-N 3.5Å; K81-G83 PolarHBondContact O-N 3.46Å |
| 82 | A | 88.4 | Confident | 78.8 | Confident | 67 Ų | 67 | 109.3 Ų | 109.3 | 55% | 0.554 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -0.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L78 A79 A80 L84 | L78-A82 WeakPolarHBondContact O-CB 3.46Å; L78-A82 PolarHBondContact O-N 3.1Å; A79-A82 PolarHBondContact O-N 3.14Å; A80-A82 VanDerWaalsContact C-N 3.27Å; A80-A82 PolarHBondContact O-N 2.95Å; A82-L84 HydrophobicContact CB-CD1 4.11Å; A82-L84 HydrophobicContact CB-CG 3.99Å; A82-L84 PolarHBondContact O-N 3.44Å |
| 83 | G | 75.2 | Confident | 77.9 | Confident | 57 Ų | 57 | 110.1 Ų | 110.1 | 59% | 0.588 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.7 | 14.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | A79 A80 K81 L85 | A79-G83 PolarHBondContact O-N 2.62Å; A80-G83 PolarHBondContact O-N 3.37Å; K81-G83 PolarHBondContact O-N 3.46Å; G83-L85 VanDerWaalsContact C-N 3.35Å |
| 84 | L | 72.6 | Confident | 76.9 | Confident | 134 Ų | 134 | 109.8 Ų | 109.8 | 70% | 0.702 | 61% | 0.606 | S | S | * | * | trans | -78.4 | -20.9 | -179 | -61.6 | 174.5 | 0 | 0 | 0 | 112.5 | A79 A82 G86 | A79-L84 PolarHBondContact O-N 2.95Å; A82-L84 HydrophobicContact CB-CD1 4.11Å; A82-L84 HydrophobicContact CB-CG 3.99Å; A82-L84 PolarHBondContact O-N 3.44Å; L84-G86 PolarHBondContact O-N 2.65Å; L84-G86 VanDerWaalsContact O-N 3.13Å | ||
| 85 | L | 62.9 | Low | 75.9 | Confident | 120 Ų | 120 | 111.7 Ų | 111.7 | 63% | 0.628 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -82.6 | 88.5 | 168.3 | -62 | -179.2 | 0 | 0 | 0 | 107.7 | A80 G83 | A80-L85 HydrophobicContact CB-CD1 3.86Å; G83-L85 VanDerWaalsContact C-N 3.35Å |
| 86 | G | 57.9 | Low | 74.8 | Confident | 61 Ų | 61 | 114 Ų | 114 | 63% | 0.629 | 64% | 0.635 | S | S | * | * | trans | -44.8 | 134.3 | -170.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L84 | L84-G86 PolarHBondContact O-N 2.65Å; L84-G86 VanDerWaalsContact O-N 3.13Å | ||
| 87 | Q | 51.5 | Low | 73.5 | Confident | 186 Ų | 186 | 114.2 Ų | 114.2 | 87% | 0.869 | 64% | 0.644 | S | S | * | * | trans | -48.3 | 129.2 | 167.5 | -177.3 | 142.7 | 78.3 | 0 | 0 | 109.6 | R89 | Q87-R89 PolarHBondContact O-N 3.07Š| ||
| 88 | P | 53.3 | Low | 72.2 | Confident | 118 Ų | 118 | 119.7 Ų | 119.7 | 77% | 0.766 | 67% | 0.665 | S | S | * | * | trans | -61.4 | 134.4 | 171.2 | 27.7 | -32.2 | 0 | 0 | 0 | 107.5 | ||||
| 89 | R | 47.5 | Very low | 70.5 | Confident | 320 Ų | 320 | 120.6 Ų | 120.6 | 100% | 1.208 | 67% | 0.673 | S | S | * | * | trans | -35.2 | 0 | -175.5 | -64.7 | 178.4 | 67.4 | 166.7 | 2.5 | 115.7 | Q87 | Q87-R89 PolarHBondContact O-N 3.07Š|
Retrieved 89 of 89 residues in 41.5 ms
(Link to these results)