| 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 | 62.6 | Low | 82.2 | Confident | 186 Ų | 186 | 120.4 Ų | 120.4 | 92% | 0.916 | 62% | 0.621 | S | S | * | * | 0 | -57.8 | 0 | -58.9 | -128.2 | 110.1 | 0 | 0 | 112.1 | V5 | M1-V5 WeakPolarHBondContact O-CG2 3.49Š| |||
| 2 | L | 67.5 | Low | 83.4 | Confident | 157 Ų | 157 | 117.8 Ų | 117.8 | 82% | 0.822 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -71.4 | -33.7 | 179.1 | -75.9 | 167.6 | 0 | 0 | 0 | 114.6 | M6 | L2-M6 PolarHBondContact O-N 3.07Å |
| 3 | T | 77.6 | Confident | 84.4 | Confident | 97 Ų | 97 | 115.2 Ų | 115.2 | 60% | 0.595 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -69.1 | -41.5 | -179.7 | 51.5 | 0 | 0 | 0 | 0 | 112.4 | V5 M6 E7 | T3-V5 VanDerWaalsContact C-N 3.34Å; T3-V5 PolarHBondContact O-N 3.33Å; T3-M6 PolarHBondContact O-N 3.48Å; T3-M6 VanDerWaalsContact O-N 3.14Å; T3-E7 PolarHBondContact O-N 3.13Å; T3-E7 VanDerWaalsContact O-N 3.15Å |
| 4 | E | 76.3 | Confident | 85.3 | Confident | 123 Ų | 123 | 115 Ų | 115 | 58% | 0.575 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -59.7 | -42.3 | 176.5 | -130.3 | 176.6 | 147.8 | 0 | 0 | 112 | M6 E7 V8 | E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.14Å; E4-E7 PolarHBondContact O-N 2.92Å; E4-V8 WeakPolarHBondContact O-CG2 3.27Å; E4-V8 PolarHBondContact O-N 3.3Å |
| 5 | V | 79.6 | Confident | 86.1 | Confident | 79 Ų | 79 | 111.3 Ų | 111.3 | 48% | 0.479 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.7 | -41.3 | 176.2 | 169.7 | 0 | 0 | 0 | 0 | 110.6 | M1 T3 E7 V8 W9 | M1-V5 WeakPolarHBondContact O-CG2 3.49Å; T3-V5 VanDerWaalsContact C-N 3.34Å; T3-V5 PolarHBondContact O-N 3.33Å; V5-E7 VanDerWaalsContact C-N 3.33Å; V5-E7 PolarHBondContact O-N 3.43Å; V5-V8 PolarHBondContact O-N 3.43Å; V5-W9 PolarHBondContact O-N 3.17Å; V5-W9 VanDerWaalsContact O-N 3.13Å |
| 6 | M | 82.7 | Confident | 86.8 | Confident | 118 Ų | 118 | 109.8 Ų | 109.8 | 58% | 0.581 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -68.7 | -29.5 | -177.3 | -164.1 | 166 | 69.5 | 0 | 0 | 113.4 | L2 T3 E4 H10 | L2-M6 PolarHBondContact O-N 3.07Å; T3-M6 PolarHBondContact O-N 3.48Å; T3-M6 VanDerWaalsContact O-N 3.14Å; E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.14Å; M6-H10 PolarHBondContact O-N 3.29Å; M6-H10 VanDerWaalsContact O-N 3.17Å; M6-H10 PolarHBondContact O-ND1 3.15Å; M6-H10 VanDerWaalsContact O-ND1 3.07Å |
| 7 | E | 85.6 | Confident | 87.5 | Confident | 138 Ų | 138 | 108.1 Ų | 108.1 | 65% | 0.645 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.7 | -41.2 | 174 | -70.3 | 176.2 | 125.6 | 0 | 0 | 111.8 | T3 E4 V5 W9 H10 G11 | T3-E7 PolarHBondContact O-N 3.13Å; T3-E7 VanDerWaalsContact O-N 3.15Å; E4-E7 PolarHBondContact O-N 2.92Å; V5-E7 VanDerWaalsContact C-N 3.33Å; V5-E7 PolarHBondContact O-N 3.43Å; E7-W9 VanDerWaalsContact C-N 3.33Å; E7-W9 PolarHBondContact O-N 2.87Å; E7-H10 PolarHBondContact O-N 3.33Å; E7-G11 PolarHBondContact O-N 2.99Å |
| 8 | V | 91.1 | Very high | 88 | Confident | 106 Ų | 106 | 105.7 Ų | 105.7 | 64% | 0.642 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.9 | -40.7 | 175.1 | 176.7 | 0 | 0 | 0 | 0 | 111 | E4 V5 G11 L12 | E4-V8 WeakPolarHBondContact O-CG2 3.27Å; E4-V8 PolarHBondContact O-N 3.3Å; V5-V8 PolarHBondContact O-N 3.43Å; V8-G11 PolarHBondContact O-N 3.36Å; V8-L12 WeakPolarHBondContact O-CB 3.46Å; V8-L12 PolarHBondContact O-N 3.46Å |
| 9 | W | 94.5 | Very high | 88.6 | Confident | 157 Ų | 157 | 107.1 Ų | 107.1 | 60% | 0.595 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.5 | -41 | 175.7 | -76.3 | 111.8 | 0 | 0 | 0 | 112.7 | V5 E7 L12 V13 | V5-W9 PolarHBondContact O-N 3.17Å; V5-W9 VanDerWaalsContact O-N 3.13Å; E7-W9 VanDerWaalsContact C-N 3.33Å; E7-W9 PolarHBondContact O-N 2.87Å; W9-L12 HydrophobicContact CE3-CD2 3.89Å; W9-L12 HydrophobicContact CZ3-CD2 3.83Å; W9-L12 PolarHBondContact O-N 3.35Å; W9-V13 VanDerWaalsContact O-CG2 3.27Å; W9-V13 WeakPolarHBondContact O-CG2 3.24Å; W9-V13 PolarHBondContact O-N 3.46Å |
| 10 | H | 93.3 | Very high | 89 | Confident | 123 Ų | 123 | 109.1 Ų | 109.1 | 57% | 0.569 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62.5 | -46.5 | 174.5 | -88.4 | 77.8 | 0 | 0 | 0 | 111.6 | M6 E7 L12 V13 I14 | M6-H10 PolarHBondContact O-N 3.29Å; M6-H10 VanDerWaalsContact O-N 3.17Å; M6-H10 PolarHBondContact O-ND1 3.15Å; M6-H10 VanDerWaalsContact O-ND1 3.07Å; E7-H10 PolarHBondContact O-N 3.33Å; H10-L12 VanDerWaalsContact C-N 3.31Å; H10-L12 PolarHBondContact O-N 3.28Å; H10-V13 PolarHBondContact O-N 3Å; H10-I14 WeakPolarHBondContact O-CD1 3.49Å; H10-I14 VanDerWaalsContact O-CG1 3.24Å; H10-I14 WeakPolarHBondContact O-CG1 3.35Å; H10-I14 PolarHBondContact O-N 2.88Å |
| 11 | G | 93.6 | Very high | 89.4 | Confident | 40 Ų | 40 | 109.5 Ų | 109.5 | 41% | 0.412 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -58.8 | -42.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | E7 V8 I14 A15 | E7-G11 PolarHBondContact O-N 2.99Å; V8-G11 PolarHBondContact O-N 3.36Å; G11-I14 PolarHBondContact O-N 3.46Å; G11-A15 WeakPolarHBondContact O-CB 3.34Å; G11-A15 PolarHBondContact O-N 3.31Å |
| 12 | L | 96 | Very high | 91.1 | Very high | 89 Ų | 89 | 106.3 Ų | 106.3 | 47% | 0.466 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.5 | -46.1 | 177.2 | -176.7 | 68.6 | 0 | 0 | 0 | 111.9 | V8 W9 H10 I14 A15 V16 | V8-L12 WeakPolarHBondContact O-CB 3.46Å; V8-L12 PolarHBondContact O-N 3.46Å; W9-L12 HydrophobicContact CE3-CD2 3.89Å; W9-L12 HydrophobicContact CZ3-CD2 3.83Å; W9-L12 PolarHBondContact O-N 3.35Å; H10-L12 VanDerWaalsContact C-N 3.31Å; H10-L12 PolarHBondContact O-N 3.28Å; L12-I14 VanDerWaalsContact C-N 3.35Å; L12-I14 PolarHBondContact O-N 2.91Å; L12-A15 PolarHBondContact O-N 3.44Å; L12-V16 WeakPolarHBondContact O-CG2 3.29Å; L12-V16 PolarHBondContact O-N 2.95Å |
| 13 | V | 97 | Very high | 92.6 | Very high | 85 Ų | 85 | 101.3 Ų | 101.3 | 52% | 0.515 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.6 | -45 | 178.2 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | W9 H10 A15 V16 V17 | W9-V13 VanDerWaalsContact O-CG2 3.27Å; W9-V13 WeakPolarHBondContact O-CG2 3.24Å; W9-V13 PolarHBondContact O-N 3.46Å; H10-V13 PolarHBondContact O-N 3Å; V13-A15 VanDerWaalsContact C-N 3.33Å; V13-A15 PolarHBondContact O-N 3.38Å; V13-V16 PolarHBondContact O-N 3.49Å; V13-V17 HydrophobicContact CG1-CG2 4.28Å; V13-V17 WeakPolarHBondContact O-CB 3.43Å; V13-V17 VanDerWaalsContact O-CG2 3.29Å; V13-V17 WeakPolarHBondContact O-CG2 3.19Å; V13-V17 PolarHBondContact O-N 3.44Å |
| 14 | I | 96.4 | Very high | 93.6 | Very high | 112 Ų | 112 | 99.4 Ų | 99.4 | 57% | 0.574 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.6 | -44.1 | 177.2 | -66.7 | 163.9 | 0 | 0 | 0 | 110.6 | H10 G11 L12 V16 V17 S18 | H10-I14 WeakPolarHBondContact O-CD1 3.49Å; H10-I14 VanDerWaalsContact O-CG1 3.24Å; H10-I14 WeakPolarHBondContact O-CG1 3.35Å; H10-I14 PolarHBondContact O-N 2.88Å; G11-I14 PolarHBondContact O-N 3.46Å; L12-I14 VanDerWaalsContact C-N 3.35Å; L12-I14 PolarHBondContact O-N 2.91Å; I14-V16 PolarHBondContact O-N 2.87Å; I14-V17 PolarHBondContact O-N 2.97Å; I14-S18 WeakPolarHBondContact O-CB 3.49Å; I14-S18 PolarHBondContact O-N 3.49Å |
| 15 | A | 97.4 | Very high | 94.6 | Very high | 60 Ų | 60 | 99.9 Ų | 99.9 | 50% | 0.496 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.8 | -44.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | G11 L12 V13 S18 L19 | G11-A15 WeakPolarHBondContact O-CB 3.34Å; G11-A15 PolarHBondContact O-N 3.31Å; L12-A15 PolarHBondContact O-N 3.44Å; V13-A15 VanDerWaalsContact C-N 3.33Å; V13-A15 PolarHBondContact O-N 3.38Å; A15-S18 PolarHBondContact O-N 3.19Å; A15-L19 WeakPolarHBondContact O-CB 3.49Å; A15-L19 PolarHBondContact O-N 2.97Å |
| 16 | V | 98 | Very high | 95.4 | Very high | 87 Ų | 87 | 101 Ų | 101 | 53% | 0.527 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.6 | -45.7 | 178.6 | 172.2 | 0 | 0 | 0 | 0 | 111.5 | L12 V13 I14 S18 L19 F20 | L12-V16 WeakPolarHBondContact O-CG2 3.29Å; L12-V16 PolarHBondContact O-N 2.95Å; V13-V16 PolarHBondContact O-N 3.49Å; I14-V16 PolarHBondContact O-N 2.87Å; V16-S18 VanDerWaalsContact C-N 3.34Å; V16-S18 PolarHBondContact O-N 3.27Å; V16-L19 PolarHBondContact O-N 2.94Å; V16-F20 WeakPolarHBondContact O-CB 3.39Å; V16-F20 PolarHBondContact O-N 3.49Å |
| 17 | V | 97.9 | Very high | 96.1 | Very high | 81 Ų | 81 | 99.9 Ų | 99.9 | 49% | 0.491 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 177.9 | 172.7 | 0 | 0 | 0 | 0 | 110.6 | V13 I14 F20 L21 | V13-V17 HydrophobicContact CG1-CG2 4.28Å; V13-V17 WeakPolarHBondContact O-CB 3.43Å; V13-V17 VanDerWaalsContact O-CG2 3.29Å; V13-V17 WeakPolarHBondContact O-CG2 3.19Å; V13-V17 PolarHBondContact O-N 3.44Å; I14-V17 PolarHBondContact O-N 2.97Å; V17-F20 PolarHBondContact O-N 3.43Å; V17-L21 WeakPolarHBondContact O-CB 3.48Å; V17-L21 PolarHBondContact O-N 3.41Å |
| 18 | S | 97.4 | Very high | 96.6 | Very high | 65 Ų | 65 | 95.6 Ų | 95.6 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 177.1 | -173.9 | 0 | 0 | 0 | 0 | 111.8 | I14 A15 V16 F20 L21 Q22 | I14-S18 WeakPolarHBondContact O-CB 3.49Å; I14-S18 PolarHBondContact O-N 3.49Å; A15-S18 PolarHBondContact O-N 3.19Å; V16-S18 VanDerWaalsContact C-N 3.34Å; V16-S18 PolarHBondContact O-N 3.27Å; S18-F20 VanDerWaalsContact C-N 3.32Å; S18-F20 PolarHBondContact O-N 3.4Å; S18-L21 PolarHBondContact O-N 3.39Å; S18-Q22 WeakPolarHBondContact O-CB 3.41Å; S18-Q22 PolarHBondContact O-N 2.9Å |
| 19 | L | 98.1 | Very high | 96.8 | Very high | 132 Ų | 132 | 94.3 Ų | 94.3 | 69% | 0.691 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -57.9 | -45.7 | 176.2 | -172 | 91.3 | 0 | 0 | 0 | 111.4 | A15 V16 Q22 A23 | A15-L19 WeakPolarHBondContact O-CB 3.49Å; A15-L19 PolarHBondContact O-N 2.97Å; V16-L19 PolarHBondContact O-N 2.94Å; L19-Q22 PolarHBondContact O-N 3.34Å; L19-A23 WeakPolarHBondContact O-CB 3.35Å; L19-A23 PolarHBondContact O-N 3.35Å |
| 20 | F | 98.1 | Very high | 96.8 | Very high | 146 Ų | 146 | 91.7 Ų | 91.7 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.5 | -45.4 | 178.3 | -175.6 | -98 | 0 | 0 | 0 | 111.8 | V16 V17 S18 Q22 A23 C24 | V16-F20 WeakPolarHBondContact O-CB 3.39Å; V16-F20 PolarHBondContact O-N 3.49Å; V17-F20 PolarHBondContact O-N 3.43Å; S18-F20 VanDerWaalsContact C-N 3.32Å; S18-F20 PolarHBondContact O-N 3.4Å; F20-Q22 VanDerWaalsContact C-N 3.31Å; F20-Q22 PolarHBondContact O-N 3.31Å; F20-A23 PolarHBondContact O-N 2.97Å; F20-C24 VanDerWaalsContact CE1-SG 3.55Å; F20-C24 PolarHBondContact O-N 2.94Å; F20-C24 PolarHBondContact O-SG 2.76Å |
| 21 | L | 97.9 | Very high | 96.9 | Very high | 118 Ų | 118 | 93 Ų | 93 | 62% | 0.618 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.5 | -43 | 177.5 | -138.6 | 97.1 | 0 | 0 | 0 | 111.1 | V17 S18 C24 F25 | V17-L21 WeakPolarHBondContact O-CB 3.48Å; V17-L21 PolarHBondContact O-N 3.41Å; S18-L21 PolarHBondContact O-N 3.39Å; L21-C24 PolarHBondContact O-N 3.46Å; L21-F25 WeakPolarHBondContact O-CB 3.42Å; L21-F25 PolarHBondContact O-N 2.87Å |
| 22 | Q | 98 | Very high | 96.9 | Very high | 120 Ų | 120 | 96.3 Ų | 96.3 | 56% | 0.561 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.6 | -41.4 | 179.8 | -173.2 | 152.7 | 7.3 | 0 | 0 | 112.1 | S18 L19 F20 F25 L26 | S18-Q22 WeakPolarHBondContact O-CB 3.41Å; S18-Q22 PolarHBondContact O-N 2.9Å; L19-Q22 PolarHBondContact O-N 3.34Å; F20-Q22 VanDerWaalsContact C-N 3.31Å; F20-Q22 PolarHBondContact O-N 3.31Å; Q22-F25 PolarHBondContact O-N 3.26Å; Q22-L26 HydrophobicContact CG-CD1 4.39Å; Q22-L26 WeakPolarHBondContact O-CG 3.45Å; Q22-L26 PolarHBondContact O-N 2.88Å |
| 23 | A | 98 | Very high | 96.6 | Very high | 51 Ų | 51 | 96.7 Ų | 96.7 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | L19 F20 L26 T27 | L19-A23 WeakPolarHBondContact O-CB 3.35Å; L19-A23 PolarHBondContact O-N 3.35Å; F20-A23 PolarHBondContact O-N 2.97Å; A23-L26 PolarHBondContact O-N 3.29Å; A23-T27 WeakPolarHBondContact O-CB 3.42Å; A23-T27 PolarHBondContact O-N 2.88Å; A23-T27 PolarHBondContact O-OG1 3.49Å |
| 24 | C | 98.2 | Very high | 96.2 | Very high | 58 Ų | 58 | 95.1 Ų | 95.1 | 39% | 0.392 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 175.4 | -68.1 | 0 | 0 | 0 | 0 | 111.6 | F20 L21 T27 A28 | F20-C24 VanDerWaalsContact CE1-SG 3.55Å; F20-C24 PolarHBondContact O-N 2.94Å; F20-C24 PolarHBondContact O-SG 2.76Å; L21-C24 PolarHBondContact O-N 3.46Å; C24-T27 PolarHBondContact O-N 3.45Å; C24-A28 WeakPolarHBondContact O-CB 3.41Å; C24-A28 PolarHBondContact O-N 2.98Å |
| 25 | F | 97.5 | Very high | 95.7 | Very high | 132 Ų | 132 | 96.7 Ų | 96.7 | 58% | 0.579 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.8 | -46 | 179.1 | -177.9 | -108.3 | 0 | 0 | 0 | 112.2 | L21 Q22 T27 A28 I29 | L21-F25 WeakPolarHBondContact O-CB 3.42Å; L21-F25 PolarHBondContact O-N 2.87Å; Q22-F25 PolarHBondContact O-N 3.26Å; F25-T27 VanDerWaalsContact C-N 3.32Å; F25-T27 PolarHBondContact O-N 3.32Å; F25-A28 PolarHBondContact O-N 3.36Å; F25-I29 HydrophobicContact CD1-CD1 3.71Å; F25-I29 HydrophobicContact CE1-CD1 3.21Å; F25-I29 HydrophobicContact CE1-CG1 4.3Å; F25-I29 HydrophobicContact CE2-CD1 4.16Å; F25-I29 HydrophobicContact CG-CD1 4.38Å; F25-I29 HydrophobicContact CZ-CD1 3.48Å; F25-I29 VanDerWaalsContact CZ-CD1 3.48Å; F25-I29 HydrophobicContact CZ-CG1 4.25Å; F25-I29 WeakPolarHBondContact O-CG1 3.4Å; F25-I29 PolarHBondContact O-N 3.26Å |
| 26 | L | 97.1 | Very high | 94.8 | Very high | 102 Ų | 102 | 100.1 Ų | 100.1 | 53% | 0.534 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.5 | -41.7 | 175.9 | -73.5 | 172.7 | 0 | 0 | 0 | 112 | Q22 A23 I29 N30 | Q22-L26 HydrophobicContact CG-CD1 4.39Å; Q22-L26 WeakPolarHBondContact O-CG 3.45Å; Q22-L26 PolarHBondContact O-N 2.88Å; A23-L26 PolarHBondContact O-N 3.29Å; L26-I29 PolarHBondContact O-N 3.49Å; L26-N30 WeakPolarHBondContact O-CB 3.38Å; L26-N30 PolarHBondContact O-N 3.48Å |
| 27 | T | 96.8 | Very high | 93.4 | Very high | 96 Ų | 96 | 101.9 Ų | 101.9 | 59% | 0.589 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.5 | -42.9 | 176.5 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | A23 C24 F25 N30 Y31 | A23-T27 WeakPolarHBondContact O-CB 3.42Å; A23-T27 PolarHBondContact O-N 2.88Å; A23-T27 PolarHBondContact O-OG1 3.49Å; C24-T27 PolarHBondContact O-N 3.45Å; F25-T27 VanDerWaalsContact C-N 3.32Å; F25-T27 PolarHBondContact O-N 3.32Å; T27-N30 PolarHBondContact O-N 2.98Å; T27-Y31 WeakPolarHBondContact O-CB 3.44Å; T27-Y31 PolarHBondContact O-N 2.95Å |
| 28 | A | 96.7 | Very high | 91.6 | Very high | 48 Ų | 48 | 104.1 Ų | 104.1 | 40% | 0.397 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.5 | -43.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | C24 F25 Y31 L32 | C24-A28 WeakPolarHBondContact O-CB 3.41Å; C24-A28 PolarHBondContact O-N 2.98Å; F25-A28 PolarHBondContact O-N 3.36Å; A28-Y31 PolarHBondContact O-N 2.93Å; A28-L32 WeakPolarHBondContact O-CB 3.47Å; A28-L32 VanDerWaalsContact O-CG 3.3Å; A28-L32 WeakPolarHBondContact O-CG 3.36Å; A28-L32 PolarHBondContact O-N 3.48Å |
| 29 | I | 96.1 | Very high | 89.8 | Confident | 78 Ų | 78 | 107.3 Ų | 107.3 | 40% | 0.4 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.9 | -47.4 | 173.8 | -70.8 | 170.9 | 0 | 0 | 0 | 110.5 | F25 L26 Y31 L32 L33 | F25-I29 HydrophobicContact CD1-CD1 3.71Å; F25-I29 HydrophobicContact CE1-CD1 3.21Å; F25-I29 HydrophobicContact CE1-CG1 4.3Å; F25-I29 HydrophobicContact CE2-CD1 4.16Å; F25-I29 HydrophobicContact CG-CD1 4.38Å; F25-I29 HydrophobicContact CZ-CD1 3.48Å; F25-I29 VanDerWaalsContact CZ-CD1 3.48Å; F25-I29 HydrophobicContact CZ-CG1 4.25Å; F25-I29 WeakPolarHBondContact O-CG1 3.4Å; F25-I29 PolarHBondContact O-N 3.26Å; L26-I29 PolarHBondContact O-N 3.49Å; I29-Y31 VanDerWaalsContact C-N 3.32Å; I29-Y31 PolarHBondContact O-N 3.48Å; I29-L32 PolarHBondContact O-N 2.85Å; I29-L33 VanDerWaalsContact O-CB 3.32Å; I29-L33 WeakPolarHBondContact O-CB 3.39Å; I29-L33 PolarHBondContact O-N 3.28Å |
| 30 | N | 94.4 | Very high | 87.9 | Confident | 102 Ų | 102 | 104.1 Ų | 104.1 | 55% | 0.545 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.3 | -40.5 | -179.3 | -176.2 | -92.4 | 0 | 0 | 0 | 112.1 | L26 T27 L33 S34 | L26-N30 WeakPolarHBondContact O-CB 3.38Å; L26-N30 PolarHBondContact O-N 3.48Å; T27-N30 PolarHBondContact O-N 2.98Å; N30-L33 PolarHBondContact O-N 2.98Å; N30-S34 WeakPolarHBondContact O-CB 3.32Å; N30-S34 PolarHBondContact O-N 2.77Å; N30-S34 PolarHBondContact O-OG 3.42Å |
| 31 | Y | 94.9 | Very high | 85.9 | Confident | 150 Ų | 150 | 103.5 Ų | 103.5 | 59% | 0.588 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.8 | -47.1 | 174.1 | 177.3 | -101.3 | 0 | 0 | 0 | 112.2 | T27 A28 I29 L33 S34 R35 | T27-Y31 WeakPolarHBondContact O-CB 3.44Å; T27-Y31 PolarHBondContact O-N 2.95Å; A28-Y31 PolarHBondContact O-N 2.93Å; I29-Y31 VanDerWaalsContact C-N 3.32Å; I29-Y31 PolarHBondContact O-N 3.48Å; Y31-L33 VanDerWaalsContact C-N 3.34Å; Y31-L33 PolarHBondContact O-N 2.94Å; Y31-S34 PolarHBondContact O-N 3.43Å; Y31-R35 WeakPolarHBondContact O-CB 3.3Å; Y31-R35 PolarHBondContact O-N 3.17Å |
| 32 | L | 92.8 | Very high | 83.6 | Confident | 110 Ų | 110 | 103.1 Ų | 103.1 | 58% | 0.576 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.7 | -40.5 | 178.2 | -72.1 | 174.2 | 0 | 0 | 0 | 112 | A28 I29 R35 H36 | A28-L32 WeakPolarHBondContact O-CB 3.47Å; A28-L32 VanDerWaalsContact O-CG 3.3Å; A28-L32 WeakPolarHBondContact O-CG 3.36Å; A28-L32 PolarHBondContact O-N 3.48Å; I29-L32 PolarHBondContact O-N 2.85Å; L32-R35 PolarHBondContact O-N 3.03Å; L32-H36 WeakPolarHBondContact O-CB 3.45Å; L32-H36 PolarHBondContact O-N 3.11Å |
| 33 | L | 90.3 | Very high | 81.5 | Confident | 98 Ų | 98 | 102.6 Ų | 102.6 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66 | -43.7 | 178 | -173.5 | 65.7 | 0 | 0 | 0 | 111.1 | I29 N30 Y31 R35 H36 M37 | I29-L33 VanDerWaalsContact O-CB 3.32Å; I29-L33 WeakPolarHBondContact O-CB 3.39Å; I29-L33 PolarHBondContact O-N 3.28Å; N30-L33 PolarHBondContact O-N 2.98Å; Y31-L33 VanDerWaalsContact C-N 3.34Å; Y31-L33 PolarHBondContact O-N 2.94Å; L33-R35 PolarHBondContact O-N 3.29Å; L33-H36 PolarHBondContact O-N 3.41Å; L33-M37 WeakPolarHBondContact O-CG 3.35Å; L33-M37 PolarHBondContact O-N 3.38Å |
| 34 | S | 88.8 | Confident | 79.1 | Confident | 52 Ų | 52 | 105.6 Ų | 105.6 | 36% | 0.364 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.8 | -46.5 | 177.1 | -57 | 0 | 0 | 0 | 0 | 110.9 | N30 Y31 H36 M37 D38 | N30-S34 WeakPolarHBondContact O-CB 3.32Å; N30-S34 PolarHBondContact O-N 2.77Å; N30-S34 PolarHBondContact O-OG 3.42Å; Y31-S34 PolarHBondContact O-N 3.43Å; S34-H36 PolarHBondContact O-N 3.39Å; S34-M37 PolarHBondContact O-N 2.95Å; S34-M37 VanDerWaalsContact O-N 3.11Å; S34-D38 PolarHBondContact O-N 3.06Å |
| 35 | R | 85.5 | Confident | 76.5 | Confident | 145 Ų | 145 | 109.2 Ų | 109.2 | 55% | 0.547 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -60.7 | -41.7 | 176.5 | -176.4 | 179.4 | -180 | -175.4 | 2.7 | 113 | Y31 L32 L33 M37 D38 D39 | Y31-R35 WeakPolarHBondContact O-CB 3.3Å; Y31-R35 PolarHBondContact O-N 3.17Å; L32-R35 PolarHBondContact O-N 3.03Å; L33-R35 PolarHBondContact O-N 3.29Å; R35-M37 PolarHBondContact O-N 3.41Å; R35-D38 PolarHBondContact O-N 3.29Å; R35-D39 PolarHBondContact O-N 2.97Å; R35-D39 VanDerWaalsContact O-N 3.17Å |
| 36 | H | 77.6 | Confident | 74.4 | Confident | 132 Ų | 132 | 108.6 Ų | 108.6 | 61% | 0.611 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.8 | -31.7 | 177.1 | -179.3 | -76.9 | 0 | 0 | 0 | 112 | L32 L33 S34 | L32-H36 WeakPolarHBondContact O-CB 3.45Å; L32-H36 PolarHBondContact O-N 3.11Å; L33-H36 PolarHBondContact O-N 3.41Å; S34-H36 PolarHBondContact O-N 3.39Å |
| 37 | M | 70.5 | Confident | 72.1 | Confident | 123 Ų | 123 | 111.5 Ų | 111.5 | 61% | 0.606 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -76.3 | -29 | 176.2 | -66.5 | -174.6 | 85.9 | 0 | 0 | 112.7 | L33 S34 R35 S40 | L33-M37 WeakPolarHBondContact O-CG 3.35Å; L33-M37 PolarHBondContact O-N 3.38Å; S34-M37 PolarHBondContact O-N 2.95Å; S34-M37 VanDerWaalsContact O-N 3.11Å; R35-M37 PolarHBondContact O-N 3.41Å; M37-S40 PolarHBondContact O-OG 3.18Å; M37-S40 VanDerWaalsContact O-OG 3.07Å |
| 38 | D | 60.1 | Low | 69.8 | Low | 129 Ų | 129 | 114.8 Ų | 114.8 | 69% | 0.69 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -71.9 | -31.1 | 173.5 | -70.3 | -37.9 | 0 | 0 | 0 | 112.4 | S34 R35 S40 | S34-D38 PolarHBondContact O-N 3.06Å; R35-D38 PolarHBondContact O-N 3.29Å; D38-S40 VanDerWaalsContact C-N 3.32Å |
| 39 | D | 59.4 | Low | 67.7 | Low | 132 Ų | 132 | 117.5 Ų | 117.5 | 71% | 0.706 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -8.8 | 177.6 | -79 | -22 | 0 | 0 | 0 | 113.2 | R35 | R35-D39 PolarHBondContact O-N 2.97Å; R35-D39 VanDerWaalsContact O-N 3.17Å |
| 40 | S | 58 | Low | 65.3 | Low | 64 Ų | 64 | 118.9 Ų | 118.9 | 45% | 0.448 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.1 | -7.4 | -173.5 | 60.8 | 0 | 0 | 0 | 0 | 116.6 | M37 D38 | M37-S40 PolarHBondContact O-OG 3.18Å; M37-S40 VanDerWaalsContact O-OG 3.07Å; D38-S40 VanDerWaalsContact C-N 3.32Å |
| 41 | D | 56.5 | Low | 62.7 | Low | 133 Ų | 133 | 119.6 Ų | 119.6 | 71% | 0.711 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -147.3 | 81.6 | 178.4 | -75.7 | -54.5 | 0 | 0 | 0 | 113 | ||
| 42 | T | 47.7 | Very low | 60.4 | Low | 111 Ų | 111 | 118 Ų | 118 | 68% | 0.681 | 68% | 0.682 | S | S | * | * | trans | -155.1 | 92.4 | 148.3 | -52.6 | 0 | 0 | 0 | 0 | 110.5 | S44 | T42-S44 PolarHBondContact O-N 3.43Å; T42-S44 VanDerWaalsContact O-N 3.16Å | ||
| 43 | P | 54.8 | Low | 58.4 | Low | 108 Ų | 108 | 118.1 Ų | 118.1 | 70% | 0.701 | 69% | 0.692 | S | S | * | * | trans | -57.9 | 115.4 | 147.3 | 24.5 | -28.4 | 0 | 0 | 0 | 107.2 | D45 | P43-D45 PolarHBondContact O-N 3.3Š| ||
| 44 | S | 47.5 | Very low | 56.5 | Low | 114 Ų | 114 | 119.3 Ų | 119.3 | 80% | 0.797 | 71% | 0.706 | S | S | * | * | trans | -68.6 | 75.8 | 172.4 | -83.7 | 0 | 0 | 0 | 0 | 110 | T42 | T42-S44 PolarHBondContact O-N 3.43Å; T42-S44 VanDerWaalsContact O-N 3.16Å | ||
| 45 | D | 43.7 | Very low | 54.2 | Low | 134 Ų | 134 | 122.8 Ų | 122.8 | 72% | 0.717 | 73% | 0.727 | S | S | * | * | trans | -98.2 | 99.5 | 158.4 | -73.6 | -24.1 | 0 | 0 | 0 | 107.1 | P43 L47 | P43-D45 PolarHBondContact O-N 3.3Å; D45-L47 VanDerWaalsContact C-N 3.27Å; D45-L47 PolarHBondContact O-N 2.83Å | ||
| 46 | S | 53 | Low | 52.4 | Low | 119 Ų | 119 | 120 Ų | 120 | 83% | 0.832 | 74% | 0.735 | S | S | * | * | trans | -63.8 | 88 | 171.1 | 59.3 | 0 | 0 | 0 | 0 | 109.4 | D48 | S46-D48 PolarHBondContact O-N 2.85Š| ||
| 47 | L | 49.1 | Very low | 50.6 | Low | 164 Ų | 164 | 119.1 Ų | 119.1 | 86% | 0.859 | 74% | 0.743 | S | S | * | * | trans | -86.6 | 93.3 | 168.1 | -78.3 | 166.9 | 0 | 0 | 0 | 108.4 | D45 S49 | D45-L47 VanDerWaalsContact C-N 3.27Å; D45-L47 PolarHBondContact O-N 2.83Å; L47-S49 PolarHBondContact O-N 3.16Å | ||
| 48 | D | 48.2 | Very low | 49.3 | Very low | 165 Ų | 165 | 121.9 Ų | 121.9 | 88% | 0.882 | 75% | 0.754 | S | S | * | * | trans | -55.3 | 131.4 | 169.2 | -120.8 | -17.4 | 0 | 0 | 0 | 109.6 | S46 | S46-D48 PolarHBondContact O-N 2.85Š| ||
| 49 | S | 53.1 | Low | 48.7 | Very low | 104 Ų | 104 | 119.5 Ų | 119.5 | 73% | 0.727 | 75% | 0.752 | S | S | * | * | trans | -74 | 129.3 | -175.1 | 71.9 | 0 | 0 | 0 | 0 | 111.4 | L47 | L47-S49 PolarHBondContact O-N 3.16Š| ||
| 50 | S | 46.3 | Very low | 48.2 | Very low | 108 Ų | 108 | 119.4 Ų | 119.4 | 76% | 0.755 | 76% | 0.757 | S | S | * | * | trans | 179.5 | 123.8 | 130.6 | -94.9 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 51 | C | 40 | Very low | 47.9 | Very low | 116 Ų | 116 | 124.5 Ų | 124.5 | 78% | 0.784 | 77% | 0.773 | S | S | * | * | trans | 68.7 | 100.8 | 141.6 | -68.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 52 | S | 45 | Very low | 48 | Very low | 116 Ų | 116 | 126.2 Ų | 126.2 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | 143.6 | 120.5 | 107 | -62.1 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 53 | S | 51.4 | Low | 48.8 | Very low | 114 Ų | 114 | 124.2 Ų | 124.2 | 80% | 0.797 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -61 | 159.6 | 170.6 | -57.2 | 0 | 0 | 0 | 0 | 112.1 | ||
| 54 | P | 50 | Low | 49.3 | Very low | 123 Ų | 123 | 126.2 Ų | 126.2 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 143.7 | -158 | 34.5 | -32.5 | 0 | 0 | 0 | 112.2 | ||
| 55 | P | 41.3 | Very low | 49.9 | Very low | 125 Ų | 125 | 129.5 Ų | 129.5 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 123.8 | 154.4 | 30 | -18.1 | 0 | 0 | 0 | 109.4 | ||
| 56 | A | 46.4 | Very low | 51.2 | Low | 87 Ų | 87 | 129.1 Ų | 129.1 | 72% | 0.719 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 156.6 | 165.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 57 | C | 41.6 | Very low | 51.9 | Low | 113 Ų | 113 | 131.5 Ų | 131.5 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | trans | 94.2 | 101.7 | 157.1 | -58 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 58 | Q | 43.2 | Very low | 52.6 | Low | 180 Ų | 180 | 129.1 Ų | 129.1 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | 103.4 | 112.5 | 126.1 | -56.6 | -108.4 | -23.9 | 0 | 0 | 118.6 | |||||
| 59 | A | 46.6 | Very low | 53.6 | Low | 79 Ų | 79 | 127 Ų | 127 | 65% | 0.653 | 76% | 0.757 | S | S | * | * | 84.9 | 131.4 | 124.9 | 0 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 60 | T | 48.6 | Very low | 54.2 | Low | 131 Ų | 131 | 130.7 Ų | 130.7 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 73.5 | 88.7 | 151 | 46.9 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 61 | E | 52.4 | Low | 54.9 | Low | 170 Ų | 170 | 130.9 Ų | 130.9 | 79% | 0.794 | 76% | 0.761 | S | S | * | * | -163.5 | 125.8 | 112.1 | 38.6 | -159.7 | 134.4 | 0 | 0 | 108.8 | V63 | E61-V63 VanDerWaalsContact C-N 3.27Å; E61-V63 HydrophobicContact CB-CG2 4.16Å; E61-V63 HydrophobicContact CG-CG2 3.77Å; E61-V63 WeakPolarHBondContact O-CG2 3.44Å; E61-V63 PolarHBondContact O-N 3.07Å | |||
| 62 | D | 57.8 | Low | 56 | Low | 169 Ų | 169 | 132.4 Ų | 132.4 | 90% | 0.904 | 76% | 0.762 | S | S | * | * | trans | -72.3 | 89.6 | 169.5 | -177.4 | 40.8 | 0 | 0 | 0 | 106.6 | ||||
| 63 | V | 65.9 | Low | 56.5 | Low | 70 Ų | 70 | 133.3 Ų | 133.3 | 42% | 0.424 | 76% | 0.764 | S | S | . | * | trans | -86.9 | 112.4 | -179.5 | -161 | 0 | 0 | 0 | 0 | 107.2 | E61 Y65 | E61-V63 VanDerWaalsContact C-N 3.27Å; E61-V63 HydrophobicContact CB-CG2 4.16Å; E61-V63 HydrophobicContact CG-CG2 3.77Å; E61-V63 WeakPolarHBondContact O-CG2 3.44Å; E61-V63 PolarHBondContact O-N 3.07Å; V63-Y65 VanDerWaalsContact C-N 3.29Å; V63-Y65 HydrophobicContact CB-CD2 4.22Å; V63-Y65 HydrophobicContact CB-CE2 3.74Å; V63-Y65 HydrophobicContact CG1-CE2 4.23Å; V63-Y65 WeakPolarHBondContact O-CD2 3.08Å; V63-Y65 PolarHBondContact O-N 2.92Å | ||
| 64 | D | 65.1 | Low | 56.3 | Low | 150 Ų | 150 | 131.4 Ų | 131.4 | 80% | 0.802 | 76% | 0.763 | S | S | * | * | trans | -75.9 | 84.2 | -179.5 | -156.1 | 4.6 | 0 | 0 | 0 | 109.6 | T66 | D64-T66 PolarHBondContact O-N 2.86Å; D64-T66 VanDerWaalsContact O-N 3.11Å | ||
| 65 | Y | 58.9 | Low | 56.4 | Low | 183 Ų | 183 | 134 Ų | 134 | 72% | 0.718 | 77% | 0.765 | S | S | * | * | trans | -67.3 | 107.4 | 174.6 | -68.6 | -84.7 | 0 | 0 | 0 | 108.8 | V63 Q67 | V63-Y65 VanDerWaalsContact C-N 3.29Å; V63-Y65 HydrophobicContact CB-CD2 4.22Å; V63-Y65 HydrophobicContact CB-CE2 3.74Å; V63-Y65 HydrophobicContact CG1-CE2 4.23Å; V63-Y65 WeakPolarHBondContact O-CD2 3.08Å; V63-Y65 PolarHBondContact O-N 2.92Å; Y65-Q67 PolarHBondContact O-N 2.83Å | ||
| 66 | T | 70.7 | Confident | 56.6 | Low | 126 Ų | 126 | 134.5 Ų | 134.5 | 77% | 0.773 | 76% | 0.76 | S | S | * | * | trans | -65.5 | 105.7 | 165 | -62.8 | 0 | 0 | 0 | 0 | 108.3 | D64 V68 | D64-T66 PolarHBondContact O-N 2.86Å; D64-T66 VanDerWaalsContact O-N 3.11Å; T66-V68 PolarHBondContact O-N 3.15Å | ||
| 67 | Q | 67.9 | Low | 56.7 | Low | 169 Ų | 169 | 137.9 Ų | 137.9 | 79% | 0.79 | 76% | 0.758 | S | S | * | * | trans | -67.6 | 119.3 | 170.7 | -71.7 | -171.7 | 41.4 | 0 | 0 | 109.2 | Y65 V69 | Y65-Q67 PolarHBondContact O-N 2.83Å; Q67-V69 PolarHBondContact O-N 3.35Å | ||
| 68 | V | 64 | Low | 57.4 | Low | 114 Ų | 114 | 140.1 Ų | 140.1 | 69% | 0.691 | 76% | 0.763 | S | S | * | * | trans | -79.9 | 101.7 | 166.8 | -84.4 | 0 | 0 | 0 | 0 | 108.4 | T66 F70 | T66-V68 PolarHBondContact O-N 3.15Å; V68-F70 PolarHBondContact O-N 3.03Å | ||
| 69 | V | 70 | Confident | 57.8 | Low | 120 Ų | 120 | 139.2 Ų | 139.2 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | -80.3 | 113.5 | 170.1 | 176.3 | 0 | 0 | 0 | 0 | 107.6 | Q67 | Q67-V69 PolarHBondContact O-N 3.35Š| ||
| 70 | F | 65.4 | Low | 58.5 | Low | 182 Ų | 182 | 139.8 Ų | 139.8 | 80% | 0.798 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 124 | 165.6 | -65.7 | -79.7 | 0 | 0 | 0 | 108 | V68 | V68-F70 PolarHBondContact O-N 3.03Š|
| 71 | S | 60.8 | Low | 58.7 | Low | 112 Ų | 112 | 139.5 Ų | 139.5 | 78% | 0.783 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 137.9 | 169.9 | -55.5 | 0 | 0 | 0 | 0 | 109.2 | ||
| 72 | D | 63.6 | Low | 59 | Low | 148 Ų | 148 | 138.5 Ų | 138.5 | 79% | 0.791 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 145.6 | 167.3 | -65.6 | -48.6 | 0 | 0 | 0 | 109.3 | G74 | D72-G74 VanDerWaalsContact C-N 3.3Å; D72-G74 PolarHBondContact O-N 2.96Å |
| 73 | P | 55.9 | Low | 59.1 | Low | 134 Ų | 134 | 138.1 Ų | 138.1 | 87% | 0.87 | 76% | 0.761 | S | S | * | * | trans | -60.5 | 94.7 | -177.5 | -17.4 | 29.9 | 0 | 0 | 0 | 109.9 | E75 | P73-E75 VanDerWaalsContact C-N 3.29Å; P73-E75 PolarHBondContact O-N 2.93Å | ||
| 74 | G | 45.3 | Very low | 58.6 | Low | 75 Ų | 75 | 145.6 Ų | 145.6 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | -69.7 | 89.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | D72 | D72-G74 VanDerWaalsContact C-N 3.3Å; D72-G74 PolarHBondContact O-N 2.96Å | ||
| 75 | E | 52.2 | Low | 58.1 | Low | 178 Ų | 178 | 146.2 Ų | 146.2 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | 30.4 | 104 | 142.1 | -167.7 | 179 | 169.8 | 0 | 0 | 115.8 | P73 | P73-E75 VanDerWaalsContact C-N 3.29Å; P73-E75 PolarHBondContact O-N 2.93Å | ||
| 76 | L | 46.6 | Very low | 58.2 | Low | 135 Ų | 135 | 144 Ų | 144 | 71% | 0.707 | 78% | 0.782 | S | S | * | * | trans | -161.3 | 125.9 | 131.3 | -113.8 | 165.9 | 0 | 0 | 0 | 113.7 | ||||
| 77 | K | 48.5 | Very low | 57.6 | Low | 157 Ų | 157 | 144.1 Ų | 144.1 | 68% | 0.683 | 78% | 0.776 | S | S | * | * | trans | 73.6 | 81.9 | 152.3 | 27.7 | -156.1 | 162.2 | -144 | 0 | 117.5 | D79 | K77-D79 PolarHBondContact O-N 3.3Š| ||
| 78 | N | 56.9 | Low | 57.3 | Low | 160 Ų | 160 | 145.1 Ų | 145.1 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | 20 | 84.7 | 122.6 | -54.4 | -39.4 | 0 | 0 | 0 | 115.5 | |||||
| 79 | D | 51.6 | Low | 56.8 | Low | 161 Ų | 161 | 148.3 Ų | 148.3 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | trans | -139.8 | 92.7 | 144.6 | -78.5 | -45 | 0 | 0 | 0 | 106.5 | K77 | K77-D79 PolarHBondContact O-N 3.3Š| ||
| 80 | S | 60.5 | Low | 56.3 | Low | 92 Ų | 92 | 149.2 Ų | 149.2 | 64% | 0.643 | 79% | 0.785 | S | S | * | * | trans | -61.6 | 133.3 | -177.6 | -165.2 | 0 | 0 | 0 | 0 | 110.2 | L82 | S80-L82 PolarHBondContact O-N 2.69Š| ||
| 81 | P | 52.9 | Low | 55.9 | Low | 125 Ų | 125 | 146.7 Ų | 146.7 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -68.9 | 93.2 | 154.8 | 26.2 | -25.3 | 0 | 0 | 0 | 107.3 | D83 | P81-D83 PolarHBondContact O-N 3.17Š| ||
| 82 | L | 59 | Low | 55.5 | Low | 149 Ų | 149 | 148 Ų | 148 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | trans | -72 | 104.6 | 164.3 | -80.6 | 168.4 | 0 | 0 | 0 | 107.5 | S80 | S80-L82 PolarHBondContact O-N 2.69Š| ||
| 83 | D | 60.3 | Low | 55.3 | Low | 161 Ų | 161 | 151.6 Ų | 151.6 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -166.2 | 50 | 145.2 | -97.9 | -14.6 | 0 | 0 | 0 | 110.6 | P81 | P81-D83 PolarHBondContact O-N 3.17Š| ||
| 84 | Y | 54.3 | Low | 55.4 | Low | 226 Ų | 226 | 149.6 Ų | 149.6 | 89% | 0.886 | 77% | 0.772 | S | S | * | * | trans | -87.5 | 115.9 | 148.8 | -118.6 | -91.7 | 0 | 0 | 0 | 105.6 | N86 | Y84-N86 PolarHBondContact O-N 3.12Š| ||
| 85 | E | 55 | Low | 56.1 | Low | 164 Ų | 164 | 152.5 Ų | 152.5 | 77% | 0.766 | 77% | 0.769 | S | S | * | * | trans | -61.3 | 80.4 | 164.9 | -76.6 | -165 | 161.3 | 0 | 0 | 109.1 | I87 | E85-I87 PolarHBondContact O-N 3.37Š| ||
| 86 | N | 60.4 | Low | 56.3 | Low | 137 Ų | 137 | 149 Ų | 149 | 73% | 0.733 | 76% | 0.76 | S | S | * | * | trans | -78.2 | 71.3 | 148.1 | -172.4 | -6.6 | 0 | 0 | 0 | 106.3 | Y84 K88 | Y84-N86 PolarHBondContact O-N 3.12Å; N86-K88 VanDerWaalsContact C-N 3.33Å; N86-K88 PolarHBondContact O-N 2.81Å; N86-K88 VanDerWaalsContact O-N 3.12Å | ||
| 87 | I | 58.6 | Low | 56.7 | Low | 128 Ų | 128 | 146.1 Ų | 146.1 | 66% | 0.656 | 75% | 0.745 | S | S | * | * | trans | -68.3 | 105.7 | 155.4 | 50 | 161.2 | 0 | 0 | 0 | 106.1 | E85 E89 | E85-I87 PolarHBondContact O-N 3.37Å; I87-E89 PolarHBondContact O-N 3.32Å | ||
| 88 | K | 62.3 | Low | 56.8 | Low | 189 Ų | 189 | 145 Ų | 145 | 82% | 0.822 | 75% | 0.754 | S | S | * | * | trans | -65.7 | 79.3 | 175.4 | -165.1 | -173.5 | -172.1 | -143.4 | 0 | 108.7 | N86 I90 | N86-K88 VanDerWaalsContact C-N 3.33Å; N86-K88 PolarHBondContact O-N 2.81Å; N86-K88 VanDerWaalsContact O-N 3.12Å; K88-I90 PolarHBondContact O-N 2.92Å | ||
| 89 | E | 53.6 | Low | 56.7 | Low | 181 Ų | 181 | 143.8 Ų | 143.8 | 85% | 0.846 | 74% | 0.743 | S | S | * | * | trans | -77.7 | 112.2 | 166 | -166.2 | 172.1 | -162 | 0 | 0 | 108 | I87 | I87-E89 PolarHBondContact O-N 3.32Š| ||
| 90 | I | 58.8 | Low | 56.8 | Low | 140 Ų | 140 | 146.3 Ų | 146.3 | 72% | 0.718 | 74% | 0.741 | S | S | * | * | trans | -36.4 | 132 | 176.8 | -78.8 | 154 | 0 | 0 | 0 | 111.9 | K88 D92 | K88-I90 PolarHBondContact O-N 2.92Å; I90-D92 PolarHBondContact O-N 2.81Å | ||
| 91 | T | 56.9 | Low | 56.6 | Low | 129 Ų | 129 | 150.2 Ų | 150.2 | 79% | 0.791 | 75% | 0.748 | S | S | * | * | trans | -27.1 | 99.8 | 157.5 | 34.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 92 | D | 53.3 | Low | 56.8 | Low | 140 Ų | 140 | 153 Ų | 153 | 75% | 0.749 | 75% | 0.748 | S | S | * | * | trans | -125 | 34.5 | 140.5 | -158.7 | 19.3 | 0 | 0 | 0 | 110.1 | I90 V94 | I90-D92 PolarHBondContact O-N 2.81Å; D92-V94 PolarHBondContact O-N 3.2Å; D92-V94 WeakPolarHBondContact OD1-CG2 3.45Å | ||
| 93 | Y | 57.8 | Low | 56.7 | Low | 223 Ų | 223 | 150.1 Ų | 150.1 | 88% | 0.875 | 74% | 0.738 | S | S | * | * | trans | -70.9 | 74.4 | 163.6 | -141.6 | -86.2 | 0 | 0 | 0 | 107.5 | N95 | Y93-N95 PolarHBondContact O-N 3.31Š| ||
| 94 | V | 58.4 | Low | 56.3 | Low | 92 Ų | 92 | 146.7 Ų | 146.7 | 56% | 0.558 | 73% | 0.726 | S | S | * | * | trans | -61.9 | 109.6 | 159.1 | 176.3 | 0 | 0 | 0 | 0 | 104.7 | D92 V96 | D92-V94 PolarHBondContact O-N 3.2Å; D92-V94 WeakPolarHBondContact OD1-CG2 3.45Å; V94-V96 HydrophobicContact CG1-CG1 4.25Å; V94-V96 PolarHBondContact O-N 3.21Å | ||
| 95 | N | 61.1 | Low | 56.5 | Low | 135 Ų | 135 | 143.7 Ų | 143.7 | 72% | 0.722 | 72% | 0.718 | S | S | * | * | trans | -52.7 | 86.2 | 157.3 | 179.3 | 79.9 | 0 | 0 | 0 | 107.1 | Y93 N97 | Y93-N95 PolarHBondContact O-N 3.31Å; N95-N97 PolarHBondContact O-N 2.81Å | ||
| 96 | V | 56 | Low | 56.2 | Low | 105 Ų | 105 | 146.8 Ų | 146.8 | 64% | 0.636 | 72% | 0.723 | S | S | * | * | trans | -64.7 | 100.8 | 166.6 | -82 | 0 | 0 | 0 | 0 | 104.8 | V94 | V94-V96 HydrophobicContact CG1-CG1 4.25Å; V94-V96 PolarHBondContact O-N 3.21Å | ||
| 97 | N | 54.1 | Low | 56 | Low | 75 Ų | 75 | 150.2 Ų | 150.2 | 40% | 0.401 | 73% | 0.727 | S | S | . | * | trans | -38.2 | 136 | 160.1 | -164.9 | 15.6 | 0 | 0 | 0 | 107.5 | N95 E99 | N95-N97 PolarHBondContact O-N 2.81Å; N97-E99 HydrophobicContact CB-CB 4.09Å; N97-E99 VanDerWaalsContact ND2-CB 3.33Å; N97-E99 WeakPolarHBondContact ND2-CB 3.33Å; N97-E99 WeakPolarHBondContact ND2-CG 3.5Å; N97-E99 PolarHBondContact ND2-OE2 3.1Å; N97-E99 CarbonylContact O-C 3.22Å; N97-E99 VanDerWaalsContact O-C 3.22Å; N97-E99 WeakPolarHBondContact O-CA 3.45Å; N97-E99 PolarHBondContact O-N 3.04Å | ||
| 98 | P | 50.4 | Low | 55.6 | Low | 133 Ų | 133 | 153.6 Ų | 153.6 | 86% | 0.864 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -53.8 | -9.8 | 170.8 | 19.7 | -32.9 | 0 | 0 | 0 | 113.2 | R100 | P98-R100 PolarHBondContact O-N 2.87Å; P98-R100 VanDerWaalsContact O-N 3.1Å |
| 99 | E | 54.7 | Low | 55.3 | Low | 134 Ų | 134 | 149.9 Ų | 149.9 | 63% | 0.626 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -64.8 | 97.9 | 156 | -59.9 | -171.5 | 169.1 | 0 | 0 | 112.7 | N97 | N97-E99 HydrophobicContact CB-CB 4.09Å; N97-E99 VanDerWaalsContact ND2-CB 3.33Å; N97-E99 WeakPolarHBondContact ND2-CB 3.33Å; N97-E99 WeakPolarHBondContact ND2-CG 3.5Å; N97-E99 PolarHBondContact ND2-OE2 3.1Å; N97-E99 CarbonylContact O-C 3.22Å; N97-E99 VanDerWaalsContact O-C 3.22Å; N97-E99 WeakPolarHBondContact O-CA 3.45Å; N97-E99 PolarHBondContact O-N 3.04Å |
| 100 | R | 54.8 | Low | 55.6 | Low | 215 Ų | 215 | 146.6 Ų | 146.6 | 81% | 0.811 | 72% | 0.719 | S | S | * | * | S | Bend | trans | 95.9 | 78 | 152.7 | -49.3 | -179.7 | -168.5 | -147.9 | 1.9 | 116.7 | P98 | P98-R100 PolarHBondContact O-N 2.87Å; P98-R100 VanDerWaalsContact O-N 3.1Å |
| 101 | H | 56.7 | Low | 55.4 | Low | 174 Ų | 174 | 145 Ų | 145 | 81% | 0.806 | 72% | 0.717 | S | S | * | * | trans | -147.1 | 64.9 | 136.6 | -92.9 | -64 | 0 | 0 | 0 | 110.6 | ||||
| 102 | K | 55.8 | Low | 55.3 | Low | 184 Ų | 184 | 142.9 Ų | 142.9 | 80% | 0.8 | 71% | 0.713 | S | S | * | * | trans | -93 | 112.9 | 149 | -162.1 | 176.8 | -175.2 | -177.9 | 0 | 105.8 | S104 | K102-S104 PolarHBondContact O-N 2.7Å; K102-S104 VanDerWaalsContact O-N 3.15Å | ||
| 103 | P | 57.5 | Low | 55.5 | Low | 87 Ų | 87 | 143.4 Ų | 143.4 | 57% | 0.565 | 72% | 0.715 | S | S | * | * | trans | -55.1 | 124.2 | 160.1 | 22.2 | -28.5 | 0 | 0 | 0 | 106.8 | F105 | P103-F105 VanDerWaalsContact C-N 3.32Å; P103-F105 HydrophobicContact CG-CE2 4.15Å; P103-F105 WeakPolarHBondContact O-CD2 3.19Å; P103-F105 PolarHBondContact O-N 3.49Å | ||
| 104 | S | 51.7 | Low | 55.6 | Low | 89 Ų | 89 | 138 Ų | 138 | 62% | 0.622 | 71% | 0.71 | S | S | * | * | trans | -63.3 | 94.1 | 177.4 | 38.4 | 0 | 0 | 0 | 0 | 108.9 | K102 W106 | K102-S104 PolarHBondContact O-N 2.7Å; K102-S104 VanDerWaalsContact O-N 3.15Å; S104-W106 PolarHBondContact O-N 2.97Å | ||
| 105 | F | 59.1 | Low | 55.9 | Low | 164 Ų | 164 | 141.9 Ų | 141.9 | 72% | 0.719 | 72% | 0.722 | S | S | * | * | trans | -68.2 | 91.1 | 156.9 | -65 | -79.6 | 0 | 0 | 0 | 106.2 | P103 Y107 | P103-F105 VanDerWaalsContact C-N 3.32Å; P103-F105 HydrophobicContact CG-CE2 4.15Å; P103-F105 WeakPolarHBondContact O-CD2 3.19Å; P103-F105 PolarHBondContact O-N 3.49Å; F105-Y107 PolarHBondContact O-N 2.91Å | ||
| 106 | W | 48.2 | Very low | 55.9 | Low | 229 Ų | 229 | 141.5 Ų | 141.5 | 87% | 0.867 | 73% | 0.727 | S | S | * | * | trans | -65.6 | 85.1 | 163.4 | -69 | 93.1 | 0 | 0 | 0 | 107 | S104 F108 | S104-W106 PolarHBondContact O-N 2.97Å; W106-F108 PolarHBondContact O-N 2.69Å | ||
| 107 | Y | 55.8 | Low | 56.5 | Low | 209 Ų | 209 | 140 Ų | 140 | 82% | 0.82 | 73% | 0.725 | S | S | * | * | trans | -61.6 | 116.7 | 161.5 | -122.7 | -92.1 | 0 | 0 | 0 | 106.1 | F105 V109 | F105-Y107 PolarHBondContact O-N 2.91Å; Y107-V109 PolarHBondContact O-N 3.02Å | ||
| 108 | F | 51.6 | Low | 57.2 | Low | 198 Ų | 198 | 145.6 Ų | 145.6 | 87% | 0.868 | 75% | 0.749 | S | S | * | * | trans | -56.8 | 110.5 | 174.8 | -129.5 | -95.9 | 0 | 0 | 0 | 108.3 | W106 | W106-F108 PolarHBondContact O-N 2.69Š| ||
| 109 | V | 55.1 | Low | 58 | Low | 112 Ų | 112 | 149.3 Ų | 149.3 | 68% | 0.679 | 75% | 0.747 | S | S | * | * | trans | -120.7 | 113.6 | 158.1 | -173.5 | 0 | 0 | 0 | 0 | 105.4 | Y107 P111 | Y107-V109 PolarHBondContact O-N 3.02Å; V109-P111 WeakPolarHBondContact O-CD 3.14Å; V109-P111 WeakPolarHBondContact O-CG 3.43Å | ||
| 110 | N | 59.1 | Low | 58.8 | Low | 111 Ų | 111 | 150.6 Ų | 150.6 | 59% | 0.594 | 76% | 0.759 | S | S | * | * | trans | -71.2 | 108.8 | 169.6 | -166.3 | -7.6 | 0 | 0 | 0 | 107.5 | A112 | N110-A112 VanDerWaalsContact C-N 3.27Å; N110-A112 PolarHBondContact O-N 3.11Å | ||
| 111 | P | 54.9 | Low | 59.4 | Low | 106 Ų | 106 | 149.1 Ų | 149.1 | 69% | 0.688 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -82.6 | -0.9 | -170.9 | -8.7 | 27.7 | 0 | 0 | 0 | 113.6 | V109 L113 | V109-P111 WeakPolarHBondContact O-CD 3.14Å; V109-P111 WeakPolarHBondContact O-CG 3.43Å; P111-L113 PolarHBondContact O-N 2.89Å |
| 112 | A | 56.2 | Low | 59.5 | Low | 85 Ų | 85 | 147.4 Ų | 147.4 | 70% | 0.702 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -65.8 | -1.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | N110 | N110-A112 VanDerWaalsContact C-N 3.27Å; N110-A112 PolarHBondContact O-N 3.11Å |
| 113 | L | 56.7 | Low | 59.7 | Low | 152 Ų | 152 | 143 Ų | 143 | 80% | 0.796 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -129.9 | 5.3 | -171.6 | -66.1 | 175.8 | 0 | 0 | 0 | 115 | P111 E115 | P111-L113 PolarHBondContact O-N 2.89Å; L113-E115 PolarHBondContact O-N 2.98Å |
| 114 | S | 59.1 | Low | 59.2 | Low | 108 Ų | 108 | 151.5 Ų | 151.5 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | -90.2 | 103 | 177.6 | -160.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 115 | E | 65.8 | Low | 59.6 | Low | 174 Ų | 174 | 154.6 Ų | 154.6 | 81% | 0.813 | 80% | 0.804 | S | S | * | * | trans | -64.8 | 140.4 | 169.1 | -66.8 | -179.1 | 162.6 | 0 | 0 | 110.3 | L113 A117 | L113-E115 PolarHBondContact O-N 2.98Å; E115-A117 PolarHBondContact O-N 3.29Å | ||
| 116 | P | 61.4 | Low | 59.6 | Low | 127 Ų | 127 | 154.1 Ų | 154.1 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -69.9 | 120.7 | 175.9 | 25.9 | -29.6 | 0 | 0 | 0 | 109.9 | E118 | P116-E118 PolarHBondContact O-N 3.29Š| ||
| 117 | A | 67.4 | Low | 60.3 | Low | 73 Ų | 73 | 149.9 Ų | 149.9 | 60% | 0.603 | 81% | 0.805 | S | S | * | * | trans | -73 | 106.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | E115 Y119 | E115-A117 PolarHBondContact O-N 3.29Å; A117-Y119 HydrophobicContact CB-CD2 4.5Å; A117-Y119 HydrophobicContact CB-CE2 3.86Å | ||
| 118 | E | 69.9 | Low | 60.5 | Low | 194 Ų | 194 | 146.5 Ų | 146.5 | 91% | 0.907 | 80% | 0.804 | S | S | * | * | trans | -82.1 | 115 | 172.5 | -169.3 | 168.4 | -164 | 0 | 0 | 108.9 | P116 | P116-E118 PolarHBondContact O-N 3.29Š| ||
| 119 | Y | 66.6 | Low | 61.1 | Low | 210 Ų | 210 | 143.3 Ų | 143.3 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | -98 | 113.1 | 175 | -68.5 | -87.1 | 0 | 0 | 0 | 108.6 | A117 | A117-Y119 HydrophobicContact CB-CD2 4.5Å; A117-Y119 HydrophobicContact CB-CE2 3.86Å | ||
| 120 | D | 71.5 | Confident | 61.5 | Low | 162 Ų | 162 | 145.3 Ų | 145.3 | 87% | 0.866 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 135 | 175 | -147.2 | -2 | 0 | 0 | 0 | 110.2 | ||
| 121 | Q | 67.9 | Low | 61.7 | Low | 184 Ų | 184 | 147.8 Ų | 147.8 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 132.6 | -166.9 | -164.4 | 172.2 | 73 | 0 | 0 | 110.8 | A123 | Q121-A123 PolarHBondContact O-N 3.4Š|
| 122 | V | 58.1 | Low | 62.2 | Low | 137 Ų | 137 | 151 Ų | 151 | 83% | 0.83 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 121.3 | -178.4 | 179.1 | 0 | 0 | 0 | 0 | 110.5 | ||
| 123 | A | 60.3 | Low | 62.7 | Low | 92 Ų | 92 | 156.5 Ų | 156.5 | 76% | 0.76 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 141.2 | 168 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q121 | Q121-A123 PolarHBondContact O-N 3.4Š|
| 124 | M | 47.4 | Very low | 63.2 | Low | 265 Ų | 265 | 156.9 Ų | 156.9 | 100% | 1.305 | 85% | 0.85 | S | S | * | * | trans | -72.5 | 0 | 176.6 | -63 | -163.4 | -63.5 | 0 | 0 | 113 |
Retrieved 124 of 124 residues in 59.3 ms
(Link to these results)