| 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 | 49.1 | Very low | 62.3 | Low | 245 Ų | 245 | 118.1 Ų | 118.1 | 100% | 1.207 | 63% | 0.625 | S | S | * | * | 0 | 36 | 0 | -72.7 | 175.8 | 149.1 | 0 | 0 | 113.3 | |||||
| 2 | M | 51.6 | Low | 63.2 | Low | 175 Ų | 175 | 114.6 Ų | 114.6 | 86% | 0.862 | 61% | 0.612 | S | S | * | * | trans | -115.2 | 34.7 | -173.7 | -64.7 | 177.4 | -178.3 | 0 | 0 | 113.7 | ||||
| 3 | K | 62.8 | Low | 63.7 | Low | 181 Ų | 181 | 110.5 Ų | 110.5 | 79% | 0.787 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -87.6 | -32.3 | -175.7 | -72.6 | 178.9 | 179 | 173.5 | 0 | 114.1 | ||
| 4 | A | 59.3 | Low | 64.1 | Low | 76 Ų | 76 | 109.3 Ų | 109.3 | 63% | 0.628 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -74.7 | -41 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | F6 I7 V8 | A4-F6 VanDerWaalsContact C-N 3.3Å; A4-F6 PolarHBondContact O-N 3.25Å; A4-I7 PolarHBondContact O-N 3.43Å; A4-V8 PolarHBondContact O-N 3.05Å |
| 5 | S | 59.2 | Low | 64.2 | Low | 96 Ų | 96 | 106 Ų | 106 | 67% | 0.671 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.9 | -36.2 | -177.7 | -174.5 | 0 | 0 | 0 | 0 | 112.7 | I7 V8 F9 | S5-I7 PolarHBondContact O-N 3.06Å; S5-V8 PolarHBondContact O-N 3.48Å; S5-F9 PolarHBondContact O-N 3.04Å; S5-F9 VanDerWaalsContact O-N 3.07Å |
| 6 | F | 62.7 | Low | 64.6 | Low | 97 Ų | 97 | 103.6 Ų | 103.6 | 43% | 0.425 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.5 | -38.9 | 178.5 | -177.5 | -105.3 | 0 | 0 | 0 | 113.1 | A4 F9 M10 L116 | A4-F6 VanDerWaalsContact C-N 3.3Å; A4-F6 PolarHBondContact O-N 3.25Å; F6-F9 PolarHBondContact O-N 3.42Å; F6-M10 HydrophobicContact CD1-CG 4.35Å; F6-M10 HydrophobicContact CE1-CE 4.49Å; F6-M10 HydrophobicContact CE1-CG 3.96Å; F6-M10 HydrophobicContact CE2-CE 3.65Å; F6-M10 HydrophobicContact CE2-CG 4.37Å; F6-M10 HydrophobicContact CZ-CE 3.6Å; F6-M10 HydrophobicContact CZ-CG 3.98Å; F6-M10 HydrophobicContact CZ-SD 4.32Å; F6-M10 WeakPolarHBondContact O-CG 3.43Å; F6-M10 PolarHBondContact O-N 3.25Å; F6-L116 HydrophobicContact CD2-CD1 4.38Å; F6-L116 HydrophobicContact CE2-CD1 3.49Å; F6-L116 VanDerWaalsContact CE2-CD1 3.49Å; F6-L116 HydrophobicContact CZ-CD1 4.2Å |
| 7 | I | 69 | Low | 64.5 | Low | 106 Ų | 106 | 100.8 Ų | 100.8 | 54% | 0.544 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.7 | -42.6 | 179.8 | -62.6 | 170.2 | 0 | 0 | 0 | 109.9 | A4 S5 F9 M10 V11 | A4-I7 PolarHBondContact O-N 3.43Å; S5-I7 PolarHBondContact O-N 3.06Å; I7-F9 PolarHBondContact O-N 3.09Å; I7-M10 PolarHBondContact O-N 3.35Å; I7-V11 HydrophobicContact CG2-CG2 4.46Å; I7-V11 WeakPolarHBondContact O-CG2 3.27Å; I7-V11 PolarHBondContact O-N 3.11Å |
| 8 | V | 69.8 | Low | 64.4 | Low | 95 Ų | 95 | 100.3 Ų | 100.3 | 58% | 0.576 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.7 | -44.6 | 176.1 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | A4 S5 M10 V11 T12 | A4-V8 PolarHBondContact O-N 3.05Å; S5-V8 PolarHBondContact O-N 3.48Å; V8-M10 PolarHBondContact O-N 3.27Å; V8-V11 PolarHBondContact O-N 2.96Å; V8-T12 PolarHBondContact O-N 3.44Å; V8-T12 PolarHBondContact O-OG1 3.44Å |
| 9 | F | 65.2 | Low | 64.4 | Low | 85 Ų | 85 | 96.2 Ų | 96.2 | 37% | 0.373 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 176.6 | -176.5 | -100.5 | 0 | 0 | 0 | 112.3 | S5 F6 I7 T12 V13 | S5-F9 PolarHBondContact O-N 3.04Å; S5-F9 VanDerWaalsContact O-N 3.07Å; F6-F9 PolarHBondContact O-N 3.42Å; I7-F9 PolarHBondContact O-N 3.09Å; F9-T12 PolarHBondContact O-N 3.04Å; F9-V13 HydrophobicContact CD1-CG2 4.28Å; F9-V13 HydrophobicContact CE1-CG2 3.86Å; F9-V13 HydrophobicContact CE2-CG2 4.18Å; F9-V13 HydrophobicContact CZ-CG2 3.79Å; F9-V13 VanDerWaalsContact O-CG2 3.31Å; F9-V13 WeakPolarHBondContact O-CG2 3.32Å; F9-V13 PolarHBondContact O-N 3.29Å |
| 10 | M | 61.5 | Low | 64.4 | Low | 53 Ų | 53 | 96.2 Ų | 96.2 | 26% | 0.261 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 176.3 | -75.2 | -71.5 | 141.9 | 0 | 0 | 112.4 | F6 I7 V8 V13 I14 | F6-M10 HydrophobicContact CD1-CG 4.35Å; F6-M10 HydrophobicContact CE1-CE 4.49Å; F6-M10 HydrophobicContact CE1-CG 3.96Å; F6-M10 HydrophobicContact CE2-CE 3.65Å; F6-M10 HydrophobicContact CE2-CG 4.37Å; F6-M10 HydrophobicContact CZ-CE 3.6Å; F6-M10 HydrophobicContact CZ-CG 3.98Å; F6-M10 HydrophobicContact CZ-SD 4.32Å; F6-M10 WeakPolarHBondContact O-CG 3.43Å; F6-M10 PolarHBondContact O-N 3.25Å; I7-M10 PolarHBondContact O-N 3.35Å; V8-M10 PolarHBondContact O-N 3.27Å; M10-V13 PolarHBondContact O-N 3.08Å; M10-I14 WeakPolarHBondContact O-CB 3.31Å; M10-I14 WeakPolarHBondContact O-CD1 3.46Å; M10-I14 WeakPolarHBondContact O-CG1 3.34Å; M10-I14 PolarHBondContact O-N 3.32Å |
| 11 | V | 74.8 | Confident | 64.2 | Low | 90 Ų | 90 | 94 Ų | 94 | 55% | 0.545 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 177.3 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | I7 V8 I14 A15 | I7-V11 HydrophobicContact CG2-CG2 4.46Å; I7-V11 WeakPolarHBondContact O-CG2 3.27Å; I7-V11 PolarHBondContact O-N 3.11Å; V8-V11 PolarHBondContact O-N 2.96Å; V11-I14 PolarHBondContact O-N 3.24Å; V11-A15 VanDerWaalsContact O-CB 3.25Å; V11-A15 WeakPolarHBondContact O-CB 3.13Å; V11-A15 PolarHBondContact O-N 3.49Å |
| 12 | T | 73.5 | Confident | 64.8 | Low | 76 Ų | 76 | 87.9 Ų | 87.9 | 47% | 0.466 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.5 | -41.1 | 178.5 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | V8 F9 A15 S16 | V8-T12 PolarHBondContact O-N 3.44Å; V8-T12 PolarHBondContact O-OG1 3.44Å; F9-T12 PolarHBondContact O-N 3.04Å; T12-A15 PolarHBondContact O-N 3.32Å; T12-S16 VanDerWaalsContact O-CB 3.23Å; T12-S16 WeakPolarHBondContact O-CB 3.31Å; T12-S16 PolarHBondContact O-N 3.19Å; T12-S16 PolarHBondContact O-OG 3.03Å |
| 13 | V | 70.4 | Confident | 65.2 | Low | 61 Ų | 61 | 88.5 Ų | 88.5 | 37% | 0.37 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.6 | -43.2 | 177.7 | 172.1 | 0 | 0 | 0 | 0 | 111 | F9 M10 S16 S17 | F9-V13 HydrophobicContact CD1-CG2 4.28Å; F9-V13 HydrophobicContact CE1-CG2 3.86Å; F9-V13 HydrophobicContact CE2-CG2 4.18Å; F9-V13 HydrophobicContact CZ-CG2 3.79Å; F9-V13 VanDerWaalsContact O-CG2 3.31Å; F9-V13 WeakPolarHBondContact O-CG2 3.32Å; F9-V13 PolarHBondContact O-N 3.29Å; M10-V13 PolarHBondContact O-N 3.08Å; V13-S16 PolarHBondContact O-N 3.27Å; V13-S17 WeakPolarHBondContact O-CB 3.44Å; V13-S17 PolarHBondContact O-N 3.5Å; V13-S17 PolarHBondContact O-OG 3.11Å |
| 14 | I | 68.7 | Low | 65.3 | Low | 94 Ų | 94 | 87.1 Ų | 87.1 | 48% | 0.482 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.8 | -41.5 | 177.9 | -66.3 | 165 | 0 | 0 | 0 | 111 | M10 V11 S17 N18 | M10-I14 WeakPolarHBondContact O-CB 3.31Å; M10-I14 WeakPolarHBondContact O-CD1 3.46Å; M10-I14 WeakPolarHBondContact O-CG1 3.34Å; M10-I14 PolarHBondContact O-N 3.32Å; V11-I14 PolarHBondContact O-N 3.24Å; I14-S17 PolarHBondContact O-OG 3.17Å; I14-S17 VanDerWaalsContact O-OG 3.08Å; I14-N18 WeakPolarHBondContact O-CB 3.08Å; I14-N18 PolarHBondContact O-N 3.45Å |
| 15 | A | 66.2 | Low | 65.7 | Low | 60 Ų | 60 | 87.2 Ų | 87.2 | 50% | 0.496 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | V11 T12 G19 | V11-A15 VanDerWaalsContact O-CB 3.25Å; V11-A15 WeakPolarHBondContact O-CB 3.13Å; V11-A15 PolarHBondContact O-N 3.49Å; T12-A15 PolarHBondContact O-N 3.32Å; A15-G19 WeakPolarHBondContact O-CA 3.13Å; A15-G19 PolarHBondContact O-N 2.8Å |
| 16 | S | 69.6 | Low | 66.1 | Low | 68 Ų | 68 | 86.7 Ų | 86.7 | 48% | 0.476 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.5 | -40.4 | 177.8 | -59.1 | 0 | 0 | 0 | 0 | 111.9 | T12 V13 T20 | T12-S16 VanDerWaalsContact O-CB 3.23Å; T12-S16 WeakPolarHBondContact O-CB 3.31Å; T12-S16 PolarHBondContact O-N 3.19Å; T12-S16 PolarHBondContact O-OG 3.03Å; V13-S16 PolarHBondContact O-N 3.27Å; S16-T20 WeakPolarHBondContact O-CB 3.2Å; S16-T20 VanDerWaalsContact O-CG2 3.28Å; S16-T20 WeakPolarHBondContact O-CG2 3.18Å; S16-T20 PolarHBondContact O-N 3.41Å; S16-T20 PolarHBondContact O-OG1 3.02Å |
| 17 | S | 64.1 | Low | 66.2 | Low | 56 Ų | 56 | 88.9 Ų | 88.9 | 39% | 0.392 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -71 | -41.6 | 179.4 | 66.4 | 0 | 0 | 0 | 0 | 112.2 | V13 I14 T20 A21 | V13-S17 WeakPolarHBondContact O-CB 3.44Å; V13-S17 PolarHBondContact O-N 3.5Å; V13-S17 PolarHBondContact O-OG 3.11Å; I14-S17 PolarHBondContact O-OG 3.17Å; I14-S17 VanDerWaalsContact O-OG 3.08Å; S17-T20 PolarHBondContact O-OG1 3.22Å; S17-T20 VanDerWaalsContact O-OG1 3.11Å; S17-A21 WeakPolarHBondContact O-CB 3.31Å; S17-A21 PolarHBondContact O-N 3.43Å; S17-A21 VanDerWaalsContact O-N 3.16Å |
| 18 | N | 61.4 | Low | 66 | Low | 91 Ų | 91 | 89.2 Ų | 89.2 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -76.8 | -36.2 | 179.3 | -69.9 | -10.6 | 0 | 0 | 0 | 111.5 | I14 A21 L22 | I14-N18 WeakPolarHBondContact O-CB 3.08Å; I14-N18 PolarHBondContact O-N 3.45Å; N18-A21 PolarHBondContact O-N 3.48Å; N18-L22 WeakPolarHBondContact O-CB 3.21Å; N18-L22 WeakPolarHBondContact O-CG 3.33Å; N18-L22 PolarHBondContact O-N 3.3Å |
| 19 | G | 64.5 | Low | 65.8 | Low | 23 Ų | 23 | 89.1 Ų | 89.1 | 24% | 0.237 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -59.2 | -54 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | A15 A21 L22 Y23 | A15-G19 WeakPolarHBondContact O-CA 3.13Å; A15-G19 PolarHBondContact O-N 2.8Å; G19-A21 VanDerWaalsContact C-N 3.31Å; G19-A21 PolarHBondContact O-N 3.07Å; G19-L22 PolarHBondContact O-N 3.49Å; G19-Y23 WeakPolarHBondContact O-CB 3.36Å; G19-Y23 WeakPolarHBondContact O-CD2 3.14Å; G19-Y23 PolarHBondContact O-N 3.41Å |
| 20 | T | 64.2 | Low | 65.9 | Low | 95 Ų | 95 | 88.6 Ų | 88.6 | 58% | 0.583 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.3 | -36.5 | 179.5 | 49.2 | 0 | 0 | 0 | 0 | 113.2 | S16 S17 K24 | S16-T20 WeakPolarHBondContact O-CB 3.2Å; S16-T20 VanDerWaalsContact O-CG2 3.28Å; S16-T20 WeakPolarHBondContact O-CG2 3.18Å; S16-T20 PolarHBondContact O-N 3.41Å; S16-T20 PolarHBondContact O-OG1 3.02Å; S17-T20 PolarHBondContact O-OG1 3.22Å; S17-T20 VanDerWaalsContact O-OG1 3.11Å; T20-K24 VanDerWaalsContact O-CB 3.27Å; T20-K24 WeakPolarHBondContact O-CB 3.49Å; T20-K24 PolarHBondContact O-N 3.37Å |
| 21 | A | 61.1 | Low | 65.8 | Low | 52 Ų | 52 | 87.6 Ų | 87.6 | 43% | 0.43 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.6 | -46.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S17 N18 G19 K24 T25 | S17-A21 WeakPolarHBondContact O-CB 3.31Å; S17-A21 PolarHBondContact O-N 3.43Å; S17-A21 VanDerWaalsContact O-N 3.16Å; N18-A21 PolarHBondContact O-N 3.48Å; G19-A21 VanDerWaalsContact C-N 3.31Å; G19-A21 PolarHBondContact O-N 3.07Å; A21-K24 PolarHBondContact O-N 2.82Å; A21-T25 PolarHBondContact O-N 2.8Å; A21-T25 PolarHBondContact O-OG1 3.28Å; A21-T25 VanDerWaalsContact O-OG1 3.1Å |
| 22 | L | 61.7 | Low | 65.4 | Low | 116 Ų | 116 | 88.5 Ų | 88.5 | 61% | 0.607 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.4 | -41.8 | 176.5 | -74.7 | 166 | 0 | 0 | 0 | 111.9 | N18 G19 K24 T25 V26 | N18-L22 WeakPolarHBondContact O-CB 3.21Å; N18-L22 WeakPolarHBondContact O-CG 3.33Å; N18-L22 PolarHBondContact O-N 3.3Å; G19-L22 PolarHBondContact O-N 3.49Å; L22-K24 VanDerWaalsContact C-N 3.33Å; L22-K24 PolarHBondContact O-N 3.44Å; L22-T25 PolarHBondContact O-N 3.42Å; L22-V26 VanDerWaalsContact O-CB 3.31Å; L22-V26 WeakPolarHBondContact O-CB 3.35Å; L22-V26 WeakPolarHBondContact O-CG2 3.1Å; L22-V26 PolarHBondContact O-N 3.31Å |
| 23 | Y | 59.6 | Low | 64.8 | Low | 188 Ų | 188 | 88 Ų | 88 | 74% | 0.737 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.4 | -40.5 | 174.6 | -87.3 | -75.7 | 0 | 0 | 0 | 111.5 | G19 H27 | G19-Y23 WeakPolarHBondContact O-CB 3.36Å; G19-Y23 WeakPolarHBondContact O-CD2 3.14Å; G19-Y23 PolarHBondContact O-N 3.41Å; Y23-H27 WeakPolarHBondContact O-CB 3.32Å; Y23-H27 PolarHBondContact O-N 3.48Å |
| 24 | K | 65.2 | Low | 64.1 | Low | 151 Ų | 151 | 91 Ų | 91 | 66% | 0.657 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.4 | -45.3 | 177.2 | -170.3 | 179.4 | 179.6 | -173.2 | 0 | 111.5 | T20 A21 L22 H27 E28 | T20-K24 VanDerWaalsContact O-CB 3.27Å; T20-K24 WeakPolarHBondContact O-CB 3.49Å; T20-K24 PolarHBondContact O-N 3.37Å; A21-K24 PolarHBondContact O-N 2.82Å; L22-K24 VanDerWaalsContact C-N 3.33Å; L22-K24 PolarHBondContact O-N 3.44Å; K24-H27 PolarHBondContact O-N 2.88Å; K24-E28 WeakPolarHBondContact O-CB 3.34Å; K24-E28 PolarHBondContact O-N 3.12Å |
| 25 | T | 68.2 | Low | 63.1 | Low | 78 Ų | 78 | 89.6 Ų | 89.6 | 48% | 0.479 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69 | -40.8 | 178.6 | -57.1 | 0 | 0 | 0 | 0 | 112.1 | A21 L22 E28 V29 | A21-T25 PolarHBondContact O-N 2.8Å; A21-T25 PolarHBondContact O-OG1 3.28Å; A21-T25 VanDerWaalsContact O-OG1 3.1Å; L22-T25 PolarHBondContact O-N 3.42Å; T25-E28 PolarHBondContact O-N 2.92Å; T25-V29 HydrophobicContact CG2-CG2 4.22Å; T25-V29 WeakPolarHBondContact O-CB 3.05Å; T25-V29 WeakPolarHBondContact O-CG2 3.46Å; T25-V29 PolarHBondContact O-N 2.85Å |
| 26 | V | 67.6 | Low | 62.6 | Low | 86 Ų | 86 | 91 Ų | 91 | 52% | 0.521 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.7 | -44.2 | 175.3 | 172.6 | 0 | 0 | 0 | 0 | 110.1 | L22 E28 V29 V30 | L22-V26 VanDerWaalsContact O-CB 3.31Å; L22-V26 WeakPolarHBondContact O-CB 3.35Å; L22-V26 WeakPolarHBondContact O-CG2 3.1Å; L22-V26 PolarHBondContact O-N 3.31Å; V26-E28 VanDerWaalsContact C-N 3.31Å; V26-E28 PolarHBondContact O-N 3.42Å; V26-V29 PolarHBondContact O-N 3.22Å; V26-V30 HydrophobicContact CG1-CG2 4.05Å; V26-V30 WeakPolarHBondContact O-CB 3.12Å; V26-V30 WeakPolarHBondContact O-CG2 3.39Å; V26-V30 PolarHBondContact O-N 2.9Å |
| 27 | H | 64 | Low | 61.9 | Low | 142 Ų | 142 | 98.4 Ų | 98.4 | 66% | 0.657 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.1 | -34.9 | 176.8 | -168.8 | -79.7 | 0 | 0 | 0 | 112.3 | Y23 K24 A31 | Y23-H27 WeakPolarHBondContact O-CB 3.32Å; Y23-H27 PolarHBondContact O-N 3.48Å; K24-H27 PolarHBondContact O-N 2.88Å; H27-A31 WeakPolarHBondContact O-CB 3.32Å; H27-A31 PolarHBondContact O-N 3.48Å |
| 28 | E | 65 | Low | 61.6 | Low | 113 Ų | 113 | 100.6 Ų | 100.6 | 53% | 0.528 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -69.4 | -47.6 | 175.1 | -174.1 | 170.4 | -173.9 | 0 | 0 | 111.4 | K24 T25 V26 V30 A31 T32 | K24-E28 WeakPolarHBondContact O-CB 3.34Å; K24-E28 PolarHBondContact O-N 3.12Å; T25-E28 PolarHBondContact O-N 2.92Å; V26-E28 VanDerWaalsContact C-N 3.31Å; V26-E28 PolarHBondContact O-N 3.42Å; E28-V30 VanDerWaalsContact C-N 3.33Å; E28-V30 PolarHBondContact O-N 2.81Å; E28-A31 PolarHBondContact O-N 3.37Å; E28-T32 WeakPolarHBondContact O-CB 3.16Å; E28-T32 PolarHBondContact O-N 3.19Å; E28-T32 PolarHBondContact O-OG1 3.26Å |
| 29 | V | 66.5 | Low | 61.5 | Low | 94 Ų | 94 | 103.3 Ų | 103.3 | 57% | 0.57 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.7 | -35.6 | 176.5 | 173.8 | 0 | 0 | 0 | 0 | 111.6 | T25 V26 G33 | T25-V29 HydrophobicContact CG2-CG2 4.22Å; T25-V29 WeakPolarHBondContact O-CB 3.05Å; T25-V29 WeakPolarHBondContact O-CG2 3.46Å; T25-V29 PolarHBondContact O-N 2.85Å; V26-V29 PolarHBondContact O-N 3.22Å; V29-G33 WeakPolarHBondContact O-CA 3.4Å; V29-G33 PolarHBondContact O-N 3.29Å |
| 30 | V | 65.8 | Low | 61.6 | Low | 74 Ų | 74 | 107.6 Ų | 107.6 | 45% | 0.448 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -71 | -42.7 | 174.9 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | V26 E28 T32 G33 I34 | V26-V30 HydrophobicContact CG1-CG2 4.05Å; V26-V30 WeakPolarHBondContact O-CB 3.12Å; V26-V30 WeakPolarHBondContact O-CG2 3.39Å; V26-V30 PolarHBondContact O-N 2.9Å; E28-V30 VanDerWaalsContact C-N 3.33Å; E28-V30 PolarHBondContact O-N 2.81Å; V30-T32 PolarHBondContact O-N 3.4Å; V30-G33 PolarHBondContact O-N 2.92Å; V30-I34 HydrophobicContact CG1-CD1 3.65Å; V30-I34 HydrophobicContact CG1-CG1 4.48Å; V30-I34 VanDerWaalsContact O-CG1 3.31Å; V30-I34 WeakPolarHBondContact O-CG1 3.41Å; V30-I34 PolarHBondContact O-N 2.94Å; V30-I34 VanDerWaalsContact O-N 3.11Å |
| 31 | A | 59 | Low | 61.8 | Low | 32 Ų | 32 | 108.4 Ų | 108.4 | 26% | 0.264 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.4 | -39.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | H27 E28 V36 | H27-A31 WeakPolarHBondContact O-CB 3.32Å; H27-A31 PolarHBondContact O-N 3.48Å; E28-A31 PolarHBondContact O-N 3.37Å; A31-V36 PolarHBondContact O-N 2.85Å |
| 32 | T | 66.7 | Low | 62 | Low | 108 Ų | 108 | 111.4 Ų | 111.4 | 66% | 0.663 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -72.7 | -39.1 | 175.7 | -54.7 | 0 | 0 | 0 | 0 | 112.2 | E28 V30 G35 | E28-T32 WeakPolarHBondContact O-CB 3.16Å; E28-T32 PolarHBondContact O-N 3.19Å; E28-T32 PolarHBondContact O-OG1 3.26Å; V30-T32 PolarHBondContact O-N 3.4Å; T32-G35 PolarHBondContact O-N 2.78Å |
| 33 | G | 60.7 | Low | 62 | Low | 67 Ų | 67 | 114.8 Ų | 114.8 | 69% | 0.691 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -72.5 | -25.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115 | V29 V30 | V29-G33 WeakPolarHBondContact O-CA 3.4Å; V29-G33 PolarHBondContact O-N 3.29Å; V30-G33 PolarHBondContact O-N 2.92Å |
| 34 | I | 56.2 | Low | 61.6 | Low | 122 Ų | 122 | 111.5 Ų | 111.5 | 63% | 0.626 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.8 | 0.3 | 176.9 | -55.2 | 171.9 | 0 | 0 | 0 | 111.1 | V30 V36 | V30-I34 HydrophobicContact CG1-CD1 3.65Å; V30-I34 HydrophobicContact CG1-CG1 4.48Å; V30-I34 VanDerWaalsContact O-CG1 3.31Å; V30-I34 WeakPolarHBondContact O-CG1 3.41Å; V30-I34 PolarHBondContact O-N 2.94Å; V30-I34 VanDerWaalsContact O-N 3.11Å; I34-V36 HydrophobicContact CB-CG2 4.26Å; I34-V36 HydrophobicContact CG2-CG2 3.83Å; I34-V36 PolarHBondContact O-N 2.88Å; I34-V36 VanDerWaalsContact O-N 3.17Å |
| 35 | G | 48.8 | Very low | 61.3 | Low | 65 Ų | 65 | 109.6 Ų | 109.6 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.5 | 14 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | T32 R37 | T32-G35 PolarHBondContact O-N 2.78Å; G35-R37 PolarHBondContact O-N 3.1Å |
| 36 | V | 55.4 | Low | 60.8 | Low | 89 Ų | 89 | 117.8 Ų | 117.8 | 54% | 0.539 | 65% | 0.654 | S | S | . | * | trans | -84.9 | 96.3 | 178.2 | -175.1 | 0 | 0 | 0 | 0 | 107.5 | A31 I34 P38 | A31-V36 PolarHBondContact O-N 2.85Å; I34-V36 HydrophobicContact CB-CG2 4.26Å; I34-V36 HydrophobicContact CG2-CG2 3.83Å; I34-V36 PolarHBondContact O-N 2.88Å; I34-V36 VanDerWaalsContact O-N 3.17Å; V36-P38 WeakPolarHBondContact O-CD 3.27Å; V36-P38 VanDerWaalsContact O-N 3.15Å | ||
| 37 | R | 53.8 | Low | 60.5 | Low | 224 Ų | 224 | 124.2 Ų | 124.2 | 85% | 0.845 | 67% | 0.669 | S | S | * | * | trans | -49.1 | 123.8 | 164.6 | -87.2 | -175.9 | 172.5 | -169.4 | -1.2 | 107.5 | G35 I39 | G35-R37 PolarHBondContact O-N 3.1Å; R37-I39 PolarHBondContact O-N 3Å | ||
| 38 | P | 57.8 | Low | 60.1 | Low | 103 Ų | 103 | 123.3 Ų | 123.3 | 67% | 0.669 | 67% | 0.674 | S | S | * | * | trans | -57.2 | 119.1 | 169.9 | 23.3 | -30.6 | 0 | 0 | 0 | 106.8 | V36 T40 | V36-P38 WeakPolarHBondContact O-CD 3.27Å; V36-P38 VanDerWaalsContact O-N 3.15Å; P38-T40 PolarHBondContact O-N 3.48Å | ||
| 39 | I | 60.8 | Low | 59.6 | Low | 147 Ų | 147 | 124.8 Ų | 124.8 | 75% | 0.754 | 69% | 0.69 | S | S | * | * | trans | -67.9 | 90.9 | 177 | -57.2 | 173.4 | 0 | 0 | 0 | 105.8 | R37 T41 | R37-I39 PolarHBondContact O-N 3Å; I39-T41 HydrophobicContact CG2-CG2 3.71Å; I39-T41 PolarHBondContact O-N 2.78Å | ||
| 40 | T | 66.1 | Low | 59.2 | Low | 114 Ų | 114 | 129.4 Ų | 129.4 | 70% | 0.699 | 71% | 0.706 | S | S | * | * | trans | -66.6 | 90.7 | 162.9 | 48.7 | 0 | 0 | 0 | 0 | 106 | P38 T42 | P38-T40 PolarHBondContact O-N 3.48Å; T40-T42 PolarHBondContact O-N 2.96Å | ||
| 41 | T | 68.5 | Low | 58.8 | Low | 112 Ų | 112 | 130.6 Ų | 130.6 | 69% | 0.687 | 72% | 0.717 | S | S | * | * | trans | -68.8 | 78.5 | 167 | 52.9 | 0 | 0 | 0 | 0 | 107.5 | I39 F43 | I39-T41 HydrophobicContact CG2-CG2 3.71Å; I39-T41 PolarHBondContact O-N 2.78Å; T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.39Å | ||
| 42 | T | 65.7 | Low | 58.5 | Low | 115 Ų | 115 | 138 Ų | 138 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | trans | -69 | 97.6 | 164.6 | -43.2 | 0 | 0 | 0 | 0 | 105.5 | T40 V44 | T40-T42 PolarHBondContact O-N 2.96Å; T42-V44 VanDerWaalsContact C-N 3.3Å; T42-V44 PolarHBondContact O-N 3Å | ||
| 43 | F | 60.1 | Low | 57.8 | Low | 187 Ų | 187 | 144.4 Ų | 144.4 | 82% | 0.82 | 76% | 0.758 | S | S | * | * | trans | -63.9 | 94.1 | 175.7 | -132.1 | -91.8 | 0 | 0 | 0 | 107.2 | T41 P45 | T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.39Å; F43-P45 WeakPolarHBondContact O-CD 3.38Å | ||
| 44 | V | 52.1 | Low | 57.7 | Low | 119 Ų | 119 | 147 Ų | 147 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | trans | -69 | 115.3 | 168.6 | 180 | 0 | 0 | 0 | 0 | 106 | T42 R46 | T42-V44 VanDerWaalsContact C-N 3.3Å; T42-V44 PolarHBondContact O-N 3Å; V44-R46 PolarHBondContact O-N 2.98Å | ||
| 45 | P | 58.7 | Low | 57.7 | Low | 111 Ų | 111 | 148.1 Ų | 148.1 | 72% | 0.721 | 77% | 0.768 | S | S | * | * | trans | -60.5 | 114.3 | 179.2 | 21.5 | -29.7 | 0 | 0 | 0 | 109.6 | F43 R47 | F43-P45 WeakPolarHBondContact O-CD 3.38Å; P45-R47 VanDerWaalsContact C-N 3.33Å; P45-R47 PolarHBondContact O-N 2.98Å | ||
| 46 | R | 56.7 | Low | 58 | Low | 250 Ų | 250 | 154.5 Ų | 154.5 | 94% | 0.943 | 78% | 0.777 | S | S | * | * | trans | -67.5 | 85.6 | 176.6 | -170.7 | 177.5 | -171.2 | 169.4 | 2.1 | 109.3 | V44 | V44-R46 PolarHBondContact O-N 2.98Š| ||
| 47 | R | 61.7 | Low | 57.7 | Low | 221 Ų | 221 | 155.8 Ų | 155.8 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -128.9 | 117.8 | 163.8 | -74.7 | -161.5 | 179.8 | -174.8 | 1.8 | 110.5 | P45 | P45-R47 VanDerWaalsContact C-N 3.33Å; P45-R47 PolarHBondContact O-N 2.98Å | ||
| 48 | T | 56 | Low | 57.5 | Low | 122 Ų | 122 | 153.9 Ų | 153.9 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | 60.3 | 87.8 | 140.6 | 56 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 49 | V | 54.3 | Low | 57.4 | Low | 144 Ų | 144 | 156.2 Ų | 156.2 | 87% | 0.873 | 80% | 0.795 | S | S | * | * | trans | -135.3 | 77.3 | 141.1 | -169.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 50 | E | 57.6 | Low | 56.9 | Low | 192 Ų | 192 | 156.8 Ų | 156.8 | 90% | 0.897 | 79% | 0.794 | S | S | * | * | trans | -92.9 | 93.7 | 165.2 | -172.8 | 171.1 | -153 | 0 | 0 | 105.6 | ||||
| 51 | S | 57.5 | Low | 56.1 | Low | 98 Ų | 98 | 161 Ų | 161 | 69% | 0.685 | 81% | 0.805 | S | S | * | * | trans | 165.2 | 96.1 | 164.8 | 172.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 52 | Q | 52.7 | Low | 55 | Low | 188 Ų | 188 | 162.1 Ų | 162.1 | 88% | 0.879 | 80% | 0.803 | S | S | * | * | trans | -179.4 | 93.4 | 132.7 | -101.5 | 179.8 | 16.8 | 0 | 0 | 108.6 | T54 | Q52-T54 PolarHBondContact O-N 2.83Š| ||
| 53 | R | 52.6 | Low | 54.2 | Low | 243 Ų | 243 | 165.5 Ų | 165.5 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | trans | -58.4 | 124.2 | 151 | -78.5 | 173.9 | 167.9 | 146.8 | -3.3 | 107.1 | ||||
| 54 | T | 58.4 | Low | 53.9 | Low | 122 Ų | 122 | 164.4 Ų | 164.4 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | trans | -169.4 | 104.7 | 136.1 | -51.3 | 0 | 0 | 0 | 0 | 109.2 | Q52 | Q52-T54 PolarHBondContact O-N 2.83Š| ||
| 55 | D | 55.4 | Low | 54.1 | Low | 145 Ų | 145 | 164 Ų | 164 | 78% | 0.775 | 81% | 0.81 | S | S | * | * | trans | 33.6 | 104.9 | 139.6 | -48.6 | -36.7 | 0 | 0 | 0 | 120.6 | ||||
| 56 | K | 56.4 | Low | 54.1 | Low | 198 Ų | 198 | 164.5 Ų | 164.5 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | 175.2 | 140.5 | 120.7 | -97.9 | 168.8 | -178.6 | -179.4 | 0 | 112.6 | |||||
| 57 | P | 49.5 | Very low | 54.3 | Low | 117 Ų | 117 | 158.4 Ų | 158.4 | 76% | 0.76 | 81% | 0.813 | S | S | * | * | trans | -92.6 | 132.6 | 171.2 | 34.9 | -27.3 | 0 | 0 | 0 | 111 | ||||
| 58 | Q | 49.7 | Very low | 53.8 | Low | 184 Ų | 184 | 156.6 Ų | 156.6 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | -148.4 | 99.6 | 168.4 | -109.9 | 175.4 | -24.3 | 0 | 0 | 106.4 | ||||
| 59 | L | 54.7 | Low | 53.7 | Low | 152 Ų | 152 | 158.7 Ų | 158.7 | 80% | 0.796 | 82% | 0.82 | S | S | * | * | 53.9 | 120.7 | 78.6 | -78.9 | 161.3 | 0 | 0 | 0 | 113.5 | |||||
| 60 | E | 49.6 | Very low | 53.6 | Low | 159 Ų | 159 | 156.6 Ų | 156.6 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | trans | 83.9 | 102.7 | 156.4 | -61.1 | 172.4 | 141.7 | 0 | 0 | 119.3 | ||||
| 61 | Q | 49.6 | Very low | 53.3 | Low | 201 Ų | 201 | 153 Ų | 153 | 94% | 0.939 | 81% | 0.808 | S | S | * | * | trans | -150.3 | 86 | 132.1 | -107 | 174.9 | 8 | 0 | 0 | 109.1 | ||||
| 62 | Q | 46.1 | Very low | 53.1 | Low | 137 Ų | 137 | 153 Ų | 153 | 64% | 0.64 | 81% | 0.808 | S | S | * | * | trans | -41.8 | 132.4 | 154.2 | -74.2 | 158.6 | -83.5 | 0 | 0 | 109.1 | ||||
| 63 | Q | 48.5 | Very low | 53.4 | Low | 186 Ų | 186 | 149.7 Ų | 149.7 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | 49.2 | 75.8 | 53.4 | -149.6 | 176.5 | 10.9 | 0 | 0 | 114 | |||||
| 64 | E | 54.4 | Low | 53.7 | Low | 163 Ų | 163 | 146 Ų | 146 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -168.7 | 100.8 | 155.8 | -103.2 | 162.2 | -162.6 | 0 | 0 | 106.7 | ||||
| 65 | S | 56.4 | Low | 53.7 | Low | 110 Ų | 110 | 148.5 Ų | 148.5 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | 62.7 | 120.8 | 84 | -60.3 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 66 | S | 58 | Low | 53.8 | Low | 122 Ų | 122 | 148.9 Ų | 148.9 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | 95.4 | 102.7 | 158.8 | -50.4 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 67 | S | 60.4 | Low | 53.8 | Low | 123 Ų | 123 | 143.9 Ų | 143.9 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | -170.2 | 139.7 | 117.3 | -134.2 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 68 | E | 53 | Low | 54.2 | Low | 182 Ų | 182 | 146.5 Ų | 146.5 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | -57.4 | 140.2 | 177.4 | -64.7 | 155.5 | 117.8 | 0 | 0 | 113.5 | ||||
| 69 | L | 52.9 | Low | 54.8 | Low | 167 Ų | 167 | 143.4 Ų | 143.4 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -159.8 | 90.3 | 136 | -151.2 | 70.3 | 0 | 0 | 0 | 111.4 | ||||
| 70 | A | 51.6 | Low | 55.1 | Low | 99 Ų | 99 | 139.8 Ų | 139.8 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | trans | -114.5 | 82.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 71 | V | 52.7 | Low | 55.8 | Low | 116 Ų | 116 | 136.1 Ų | 136.1 | 70% | 0.703 | 76% | 0.757 | S | S | * | * | trans | -146.3 | 104.3 | 174.2 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 72 | S | 51.8 | Low | 56.8 | Low | 99 Ų | 99 | 131.2 Ų | 131.2 | 69% | 0.692 | 74% | 0.741 | S | S | * | * | trans | 55.6 | 115.1 | 147.6 | 62.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 73 | T | 59.3 | Low | 58.1 | Low | 119 Ų | 119 | 128.9 Ų | 128.9 | 73% | 0.73 | 74% | 0.736 | S | S | * | * | trans | -148.8 | 68.6 | 150.9 | 14.3 | 0 | 0 | 0 | 0 | 112.3 | H75 | T73-H75 PolarHBondContact O-N 3.08Š| ||
| 74 | D | 59.8 | Low | 58.9 | Low | 165 Ų | 165 | 126.4 Ų | 126.4 | 88% | 0.882 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | 27.2 | 168.2 | -77.1 | -38.7 | 0 | 0 | 0 | 113.5 | ||
| 75 | H | 57.5 | Low | 59.9 | Low | 175 Ų | 175 | 125.6 Ų | 125.6 | 81% | 0.81 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121 | 0.5 | -171.3 | -97.4 | -79.2 | 0 | 0 | 0 | 116.4 | T73 | T73-H75 PolarHBondContact O-N 3.08Š|
| 76 | E | 57 | Low | 60.9 | Low | 152 Ų | 152 | 125.5 Ų | 125.5 | 71% | 0.71 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -93.6 | -14.3 | -169.6 | -144.1 | 178.4 | 147.4 | 0 | 0 | 115.2 | K78 | E76-K78 PolarHBondContact O-N 3.33Š|
| 77 | S | 56.9 | Low | 61.6 | Low | 94 Ų | 94 | 122.9 Ų | 122.9 | 66% | 0.657 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -78.3 | -19.3 | -170.3 | 70.2 | 0 | 0 | 0 | 0 | 115.4 | S80 | S77-S80 PolarHBondContact O-OG 3.16Å |
| 78 | K | 59.2 | Low | 62.2 | Low | 171 Ų | 171 | 122.1 Ų | 122.1 | 74% | 0.743 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -82.1 | -29.8 | 179.4 | -73.5 | -175.8 | 178.9 | 176.8 | 0 | 113.2 | E76 | E76-K78 PolarHBondContact O-N 3.33Å |
| 79 | N | 61.3 | Low | 63.1 | Low | 120 Ų | 120 | 118.5 Ų | 118.5 | 64% | 0.642 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -78.5 | -32.7 | -178.4 | -74.3 | 12.1 | 0 | 0 | 0 | 112.2 | S81 V82 V83 | N79-S81 VanDerWaalsContact C-N 3.34Å; N79-S81 PolarHBondContact O-N 3.02Å; N79-V82 PolarHBondContact O-N 2.83Å; N79-V83 WeakPolarHBondContact O-CG2 3.23Å; N79-V83 PolarHBondContact O-N 3.48Å; N79-V83 VanDerWaalsContact O-N 3.09Å |
| 80 | S | 60.5 | Low | 63.9 | Low | 76 Ų | 76 | 116 Ų | 116 | 53% | 0.531 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -63.8 | -38 | 179.3 | 65.7 | 0 | 0 | 0 | 0 | 112.5 | S77 V82 M84 | S77-S80 PolarHBondContact O-OG 3.16Å; S80-V82 PolarHBondContact O-N 2.89Å; S80-M84 WeakPolarHBondContact O-CB 3.42Å; S80-M84 PolarHBondContact O-N 3.45Å |
| 81 | S | 65.8 | Low | 64.5 | Low | 81 Ų | 81 | 118 Ų | 118 | 57% | 0.566 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67.2 | -34.9 | 177.1 | -177.9 | 0 | 0 | 0 | 0 | 113 | N79 K85 | N79-S81 VanDerWaalsContact C-N 3.34Å; N79-S81 PolarHBondContact O-N 3.02Å; S81-K85 WeakPolarHBondContact O-CB 3.46Å; S81-K85 PolarHBondContact O-N 3.11Å |
| 82 | V | 70.3 | Confident | 65 | Low | 99 Ų | 99 | 117.6 Ų | 117.6 | 60% | 0.6 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -73.4 | -42.1 | 179.5 | 177.6 | 0 | 0 | 0 | 0 | 110.4 | N79 S80 M84 K85 N86 | N79-V82 PolarHBondContact O-N 2.83Å; S80-V82 PolarHBondContact O-N 2.89Å; V82-M84 VanDerWaalsContact C-N 3.34Å; V82-K85 PolarHBondContact O-N 3.49Å; V82-N86 PolarHBondContact O-N 3.45Å |
| 83 | V | 72.5 | Confident | 65.5 | Low | 87 Ų | 87 | 119.6 Ų | 119.6 | 53% | 0.527 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -61.9 | -44.2 | 174.6 | 175.1 | 0 | 0 | 0 | 0 | 110.5 | N79 K85 N86 I87 | N79-V83 WeakPolarHBondContact O-CG2 3.23Å; N79-V83 PolarHBondContact O-N 3.48Å; N79-V83 VanDerWaalsContact O-N 3.09Å; V83-K85 PolarHBondContact O-N 3.36Å; V83-N86 PolarHBondContact O-N 3.02Å; V83-I87 HydrophobicContact CG1-CD1 3.85Å; V83-I87 VanDerWaalsContact O-CG1 3.27Å; V83-I87 WeakPolarHBondContact O-CG1 3.45Å; V83-I87 PolarHBondContact O-N 2.92Å; V83-I87 VanDerWaalsContact O-N 3.08Å |
| 84 | M | 65.6 | Low | 65.5 | Low | 134 Ų | 134 | 119.4 Ų | 119.4 | 66% | 0.66 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64.6 | -38.1 | 179 | -161.4 | 68.3 | 156.2 | 0 | 0 | 112.6 | S80 V82 L88 | S80-M84 WeakPolarHBondContact O-CB 3.42Å; S80-M84 PolarHBondContact O-N 3.45Å; V82-M84 VanDerWaalsContact C-N 3.34Å; M84-L88 WeakPolarHBondContact O-CB 3.48Å; M84-L88 PolarHBondContact O-N 3.29Å |
| 85 | K | 76 | Confident | 65.5 | Low | 146 Ų | 146 | 118.7 Ų | 118.7 | 64% | 0.635 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.4 | -42 | 176.5 | -170.7 | -177.7 | 176.4 | -166.4 | 0 | 111.9 | S81 V82 V83 I87 L88 D89 | S81-K85 WeakPolarHBondContact O-CB 3.46Å; S81-K85 PolarHBondContact O-N 3.11Å; V82-K85 PolarHBondContact O-N 3.49Å; V83-K85 PolarHBondContact O-N 3.36Å; K85-I87 VanDerWaalsContact C-N 3.35Å; K85-I87 PolarHBondContact O-N 3.06Å; K85-L88 PolarHBondContact O-N 3.35Å; K85-D89 PolarHBondContact O-N 2.96Å |
| 86 | N | 76.8 | Confident | 65.6 | Low | 108 Ų | 108 | 117.7 Ų | 117.7 | 58% | 0.578 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -64.2 | -40.9 | 178.7 | -167.8 | 59.3 | 0 | 0 | 0 | 112 | V82 V83 D89 E90 | V82-N86 PolarHBondContact O-N 3.45Å; V83-N86 PolarHBondContact O-N 3.02Å; N86-D89 PolarHBondContact O-N 2.7Å; N86-E90 PolarHBondContact O-N 2.96Å; N86-E90 VanDerWaalsContact O-N 3.11Å |
| 87 | I | 73.4 | Confident | 66 | Low | 68 Ų | 68 | 111.8 Ų | 111.8 | 35% | 0.349 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.5 | -46.2 | 175.1 | -67.9 | 168.8 | 0 | 0 | 0 | 110.2 | V83 K85 D89 E90 Y91 | V83-I87 HydrophobicContact CG1-CD1 3.85Å; V83-I87 VanDerWaalsContact O-CG1 3.27Å; V83-I87 WeakPolarHBondContact O-CG1 3.45Å; V83-I87 PolarHBondContact O-N 2.92Å; V83-I87 VanDerWaalsContact O-N 3.08Å; K85-I87 VanDerWaalsContact C-N 3.35Å; K85-I87 PolarHBondContact O-N 3.06Å; I87-D89 PolarHBondContact O-N 3.4Å; I87-E90 PolarHBondContact O-N 3.02Å; I87-Y91 HydrophobicContact CG2-CD2 3.58Å; I87-Y91 HydrophobicContact CG2-CE2 3.38Å; I87-Y91 WeakPolarHBondContact O-CD2 3.25Å; I87-Y91 PolarHBondContact O-N 3.4Å |
| 88 | L | 73 | Confident | 66.1 | Low | 107 Ų | 107 | 112.3 Ų | 112.3 | 56% | 0.56 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.6 | -40.3 | -178.9 | -166 | 71 | 0 | 0 | 0 | 112.6 | M84 K85 Y91 M92 | M84-L88 WeakPolarHBondContact O-CB 3.48Å; M84-L88 PolarHBondContact O-N 3.29Å; K85-L88 PolarHBondContact O-N 3.35Å; L88-Y91 PolarHBondContact O-N 3.35Å; L88-M92 VanDerWaalsContact O-CG 3.31Å; L88-M92 WeakPolarHBondContact O-CG 3.33Å; L88-M92 PolarHBondContact O-N 3.19Å |
| 89 | D | 72 | Confident | 66.2 | Low | 105 Ų | 105 | 112.5 Ų | 112.5 | 56% | 0.561 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.6 | -42 | 174.9 | -100.1 | -8.2 | 0 | 0 | 0 | 111.8 | K85 N86 I87 Y91 M92 H93 | K85-D89 PolarHBondContact O-N 2.96Å; N86-D89 PolarHBondContact O-N 2.7Å; I87-D89 PolarHBondContact O-N 3.4Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 2.86Å; D89-M92 PolarHBondContact O-N 2.85Å; D89-H93 PolarHBondContact O-N 3.39Å |
| 90 | E | 68.1 | Low | 66.2 | Low | 116 Ų | 116 | 112.5 Ų | 112.5 | 54% | 0.542 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.5 | -42.1 | 177.4 | -166.8 | 176.9 | -179.4 | 0 | 0 | 111.4 | N86 I87 H93 F94 | N86-E90 PolarHBondContact O-N 2.96Å; N86-E90 VanDerWaalsContact O-N 3.11Å; I87-E90 PolarHBondContact O-N 3.02Å; E90-H93 PolarHBondContact O-N 2.86Å; E90-F94 HydrophobicContact CG-CE2 4.12Å; E90-F94 WeakPolarHBondContact O-CD2 3.48Å |
| 91 | Y | 65.4 | Low | 66.3 | Low | 139 Ų | 139 | 111 Ų | 111 | 55% | 0.545 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.9 | -41 | 175.3 | -81.2 | -73.5 | 0 | 0 | 0 | 112.6 | I87 L88 D89 H93 F94 F95 | I87-Y91 HydrophobicContact CG2-CD2 3.58Å; I87-Y91 HydrophobicContact CG2-CE2 3.38Å; I87-Y91 WeakPolarHBondContact O-CD2 3.25Å; I87-Y91 PolarHBondContact O-N 3.4Å; L88-Y91 PolarHBondContact O-N 3.35Å; D89-Y91 VanDerWaalsContact C-N 3.34Å; D89-Y91 PolarHBondContact O-N 2.86Å; Y91-H93 VanDerWaalsContact C-N 3.3Å; Y91-H93 PolarHBondContact O-N 2.85Å; Y91-F94 PolarHBondContact O-N 3.5Å; Y91-F94 VanDerWaalsContact O-N 3.12Å; Y91-F95 WeakPolarHBondContact O-CD2 3.42Å |
| 92 | M | 61.9 | Low | 66.4 | Low | 109 Ų | 109 | 110.6 Ų | 110.6 | 54% | 0.537 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.3 | -39.7 | 179.9 | -75.1 | -68.7 | 156.2 | 0 | 0 | 112.1 | L88 D89 F94 F95 E96 | L88-M92 VanDerWaalsContact O-CG 3.31Å; L88-M92 WeakPolarHBondContact O-CG 3.33Å; L88-M92 PolarHBondContact O-N 3.19Å; D89-M92 PolarHBondContact O-N 2.85Å; M92-F94 VanDerWaalsContact C-N 3.27Å; M92-F94 PolarHBondContact O-N 3Å; M92-F95 PolarHBondContact O-N 2.71Å; M92-E96 PolarHBondContact O-N 2.96Å |
| 93 | H | 62.3 | Low | 66.3 | Low | 140 Ų | 140 | 111 Ų | 111 | 65% | 0.648 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -62 | -31.2 | 177.1 | -172.4 | -102.6 | 0 | 0 | 0 | 113 | D89 E90 Y91 F95 | D89-H93 PolarHBondContact O-N 3.39Å; E90-H93 PolarHBondContact O-N 2.86Å; Y91-H93 VanDerWaalsContact C-N 3.3Å; Y91-H93 PolarHBondContact O-N 2.85Å; H93-F95 VanDerWaalsContact C-N 3.31Å; H93-F95 PolarHBondContact O-N 3.02Å |
| 94 | F | 60 | Low | 66.1 | Low | 115 Ų | 115 | 112.8 Ų | 112.8 | 50% | 0.504 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -72.6 | -21.1 | 176.2 | -77.7 | -72.8 | 0 | 0 | 0 | 114.3 | E90 Y91 M92 K100 | E90-F94 HydrophobicContact CG-CE2 4.12Å; E90-F94 WeakPolarHBondContact O-CD2 3.48Å; Y91-F94 PolarHBondContact O-N 3.5Å; Y91-F94 VanDerWaalsContact O-N 3.12Å; M92-F94 VanDerWaalsContact C-N 3.27Å; M92-F94 PolarHBondContact O-N 3Å; F94-K100 PolarHBondContact O-NZ 2.93Å |
| 95 | F | 60.5 | Low | 66.4 | Low | 150 Ų | 150 | 115.1 Ų | 115.1 | 66% | 0.658 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -93.4 | -13.7 | 179.6 | -70.3 | -72.3 | 0 | 0 | 0 | 113.6 | Y91 M92 H93 G97 | Y91-F95 WeakPolarHBondContact O-CD2 3.42Å; M92-F95 PolarHBondContact O-N 2.71Å; H93-F95 VanDerWaalsContact C-N 3.31Å; H93-F95 PolarHBondContact O-N 3.02Å; F95-G97 PolarHBondContact O-N 3.32Å |
| 96 | E | 59.9 | Low | 66.4 | Low | 154 Ų | 154 | 115.3 Ų | 115.3 | 72% | 0.72 | 56% | 0.563 | S | S | * | * | trans | -78.2 | 1.4 | -173.2 | -142.8 | 161.7 | -161.8 | 0 | 0 | 114.5 | M92 P98 | M92-E96 PolarHBondContact O-N 2.96Å; E96-P98 WeakPolarHBondContact O-CD 3.22Å | ||
| 97 | G | 63.8 | Low | 66.3 | Low | 29 Ų | 29 | 114.9 Ų | 114.9 | 30% | 0.299 | 56% | 0.561 | S | S | . | * | trans | -77.5 | 116.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | F95 K99 K100 | F95-G97 PolarHBondContact O-N 3.32Å; G97-K99 PolarHBondContact O-N 3.44Å; G97-K100 PolarHBondContact O-N 3.46Å | ||
| 98 | P | 60.1 | Low | 66.5 | Low | 104 Ų | 104 | 116.7 Ų | 116.7 | 68% | 0.675 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.6 | -21.5 | 179.4 | 22.8 | -33.5 | 0 | 0 | 0 | 113.4 | E96 T102 | E96-P98 WeakPolarHBondContact O-CD 3.22Å; P98-T102 PolarHBondContact O-N 2.86Å; P98-T102 PolarHBondContact O-OG1 3.47Å |
| 99 | K | 62 | Low | 66.7 | Low | 175 Ų | 175 | 121 Ų | 121 | 76% | 0.761 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -72.9 | -31.7 | 177.7 | -64.3 | -176.3 | -179.7 | 178.5 | 0 | 113.3 | G97 T102 L103 | G97-K99 PolarHBondContact O-N 3.44Å; K99-T102 WeakPolarHBondContact CA-OG1 3.38Å; K99-T102 PolarHBondContact O-OG1 3.32Å; K99-L103 WeakPolarHBondContact O-CG 3.23Å; K99-L103 PolarHBondContact O-N 3.43Å |
| 100 | K | 60.1 | Low | 67 | Low | 120 Ų | 120 | 122 Ų | 122 | 52% | 0.522 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -78.6 | -39 | 178.5 | -69.8 | -174.2 | -176.8 | 175 | 0 | 111.4 | F94 G97 T102 L103 L104 | F94-K100 PolarHBondContact O-NZ 2.93Å; G97-K100 PolarHBondContact O-N 3.46Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 2.97Å; K100-L103 PolarHBondContact O-N 3.34Å; K100-L104 WeakPolarHBondContact O-CB 3.38Å; K100-L104 PolarHBondContact O-N 3.27Å |
| 101 | A | 63.7 | Low | 67.4 | Low | 44 Ų | 44 | 124.1 Ų | 124.1 | 36% | 0.364 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -61.7 | -36.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | R105 | A101-R105 WeakPolarHBondContact O-CB 3.13Å; A101-R105 VanDerWaalsContact O-CG 3.23Å; A101-R105 WeakPolarHBondContact O-CG 3.47Å; A101-R105 PolarHBondContact O-N 3.33Å |
| 102 | T | 66.5 | Low | 68 | Low | 73 Ų | 73 | 121.1 Ų | 121.1 | 45% | 0.448 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -72.1 | -39.3 | 176.9 | 41.8 | 0 | 0 | 0 | 0 | 112.8 | P98 K99 K100 R105 K106 | P98-T102 PolarHBondContact O-N 2.86Å; P98-T102 PolarHBondContact O-OG1 3.47Å; K99-T102 WeakPolarHBondContact CA-OG1 3.38Å; K99-T102 PolarHBondContact O-OG1 3.32Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 2.97Å; T102-R105 PolarHBondContact O-N 3.29Å; T102-K106 WeakPolarHBondContact O-CG 3.28Å; T102-K106 PolarHBondContact O-N 3.21Å |
| 103 | L | 68.1 | Low | 68.8 | Low | 108 Ų | 108 | 123.9 Ų | 123.9 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.8 | -44.2 | 172.5 | -75.7 | 170.3 | 0 | 0 | 0 | 111.8 | K99 K100 R105 K106 L107 | K99-L103 WeakPolarHBondContact O-CG 3.23Å; K99-L103 PolarHBondContact O-N 3.43Å; K100-L103 PolarHBondContact O-N 3.34Å; L103-R105 VanDerWaalsContact C-N 3.35Å; L103-R105 PolarHBondContact O-N 3.49Å; L103-K106 PolarHBondContact O-N 3.48Å; L103-L107 WeakPolarHBondContact O-CG 3.22Å; L103-L107 PolarHBondContact O-N 3.01Å |
| 104 | L | 68.7 | Low | 69.4 | Low | 125 Ų | 125 | 121.2 Ų | 121.2 | 65% | 0.654 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.2 | -42.6 | 177.9 | -146.1 | 83.5 | 0 | 0 | 0 | 111.3 | K100 K106 L107 L108 | K100-L104 WeakPolarHBondContact O-CB 3.38Å; K100-L104 PolarHBondContact O-N 3.27Å; L104-K106 PolarHBondContact O-N 3.02Å; L104-L107 PolarHBondContact O-N 3.43Å; L104-L108 WeakPolarHBondContact O-CB 3.36Å; L104-L108 PolarHBondContact O-N 2.95Å |
| 105 | R | 71.7 | Confident | 70.1 | Confident | 183 Ų | 183 | 120.3 Ų | 120.3 | 69% | 0.691 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.4 | -38.8 | 175 | -76 | 175.3 | -170.7 | -174.5 | 4.6 | 112.7 | A101 T102 L103 R109 | A101-R105 WeakPolarHBondContact O-CB 3.13Å; A101-R105 VanDerWaalsContact O-CG 3.23Å; A101-R105 WeakPolarHBondContact O-CG 3.47Å; A101-R105 PolarHBondContact O-N 3.33Å; T102-R105 PolarHBondContact O-N 3.29Å; L103-R105 VanDerWaalsContact C-N 3.35Å; L103-R105 PolarHBondContact O-N 3.49Å; R105-R109 VanDerWaalsContact O-CB 3.28Å; R105-R109 WeakPolarHBondContact O-CB 3.28Å; R105-R109 PolarHBondContact O-N 2.91Å |
| 106 | K | 76.2 | Confident | 70.5 | Confident | 150 Ų | 150 | 116.5 Ų | 116.5 | 65% | 0.652 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66 | -49.1 | 176.5 | -77.7 | -179.1 | 179.9 | -178.5 | 0 | 111.6 | T102 L103 L104 L108 R109 Q110 | T102-K106 WeakPolarHBondContact O-CG 3.28Å; T102-K106 PolarHBondContact O-N 3.21Å; L103-K106 PolarHBondContact O-N 3.48Å; L104-K106 PolarHBondContact O-N 3.02Å; K106-L108 VanDerWaalsContact C-N 3.33Å; K106-L108 PolarHBondContact O-N 3.42Å; K106-R109 PolarHBondContact O-N 2.95Å; K106-Q110 WeakPolarHBondContact O-CB 3.14Å; K106-Q110 PolarHBondContact O-N 3.45Å |
| 107 | L | 74.6 | Confident | 71.1 | Confident | 99 Ų | 99 | 113.8 Ų | 113.8 | 52% | 0.518 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.9 | -39.3 | 178.5 | -70.5 | 172.4 | 0 | 0 | 0 | 111.9 | L103 L104 Q110 K111 | L103-L107 WeakPolarHBondContact O-CG 3.22Å; L103-L107 PolarHBondContact O-N 3.01Å; L104-L107 PolarHBondContact O-N 3.43Å; L107-Q110 PolarHBondContact O-N 2.96Å; L107-K111 WeakPolarHBondContact O-CB 3.28Å; L107-K111 PolarHBondContact O-N 3.4Å |
| 108 | L | 77.4 | Confident | 71.7 | Confident | 106 Ų | 106 | 118.4 Ų | 118.4 | 56% | 0.555 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.4 | -45.5 | 176.3 | -171.1 | 66.2 | 0 | 0 | 0 | 110.9 | L104 K106 Q110 K111 I112 | L104-L108 WeakPolarHBondContact O-CB 3.36Å; L104-L108 PolarHBondContact O-N 2.95Å; K106-L108 VanDerWaalsContact C-N 3.33Å; K106-L108 PolarHBondContact O-N 3.42Å; L108-Q110 VanDerWaalsContact C-N 3.34Å; L108-Q110 PolarHBondContact O-N 3.49Å; L108-K111 PolarHBondContact O-N 3.07Å; L108-I112 HydrophobicContact CD1-CD1 4.12Å; L108-I112 HydrophobicContact CG-CD1 3.77Å; L108-I112 WeakPolarHBondContact O-CB 3.25Å; L108-I112 WeakPolarHBondContact O-CD1 3.49Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 3.01Å |
| 109 | R | 77.4 | Confident | 72 | Confident | 198 Ų | 198 | 121.7 Ų | 121.7 | 75% | 0.747 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.9 | -41.3 | 175.4 | -175.2 | 179.6 | -80.3 | -171.1 | -4.8 | 111.6 | R105 K106 W113 | R105-R109 VanDerWaalsContact O-CB 3.28Å; R105-R109 WeakPolarHBondContact O-CB 3.28Å; R105-R109 PolarHBondContact O-N 2.91Å; K106-R109 PolarHBondContact O-N 2.95Å; R109-W113 VanDerWaalsContact O-CB 3.25Å; R109-W113 WeakPolarHBondContact O-CB 3.31Å; R109-W113 PolarHBondContact O-N 2.9Å |
| 110 | Q | 79.8 | Confident | 72 | Confident | 124 Ų | 124 | 120.1 Ų | 120.1 | 58% | 0.579 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.4 | -49.3 | 177.9 | -172.9 | 177.5 | 3.1 | 0 | 0 | 111.6 | K106 L107 L108 I112 W113 T114 | K106-Q110 WeakPolarHBondContact O-CB 3.14Å; K106-Q110 PolarHBondContact O-N 3.45Å; L107-Q110 PolarHBondContact O-N 2.96Å; L108-Q110 VanDerWaalsContact C-N 3.34Å; L108-Q110 PolarHBondContact O-N 3.49Å; Q110-I112 PolarHBondContact O-N 2.92Å; Q110-W113 WeakPolarHBondContact O-CB 3.38Å; Q110-W113 PolarHBondContact O-N 3.04Å; Q110-T114 PolarHBondContact O-N 3.45Å; Q110-T114 PolarHBondContact O-OG1 2.89Å |
| 111 | K | 75 | Confident | 71.9 | Confident | 162 Ų | 162 | 120.3 Ų | 120.3 | 70% | 0.704 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -63.2 | -40.7 | 178.4 | -78.8 | -167.3 | 173.1 | -170 | 0 | 112.5 | L107 L108 W113 T114 L115 | L107-K111 WeakPolarHBondContact O-CB 3.28Å; L107-K111 PolarHBondContact O-N 3.4Å; L108-K111 PolarHBondContact O-N 3.07Å; K111-W113 VanDerWaalsContact C-N 3.34Å; K111-T114 PolarHBondContact O-N 3.44Å; K111-L115 VanDerWaalsContact O-CB 3.28Å; K111-L115 WeakPolarHBondContact O-CB 3.41Å; K111-L115 PolarHBondContact O-N 2.91Å |
| 112 | I | 77.6 | Confident | 72.4 | Confident | 75 Ų | 75 | 124.1 Ų | 124.1 | 39% | 0.385 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -64 | -42 | 175.8 | -66.9 | 165.6 | 0 | 0 | 0 | 110.3 | L108 Q110 L115 L116 | L108-I112 HydrophobicContact CD1-CD1 4.12Å; L108-I112 HydrophobicContact CG-CD1 3.77Å; L108-I112 WeakPolarHBondContact O-CB 3.25Å; L108-I112 WeakPolarHBondContact O-CD1 3.49Å; L108-I112 WeakPolarHBondContact O-CG1 3.49Å; L108-I112 PolarHBondContact O-N 3.01Å; Q110-I112 PolarHBondContact O-N 2.92Å; I112-L115 PolarHBondContact O-N 3.27Å; I112-L116 WeakPolarHBondContact O-CB 3.43Å; I112-L116 PolarHBondContact O-N 3.09Å |
| 113 | W | 80.1 | Confident | 72.7 | Confident | 167 Ų | 167 | 126.8 Ų | 126.8 | 63% | 0.633 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -63.3 | -45.8 | 177.6 | -173.6 | -85.7 | 0 | 0 | 0 | 112.4 | R109 Q110 K111 L115 L116 L117 | R109-W113 VanDerWaalsContact O-CB 3.25Å; R109-W113 WeakPolarHBondContact O-CB 3.31Å; R109-W113 PolarHBondContact O-N 2.9Å; Q110-W113 WeakPolarHBondContact O-CB 3.38Å; Q110-W113 PolarHBondContact O-N 3.04Å; K111-W113 VanDerWaalsContact C-N 3.34Å; W113-L115 VanDerWaalsContact C-N 3.33Å; W113-L115 PolarHBondContact O-N 3.48Å; W113-L116 WeakPolarHBondContact O-CB 3.35Å; W113-L116 PolarHBondContact O-N 3.39Å; W113-L117 VanDerWaalsContact NE1-CD1 3.35Å; W113-L117 PolarHBondContact O-N 2.93Å |
| 114 | T | 75.3 | Confident | 72.9 | Confident | 85 Ų | 85 | 127.8 Ų | 127.8 | 52% | 0.521 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -64.5 | -39.1 | 176.8 | -49.8 | 0 | 0 | 0 | 0 | 111.6 | Q110 K111 L116 L117 L118 | Q110-T114 PolarHBondContact O-N 3.45Å; Q110-T114 PolarHBondContact O-OG1 2.89Å; K111-T114 PolarHBondContact O-N 3.44Å; T114-L116 VanDerWaalsContact C-N 3.33Å; T114-L117 PolarHBondContact O-N 3.22Å; T114-L118 PolarHBondContact O-N 3.38Å; T114-L118 VanDerWaalsContact O-N 3.09Å |
| 115 | L | 72.8 | Confident | 73.2 | Confident | 96 Ų | 96 | 128 Ų | 128 | 50% | 0.503 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68.2 | -33.2 | 176.8 | -166.4 | 71.5 | 0 | 0 | 0 | 112.3 | K111 I112 W113 | K111-L115 VanDerWaalsContact O-CB 3.28Å; K111-L115 WeakPolarHBondContact O-CB 3.41Å; K111-L115 PolarHBondContact O-N 2.91Å; I112-L115 PolarHBondContact O-N 3.27Å; W113-L115 VanDerWaalsContact C-N 3.33Å; W113-L115 PolarHBondContact O-N 3.48Å |
| 116 | L | 69.4 | Low | 73.3 | Confident | 69 Ų | 69 | 124.6 Ų | 124.6 | 36% | 0.361 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.4 | -42.8 | 174.5 | -167.3 | 79.5 | 0 | 0 | 0 | 111.5 | F6 I112 W113 T114 R119 | F6-L116 HydrophobicContact CD2-CD1 4.38Å; F6-L116 HydrophobicContact CE2-CD1 3.49Å; F6-L116 VanDerWaalsContact CE2-CD1 3.49Å; F6-L116 HydrophobicContact CZ-CD1 4.2Å; I112-L116 WeakPolarHBondContact O-CB 3.43Å; I112-L116 PolarHBondContact O-N 3.09Å; W113-L116 WeakPolarHBondContact O-CB 3.35Å; W113-L116 PolarHBondContact O-N 3.39Å; T114-L116 VanDerWaalsContact C-N 3.33Å; L116-R119 PolarHBondContact O-N 3.22Å |
| 117 | L | 73 | Confident | 73.1 | Confident | 98 Ų | 98 | 122.9 Ų | 122.9 | 51% | 0.513 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.1 | -34.1 | 178.1 | -75.6 | 170.9 | 0 | 0 | 0 | 112.8 | W113 T114 R119 L120 | W113-L117 VanDerWaalsContact NE1-CD1 3.35Å; W113-L117 PolarHBondContact O-N 2.93Å; T114-L117 PolarHBondContact O-N 3.22Å; L117-R119 PolarHBondContact O-N 3.17Å; L117-L120 PolarHBondContact O-N 3.37Å |
| 118 | L | 77.3 | Confident | 73 | Confident | 126 Ų | 126 | 124.6 Ų | 124.6 | 66% | 0.66 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | -12.8 | 178 | -166 | 67.9 | 0 | 0 | 0 | 113.5 | T114 | T114-L118 PolarHBondContact O-N 3.38Å; T114-L118 VanDerWaalsContact O-N 3.09Å |
| 119 | R | 65.3 | Low | 72.6 | Confident | 172 Ų | 172 | 126 Ų | 126 | 65% | 0.649 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | -2.2 | 177.6 | -67.9 | -68.8 | -177 | 79.2 | -0.6 | 113.8 | L116 L117 | L116-R119 PolarHBondContact O-N 3.22Å; L117-R119 PolarHBondContact O-N 3.17Å |
| 120 | L | 61.3 | Low | 72.2 | Confident | 142 Ų | 142 | 120 Ų | 120 | 74% | 0.743 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -12.5 | 177.3 | -87.4 | 145.8 | 0 | 0 | 0 | 113.1 | L117 | L117-L120 PolarHBondContact O-N 3.37Š|
| 121 | G | 59.7 | Low | 71.5 | Confident | 124 Ų | 124 | 119.6 Ų | 119.6 | 100% | 1.278 | 63% | 0.632 | S | S | * | * | trans | -111.7 | 0 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.3 |
Retrieved 121 of 121 residues in 68.6 ms
(Link to these results)