| 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 | 60.1 | Low | 78.1 | Confident | 216 Ų | 216 | 113.2 Ų | 113.2 | 100% | 1.064 | 62% | 0.617 | S | S | * | * | 0 | -36.3 | 0 | -139.6 | 157.9 | 175.4 | 0 | 0 | 113.6 | L5 | M1-L5 PolarHBondContact O-N 3.46Š| |||
| 2 | G | 73.2 | Confident | 78.8 | Confident | 47 Ų | 47 | 111.8 Ų | 111.8 | 49% | 0.485 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -66.7 | -35 | -177.4 | 0 | 0 | 0 | 0 | 0 | 117 | R6 | G2-R6 WeakPolarHBondContact O-CG 3.47Å; G2-R6 PolarHBondContact O-N 3.33Å; G2-R6 VanDerWaalsContact O-N 3.07Å |
| 3 | V | 76 | Confident | 79.2 | Confident | 123 Ų | 123 | 107.6 Ų | 107.6 | 75% | 0.745 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.4 | -42.2 | -179.5 | -179.3 | 0 | 0 | 0 | 0 | 111.8 | R6 A7 | V3-R6 PolarHBondContact O-N 3.01Å; V3-A7 WeakPolarHBondContact O-CB 3.39Å; V3-A7 PolarHBondContact O-N 2.89Å |
| 4 | V | 77.8 | Confident | 79.8 | Confident | 104 Ų | 104 | 104.3 Ų | 104.3 | 63% | 0.63 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -65.3 | -41.8 | 177.5 | 179.1 | 0 | 0 | 0 | 0 | 111.2 | R6 A7 T8 | V4-R6 PolarHBondContact O-N 3.09Å; V4-A7 PolarHBondContact O-N 3.26Å; V4-T8 WeakPolarHBondContact O-CB 3.23Å; V4-T8 PolarHBondContact O-N 2.86Å; V4-T8 PolarHBondContact O-OG1 2.78Å |
| 5 | L | 76.9 | Confident | 80.3 | Confident | 110 Ų | 110 | 100.9 Ų | 100.9 | 58% | 0.576 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.9 | -41.8 | 177.6 | -152.7 | 96 | 0 | 0 | 0 | 111.5 | M1 T8 N9 | M1-L5 PolarHBondContact O-N 3.46Å; L5-T8 PolarHBondContact O-N 3.14Å; L5-N9 WeakPolarHBondContact O-CB 3.38Å; L5-N9 VanDerWaalsContact O-CG 3.3Å; L5-N9 PolarHBondContact O-N 2.68Å |
| 6 | R | 78.9 | Confident | 80.7 | Confident | 199 Ų | 199 | 99.3 Ų | 99.3 | 75% | 0.751 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.8 | -42.7 | 175.5 | -74.4 | 180 | -179.6 | -171.3 | 0.3 | 112.2 | G2 V3 V4 N9 Y10 | G2-R6 WeakPolarHBondContact O-CG 3.47Å; G2-R6 PolarHBondContact O-N 3.33Å; G2-R6 VanDerWaalsContact O-N 3.07Å; V3-R6 PolarHBondContact O-N 3.01Å; V4-R6 PolarHBondContact O-N 3.09Å; R6-N9 PolarHBondContact O-N 2.77Å; R6-Y10 VanDerWaalsContact O-CB 3.32Å; R6-Y10 WeakPolarHBondContact O-CB 3.44Å; R6-Y10 PolarHBondContact O-N 3.14Å |
| 7 | A | 80.5 | Confident | 81.1 | Confident | 59 Ų | 59 | 101.5 Ų | 101.5 | 49% | 0.488 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.9 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | V3 V4 Y10 A11 | V3-A7 WeakPolarHBondContact O-CB 3.39Å; V3-A7 PolarHBondContact O-N 2.89Å; V4-A7 PolarHBondContact O-N 3.26Å; A7-Y10 PolarHBondContact O-N 3.5Å; A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 3.08Å |
| 8 | T | 83.6 | Confident | 81.5 | Confident | 69 Ų | 69 | 100.1 Ų | 100.1 | 42% | 0.423 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65 | -46.2 | 177.4 | -52 | 0 | 0 | 0 | 0 | 111.1 | V4 L5 Y10 A11 L12 | V4-T8 WeakPolarHBondContact O-CB 3.23Å; V4-T8 PolarHBondContact O-N 2.86Å; V4-T8 PolarHBondContact O-OG1 2.78Å; L5-T8 PolarHBondContact O-N 3.14Å; T8-Y10 VanDerWaalsContact C-N 3.33Å; T8-Y10 PolarHBondContact O-N 3.41Å; T8-A11 PolarHBondContact O-N 3.17Å; T8-L12 HydrophobicContact CG2-CD1 4.08Å; T8-L12 WeakPolarHBondContact O-CB 3.45Å; T8-L12 VanDerWaalsContact O-CG 3.32Å; T8-L12 WeakPolarHBondContact O-CG 3.16Å; T8-L12 PolarHBondContact O-N 3.33Å |
| 9 | N | 82.5 | Confident | 81.8 | Confident | 92 Ų | 92 | 100.8 Ų | 100.8 | 49% | 0.492 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.3 | -39.2 | 176 | -73.7 | -10.2 | 0 | 0 | 0 | 112 | L5 R6 L12 S13 | L5-N9 WeakPolarHBondContact O-CB 3.38Å; L5-N9 VanDerWaalsContact O-CG 3.3Å; L5-N9 PolarHBondContact O-N 2.68Å; R6-N9 PolarHBondContact O-N 2.77Å; N9-L12 PolarHBondContact O-N 3.1Å; N9-S13 WeakPolarHBondContact O-CB 3.33Å; N9-S13 PolarHBondContact O-N 3.29Å; N9-S13 PolarHBondContact O-OG 3.37Å |
| 10 | Y | 82.9 | Confident | 82.1 | Confident | 168 Ų | 168 | 99.8 Ų | 99.8 | 66% | 0.659 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.7 | -48.8 | 175.5 | -173.4 | -99.7 | 0 | 0 | 0 | 111.2 | R6 A7 T8 L12 S13 V14 | R6-Y10 VanDerWaalsContact O-CB 3.32Å; R6-Y10 WeakPolarHBondContact O-CB 3.44Å; R6-Y10 PolarHBondContact O-N 3.14Å; A7-Y10 PolarHBondContact O-N 3.5Å; T8-Y10 VanDerWaalsContact C-N 3.33Å; T8-Y10 PolarHBondContact O-N 3.41Å; Y10-L12 PolarHBondContact O-N 3.25Å; Y10-S13 WeakPolarHBondContact CA-OG 3.43Å; Y10-S13 PolarHBondContact O-N 3.42Å; Y10-S13 PolarHBondContact O-OG 3.14Å; Y10-V14 HydrophobicContact CD1-CG2 4.1Å; Y10-V14 HydrophobicContact CE1-CG2 3.74Å; Y10-V14 HydrophobicContact CE2-CG2 4.33Å; Y10-V14 WeakPolarHBondContact O-CG2 3.5Å; Y10-V14 PolarHBondContact O-N 2.96Å |
| 11 | A | 86.3 | Confident | 82.3 | Confident | 58 Ų | 58 | 99 Ų | 99 | 48% | 0.479 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60 | -42.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A7 T8 V14 S15 | A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 3.08Å; T8-A11 PolarHBondContact O-N 3.17Å; A11-V14 PolarHBondContact O-N 2.97Å; A11-S15 WeakPolarHBondContact O-CB 3.49Å; A11-S15 PolarHBondContact O-N 3.05Å; A11-S15 PolarHBondContact O-OG 3.2Å |
| 12 | L | 86.9 | Confident | 83.6 | Confident | 97 Ų | 97 | 91.9 Ų | 91.9 | 51% | 0.508 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -42.8 | 174.6 | -74.1 | 170.9 | 0 | 0 | 0 | 111.7 | T8 N9 Y10 S15 T16 | T8-L12 HydrophobicContact CG2-CD1 4.08Å; T8-L12 WeakPolarHBondContact O-CB 3.45Å; T8-L12 VanDerWaalsContact O-CG 3.32Å; T8-L12 WeakPolarHBondContact O-CG 3.16Å; T8-L12 PolarHBondContact O-N 3.33Å; N9-L12 PolarHBondContact O-N 3.1Å; Y10-L12 PolarHBondContact O-N 3.25Å; L12-S15 WeakPolarHBondContact CA-OG 3.31Å; L12-S15 PolarHBondContact O-N 3.11Å; L12-S15 PolarHBondContact O-OG 3.03Å; L12-T16 WeakPolarHBondContact O-CB 3.34Å; L12-T16 VanDerWaalsContact O-CG2 3.31Å; L12-T16 WeakPolarHBondContact O-CG2 3.49Å; L12-T16 PolarHBondContact O-N 3.29Å; L12-T16 PolarHBondContact O-OG1 3.37Å |
| 13 | S | 84 | Confident | 84.1 | Confident | 57 Ų | 57 | 93.3 Ų | 93.3 | 40% | 0.399 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -41.3 | 176.9 | 71.9 | 0 | 0 | 0 | 0 | 112.8 | N9 Y10 T16 F17 | N9-S13 WeakPolarHBondContact O-CB 3.33Å; N9-S13 PolarHBondContact O-N 3.29Å; N9-S13 PolarHBondContact O-OG 3.37Å; Y10-S13 WeakPolarHBondContact CA-OG 3.43Å; Y10-S13 PolarHBondContact O-N 3.42Å; Y10-S13 PolarHBondContact O-OG 3.14Å; S13-T16 WeakPolarHBondContact CA-OG1 3.27Å; S13-T16 PolarHBondContact O-OG1 3.01Å; S13-F17 WeakPolarHBondContact O-CB 3.44Å; S13-F17 PolarHBondContact O-N 3.42Å |
| 14 | V | 88.4 | Confident | 84.5 | Confident | 61 Ų | 61 | 91.5 Ų | 91.5 | 37% | 0.37 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.7 | -45.9 | 176.3 | 173.1 | 0 | 0 | 0 | 0 | 110.9 | Y10 A11 F17 V18 | Y10-V14 HydrophobicContact CD1-CG2 4.1Å; Y10-V14 HydrophobicContact CE1-CG2 3.74Å; Y10-V14 HydrophobicContact CE2-CG2 4.33Å; Y10-V14 WeakPolarHBondContact O-CG2 3.5Å; Y10-V14 PolarHBondContact O-N 2.96Å; A11-V14 PolarHBondContact O-N 2.97Å; V14-F17 PolarHBondContact O-N 3.34Å; V14-V18 HydrophobicContact CG1-CG2 4.38Å; V14-V18 WeakPolarHBondContact O-CB 3.27Å; V14-V18 VanDerWaalsContact O-CG2 3.24Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 3.16Å |
| 15 | S | 86.3 | Confident | 84.9 | Confident | 53 Ų | 53 | 93.1 Ų | 93.1 | 37% | 0.371 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.4 | -43.3 | 178.9 | 61.9 | 0 | 0 | 0 | 0 | 112.5 | A11 L12 V18 L19 | A11-S15 WeakPolarHBondContact O-CB 3.49Å; A11-S15 PolarHBondContact O-N 3.05Å; A11-S15 PolarHBondContact O-OG 3.2Å; L12-S15 WeakPolarHBondContact CA-OG 3.31Å; L12-S15 PolarHBondContact O-N 3.11Å; L12-S15 PolarHBondContact O-OG 3.03Å; S15-V18 PolarHBondContact O-N 3.3Å; S15-L19 WeakPolarHBondContact O-CB 3.45Å; S15-L19 VanDerWaalsContact O-CG 3.32Å; S15-L19 WeakPolarHBondContact O-CG 3.34Å; S15-L19 PolarHBondContact O-N 3.39Å |
| 16 | T | 86.9 | Confident | 85.2 | Confident | 76 Ų | 76 | 91.5 Ų | 91.5 | 47% | 0.466 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 175.4 | 49.3 | 0 | 0 | 0 | 0 | 111.7 | L12 S13 V18 L19 V20 | L12-T16 WeakPolarHBondContact O-CB 3.34Å; L12-T16 VanDerWaalsContact O-CG2 3.31Å; L12-T16 WeakPolarHBondContact O-CG2 3.49Å; L12-T16 PolarHBondContact O-N 3.29Å; L12-T16 PolarHBondContact O-OG1 3.37Å; S13-T16 WeakPolarHBondContact CA-OG1 3.27Å; S13-T16 PolarHBondContact O-OG1 3.01Å; T16-V18 PolarHBondContact O-N 3.37Å; T16-L19 PolarHBondContact O-N 3.23Å; T16-V20 WeakPolarHBondContact O-CB 3.35Å; T16-V20 VanDerWaalsContact O-CG2 3.27Å; T16-V20 WeakPolarHBondContact O-CG2 3.41Å; T16-V20 PolarHBondContact O-N 3.33Å |
| 17 | F | 87.2 | Confident | 85.4 | Confident | 136 Ų | 136 | 88 Ų | 88 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62 | -44 | 175.5 | -173.7 | -108.1 | 0 | 0 | 0 | 112.3 | S13 V14 V20 I21 | S13-F17 WeakPolarHBondContact O-CB 3.44Å; S13-F17 PolarHBondContact O-N 3.42Å; V14-F17 PolarHBondContact O-N 3.34Å; F17-V20 PolarHBondContact O-N 2.95Å; F17-I21 HydrophobicContact CD1-CD1 3.65Å; F17-I21 HydrophobicContact CE1-CD1 3.19Å; F17-I21 HydrophobicContact CE1-CG1 4.27Å; F17-I21 HydrophobicContact CE2-CD1 4.25Å; F17-I21 HydrophobicContact CG-CD1 4.36Å; F17-I21 HydrophobicContact CZ-CD1 3.53Å; F17-I21 HydrophobicContact CZ-CG1 4.32Å; F17-I21 WeakPolarHBondContact O-CG1 3.23Å; F17-I21 PolarHBondContact O-N 3.33Å |
| 18 | V | 89 | Confident | 85.6 | Confident | 77 Ų | 77 | 92 Ų | 92 | 47% | 0.467 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 175.3 | 170.7 | 0 | 0 | 0 | 0 | 111 | V14 S15 T16 V20 I21 V22 | V14-V18 HydrophobicContact CG1-CG2 4.38Å; V14-V18 WeakPolarHBondContact O-CB 3.27Å; V14-V18 VanDerWaalsContact O-CG2 3.24Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 3.16Å; S15-V18 PolarHBondContact O-N 3.3Å; T16-V18 PolarHBondContact O-N 3.37Å; V18-V20 VanDerWaalsContact C-N 3.33Å; V18-V20 PolarHBondContact O-N 3.33Å; V18-I21 PolarHBondContact O-N 2.94Å; V18-V22 HydrophobicContact CG1-CG2 4.32Å; V18-V22 WeakPolarHBondContact O-CB 3.43Å; V18-V22 VanDerWaalsContact O-CG2 3.26Å; V18-V22 WeakPolarHBondContact O-CG2 3.47Å; V18-V22 PolarHBondContact O-N 2.86Å |
| 19 | L | 87.2 | Confident | 85.5 | Confident | 114 Ų | 114 | 91.1 Ų | 91.1 | 60% | 0.597 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.1 | -41.3 | 176.8 | -74.8 | 172.6 | 0 | 0 | 0 | 112 | S15 T16 S23 | S15-L19 WeakPolarHBondContact O-CB 3.45Å; S15-L19 VanDerWaalsContact O-CG 3.32Å; S15-L19 WeakPolarHBondContact O-CG 3.34Å; S15-L19 PolarHBondContact O-N 3.39Å; T16-L19 PolarHBondContact O-N 3.23Å; L19-S23 VanDerWaalsContact O-CB 3.25Å; L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.48Å; L19-S23 PolarHBondContact O-OG 3.47Å |
| 20 | V | 86.9 | Confident | 85.3 | Confident | 80 Ų | 80 | 89.5 Ų | 89.5 | 49% | 0.485 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.3 | -45.4 | 176.5 | 170.4 | 0 | 0 | 0 | 0 | 111 | T16 F17 V18 V22 S23 L24 | T16-V20 WeakPolarHBondContact O-CB 3.35Å; T16-V20 VanDerWaalsContact O-CG2 3.27Å; T16-V20 WeakPolarHBondContact O-CG2 3.41Å; T16-V20 PolarHBondContact O-N 3.33Å; F17-V20 PolarHBondContact O-N 2.95Å; V18-V20 VanDerWaalsContact C-N 3.33Å; V18-V20 PolarHBondContact O-N 3.33Å; V20-V22 PolarHBondContact O-N 2.88Å; V20-S23 PolarHBondContact O-N 3.16Å; V20-L24 HydrophobicContact CG1-CD1 3.76Å; V20-L24 HydrophobicContact CG1-CG 4.33Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.32Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.44Å |
| 21 | I | 87.6 | Confident | 85.1 | Confident | 83 Ų | 83 | 85.9 Ų | 85.9 | 43% | 0.426 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.7 | -46.9 | 176.7 | -74.6 | 175.9 | 0 | 0 | 0 | 111.1 | F17 V18 S23 L24 Y25 | F17-I21 HydrophobicContact CD1-CD1 3.65Å; F17-I21 HydrophobicContact CE1-CD1 3.19Å; F17-I21 HydrophobicContact CE1-CG1 4.27Å; F17-I21 HydrophobicContact CE2-CD1 4.25Å; F17-I21 HydrophobicContact CG-CD1 4.36Å; F17-I21 HydrophobicContact CZ-CD1 3.53Å; F17-I21 HydrophobicContact CZ-CG1 4.32Å; F17-I21 WeakPolarHBondContact O-CG1 3.23Å; F17-I21 PolarHBondContact O-N 3.33Å; V18-I21 PolarHBondContact O-N 2.94Å; I21-S23 VanDerWaalsContact C-N 3.35Å; I21-L24 PolarHBondContact O-N 3.12Å; I21-Y25 VanDerWaalsContact O-CB 3.28Å; I21-Y25 WeakPolarHBondContact O-CB 3.46Å; I21-Y25 PolarHBondContact O-N 2.87Å |
| 22 | V | 86.8 | Confident | 84.7 | Confident | 67 Ų | 67 | 84.8 Ų | 84.8 | 41% | 0.406 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 179.8 | 172.1 | 0 | 0 | 0 | 0 | 110.2 | V18 V20 Y25 Y26 | V18-V22 HydrophobicContact CG1-CG2 4.32Å; V18-V22 WeakPolarHBondContact O-CB 3.43Å; V18-V22 VanDerWaalsContact O-CG2 3.26Å; V18-V22 WeakPolarHBondContact O-CG2 3.47Å; V18-V22 PolarHBondContact O-N 2.86Å; V20-V22 PolarHBondContact O-N 2.88Å; V22-Y25 WeakPolarHBondContact O-CB 3.44Å; V22-Y25 PolarHBondContact O-N 3.38Å; V22-Y26 HydrophobicContact CG1-CD2 3.7Å; V22-Y26 HydrophobicContact CG1-CE2 3.61Å; V22-Y26 VanDerWaalsContact O-CD2 3.23Å; V22-Y26 WeakPolarHBondContact O-CD2 3.22Å; V22-Y26 PolarHBondContact O-N 3.2Å |
| 23 | S | 83.4 | Confident | 84.2 | Confident | 76 Ų | 76 | 87.2 Ų | 87.2 | 53% | 0.531 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 177.2 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | L19 V20 I21 Y25 Y26 L27 | L19-S23 VanDerWaalsContact O-CB 3.25Å; L19-S23 WeakPolarHBondContact O-CB 3.46Å; L19-S23 PolarHBondContact O-N 3.48Å; L19-S23 PolarHBondContact O-OG 3.47Å; V20-S23 PolarHBondContact O-N 3.16Å; I21-S23 VanDerWaalsContact C-N 3.35Å; S23-Y25 VanDerWaalsContact C-N 3.34Å; S23-Y25 PolarHBondContact O-N 3.31Å; S23-Y26 PolarHBondContact O-N 2.82Å; S23-L27 WeakPolarHBondContact O-CB 3.35Å; S23-L27 PolarHBondContact O-N 3.12Å |
| 24 | L | 83.6 | Confident | 83.9 | Confident | 86 Ų | 86 | 92.3 Ų | 92.3 | 45% | 0.45 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -39.2 | 174.5 | -75.7 | 170.4 | 0 | 0 | 0 | 111.6 | V20 I21 L27 L28 | V20-L24 HydrophobicContact CG1-CD1 3.76Å; V20-L24 HydrophobicContact CG1-CG 4.33Å; V20-L24 WeakPolarHBondContact O-CB 3.47Å; V20-L24 VanDerWaalsContact O-CG 3.32Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.44Å; I21-L24 PolarHBondContact O-N 3.12Å; L24-L27 PolarHBondContact O-N 3.31Å; L24-L28 VanDerWaalsContact O-CB 3.26Å; L24-L28 WeakPolarHBondContact O-CB 3.47Å; L24-L28 VanDerWaalsContact O-CG 3.22Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 3.13Å |
| 25 | Y | 86.8 | Confident | 83.5 | Confident | 138 Ų | 138 | 96.5 Ų | 96.5 | 54% | 0.541 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 176.7 | 176.7 | -98.1 | 0 | 0 | 0 | 111.9 | I21 V22 S23 L27 S29 | I21-Y25 VanDerWaalsContact O-CB 3.28Å; I21-Y25 WeakPolarHBondContact O-CB 3.46Å; I21-Y25 PolarHBondContact O-N 2.87Å; V22-Y25 WeakPolarHBondContact O-CB 3.44Å; V22-Y25 PolarHBondContact O-N 3.38Å; S23-Y25 VanDerWaalsContact C-N 3.34Å; S23-Y25 PolarHBondContact O-N 3.31Å; Y25-L27 VanDerWaalsContact C-N 3.34Å; Y25-S29 WeakPolarHBondContact CE2-OG 3.45Å; Y25-S29 WeakPolarHBondContact O-CB 3.21Å; Y25-S29 PolarHBondContact O-N 3.35Å; Y25-S29 PolarHBondContact O-OG 3.22Å |
| 26 | Y | 84 | Confident | 83.3 | Confident | 75 Ų | 75 | 98.2 Ų | 98.2 | 29% | 0.294 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.7 | -37.1 | 175.9 | -83.5 | -73.7 | 0 | 0 | 0 | 112.3 | V22 S23 K31 G32 R34 | V22-Y26 HydrophobicContact CG1-CD2 3.7Å; V22-Y26 HydrophobicContact CG1-CE2 3.61Å; V22-Y26 VanDerWaalsContact O-CD2 3.23Å; V22-Y26 WeakPolarHBondContact O-CD2 3.22Å; V22-Y26 PolarHBondContact O-N 3.2Å; S23-Y26 PolarHBondContact O-N 2.82Å; Y26-K31 HydrophobicContact CD1-CB 4.16Å; Y26-K31 CarbonylContact O-C 3.41Å; Y26-K31 PolarHBondContact O-N 3.42Å; Y26-G32 PolarHBondContact O-N 3Å; Y26-R34 HydrophobicContact CE1-CB 4.28Å |
| 27 | L | 83.4 | Confident | 83.1 | Confident | 126 Ų | 126 | 99.4 Ų | 99.4 | 66% | 0.66 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.2 | -50.8 | 177.1 | -169.9 | 71.4 | 0 | 0 | 0 | 111.8 | S23 L24 Y25 G30 | S23-L27 WeakPolarHBondContact O-CB 3.35Å; S23-L27 PolarHBondContact O-N 3.12Å; L24-L27 PolarHBondContact O-N 3.31Å; Y25-L27 VanDerWaalsContact C-N 3.34Å; L27-G30 PolarHBondContact O-N 3.45Å |
| 28 | L | 83.6 | Confident | 82.9 | Confident | 143 Ų | 143 | 94.7 Ų | 94.7 | 75% | 0.749 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -72.8 | -30 | -176.5 | -67.1 | 172.8 | 0 | 0 | 0 | 113 | L24 G30 | L24-L28 VanDerWaalsContact O-CB 3.26Å; L24-L28 WeakPolarHBondContact O-CB 3.47Å; L24-L28 VanDerWaalsContact O-CG 3.22Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 3.13Å; L28-G30 PolarHBondContact O-N 2.7Å |
| 29 | S | 82.2 | Confident | 82.7 | Confident | 51 Ų | 51 | 98.3 Ų | 98.3 | 36% | 0.357 | 51% | 0.513 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | 3.7 | 177.5 | -57.3 | 0 | 0 | 0 | 0 | 113.6 | Y25 K31 | Y25-S29 WeakPolarHBondContact CE2-OG 3.45Å; Y25-S29 WeakPolarHBondContact O-CB 3.21Å; Y25-S29 PolarHBondContact O-N 3.35Å; Y25-S29 PolarHBondContact O-OG 3.22Å; S29-K31 PolarHBondContact O-N 3.06Å; S29-K31 VanDerWaalsContact O-N 3.08Å |
| 30 | G | 78.1 | Confident | 82.6 | Confident | 58 Ų | 58 | 97.5 Ų | 97.5 | 60% | 0.598 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.5 | 8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L27 L28 G32 | L27-G30 PolarHBondContact O-N 3.45Å; L28-G30 PolarHBondContact O-N 2.7Å; G30-G32 VanDerWaalsContact C-N 3.33Å |
| 31 | K | 79 | Confident | 82.6 | Confident | 91 Ų | 91 | 96.7 Ų | 96.7 | 40% | 0.396 | 50% | 0.501 | S | S | . | . | trans | -94.6 | 18.5 | -178.8 | -69.4 | 179.5 | -175.8 | 169.3 | 0 | 112.5 | Y26 S29 H33 R34 | Y26-K31 HydrophobicContact CD1-CB 4.16Å; Y26-K31 CarbonylContact O-C 3.41Å; Y26-K31 PolarHBondContact O-N 3.42Å; S29-K31 PolarHBondContact O-N 3.06Å; S29-K31 VanDerWaalsContact O-N 3.08Å; K31-H33 PolarHBondContact O-N 3.3Å; K31-H33 VanDerWaalsContact O-N 3.16Å; K31-R34 HydrophobicContact CB-CG 4.32Å; K31-R34 VanDerWaalsContact O-CB 3.32Å; K31-R34 WeakPolarHBondContact O-CB 3.43Å; K31-R34 PolarHBondContact O-N 3.29Å | ||
| 32 | G | 76.5 | Confident | 82.3 | Confident | 36 Ų | 36 | 96.8 Ų | 96.8 | 37% | 0.371 | 51% | 0.506 | S | S | . | . | G | 310 helix | trans | -54.9 | -33.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y26 G30 R34 F35 | Y26-G32 PolarHBondContact O-N 3Å; G30-G32 VanDerWaalsContact C-N 3.33Å; G32-R34 PolarHBondContact O-N 3.17Å; G32-R34 VanDerWaalsContact O-N 3.11Å; G32-F35 PolarHBondContact O-N 3.41Å |
| 33 | H | 76.9 | Confident | 82 | Confident | 148 Ų | 148 | 100.7 Ų | 100.7 | 69% | 0.685 | 52% | 0.517 | S | S | * | . | G | 310 helix | trans | -61 | -17.9 | 175.2 | 70.4 | -86.8 | 0 | 0 | 0 | 114.4 | K31 F35 | K31-H33 PolarHBondContact O-N 3.3Å; K31-H33 VanDerWaalsContact O-N 3.16Å; H33-F35 VanDerWaalsContact C-N 3.3Å |
| 34 | R | 78.8 | Confident | 82.2 | Confident | 163 Ų | 163 | 98.5 Ų | 98.5 | 62% | 0.615 | 50% | 0.5 | S | S | * | . | G | 310 helix | trans | -75.1 | -21.2 | 175.5 | -64.6 | -169.8 | 65.8 | -176.2 | 0.2 | 112.6 | Y26 K31 G32 D36 | Y26-R34 HydrophobicContact CE1-CB 4.28Å; K31-R34 HydrophobicContact CB-CG 4.32Å; K31-R34 VanDerWaalsContact O-CB 3.32Å; K31-R34 WeakPolarHBondContact O-CB 3.43Å; K31-R34 PolarHBondContact O-N 3.29Å; G32-R34 PolarHBondContact O-N 3.17Å; G32-R34 VanDerWaalsContact O-N 3.11Å; R34-D36 VanDerWaalsContact C-N 3.29Å; R34-D36 PolarHBondContact O-N 3.28Å |
| 35 | F | 79.2 | Confident | 82.3 | Confident | 149 Ų | 149 | 97.2 Ų | 97.2 | 65% | 0.654 | 50% | 0.499 | S | S | * | . | trans | -87.6 | 73 | 173.9 | -167.7 | -96.1 | 0 | 0 | 0 | 109.1 | G32 H33 I37 | G32-F35 PolarHBondContact O-N 3.41Å; H33-F35 VanDerWaalsContact C-N 3.3Å; F35-I37 HydrophobicContact CD1-CG1 4.34Å; F35-I37 HydrophobicContact CE1-CD1 4.03Å; F35-I37 HydrophobicContact CE1-CG1 3.87Å | ||
| 36 | D | 81.7 | Confident | 82.3 | Confident | 90 Ų | 90 | 91.3 Ų | 91.3 | 48% | 0.481 | 48% | 0.478 | S | S | . | . | trans | -100.4 | 100.4 | -179.2 | -173.4 | -0.7 | 0 | 0 | 0 | 110.9 | R34 G38 W39 L40 | R34-D36 VanDerWaalsContact C-N 3.29Å; R34-D36 PolarHBondContact O-N 3.28Å; D36-G38 PolarHBondContact O-N 3.25Å; D36-G38 VanDerWaalsContact OD1-CA 3.26Å; D36-G38 WeakPolarHBondContact OD1-CA 3.48Å; D36-G38 PolarHBondContact OD1-N 3.3Å; D36-W39 HydrophobicContact CB-CB 3.86Å; D36-W39 VanDerWaalsContact CG-N 3.34Å; D36-W39 PolarHBondContact O-N 2.89Å; D36-W39 PolarHBondContact OD1-N 3.31Å; D36-W39 VanDerWaalsContact OD1-N 3.14Å; D36-W39 PolarHBondContact OD2-N 2.74Å; D36-L40 PolarHBondContact O-N 2.81Å | ||
| 37 | I | 82.7 | Confident | 82.4 | Confident | 101 Ų | 101 | 90.6 Ų | 90.6 | 52% | 0.518 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.6 | -31.6 | 174.3 | -57.4 | 172.8 | 0 | 0 | 0 | 110.3 | F35 L40 L41 | F35-I37 HydrophobicContact CD1-CG1 4.34Å; F35-I37 HydrophobicContact CE1-CD1 4.03Å; F35-I37 HydrophobicContact CE1-CG1 3.87Å; I37-L40 WeakPolarHBondContact O-CB 3.3Å; I37-L40 PolarHBondContact O-N 3.35Å; I37-L41 HydrophobicContact CG2-CD1 4.01Å; I37-L41 HydrophobicContact CG2-CG 4.24Å; I37-L41 WeakPolarHBondContact O-CB 3.45Å; I37-L41 WeakPolarHBondContact O-CG 3.33Å; I37-L41 PolarHBondContact O-N 3.45Å |
| 38 | G | 83.8 | Confident | 82.8 | Confident | 36 Ų | 36 | 89.6 Ų | 89.6 | 37% | 0.371 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.7 | -41.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D36 L41 T42 | D36-G38 PolarHBondContact O-N 3.25Å; D36-G38 VanDerWaalsContact OD1-CA 3.26Å; D36-G38 WeakPolarHBondContact OD1-CA 3.48Å; D36-G38 PolarHBondContact OD1-N 3.3Å; G38-L41 PolarHBondContact O-N 3.32Å; G38-T42 WeakPolarHBondContact O-CB 3.42Å; G38-T42 VanDerWaalsContact O-CG2 3.29Å; G38-T42 WeakPolarHBondContact O-CG2 3.44Å; G38-T42 PolarHBondContact O-N 2.94Å; G38-T42 PolarHBondContact O-OG1 3.05Å |
| 39 | W | 84.3 | Confident | 83.2 | Confident | 153 Ų | 153 | 85.3 Ų | 85.3 | 58% | 0.58 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.7 | -45 | 172.5 | -179.6 | 88.8 | 0 | 0 | 0 | 111.7 | D36 L41 T42 K43 | D36-W39 HydrophobicContact CB-CB 3.86Å; D36-W39 VanDerWaalsContact CG-N 3.34Å; D36-W39 PolarHBondContact O-N 2.89Å; D36-W39 PolarHBondContact OD1-N 3.31Å; D36-W39 VanDerWaalsContact OD1-N 3.14Å; D36-W39 PolarHBondContact OD2-N 2.74Å; W39-L41 PolarHBondContact O-N 3.43Å; W39-T42 PolarHBondContact O-N 2.86Å; W39-T42 PolarHBondContact O-OG1 3.4Å; W39-K43 HydrophobicContact CD2-CG 4.12Å; W39-K43 HydrophobicContact CG-CG 4.13Å; W39-K43 HydrophobicContact CZ2-CG 4.33Å; W39-K43 WeakPolarHBondContact O-CB 3.45Å; W39-K43 VanDerWaalsContact O-CG 3.3Å; W39-K43 WeakPolarHBondContact O-CG 3.43Å; W39-K43 PolarHBondContact O-N 3.21Å |
| 40 | L | 86 | Confident | 83.7 | Confident | 97 Ų | 97 | 82.9 Ų | 82.9 | 51% | 0.508 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.5 | -48.9 | 177.2 | 179.7 | 69.3 | 0 | 0 | 0 | 111.3 | D36 I37 T44 | D36-L40 PolarHBondContact O-N 2.81Å; I37-L40 WeakPolarHBondContact O-CB 3.3Å; I37-L40 PolarHBondContact O-N 3.35Å; L40-T44 VanDerWaalsContact O-CB 3.3Å; L40-T44 WeakPolarHBondContact O-CB 3.38Å; L40-T44 PolarHBondContact O-N 3Å; L40-T44 VanDerWaalsContact O-N 3.11Å; L40-T44 PolarHBondContact O-OG1 3.37Å |
| 41 | L | 86.7 | Confident | 84.4 | Confident | 64 Ų | 64 | 83 Ų | 83 | 34% | 0.335 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.7 | -43.9 | -178.1 | -76.8 | 179.8 | 0 | 0 | 0 | 111.8 | I37 G38 W39 W49 Y136 | I37-L41 HydrophobicContact CG2-CD1 4.01Å; I37-L41 HydrophobicContact CG2-CG 4.24Å; I37-L41 WeakPolarHBondContact O-CB 3.45Å; I37-L41 WeakPolarHBondContact O-CG 3.33Å; I37-L41 PolarHBondContact O-N 3.45Å; G38-L41 PolarHBondContact O-N 3.32Å; W39-L41 PolarHBondContact O-N 3.43Å; L41-W49 HydrophobicContact CD2-CZ2 4.03Å; L41-Y136 WeakPolarHBondContact CA-OH 3.27Å; L41-Y136 VanDerWaalsContact CB-OH 3.24Å; L41-Y136 WeakPolarHBondContact CB-OH 3.47Å; L41-Y136 HydrophobicContact CD2-CE1 4.16Å; L41-Y136 PolarHBondContact O-OH 3.34Å |
| 42 | T | 81 | Confident | 85.2 | Confident | 85 Ų | 85 | 81.7 Ų | 81.7 | 52% | 0.521 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -78.9 | -27.4 | -176.8 | 55.4 | 0 | 0 | 0 | 0 | 114.4 | G38 W39 L132 | G38-T42 WeakPolarHBondContact O-CB 3.42Å; G38-T42 VanDerWaalsContact O-CG2 3.29Å; G38-T42 WeakPolarHBondContact O-CG2 3.44Å; G38-T42 PolarHBondContact O-N 2.94Å; G38-T42 PolarHBondContact O-OG1 3.05Å; W39-T42 PolarHBondContact O-N 2.86Å; W39-T42 PolarHBondContact O-OG1 3.4Å; T42-L132 HydrophobicContact CG2-CD2 4.3Å |
| 43 | K | 81.1 | Confident | 86.1 | Confident | 149 Ų | 149 | 80 Ų | 80 | 65% | 0.648 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -89.3 | -22.5 | 178.8 | -67.2 | -61.7 | -173.8 | -178.3 | 0 | 113.9 | W39 | W39-K43 HydrophobicContact CD2-CG 4.12Å; W39-K43 HydrophobicContact CG-CG 4.13Å; W39-K43 HydrophobicContact CZ2-CG 4.33Å; W39-K43 WeakPolarHBondContact O-CB 3.45Å; W39-K43 VanDerWaalsContact O-CG 3.3Å; W39-K43 WeakPolarHBondContact O-CG 3.43Å; W39-K43 PolarHBondContact O-N 3.21Å |
| 44 | T | 85.7 | Confident | 87 | Confident | 29 Ų | 29 | 74.4 Ų | 74.4 | 18% | 0.178 | 37% | 0.373 | C | S | . | . | S | Bend | trans | -68.8 | 134.3 | 174.2 | -58.1 | 0 | 0 | 0 | 0 | 109.7 | L40 M48 | L40-T44 VanDerWaalsContact O-CB 3.3Å; L40-T44 WeakPolarHBondContact O-CB 3.38Å; L40-T44 PolarHBondContact O-N 3Å; L40-T44 VanDerWaalsContact O-N 3.11Å; L40-T44 PolarHBondContact O-OG1 3.37Å; T44-M48 HydrophobicContact CG2-CB 4.32Å; T44-M48 HydrophobicContact CG2-CG 4.48Å; T44-M48 HydrophobicContact CG2-SD 3.57Å; T44-M48 VanDerWaalsContact CG2-SD 3.57Å |
| 45 | S | 85.8 | Confident | 87.8 | Confident | 59 Ų | 59 | 69 Ų | 69 | 41% | 0.413 | 36% | 0.363 | S | S | . | . | trans | -64 | 135.5 | -176.1 | 62.3 | 0 | 0 | 0 | 0 | 111.5 | Q47 M48 | S45-Q47 PolarHBondContact O-N 2.93Å; S45-M48 WeakPolarHBondContact O-CB 3.42Å; S45-M48 PolarHBondContact O-N 2.65Å; S45-M48 WeakPolarHBondContact OG-CB 3.19Å; S45-M48 PolarHBondContact OG-N 2.9Å | ||
| 46 | P | 86.9 | Confident | 88.6 | Confident | 15 Ų | 15 | 65.4 Ų | 65.4 | 10% | 0.097 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -58.1 | -32.5 | 176.5 | -25.2 | 33.4 | 0 | 0 | 0 | 113.3 | M48 W49 S50 N131 L132 | P46-M48 VanDerWaalsContact C-N 3.28Å; P46-M48 PolarHBondContact O-N 3.05Å; P46-W49 PolarHBondContact O-N 3.08Å; P46-S50 PolarHBondContact O-N 3.44Å; P46-S50 VanDerWaalsContact O-N 3.09Å; P46-N131 WeakPolarHBondContact CB-O 3.35Å; P46-N131 HydrophobicContact CG-CB 4.38Å; P46-L132 HydrophobicContact CG-CB 4.49Å; P46-L132 HydrophobicContact CG-CD1 4.05Å |
| 47 | Q | 88 | Confident | 89.3 | Confident | 60 Ų | 60 | 61.1 Ų | 61.1 | 28% | 0.28 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64 | -33.9 | 176.9 | -65.3 | 78.6 | 10.1 | 0 | 0 | 111.8 | S45 S50 S51 | S45-Q47 PolarHBondContact O-N 2.93Å; Q47-S50 PolarHBondContact O-N 3.11Å; Q47-S51 VanDerWaalsContact O-CB 3.32Å; Q47-S51 WeakPolarHBondContact O-CB 3.34Å; Q47-S51 PolarHBondContact O-N 3.39Å; Q47-S51 PolarHBondContact O-OG 3.23Å; Q47-S51 VanDerWaalsContact O-OG 3.07Å |
| 48 | M | 91 | Very high | 89.9 | Confident | 105 Ų | 105 | 59.4 Ų | 59.4 | 52% | 0.517 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.4 | -47.9 | 175.6 | -173.2 | -177.6 | -149.6 | 0 | 0 | 110.9 | T44 S45 P46 S50 S51 L52 | T44-M48 HydrophobicContact CG2-CB 4.32Å; T44-M48 HydrophobicContact CG2-CG 4.48Å; T44-M48 HydrophobicContact CG2-SD 3.57Å; T44-M48 VanDerWaalsContact CG2-SD 3.57Å; S45-M48 WeakPolarHBondContact O-CB 3.42Å; S45-M48 PolarHBondContact O-N 2.65Å; S45-M48 WeakPolarHBondContact OG-CB 3.19Å; S45-M48 PolarHBondContact OG-N 2.9Å; P46-M48 VanDerWaalsContact C-N 3.28Å; P46-M48 PolarHBondContact O-N 3.05Å; M48-S50 PolarHBondContact O-N 3.32Å; M48-S51 PolarHBondContact O-N 3Å; M48-L52 HydrophobicContact CG-CD1 4.15Å; M48-L52 WeakPolarHBondContact O-CB 3.38Å; M48-L52 VanDerWaalsContact O-CG 3.3Å; M48-L52 WeakPolarHBondContact O-CG 3.35Å; M48-L52 PolarHBondContact O-N 3.23Å |
| 49 | W | 92.1 | Very high | 90.6 | Very high | 53 Ų | 53 | 60.2 Ų | 60.2 | 20% | 0.201 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.4 | -45.2 | 178.2 | -71.7 | 105.9 | 0 | 0 | 0 | 112.3 | L41 P46 L52 G53 Y136 F139 | L41-W49 HydrophobicContact CD2-CZ2 4.03Å; P46-W49 PolarHBondContact O-N 3.08Å; W49-L52 PolarHBondContact O-N 3.33Å; W49-G53 PolarHBondContact O-N 3.27Å; W49-Y136 HydrophobicContact CB-CD1 4.43Å; W49-Y136 AromaticContact CD1-CE1 3.63Å; W49-Y136 HydrophobicContact CD2-CD1 4.07Å; W49-Y136 AromaticContact CD2-CE1 4Å; W49-Y136 HydrophobicContact CD2-CE1 4Å; W49-Y136 AromaticContact CE2-CE1 3.76Å; W49-Y136 AromaticContact CG-CD1 3.94Å; W49-Y136 HydrophobicContact CG-CD1 3.94Å; W49-Y136 AromaticContact CG-CE1 3.92Å; W49-Y136 HydrophobicContact CG-CE1 3.92Å; W49-Y136 HydrophobicContact CZ2-CE1 4.42Å; W49-Y136 AromaticContact NE1-CE1 3.53Å; W49-F139 HydrophobicContact CB-CB 4.21Å; W49-F139 HydrophobicContact CE3-CB 4.16Å; W49-F139 AromaticContact CE3-CD1 3.77Å; W49-F139 HydrophobicContact CE3-CD1 3.77Å; W49-F139 AromaticContact CE3-CD2 3.74Å; W49-F139 HydrophobicContact CE3-CD2 3.74Å; W49-F139 HydrophobicContact CE3-CE1 4.06Å; W49-F139 HydrophobicContact CE3-CE2 4.01Å; W49-F139 AromaticContact CE3-CG 3.6Å; W49-F139 HydrophobicContact CE3-CG 3.6Å; W49-F139 HydrophobicContact CE3-CZ 4.17Å; W49-F139 AromaticContact CZ3-CD1 3.9Å; W49-F139 HydrophobicContact CZ3-CD1 3.9Å; W49-F139 HydrophobicContact CZ3-CD2 4.24Å; W49-F139 AromaticContact CZ3-CE1 3.74Å; W49-F139 HydrophobicContact CZ3-CE1 3.74Å; W49-F139 HydrophobicContact CZ3-CE2 4.06Å; W49-F139 HydrophobicContact CZ3-CG 4.16Å; W49-F139 AromaticContact CZ3-CZ 3.82Å; W49-F139 HydrophobicContact CZ3-CZ 3.82Å; W49-F139 WeakPolarHBondContact O-CB 3.24Å; W49-F139 WeakPolarHBondContact O-CD2 3.46Å |
| 50 | S | 91.9 | Very high | 91.2 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66 | -44.9 | 179.1 | 179.4 | 0 | 0 | 0 | 0 | 112.3 | P46 Q47 M48 L52 G53 I54 Q115 M138 M204 | P46-S50 PolarHBondContact O-N 3.44Å; P46-S50 VanDerWaalsContact O-N 3.09Å; Q47-S50 PolarHBondContact O-N 3.11Å; M48-S50 PolarHBondContact O-N 3.32Å; S50-L52 PolarHBondContact O-N 3.48Å; S50-G53 WeakPolarHBondContact O-CA 3.32Å; S50-G53 PolarHBondContact O-N 2.95Å; S50-G53 VanDerWaalsContact O-N 3.08Å; S50-I54 WeakPolarHBondContact O-CG1 3.34Å; S50-I54 PolarHBondContact O-N 2.99Å; S50-Q115 VanDerWaalsContact CB-NE2 3.33Å; S50-Q115 WeakPolarHBondContact OG-CG 3.11Å; S50-Q115 PolarHBondContact OG-NE2 3.43Å; S50-M138 PolarHBondContact OG-SD 3.4Å; S50-M204 VanDerWaalsContact CB-CE 3.45Å; S50-M204 VanDerWaalsContact OG-CE 3.25Å; S50-M204 WeakPolarHBondContact OG-CE 3.36Å |
| 51 | S | 93.5 | Very high | 91.7 | Very high | 59 Ų | 59 | 50 Ų | 50 | 41% | 0.413 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66 | -35.9 | 177.9 | -64.3 | 0 | 0 | 0 | 0 | 112.8 | Q47 M48 G53 I54 A55 Q115 | Q47-S51 VanDerWaalsContact O-CB 3.32Å; Q47-S51 WeakPolarHBondContact O-CB 3.34Å; Q47-S51 PolarHBondContact O-N 3.39Å; Q47-S51 PolarHBondContact O-OG 3.23Å; Q47-S51 VanDerWaalsContact O-OG 3.07Å; M48-S51 PolarHBondContact O-N 3Å; S51-G53 VanDerWaalsContact C-N 3.33Å; S51-I54 PolarHBondContact O-N 3.42Å; S51-A55 WeakPolarHBondContact O-CB 3.47Å; S51-A55 PolarHBondContact O-N 2.95Å; S51-Q115 PolarHBondContact OG-NE2 3.19Å |
| 52 | L | 95.5 | Very high | 92.2 | Very high | 64 Ų | 64 | 50.4 Ų | 50.4 | 34% | 0.335 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.6 | -39.1 | 170.1 | -75.4 | 172.7 | 0 | 0 | 0 | 111.6 | M48 W49 S50 A55 F56 F139 | M48-L52 HydrophobicContact CG-CD1 4.15Å; M48-L52 WeakPolarHBondContact O-CB 3.38Å; M48-L52 VanDerWaalsContact O-CG 3.3Å; M48-L52 WeakPolarHBondContact O-CG 3.35Å; M48-L52 PolarHBondContact O-N 3.23Å; W49-L52 PolarHBondContact O-N 3.33Å; S50-L52 PolarHBondContact O-N 3.48Å; L52-A55 PolarHBondContact O-N 3.16Å; L52-F56 HydrophobicContact CB-CD2 4.41Å; L52-F56 HydrophobicContact CB-CE2 4.27Å; L52-F56 HydrophobicContact CD2-CE2 4.44Å; L52-F56 WeakPolarHBondContact O-CB 3.29Å; L52-F56 WeakPolarHBondContact O-CD2 3.31Å; L52-F56 WeakPolarHBondContact O-CG 3.47Å; L52-F56 PolarHBondContact O-N 3.05Å; L52-F139 HydrophobicContact CB-CD2 4.01Å; L52-F139 HydrophobicContact CB-CE2 4.07Å |
| 53 | G | 94.9 | Very high | 93 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58 | -48.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | W49 S50 S51 F56 A57 G142 | W49-G53 PolarHBondContact O-N 3.27Å; S50-G53 WeakPolarHBondContact O-CA 3.32Å; S50-G53 PolarHBondContact O-N 2.95Å; S50-G53 VanDerWaalsContact O-N 3.08Å; S51-G53 VanDerWaalsContact C-N 3.33Å; G53-F56 PolarHBondContact O-N 3.47Å; G53-A57 WeakPolarHBondContact O-CB 3.47Å; G53-A57 PolarHBondContact O-N 3.5Å; G53-G142 WeakPolarHBondContact O-CA 3.32Å |
| 54 | I | 95.5 | Very high | 93.7 | Very high | 32 Ų | 32 | 42.7 Ų | 42.7 | 16% | 0.164 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.5 | -47.1 | 176.3 | -63.4 | 168.9 | 0 | 0 | 0 | 110.5 | S50 S51 F56 A57 I58 A108 I111 Q115 | S50-I54 WeakPolarHBondContact O-CG1 3.34Å; S50-I54 PolarHBondContact O-N 2.99Å; S51-I54 PolarHBondContact O-N 3.42Å; I54-F56 PolarHBondContact O-N 2.88Å; I54-A57 PolarHBondContact O-N 3.2Å; I54-I58 PolarHBondContact O-N 3.07Å; I54-A108 HydrophobicContact CG2-CB 4.02Å; I54-I111 HydrophobicContact CD1-CG2 4.14Å; I54-I111 HydrophobicContact CG1-CB 3.98Å; I54-I111 HydrophobicContact CG1-CG2 3.5Å; I54-I111 VanDerWaalsContact CG1-CG2 3.5Å; I54-Q115 VanDerWaalsContact CD1-CD 3.4Å; I54-Q115 HydrophobicContact CD1-CG 4.09Å |
| 55 | A | 96.5 | Very high | 94.2 | Very high | 50 Ų | 50 | 41.5 Ų | 41.5 | 41% | 0.413 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.3 | -45.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S51 L52 S59 | S51-A55 WeakPolarHBondContact O-CB 3.47Å; S51-A55 PolarHBondContact O-N 2.95Å; L52-A55 PolarHBondContact O-N 3.16Å; A55-S59 VanDerWaalsContact O-CB 3.22Å; A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.19Å; A55-S59 PolarHBondContact O-OG 3.25Å |
| 56 | F | 95.8 | Very high | 94.8 | Very high | 72 Ų | 72 | 41.4 Ų | 41.4 | 32% | 0.316 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.6 | -36.1 | 178 | -72.6 | -44.2 | 0 | 0 | 0 | 112.8 | L52 G53 I54 I58 L60 F139 L143 | L52-F56 HydrophobicContact CB-CD2 4.41Å; L52-F56 HydrophobicContact CB-CE2 4.27Å; L52-F56 HydrophobicContact CD2-CE2 4.44Å; L52-F56 WeakPolarHBondContact O-CB 3.29Å; L52-F56 WeakPolarHBondContact O-CD2 3.31Å; L52-F56 WeakPolarHBondContact O-CG 3.47Å; L52-F56 PolarHBondContact O-N 3.05Å; G53-F56 PolarHBondContact O-N 3.47Å; I54-F56 PolarHBondContact O-N 2.88Å; F56-I58 PolarHBondContact O-N 3.43Å; F56-L60 HydrophobicContact CB-CD1 4.06Å; F56-L60 HydrophobicContact CB-CG 4.49Å; F56-L60 HydrophobicContact CD1-CD1 4.23Å; F56-L60 HydrophobicContact CD1-CG 4.36Å; F56-L60 HydrophobicContact CG-CD1 4.43Å; F56-L60 VanDerWaalsContact O-CB 3.26Å; F56-L60 WeakPolarHBondContact O-CB 3.4Å; F56-L60 WeakPolarHBondContact O-CG 3.39Å; F56-L60 PolarHBondContact O-N 3.18Å; F56-L60 VanDerWaalsContact O-N 3.14Å; F56-F139 AromaticContact CD2-CE2 3.83Å; F56-F139 HydrophobicContact CD2-CE2 3.83Å; F56-F139 AromaticContact CE2-CE2 3.77Å; F56-F139 HydrophobicContact CE2-CE2 3.77Å; F56-F139 HydrophobicContact CE2-CZ 4.36Å; F56-L143 HydrophobicContact CD2-CD1 4.44Å |
| 57 | A | 96.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -58.7 | -48.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G53 I54 S61 A108 G142 | G53-A57 WeakPolarHBondContact O-CB 3.47Å; G53-A57 PolarHBondContact O-N 3.5Å; I54-A57 PolarHBondContact O-N 3.2Å; A57-S61 VanDerWaalsContact O-CB 3.27Å; A57-S61 WeakPolarHBondContact O-CB 3.38Å; A57-S61 PolarHBondContact O-OG 2.84Å; A57-A108 HydrophobicContact CB-CB 4.45Å; A57-G142 WeakPolarHBondContact CA-O 3.38Å |
| 58 | I | 96.7 | Very high | 95.7 | Very high | 65 Ų | 65 | 44.8 Ų | 44.8 | 33% | 0.333 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -75.1 | -55.4 | 179.2 | -54.8 | -177.7 | 0 | 0 | 0 | 110.7 | I54 F56 L60 S61 V62 A108 | I54-I58 PolarHBondContact O-N 3.07Å; F56-I58 PolarHBondContact O-N 3.43Å; I58-L60 PolarHBondContact O-N 3.48Å; I58-S61 PolarHBondContact O-N 3.02Å; I58-V62 HydrophobicContact CG2-CG2 4Å; I58-V62 WeakPolarHBondContact O-CG2 3.42Å; I58-V62 PolarHBondContact O-N 3.35Å; I58-A108 HydrophobicContact CD1-CB 3.39Å; I58-A108 HydrophobicContact CG1-CB 3.12Å |
| 59 | S | 97.4 | Very high | 95.9 | Very high | 53 Ų | 53 | 42.7 Ų | 42.7 | 37% | 0.371 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.4 | -47.2 | -168.8 | 58.8 | 0 | 0 | 0 | 0 | 112.3 | A55 S61 V62 V63 | A55-S59 VanDerWaalsContact O-CB 3.22Å; A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.19Å; A55-S59 PolarHBondContact O-OG 3.25Å; S59-S61 VanDerWaalsContact C-N 3.35Å; S59-S61 PolarHBondContact O-N 3.43Å; S59-V62 PolarHBondContact O-N 2.87Å; S59-V63 WeakPolarHBondContact O-CB 3.48Å; S59-V63 VanDerWaalsContact O-CG2 3.24Å; S59-V63 WeakPolarHBondContact O-CG2 3.43Å; S59-V63 PolarHBondContact O-N 3.47Å |
| 60 | L | 97.1 | Very high | 96.2 | Very high | 36 Ų | 36 | 46.6 Ų | 46.6 | 19% | 0.188 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.7 | -36.2 | -179.9 | -60.9 | 176.9 | 0 | 0 | 0 | 111.8 | F56 I58 V63 G64 L143 G146 L147 | F56-L60 HydrophobicContact CB-CD1 4.06Å; F56-L60 HydrophobicContact CB-CG 4.49Å; F56-L60 HydrophobicContact CD1-CD1 4.23Å; F56-L60 HydrophobicContact CD1-CG 4.36Å; F56-L60 HydrophobicContact CG-CD1 4.43Å; F56-L60 VanDerWaalsContact O-CB 3.26Å; F56-L60 WeakPolarHBondContact O-CB 3.4Å; F56-L60 WeakPolarHBondContact O-CG 3.39Å; F56-L60 PolarHBondContact O-N 3.18Å; F56-L60 VanDerWaalsContact O-N 3.14Å; I58-L60 PolarHBondContact O-N 3.48Å; L60-V63 PolarHBondContact O-N 2.95Å; L60-G64 PolarHBondContact O-N 3.32Å; L60-L143 HydrophobicContact CD1-CD1 4.29Å; L60-G146 WeakPolarHBondContact CB-O 3.31Å; L60-L147 HydrophobicContact CD1-CD2 4.01Å; L60-L147 HydrophobicContact CD1-CG 4.14Å |
| 61 | S | 97 | Very high | 96.3 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.7 | -43.6 | 175.7 | -58.3 | 0 | 0 | 0 | 0 | 111.8 | A57 I58 S59 G64 A65 G104 N149 | A57-S61 VanDerWaalsContact O-CB 3.27Å; A57-S61 WeakPolarHBondContact O-CB 3.38Å; A57-S61 PolarHBondContact O-OG 2.84Å; I58-S61 PolarHBondContact O-N 3.02Å; S59-S61 VanDerWaalsContact C-N 3.35Å; S59-S61 PolarHBondContact O-N 3.43Å; S61-G64 PolarHBondContact O-N 3.19Å; S61-A65 PolarHBondContact O-N 3.49Å; S61-G104 WeakPolarHBondContact OG-CA 3.24Å; S61-N149 VanDerWaalsContact OG-CB 3.31Å; S61-N149 WeakPolarHBondContact OG-CB 3.43Å; S61-N149 PolarHBondContact OG-ND2 2.9Å |
| 62 | V | 97.3 | Very high | 96.4 | Very high | 72 Ų | 72 | 45.8 Ų | 45.8 | 44% | 0.436 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -67.3 | -39.3 | 177.9 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | I58 S59 G64 A65 A66 A101 | I58-V62 HydrophobicContact CG2-CG2 4Å; I58-V62 WeakPolarHBondContact O-CG2 3.42Å; I58-V62 PolarHBondContact O-N 3.35Å; S59-V62 PolarHBondContact O-N 2.87Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.98Å; V62-A65 PolarHBondContact O-N 3.06Å; V62-A66 WeakPolarHBondContact O-CB 3.37Å; V62-A66 PolarHBondContact O-N 3.48Å; V62-A101 HydrophobicContact CG2-CB 4.36Å |
| 63 | V | 97.7 | Very high | 96.3 | Very high | 73 Ų | 73 | 43.6 Ų | 43.6 | 44% | 0.442 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.8 | -43.4 | 173.4 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | S59 L60 A66 W67 L150 | S59-V63 WeakPolarHBondContact O-CB 3.48Å; S59-V63 VanDerWaalsContact O-CG2 3.24Å; S59-V63 WeakPolarHBondContact O-CG2 3.43Å; S59-V63 PolarHBondContact O-N 3.47Å; L60-V63 PolarHBondContact O-N 2.95Å; V63-A66 PolarHBondContact O-N 3.49Å; V63-W67 WeakPolarHBondContact O-CB 3.2Å; V63-W67 PolarHBondContact O-N 3.34Å; V63-L150 HydrophobicContact CB-CD1 4.23Å; V63-L150 HydrophobicContact CG1-CD1 3.81Å |
| 64 | G | 96.1 | Very high | 96.4 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.6 | -46.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L60 S61 V62 W67 G68 | L60-G64 PolarHBondContact O-N 3.32Å; S61-G64 PolarHBondContact O-N 3.19Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.98Å; G64-W67 PolarHBondContact O-N 3.09Å; G64-G68 PolarHBondContact O-N 3.48Å |
| 65 | A | 96.4 | Very high | 96.3 | Very high | 4 Ų | 4 | 46.1 Ų | 46.1 | 3% | 0.033 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.5 | -48.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S61 V62 W67 G68 I69 C97 A101 | S61-A65 PolarHBondContact O-N 3.49Å; V62-A65 PolarHBondContact O-N 3.06Å; A65-W67 VanDerWaalsContact C-N 3.33Å; A65-W67 PolarHBondContact O-N 3.38Å; A65-G68 PolarHBondContact O-N 3.1Å; A65-I69 WeakPolarHBondContact O-CB 3.24Å; A65-I69 WeakPolarHBondContact O-CG1 3.31Å; A65-I69 PolarHBondContact O-N 2.76Å; A65-C97 WeakPolarHBondContact CB-O 3.37Å; A65-A101 HydrophobicContact CB-CB 3.82Å |
| 66 | A | 97.4 | Very high | 96.2 | Very high | 56 Ų | 56 | 44.3 Ų | 44.3 | 46% | 0.463 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.6 | -42.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V62 V63 I69 F70 | V62-A66 WeakPolarHBondContact O-CB 3.37Å; V62-A66 PolarHBondContact O-N 3.48Å; V63-A66 PolarHBondContact O-N 3.49Å; A66-I69 PolarHBondContact O-N 3.39Å; A66-F70 WeakPolarHBondContact O-CB 3.2Å; A66-F70 PolarHBondContact O-N 3.39Å |
| 67 | W | 97.1 | Very high | 96.1 | Very high | 146 Ų | 146 | 46 Ų | 46 | 55% | 0.553 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -63.5 | -44.7 | 176.2 | -161.7 | -66.4 | 0 | 0 | 0 | 111.4 | V63 G64 A65 F70 L71 V154 | V63-W67 WeakPolarHBondContact O-CB 3.2Å; V63-W67 PolarHBondContact O-N 3.34Å; G64-W67 PolarHBondContact O-N 3.09Å; A65-W67 VanDerWaalsContact C-N 3.33Å; A65-W67 PolarHBondContact O-N 3.38Å; W67-F70 PolarHBondContact O-N 2.84Å; W67-L71 WeakPolarHBondContact O-CG 3.47Å; W67-L71 PolarHBondContact O-N 3.35Å; W67-L71 VanDerWaalsContact O-N 3.1Å; W67-V154 HydrophobicContact CB-CG2 4.23Å; W67-V154 HydrophobicContact CG-CG2 4.03Å |
| 68 | G | 96 | Very high | 96 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.7 | -43.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G64 A65 F70 L71 T72 G153 | G64-G68 PolarHBondContact O-N 3.48Å; A65-G68 PolarHBondContact O-N 3.1Å; G68-F70 PolarHBondContact O-N 3.06Å; G68-L71 PolarHBondContact O-N 2.9Å; G68-T72 PolarHBondContact O-N 3.46Å; G68-T72 PolarHBondContact O-OG1 3.14Å; G68-G153 WeakPolarHBondContact CA-O 3.39Å |
| 69 | I | 96.8 | Very high | 95.7 | Very high | 62 Ų | 62 | 45.6 Ų | 45.6 | 32% | 0.318 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 176.1 | -67.4 | 167 | 0 | 0 | 0 | 110.6 | A65 A66 G73 I94 C97 | A65-I69 WeakPolarHBondContact O-CB 3.24Å; A65-I69 WeakPolarHBondContact O-CG1 3.31Å; A65-I69 PolarHBondContact O-N 2.76Å; A66-I69 PolarHBondContact O-N 3.39Å; I69-G73 WeakPolarHBondContact O-CA 3.17Å; I69-G73 PolarHBondContact O-N 2.98Å; I69-I94 HydrophobicContact CG1-CG2 4.23Å; I69-I94 HydrophobicContact CG2-CG2 4.49Å; I69-C97 HydrophobicContact CG1-CB 3.83Å |
| 70 | F | 96.7 | Very high | 95.5 | Very high | 134 Ų | 134 | 43.5 Ų | 43.5 | 59% | 0.588 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -62.3 | -46.2 | 177.8 | 172.3 | -105.5 | 0 | 0 | 0 | 112.3 | A66 W67 G68 T74 | A66-F70 WeakPolarHBondContact O-CB 3.2Å; A66-F70 PolarHBondContact O-N 3.39Å; W67-F70 PolarHBondContact O-N 2.84Å; G68-F70 PolarHBondContact O-N 3.06Å; F70-T74 HydrophobicContact CD2-CG2 3.92Å; F70-T74 HydrophobicContact CE2-CG2 3.58Å; F70-T74 HydrophobicContact CZ-CG2 4Å; F70-T74 WeakPolarHBondContact O-CB 3.39Å; F70-T74 VanDerWaalsContact O-CG2 3.29Å; F70-T74 WeakPolarHBondContact O-CG2 3.48Å; F70-T74 PolarHBondContact O-N 3.16Å; F70-T74 VanDerWaalsContact O-N 3.09Å; F70-T74 PolarHBondContact O-OG1 2.96Å |
| 71 | L | 95.8 | Very high | 95.3 | Very high | 43 Ų | 43 | 48.7 Ų | 48.7 | 23% | 0.225 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.2 | -46.5 | 179.3 | -69.4 | 176.2 | 0 | 0 | 0 | 112.5 | W67 G68 T74 S75 I158 | W67-L71 WeakPolarHBondContact O-CG 3.47Å; W67-L71 PolarHBondContact O-N 3.35Å; W67-L71 VanDerWaalsContact O-N 3.1Å; G68-L71 PolarHBondContact O-N 2.9Å; L71-T74 PolarHBondContact O-OG1 3.15Å; L71-T74 VanDerWaalsContact O-OG1 3.08Å; L71-S75 PolarHBondContact O-OG 3.25Å; L71-I158 HydrophobicContact CD1-CG1 3.78Å |
| 72 | T | 94.2 | Very high | 95 | Very high | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -73.5 | -43.1 | 179.5 | -64 | 0 | 0 | 0 | 0 | 111.5 | G68 T74 S75 I76 I94 G157 | G68-T72 PolarHBondContact O-N 3.46Å; G68-T72 PolarHBondContact O-OG1 3.14Å; T72-T74 PolarHBondContact O-N 3.5Å; T72-S75 WeakPolarHBondContact O-CB 3.37Å; T72-S75 PolarHBondContact O-N 3.43Å; T72-S75 VanDerWaalsContact O-N 3.11Å; T72-I76 HydrophobicContact CG2-CD1 3.68Å; T72-I76 HydrophobicContact CG2-CG1 4.17Å; T72-I76 WeakPolarHBondContact O-CG1 3.31Å; T72-I76 PolarHBondContact O-N 3.45Å; T72-I94 HydrophobicContact CG2-CG1 4.27Å; T72-G157 WeakPolarHBondContact OG1-CA 3.17Å; T72-G157 PolarHBondContact OG1-O 3.03Å |
| 73 | G | 94.8 | Very high | 94.7 | Very high | 18 Ų | 18 | 55.3 Ų | 55.3 | 19% | 0.186 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.1 | -43.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | I69 S75 I76 V77 | I69-G73 WeakPolarHBondContact O-CA 3.17Å; I69-G73 PolarHBondContact O-N 2.98Å; G73-S75 PolarHBondContact O-N 3.28Å; G73-I76 PolarHBondContact O-N 3.1Å; G73-V77 WeakPolarHBondContact O-CG2 3.33Å; G73-V77 PolarHBondContact O-N 2.93Å |
| 74 | T | 95.5 | Very high | 94.4 | Very high | 70 Ų | 70 | 55.3 Ų | 55.3 | 43% | 0.429 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.7 | -36 | 174.2 | 50.3 | 0 | 0 | 0 | 0 | 112 | F70 L71 T72 G78 | F70-T74 HydrophobicContact CD2-CG2 3.92Å; F70-T74 HydrophobicContact CE2-CG2 3.58Å; F70-T74 HydrophobicContact CZ-CG2 4Å; F70-T74 WeakPolarHBondContact O-CB 3.39Å; F70-T74 VanDerWaalsContact O-CG2 3.29Å; F70-T74 WeakPolarHBondContact O-CG2 3.48Å; F70-T74 PolarHBondContact O-N 3.16Å; F70-T74 VanDerWaalsContact O-N 3.09Å; F70-T74 PolarHBondContact O-OG1 2.96Å; L71-T74 PolarHBondContact O-OG1 3.15Å; L71-T74 VanDerWaalsContact O-OG1 3.08Å; T72-T74 PolarHBondContact O-N 3.5Å; T74-G78 PolarHBondContact O-N 3.18Å |
| 75 | S | 93.9 | Very high | 94.1 | Very high | 15 Ų | 15 | 62.1 Ų | 62.1 | 11% | 0.105 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -75 | -39.3 | 179.3 | -54.2 | 0 | 0 | 0 | 0 | 112.8 | L71 T72 G73 G78 G79 S161 | L71-S75 PolarHBondContact O-OG 3.25Å; T72-S75 WeakPolarHBondContact O-CB 3.37Å; T72-S75 PolarHBondContact O-N 3.43Å; T72-S75 VanDerWaalsContact O-N 3.11Å; G73-S75 PolarHBondContact O-N 3.28Å; S75-G78 PolarHBondContact O-N 2.91Å; S75-G79 PolarHBondContact O-N 2.95Å; S75-S161 WeakPolarHBondContact OG-CB 3.26Å; S75-S161 PolarHBondContact OG-OG 3.08Å |
| 76 | I | 94.3 | Very high | 93.8 | Very high | 12 Ų | 12 | 61.9 Ų | 61.9 | 6% | 0.062 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -63.7 | -43.4 | 174 | -68.7 | 172.4 | 0 | 0 | 0 | 110.4 | T72 G73 G80 R87 N90 I94 A164 | T72-I76 HydrophobicContact CG2-CD1 3.68Å; T72-I76 HydrophobicContact CG2-CG1 4.17Å; T72-I76 WeakPolarHBondContact O-CG1 3.31Å; T72-I76 PolarHBondContact O-N 3.45Å; G73-I76 PolarHBondContact O-N 3.1Å; I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 2.98Å; I76-R87 HydrophobicContact CG2-CG 4.43Å; I76-N90 HydrophobicContact CD1-CB 3.81Å; I76-N90 WeakPolarHBondContact CD1-O 3.24Å; I76-N90 HydrophobicContact CG1-CB 3.98Å; I76-I94 HydrophobicContact CD1-CD1 4.04Å; I76-I94 HydrophobicContact CD1-CG1 4.22Å; I76-A164 HydrophobicContact CG1-CB 3.81Å |
| 77 | V | 94.5 | Very high | 93.3 | Very high | 106 Ų | 106 | 66.4 Ų | 66.4 | 64% | 0.642 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -66 | -45.5 | 177.1 | 175.3 | 0 | 0 | 0 | 0 | 110.5 | G73 G80 | G73-V77 WeakPolarHBondContact O-CG2 3.33Å; G73-V77 PolarHBondContact O-N 2.93Å; V77-G80 PolarHBondContact O-N 3.44Å |
| 78 | G | 93.9 | Very high | 93 | Very high | 46 Ų | 46 | 64.8 Ų | 64.8 | 47% | 0.474 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.6 | -48.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | T74 S75 G80 | T74-G78 PolarHBondContact O-N 3.18Å; S75-G78 PolarHBondContact O-N 2.91Å; G78-G80 VanDerWaalsContact C-N 3.32Å |
| 79 | G | 90.8 | Very high | 92.7 | Very high | 11 Ų | 11 | 68 Ų | 68 | 11% | 0.113 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -70.9 | -27.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.4 | S75 I81 K82 A83 | S75-G79 PolarHBondContact O-N 2.95Å; G79-I81 VanDerWaalsContact C-N 3.25Å; G79-I81 PolarHBondContact O-N 3.22Å; G79-K82 PolarHBondContact O-N 3.4Å; G79-A83 PolarHBondContact O-N 2.89Å; G79-A83 VanDerWaalsContact O-N 3.16Å |
| 80 | G | 91.8 | Very high | 92.4 | Very high | 9 Ų | 9 | 65.1 Ų | 65.1 | 9% | 0.093 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -70.7 | -16.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | I76 V77 G78 A83 P84 | I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 2.98Å; V77-G80 PolarHBondContact O-N 3.44Å; G78-G80 VanDerWaalsContact C-N 3.32Å; G80-A83 CarbonylContact O-C 3.56Å; G80-P84 WeakPolarHBondContact O-CA 3.4Å |
| 81 | I | 93.7 | Very high | 92.3 | Very high | 146 Ų | 146 | 62.6 Ų | 62.6 | 75% | 0.749 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -47.4 | 176.5 | -62.6 | 169.9 | 0 | 0 | 0 | 110.5 | G79 | G79-I81 VanDerWaalsContact C-N 3.25Å; G79-I81 PolarHBondContact O-N 3.22Å |
| 82 | K | 90.3 | Very high | 92.1 | Very high | 201 Ų | 201 | 63.1 Ų | 63.1 | 87% | 0.874 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -32.9 | -180 | -171 | 173.5 | -179.1 | 178.2 | 0 | 112.5 | G79 | G79-K82 PolarHBondContact O-N 3.4Š|
| 83 | A | 91 | Very high | 92 | Very high | 9 Ų | 9 | 63.1 Ų | 63.1 | 7% | 0.074 | 34% | 0.339 | C | S | . | . | trans | -127.5 | 80.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | G79 G80 R85 I86 A168 | G79-A83 PolarHBondContact O-N 2.89Å; G79-A83 VanDerWaalsContact O-N 3.16Å; G80-A83 CarbonylContact O-C 3.56Å; A83-R85 PolarHBondContact O-N 3.48Å; A83-I86 HydrophobicContact CB-CG2 4.21Å; A83-I86 WeakPolarHBondContact O-CG1 3.45Å; A83-I86 PolarHBondContact O-N 2.95Å; A83-A168 HydrophobicContact CB-CB 4.32Å | ||
| 84 | P | 91.4 | Very high | 92.1 | Very high | 73 Ų | 73 | 64.1 Ų | 64.1 | 47% | 0.474 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -13.6 | -173.1 | 25.7 | -35.5 | 0 | 0 | 0 | 114.7 | G80 I86 R87 | G80-P84 WeakPolarHBondContact O-CA 3.4Å; P84-I86 PolarHBondContact O-N 3.45Å; P84-R87 PolarHBondContact O-N 2.99Å; P84-R87 PolarHBondContact O-NE 3.37Å |
| 85 | R | 89.9 | Confident | 92 | Very high | 143 Ų | 143 | 65.6 Ų | 65.6 | 54% | 0.54 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -24.3 | 175.8 | 65.6 | -179.9 | 178.4 | -123.8 | -4.4 | 114 | A83 R87 | A83-R85 PolarHBondContact O-N 3.48Å; R85-R87 PolarHBondContact O-N 2.9Å |
| 86 | I | 89.9 | Confident | 92.1 | Very high | 0 Ų | 0 | 67.3 Ų | 67.3 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -72.1 | -20.6 | -177.8 | 76 | 178.8 | 0 | 0 | 0 | 112.2 | A83 P84 T88 N90 D167 A168 | A83-I86 HydrophobicContact CB-CG2 4.21Å; A83-I86 WeakPolarHBondContact O-CG1 3.45Å; A83-I86 PolarHBondContact O-N 2.95Å; P84-I86 PolarHBondContact O-N 3.45Å; I86-T88 VanDerWaalsContact C-N 3.32Å; I86-T88 PolarHBondContact O-N 2.94Å; I86-N90 WeakPolarHBondContact O-CB 3.34Å; I86-N90 PolarHBondContact O-N 3.47Å; I86-N90 PolarHBondContact O-OD1 3.36Å; I86-D167 HydrophobicContact CG2-CB 4.35Å; I86-D167 WeakPolarHBondContact CG2-OD2 3.5Å; I86-A168 HydrophobicContact CD1-CB 4.24Å; I86-A168 HydrophobicContact CG2-CB 4.24Å |
| 87 | R | 87.4 | Confident | 92.1 | Very high | 151 Ų | 151 | 66.8 Ų | 66.8 | 57% | 0.57 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -64 | -31.3 | -172.3 | -69 | -173.1 | -66 | 175.6 | -0.5 | 114.2 | I76 P84 R85 L91 | I76-R87 HydrophobicContact CG2-CG 4.43Å; P84-R87 PolarHBondContact O-N 2.99Å; P84-R87 PolarHBondContact O-NE 3.37Å; R85-R87 PolarHBondContact O-N 2.9Å; R87-L91 WeakPolarHBondContact O-CG 3.5Å |
| 88 | T | 91.1 | Very high | 92.1 | Very high | 111 Ų | 111 | 66.7 Ų | 66.7 | 68% | 0.681 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -93.7 | -39.7 | 179.9 | 48.5 | 0 | 0 | 0 | 0 | 111.5 | I86 | I86-T88 VanDerWaalsContact C-N 3.32Å; I86-T88 PolarHBondContact O-N 2.94Å |
| 89 | K | 89.2 | Confident | 92.2 | Very high | 69 Ų | 69 | 65.5 Ų | 65.5 | 30% | 0.3 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -68 | -42.2 | -177.1 | -165.1 | -176.7 | -177.5 | -168.8 | 0 | 112.4 | L91 D167 A171 F174 | K89-L91 VanDerWaalsContact C-N 3.29Å; K89-L91 PolarHBondContact O-N 2.87Å; K89-D167 IonicContact NZ-OD1 2.77Å; K89-D167 PolarHBondContact NZ-OD1 3.5Å; K89-A171 PolarHBondContact NZ-O 3.49Å; K89-F174 HydrophobicContact CD-CB 4.36Å; K89-F174 HydrophobicContact CD-CD1 4.03Å; K89-F174 HydrophobicContact CD-CE1 4.47Å; K89-F174 HydrophobicContact CD-CG 4.08Å; K89-F174 HydrophobicContact CG-CD1 3.94Å; K89-F174 HydrophobicContact CG-CE1 3.87Å; K89-F174 HydrophobicContact CG-CG 4.26Å; K89-F174 HydrophobicContact CG-CZ 4.17Å; K89-F174 VanDerWaalsContact O-CZ 3.27Å; K89-F174 WeakPolarHBondContact O-CZ 3.44Å |
| 90 | N | 90.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.5 | 4.8 | -177 | -67 | 72.8 | 0 | 0 | 0 | 114.1 | I76 I86 V92 S93 A164 F174 | I76-N90 HydrophobicContact CD1-CB 3.81Å; I76-N90 WeakPolarHBondContact CD1-O 3.24Å; I76-N90 HydrophobicContact CG1-CB 3.98Å; I86-N90 WeakPolarHBondContact O-CB 3.34Å; I86-N90 PolarHBondContact O-N 3.47Å; I86-N90 PolarHBondContact O-OD1 3.36Å; N90-V92 PolarHBondContact O-N 3.48Å; N90-S93 PolarHBondContact O-N 3.49Å; N90-A164 WeakPolarHBondContact ND2-CA 3.31Å; N90-A164 PolarHBondContact ND2-N 2.94Å; N90-F174 HydrophobicContact CB-CE2 4.39Å; N90-F174 WeakPolarHBondContact ND2-CD2 3.44Å; N90-F174 WeakPolarHBondContact ND2-CE2 3.49Å |
| 91 | L | 93.1 | Very high | 92.6 | Very high | 81 Ų | 81 | 65.7 Ų | 65.7 | 42% | 0.424 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.6 | -24.1 | 172 | -69 | 175.9 | 0 | 0 | 0 | 112.4 | R87 K89 S93 I94 I95 | R87-L91 WeakPolarHBondContact O-CG 3.5Å; K89-L91 VanDerWaalsContact C-N 3.29Å; K89-L91 PolarHBondContact O-N 2.87Å; L91-S93 PolarHBondContact O-N 3.37Å; L91-I94 HydrophobicContact CD2-CD1 4.05Å; L91-I94 WeakPolarHBondContact O-CB 3.48Å; L91-I94 PolarHBondContact O-N 3.42Å; L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 3.25Å |
| 92 | V | 92.9 | Very high | 92.7 | Very high | 55 Ų | 55 | 62.8 Ų | 62.8 | 33% | 0.333 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.5 | -39.4 | 176.5 | -178.6 | 0 | 0 | 0 | 0 | 111.4 | N90 I94 I95 F96 L178 | N90-V92 PolarHBondContact O-N 3.48Å; V92-I94 VanDerWaalsContact C-N 3.32Å; V92-I94 PolarHBondContact O-N 3Å; V92-I95 WeakPolarHBondContact O-CB 3.38Å; V92-I95 PolarHBondContact O-N 3Å; V92-I95 VanDerWaalsContact O-N 3.17Å; V92-F96 HydrophobicContact CG1-CD2 4.06Å; V92-F96 HydrophobicContact CG1-CE2 3.57Å; V92-F96 HydrophobicContact CG1-CZ 4.02Å; V92-F96 WeakPolarHBondContact O-CD2 3.27Å; V92-F96 PolarHBondContact O-N 3.07Å; V92-L178 HydrophobicContact CG1-CD1 4Å |
| 93 | S | 92.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -65 | -35 | 177.7 | -48.2 | 0 | 0 | 0 | 0 | 112.3 | N90 L91 F96 C97 E181 | N90-S93 PolarHBondContact O-N 3.49Å; L91-S93 PolarHBondContact O-N 3.37Å; S93-F96 PolarHBondContact O-N 3.22Å; S93-C97 PolarHBondContact O-N 3.14Å; S93-C97 PolarHBondContact O-SG 3.43Å; S93-E181 VanDerWaalsContact OG-CD 3.28Å; S93-E181 PolarHBondContact OG-OE1 3.5Å; S93-E181 PolarHBondContact OG-OE2 2.89Å; S93-E181 VanDerWaalsContact OG-OE2 3.06Å |
| 94 | I | 95.3 | Very high | 93.1 | Very high | 39 Ų | 39 | 55.3 Ų | 55.3 | 20% | 0.2 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.8 | -42.4 | 173.8 | -62.8 | -178.1 | 0 | 0 | 0 | 110.2 | I69 T72 I76 L91 V92 F96 C97 E98 | I69-I94 HydrophobicContact CG1-CG2 4.23Å; I69-I94 HydrophobicContact CG2-CG2 4.49Å; T72-I94 HydrophobicContact CG2-CG1 4.27Å; I76-I94 HydrophobicContact CD1-CD1 4.04Å; I76-I94 HydrophobicContact CD1-CG1 4.22Å; L91-I94 HydrophobicContact CD2-CD1 4.05Å; L91-I94 WeakPolarHBondContact O-CB 3.48Å; L91-I94 PolarHBondContact O-N 3.42Å; V92-I94 VanDerWaalsContact C-N 3.32Å; V92-I94 PolarHBondContact O-N 3Å; I94-F96 VanDerWaalsContact C-N 3.32Å; I94-F96 PolarHBondContact O-N 2.96Å; I94-C97 WeakPolarHBondContact O-CB 3.26Å; I94-C97 PolarHBondContact O-N 2.93Å; I94-C97 VanDerWaalsContact O-N 3.16Å; I94-E98 PolarHBondContact O-N 3.35Å |
| 95 | I | 95.4 | Very high | 93.3 | Very high | 100 Ų | 100 | 56 Ų | 56 | 51% | 0.513 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.3 | -39.2 | 178.6 | -64 | 167.5 | 0 | 0 | 0 | 110.9 | L91 V92 E98 A99 | L91-I95 WeakPolarHBondContact O-CG1 3.34Å; L91-I95 PolarHBondContact O-N 3.25Å; V92-I95 WeakPolarHBondContact O-CB 3.38Å; V92-I95 PolarHBondContact O-N 3Å; V92-I95 VanDerWaalsContact O-N 3.17Å; I95-E98 PolarHBondContact O-N 3.34Å; I95-A99 PolarHBondContact O-N 2.98Å |
| 96 | F | 94.3 | Very high | 93.6 | Very high | 52 Ų | 52 | 53.1 Ų | 53.1 | 23% | 0.228 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65 | -38.2 | 174.9 | -71.9 | -46 | 0 | 0 | 0 | 112.9 | V92 S93 I94 E98 A99 V156 L178 E181 I182 | V92-F96 HydrophobicContact CG1-CD2 4.06Å; V92-F96 HydrophobicContact CG1-CE2 3.57Å; V92-F96 HydrophobicContact CG1-CZ 4.02Å; V92-F96 WeakPolarHBondContact O-CD2 3.27Å; V92-F96 PolarHBondContact O-N 3.07Å; S93-F96 PolarHBondContact O-N 3.22Å; I94-F96 VanDerWaalsContact C-N 3.32Å; I94-F96 PolarHBondContact O-N 2.96Å; F96-E98 VanDerWaalsContact C-N 3.32Å; F96-A99 PolarHBondContact O-N 3.05Å; F96-V156 HydrophobicContact CB-CG1 3.76Å; F96-L178 HydrophobicContact CE2-CD1 3.86Å; F96-E181 HydrophobicContact CD2-CB 4.25Å; F96-E181 HydrophobicContact CE2-CB 4.39Å; F96-I182 HydrophobicContact CZ-CG1 4.31Å |
| 97 | C | 94.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.3 | -37.1 | 172.1 | -68.4 | 0 | 0 | 0 | 0 | 112 | A65 I69 S93 I94 V100 | A65-C97 WeakPolarHBondContact CB-O 3.37Å; I69-C97 HydrophobicContact CG1-CB 3.83Å; S93-C97 PolarHBondContact O-N 3.14Å; S93-C97 PolarHBondContact O-SG 3.43Å; I94-C97 WeakPolarHBondContact O-CB 3.26Å; I94-C97 PolarHBondContact O-N 2.93Å; I94-C97 VanDerWaalsContact O-N 3.16Å; C97-V100 WeakPolarHBondContact O-CB 3.3Å; C97-V100 PolarHBondContact O-N 3.01Å |
| 98 | E | 95.9 | Very high | 94.2 | Very high | 105 Ų | 105 | 46.2 Ų | 46.2 | 49% | 0.491 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -69.1 | -39.2 | 176.8 | -171.9 | 180 | 176.4 | 0 | 0 | 112.5 | I94 I95 F96 V100 A101 I102 | I94-E98 PolarHBondContact O-N 3.35Å; I95-E98 PolarHBondContact O-N 3.34Å; F96-E98 VanDerWaalsContact C-N 3.32Å; E98-V100 PolarHBondContact O-N 3.43Å; E98-V100 VanDerWaalsContact O-N 3.14Å; E98-A101 WeakPolarHBondContact O-CB 3.27Å; E98-A101 PolarHBondContact O-N 2.93Å; E98-I102 PolarHBondContact O-N 3.18Å |
| 99 | A | 94.9 | Very high | 94.4 | Very high | 21 Ų | 21 | 46.4 Ų | 46.4 | 17% | 0.174 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -56.5 | -31.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | I95 F96 A101 I102 Y103 | I95-A99 PolarHBondContact O-N 2.98Å; F96-A99 PolarHBondContact O-N 3.05Å; A99-A101 VanDerWaalsContact C-N 3.32Å; A99-A101 PolarHBondContact O-N 3.1Å; A99-I102 WeakPolarHBondContact O-CB 3.32Å; A99-I102 PolarHBondContact O-N 3.39Å; A99-I102 VanDerWaalsContact O-N 3.16Å; A99-Y103 WeakPolarHBondContact O-CD1 3.34Å; A99-Y103 WeakPolarHBondContact O-CD2 3.26Å; A99-Y103 VanDerWaalsContact O-CG 3.29Å; A99-Y103 PolarHBondContact O-N 3.47Å |
| 100 | V | 94.9 | Very high | 94.6 | Very high | 1 Ų | 1 | 45.2 Ų | 45.2 | 1% | 0.006 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.1 | -35.4 | 174.7 | 177 | 0 | 0 | 0 | 0 | 112.3 | C97 E98 Y103 G104 N149 C152 | C97-V100 WeakPolarHBondContact O-CB 3.3Å; C97-V100 PolarHBondContact O-N 3.01Å; E98-V100 PolarHBondContact O-N 3.43Å; E98-V100 VanDerWaalsContact O-N 3.14Å; V100-Y103 WeakPolarHBondContact O-CB 3.39Å; V100-Y103 PolarHBondContact O-N 3Å; V100-G104 PolarHBondContact O-N 3.12Å; V100-N149 HydrophobicContact CG1-CB 3.47Å; V100-N149 VanDerWaalsContact CG1-CB 3.47Å; V100-N149 WeakPolarHBondContact CG1-O 3.37Å; V100-C152 HydrophobicContact CG2-CB 4.48Å |
| 101 | A | 95.9 | Very high | 94.7 | Very high | 23 Ų | 23 | 45.2 Ų | 45.2 | 19% | 0.19 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -70.5 | -35.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V62 A65 E98 A99 Y103 G104 I105 | V62-A101 HydrophobicContact CG2-CB 4.36Å; A65-A101 HydrophobicContact CB-CB 3.82Å; E98-A101 WeakPolarHBondContact O-CB 3.27Å; E98-A101 PolarHBondContact O-N 2.93Å; A99-A101 VanDerWaalsContact C-N 3.32Å; A99-A101 PolarHBondContact O-N 3.1Å; A101-Y103 VanDerWaalsContact C-N 3.29Å; A101-Y103 PolarHBondContact O-N 3.41Å; A101-G104 PolarHBondContact O-N 3.3Å; A101-G104 VanDerWaalsContact O-N 3.12Å; A101-I105 PolarHBondContact O-N 3.46Å |
| 102 | I | 96.3 | Very high | 94.7 | Very high | 84 Ų | 84 | 42.7 Ų | 42.7 | 43% | 0.431 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61.5 | -40.6 | 175.1 | -60.2 | 178 | 0 | 0 | 0 | 110.3 | E98 A99 G104 I105 I106 | E98-I102 PolarHBondContact O-N 3.18Å; A99-I102 WeakPolarHBondContact O-CB 3.32Å; A99-I102 PolarHBondContact O-N 3.39Å; A99-I102 VanDerWaalsContact O-N 3.16Å; I102-G104 VanDerWaalsContact C-N 3.31Å; I102-G104 PolarHBondContact O-N 3.44Å; I102-I105 VanDerWaalsContact O-CG2 3.26Å; I102-I105 WeakPolarHBondContact O-CG2 3.49Å; I102-I105 PolarHBondContact O-N 3Å; I102-I106 HydrophobicContact CG2-CD1 3.72Å; I102-I106 HydrophobicContact CG2-CG1 4.29Å; I102-I106 WeakPolarHBondContact O-CB 3.32Å; I102-I106 VanDerWaalsContact O-CG1 3.24Å; I102-I106 WeakPolarHBondContact O-CG1 3.32Å; I102-I106 PolarHBondContact O-N 3.45Å |
| 103 | Y | 95.1 | Very high | 94.7 | Very high | 54 Ų | 54 | 44.1 Ų | 44.1 | 21% | 0.212 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.1 | -42.3 | 173.4 | -60.3 | -22.1 | 0 | 0 | 0 | 112.3 | A99 V100 A101 M107 L189 V192 | A99-Y103 WeakPolarHBondContact O-CD1 3.34Å; A99-Y103 WeakPolarHBondContact O-CD2 3.26Å; A99-Y103 VanDerWaalsContact O-CG 3.29Å; A99-Y103 PolarHBondContact O-N 3.47Å; V100-Y103 WeakPolarHBondContact O-CB 3.39Å; V100-Y103 PolarHBondContact O-N 3Å; A101-Y103 VanDerWaalsContact C-N 3.29Å; A101-Y103 PolarHBondContact O-N 3.41Å; Y103-M107 WeakPolarHBondContact O-CB 3.43Å; Y103-M107 WeakPolarHBondContact O-CG 3.4Å; Y103-M107 PolarHBondContact O-N 3.36Å; Y103-M107 VanDerWaalsContact O-N 3.1Å; Y103-L189 HydrophobicContact CD1-CD2 4.46Å; Y103-L189 HydrophobicContact CE1-CD2 3.8Å; Y103-L189 HydrophobicContact CE2-CD2 4.01Å; Y103-L189 HydrophobicContact CE2-CG 4.21Å; Y103-V192 HydrophobicContact CG-CG2 4.07Å |
| 104 | G | 95.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.9 | -47 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | S61 V100 A101 I102 M107 A108 | S61-G104 WeakPolarHBondContact OG-CA 3.24Å; V100-G104 PolarHBondContact O-N 3.12Å; A101-G104 PolarHBondContact O-N 3.3Å; A101-G104 VanDerWaalsContact O-N 3.12Å; I102-G104 VanDerWaalsContact C-N 3.31Å; I102-G104 PolarHBondContact O-N 3.44Å; G104-M107 PolarHBondContact O-N 3.45Å; G104-A108 WeakPolarHBondContact O-CB 3.31Å; G104-A108 PolarHBondContact O-N 3.33Å |
| 105 | I | 96.2 | Very high | 94 | Very high | 87 Ų | 87 | 47.6 Ų | 47.6 | 45% | 0.446 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -68.2 | -38.9 | 179.5 | -167.5 | 173.2 | 0 | 0 | 0 | 112 | A101 I102 M107 A108 I109 | A101-I105 PolarHBondContact O-N 3.46Å; I102-I105 VanDerWaalsContact O-CG2 3.26Å; I102-I105 WeakPolarHBondContact O-CG2 3.49Å; I102-I105 PolarHBondContact O-N 3Å; I105-M107 VanDerWaalsContact C-N 3.34Å; I105-M107 PolarHBondContact O-N 2.87Å; I105-A108 PolarHBondContact O-N 2.91Å; I105-I109 HydrophobicContact CG1-CD1 4.24Å; I105-I109 WeakPolarHBondContact O-CG1 3.41Å; I105-I109 PolarHBondContact O-N 2.62Å |
| 106 | I | 95.9 | Very high | 93.5 | Very high | 83 Ų | 83 | 47.7 Ų | 47.7 | 43% | 0.426 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.4 | -48 | 174.3 | -70.3 | 170.6 | 0 | 0 | 0 | 109.9 | I102 A108 I109 V110 | I102-I106 HydrophobicContact CG2-CD1 3.72Å; I102-I106 HydrophobicContact CG2-CG1 4.29Å; I102-I106 WeakPolarHBondContact O-CB 3.32Å; I102-I106 VanDerWaalsContact O-CG1 3.24Å; I102-I106 WeakPolarHBondContact O-CG1 3.32Å; I102-I106 PolarHBondContact O-N 3.45Å; I106-A108 VanDerWaalsContact C-N 3.31Å; I106-A108 PolarHBondContact O-N 3.37Å; I106-I109 PolarHBondContact O-N 2.95Å; I106-V110 HydrophobicContact CG2-CG2 4.45Å; I106-V110 WeakPolarHBondContact O-CG2 3.41Å; I106-V110 PolarHBondContact O-N 2.73Å |
| 107 | M | 95 | Very high | 92.9 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -64.2 | -36.6 | 179.9 | -76.3 | -54.4 | -54.7 | 0 | 0 | 113 | Y103 G104 I105 V110 I111 V145 V192 I196 | Y103-M107 WeakPolarHBondContact O-CB 3.43Å; Y103-M107 WeakPolarHBondContact O-CG 3.4Å; Y103-M107 PolarHBondContact O-N 3.36Å; Y103-M107 VanDerWaalsContact O-N 3.1Å; G104-M107 PolarHBondContact O-N 3.45Å; I105-M107 VanDerWaalsContact C-N 3.34Å; I105-M107 PolarHBondContact O-N 2.87Å; M107-V110 PolarHBondContact O-N 2.95Å; M107-I111 HydrophobicContact CE-CD1 4.47Å; M107-I111 WeakPolarHBondContact O-CB 3.35Å; M107-I111 VanDerWaalsContact O-CG1 3.25Å; M107-I111 WeakPolarHBondContact O-CG1 3.42Å; M107-I111 PolarHBondContact O-N 2.94Å; M107-V145 HydrophobicContact CB-CG1 3.98Å; M107-V145 HydrophobicContact CB-CG2 4.44Å; M107-V145 HydrophobicContact CE-CG2 4.15Å; M107-V145 HydrophobicContact CG-CB 4.47Å; M107-V145 HydrophobicContact CG-CG1 3.79Å; M107-V145 HydrophobicContact CG-CG2 3.96Å; M107-V192 HydrophobicContact CG-CG1 4.08Å; M107-V192 HydrophobicContact CG-CG2 4.22Å; M107-V192 HydrophobicContact SD-CG1 3.83Å; M107-I196 HydrophobicContact CE-CG1 3.93Å; M107-I196 HydrophobicContact SD-CD1 4.1Å; M107-I196 HydrophobicContact SD-CG1 3.5Å; M107-I196 WeakPolarHBondContact SD-CG1 3.48Å |
| 108 | A | 95 | Very high | 91.9 | Very high | 6 Ų | 6 | 51.4 Ų | 51.4 | 5% | 0.05 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.4 | -37.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | I54 A57 I58 G104 I105 I106 G112 | I54-A108 HydrophobicContact CG2-CB 4.02Å; A57-A108 HydrophobicContact CB-CB 4.45Å; I58-A108 HydrophobicContact CD1-CB 3.39Å; I58-A108 HydrophobicContact CG1-CB 3.12Å; G104-A108 WeakPolarHBondContact O-CB 3.31Å; G104-A108 PolarHBondContact O-N 3.33Å; I105-A108 PolarHBondContact O-N 2.91Å; I106-A108 VanDerWaalsContact C-N 3.31Å; I106-A108 PolarHBondContact O-N 3.37Å; A108-G112 PolarHBondContact O-N 3.44Å |
| 109 | I | 95 | Very high | 90.9 | Very high | 114 Ų | 114 | 50.2 Ų | 50.2 | 59% | 0.585 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -64.7 | -44.9 | 172.8 | -66.9 | 165.7 | 0 | 0 | 0 | 110.4 | I105 I106 G112 S113 | I105-I109 HydrophobicContact CG1-CD1 4.24Å; I105-I109 WeakPolarHBondContact O-CG1 3.41Å; I105-I109 PolarHBondContact O-N 2.62Å; I106-I109 PolarHBondContact O-N 2.95Å; I109-G112 PolarHBondContact O-N 3.3Å; I109-S113 WeakPolarHBondContact O-CB 3.46Å; I109-S113 PolarHBondContact O-N 2.91Å |
| 110 | V | 93.8 | Very high | 89.6 | Confident | 45 Ų | 45 | 53.8 Ų | 53.8 | 27% | 0.273 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -61.2 | -47.3 | 178.6 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | I106 M107 S113 | I106-V110 HydrophobicContact CG2-CG2 4.45Å; I106-V110 WeakPolarHBondContact O-CG2 3.41Å; I106-V110 PolarHBondContact O-N 2.73Å; M107-V110 PolarHBondContact O-N 2.95Å; V110-S113 PolarHBondContact O-N 3.47Å; V110-S113 PolarHBondContact O-OG 3.14Å |
| 111 | I | 92.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 177.6 | -64.4 | 167.3 | 0 | 0 | 0 | 110.6 | I54 M107 S113 K114 M138 A141 T199 | I54-I111 HydrophobicContact CD1-CG2 4.14Å; I54-I111 HydrophobicContact CG1-CB 3.98Å; I54-I111 HydrophobicContact CG1-CG2 3.5Å; I54-I111 VanDerWaalsContact CG1-CG2 3.5Å; M107-I111 HydrophobicContact CE-CD1 4.47Å; M107-I111 WeakPolarHBondContact O-CB 3.35Å; M107-I111 VanDerWaalsContact O-CG1 3.25Å; M107-I111 WeakPolarHBondContact O-CG1 3.42Å; M107-I111 PolarHBondContact O-N 2.94Å; I111-S113 VanDerWaalsContact C-N 3.31Å; I111-S113 PolarHBondContact O-N 3.49Å; I111-K114 PolarHBondContact O-N 2.92Å; I111-K114 VanDerWaalsContact O-N 3.12Å; I111-M138 HydrophobicContact CG2-CB 3.75Å; I111-M138 HydrophobicContact CG2-CG 3.86Å; I111-M138 HydrophobicContact CG2-SD 3.81Å; I111-A141 HydrophobicContact CD1-CB 4.33Å; I111-T199 HydrophobicContact CG1-CG2 3.98Å |
| 112 | G | 92.3 | Very high | 87 | Confident | 27 Ų | 27 | 61.1 Ų | 61.1 | 28% | 0.278 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.6 | -38.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A108 I109 K114 Q115 | A108-G112 PolarHBondContact O-N 3.44Å; I109-G112 PolarHBondContact O-N 3.3Å; G112-K114 PolarHBondContact O-N 2.76Å; G112-Q115 WeakPolarHBondContact O-CB 3.49Å; G112-Q115 PolarHBondContact O-N 2.97Å; G112-Q115 VanDerWaalsContact O-N 3.14Å |
| 113 | S | 92.1 | Very high | 85.7 | Confident | 85 Ų | 85 | 58.5 Ų | 58.5 | 59% | 0.594 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64 | -22.1 | 177.6 | 74.9 | 0 | 0 | 0 | 0 | 114.1 | I109 V110 I111 | I109-S113 WeakPolarHBondContact O-CB 3.46Å; I109-S113 PolarHBondContact O-N 2.91Å; V110-S113 PolarHBondContact O-N 3.47Å; V110-S113 PolarHBondContact O-OG 3.14Å; I111-S113 VanDerWaalsContact C-N 3.31Å; I111-S113 PolarHBondContact O-N 3.49Å |
| 114 | K | 88.5 | Confident | 84.8 | Confident | 53 Ų | 53 | 60.4 Ų | 60.4 | 23% | 0.23 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.4 | -9.2 | 179.1 | -67.5 | 173.9 | 169.6 | -85.7 | 0 | 113.1 | I111 G112 Q116 M138 T199 | I111-K114 PolarHBondContact O-N 2.92Å; I111-K114 VanDerWaalsContact O-N 3.12Å; G112-K114 PolarHBondContact O-N 2.76Å; K114-Q116 PolarHBondContact O-N 2.87Å; K114-M138 HydrophobicContact CB-CE 3.37Å; K114-M138 HydrophobicContact CB-SD 4.21Å; K114-M138 HydrophobicContact CD-CE 4.41Å; K114-T199 WeakPolarHBondContact CE-O 3.32Å; K114-T199 PolarHBondContact NZ-O 2.76Å |
| 115 | Q | 85.8 | Confident | 84 | Confident | 59 Ų | 59 | 69.7 Ų | 69.7 | 28% | 0.276 | 41% | 0.406 | S | S | . | . | trans | -72.7 | 126.2 | 175 | -64.1 | -166.3 | -43.7 | 0 | 0 | 109.9 | S50 S51 I54 G112 M138 M204 | S50-Q115 VanDerWaalsContact CB-NE2 3.33Å; S50-Q115 WeakPolarHBondContact OG-CG 3.11Å; S50-Q115 PolarHBondContact OG-NE2 3.43Å; S51-Q115 PolarHBondContact OG-NE2 3.19Å; I54-Q115 VanDerWaalsContact CD1-CD 3.4Å; I54-Q115 HydrophobicContact CD1-CG 4.09Å; G112-Q115 WeakPolarHBondContact O-CB 3.49Å; G112-Q115 PolarHBondContact O-N 2.97Å; G112-Q115 VanDerWaalsContact O-N 3.14Å; Q115-M138 HydrophobicContact CG-SD 4.41Å; Q115-M204 HydrophobicContact CB-CE 4.33Å; Q115-M204 HydrophobicContact CG-CE 3.89Å | ||
| 116 | Q | 85.1 | Confident | 83.3 | Confident | 103 Ų | 103 | 75.4 Ų | 75.4 | 48% | 0.481 | 42% | 0.422 | S | S | . | . | trans | -127.5 | 147.6 | 172.7 | -67.3 | -64.4 | -49.7 | 0 | 0 | 109.3 | K114 M204 | K114-Q116 PolarHBondContact O-N 2.87Å; Q116-M204 WeakPolarHBondContact CB-O 3.32Å; Q116-M204 WeakPolarHBondContact CG-O 3.37Å | ||
| 117 | P | 80.1 | Confident | 82.6 | Confident | 105 Ų | 105 | 72.3 Ų | 72.3 | 68% | 0.682 | 41% | 0.407 | S | S | * | . | trans | -63 | 139 | 174.5 | 27.7 | -33.5 | 0 | 0 | 0 | 109.7 | ||||
| 118 | F | 74.3 | Confident | 81.9 | Confident | 24 Ų | 24 | 74.8 Ų | 74.8 | 11% | 0.105 | 42% | 0.422 | C | S | . | . | trans | -135.2 | 132.4 | 179 | 163.4 | -99.2 | 0 | 0 | 0 | 109.2 | P120 A123 V127 V128 N131 N206 | F118-P120 HydrophobicContact CD1-CB 4.46Å; F118-P120 VanDerWaalsContact CE1-CA 3.44Å; F118-P120 HydrophobicContact CE1-CB 3.79Å; F118-P120 HydrophobicContact CZ-CB 4.49Å; F118-P120 WeakPolarHBondContact O-CD 3.42Å; F118-A123 HydrophobicContact CD2-CB 4.45Å; F118-A123 HydrophobicContact CE1-CB 4.5Å; F118-A123 HydrophobicContact CE2-CB 3.21Å; F118-A123 HydrophobicContact CZ-CB 3.25Å; F118-V127 HydrophobicContact CD2-CG1 4.24Å; F118-V127 HydrophobicContact CE2-CB 4.48Å; F118-V127 HydrophobicContact CE2-CG1 3.69Å; F118-V128 HydrophobicContact CZ-CG2 3.87Å; F118-N131 WeakPolarHBondContact CD2-ND2 3.39Å; F118-N131 WeakPolarHBondContact CE2-ND2 3.48Å; F118-N206 WeakPolarHBondContact CA-OD1 3.33Å; F118-N206 WeakPolarHBondContact CD2-OD1 3.11Å | ||
| 119 | D | 74.1 | Confident | 81.4 | Confident | 81 Ų | 81 | 76.5 Ų | 76.5 | 43% | 0.433 | 44% | 0.437 | S | S | . | . | trans | -97.2 | 107.6 | 175.1 | -172.7 | -8.3 | 0 | 0 | 0 | 109.9 | A121 N206 | D119-A121 PolarHBondContact O-N 3.45Å; D119-A121 WeakPolarHBondContact OD1-CB 3.25Å; D119-A121 PolarHBondContact OD1-N 3.37Å; D119-N206 PolarHBondContact N-OD1 2.97Å | ||
| 120 | P | 69.1 | Low | 81 | Confident | 95 Ų | 95 | 72.6 Ų | 72.6 | 62% | 0.617 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -17.3 | -179.5 | 26.9 | -33.7 | 0 | 0 | 0 | 113.9 | F118 | F118-P120 HydrophobicContact CD1-CB 4.46Å; F118-P120 VanDerWaalsContact CE1-CA 3.44Å; F118-P120 HydrophobicContact CE1-CB 3.79Å; F118-P120 HydrophobicContact CZ-CB 4.49Å; F118-P120 WeakPolarHBondContact O-CD 3.42Å |
| 121 | A | 68.2 | Low | 80.6 | Confident | 92 Ų | 92 | 70.5 Ų | 70.5 | 76% | 0.76 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.4 | -30 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | D119 | D119-A121 PolarHBondContact O-N 3.45Å; D119-A121 WeakPolarHBondContact OD1-CB 3.25Å; D119-A121 PolarHBondContact OD1-N 3.37Å |
| 122 | A | 67.5 | Low | 80.4 | Confident | 87 Ų | 87 | 71.5 Ų | 71.5 | 72% | 0.719 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.4 | -6.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 123 | A | 68.8 | Low | 80.3 | Confident | 28 Ų | 28 | 72.1 Ų | 72.1 | 23% | 0.231 | 42% | 0.416 | C | S | . | . | trans | -88.9 | 138.6 | -166.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | F118 V127 V128 | F118-A123 HydrophobicContact CD2-CB 4.45Å; F118-A123 HydrophobicContact CE1-CB 4.5Å; F118-A123 HydrophobicContact CE2-CB 3.21Å; F118-A123 HydrophobicContact CZ-CB 3.25Å; A123-V127 HydrophobicContact CB-CB 4.29Å; A123-V127 HydrophobicContact CB-CG1 4.42Å; A123-V128 HydrophobicContact CB-CG2 3.95Å | ||
| 124 | T | 76.2 | Confident | 80.2 | Confident | 94 Ų | 94 | 68.1 Ų | 68.1 | 58% | 0.577 | 39% | 0.389 | S | S | * | . | trans | -67.4 | 150.7 | 169.4 | -61 | 0 | 0 | 0 | 0 | 110.3 | R126 V127 V128 | T124-R126 PolarHBondContact O-N 2.89Å; T124-V127 WeakPolarHBondContact O-CB 3.49Å; T124-V127 PolarHBondContact O-N 3.47Å; T124-V128 PolarHBondContact O-N 3.49Å; T124-V128 VanDerWaalsContact O-N 3.1Å | ||
| 125 | Y | 79 | Confident | 80.3 | Confident | 196 Ų | 196 | 65.6 Ų | 65.6 | 77% | 0.769 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -47.3 | -37.7 | 176.9 | 177.6 | -97 | 0 | 0 | 0 | 113.8 | V128 A129 | Y125-V128 PolarHBondContact O-N 2.89Å; Y125-A129 WeakPolarHBondContact O-CB 3.29Å; Y125-A129 PolarHBondContact O-N 3.35Å |
| 126 | R | 80.2 | Confident | 80.6 | Confident | 206 Ų | 206 | 66 Ų | 66 | 78% | 0.777 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -63.6 | -41.4 | 176.9 | -65.3 | -175.2 | 69.2 | -164.5 | -0.7 | 113 | T124 A129 A130 | T124-R126 PolarHBondContact O-N 2.89Å; R126-A129 PolarHBondContact O-N 2.89Å; R126-A130 WeakPolarHBondContact O-CB 3.44Å; R126-A130 PolarHBondContact O-N 2.95Å |
| 127 | V | 80.6 | Confident | 81 | Confident | 19 Ų | 19 | 64.4 Ų | 64.4 | 12% | 0.115 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -70 | -39.6 | 179.5 | -173.6 | 0 | 0 | 0 | 0 | 109.8 | F118 A123 T124 A130 N131 | F118-V127 HydrophobicContact CD2-CG1 4.24Å; F118-V127 HydrophobicContact CE2-CB 4.48Å; F118-V127 HydrophobicContact CE2-CG1 3.69Å; A123-V127 HydrophobicContact CB-CB 4.29Å; A123-V127 HydrophobicContact CB-CG1 4.42Å; T124-V127 WeakPolarHBondContact O-CB 3.49Å; T124-V127 PolarHBondContact O-N 3.47Å; V127-A130 PolarHBondContact O-N 2.82Å; V127-N131 WeakPolarHBondContact CG1-ND2 3.44Å; V127-N131 WeakPolarHBondContact O-CB 3.25Å; V127-N131 PolarHBondContact O-N 3.09Å; V127-N131 PolarHBondContact O-ND2 3.3Å |
| 128 | V | 81.8 | Confident | 81.7 | Confident | 51 Ų | 51 | 59.4 Ų | 59.4 | 31% | 0.309 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.5 | -47 | 172.9 | 179 | 0 | 0 | 0 | 0 | 110.7 | F118 A123 T124 Y125 A130 N131 L132 | F118-V128 HydrophobicContact CZ-CG2 3.87Å; A123-V128 HydrophobicContact CB-CG2 3.95Å; T124-V128 PolarHBondContact O-N 3.49Å; T124-V128 VanDerWaalsContact O-N 3.1Å; Y125-V128 PolarHBondContact O-N 2.89Å; V128-A130 PolarHBondContact O-N 3.35Å; V128-N131 PolarHBondContact O-N 3.33Å; V128-L132 WeakPolarHBondContact O-CB 3.38Å; V128-L132 PolarHBondContact O-N 2.91Å |
| 129 | A | 83.8 | Confident | 82.7 | Confident | 43 Ų | 43 | 60.3 Ų | 60.3 | 36% | 0.355 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.7 | -41.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y125 R126 L132 A133 | Y125-A129 WeakPolarHBondContact O-CB 3.29Å; Y125-A129 PolarHBondContact O-N 3.35Å; R126-A129 PolarHBondContact O-N 2.89Å; A129-L132 PolarHBondContact O-N 2.91Å; A129-A133 WeakPolarHBondContact O-CB 3.39Å; A129-A133 PolarHBondContact O-N 3.35Å |
| 130 | A | 85.9 | Confident | 83.6 | Confident | 32 Ų | 32 | 57.7 Ų | 57.7 | 26% | 0.264 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.8 | -45.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | R126 V127 V128 L132 A133 G134 I208 | R126-A130 WeakPolarHBondContact O-CB 3.44Å; R126-A130 PolarHBondContact O-N 2.95Å; V127-A130 PolarHBondContact O-N 2.82Å; V128-A130 PolarHBondContact O-N 3.35Å; A130-L132 PolarHBondContact O-N 3.22Å; A130-A133 PolarHBondContact O-N 2.97Å; A130-G134 PolarHBondContact O-N 2.89Å; A130-I208 HydrophobicContact CB-CB 4.42Å; A130-I208 HydrophobicContact CB-CD1 4.16Å; A130-I208 HydrophobicContact CB-CG2 4.37Å |
| 131 | N | 87.4 | Confident | 84.9 | Confident | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.4 | -39.9 | 176.4 | -79.8 | -66.6 | 0 | 0 | 0 | 112.2 | P46 F118 V127 V128 G134 G135 M204 G205 | P46-N131 WeakPolarHBondContact CB-O 3.35Å; P46-N131 HydrophobicContact CG-CB 4.38Å; F118-N131 WeakPolarHBondContact CD2-ND2 3.39Å; F118-N131 WeakPolarHBondContact CE2-ND2 3.48Å; V127-N131 WeakPolarHBondContact CG1-ND2 3.44Å; V127-N131 WeakPolarHBondContact O-CB 3.25Å; V127-N131 PolarHBondContact O-N 3.09Å; V127-N131 PolarHBondContact O-ND2 3.3Å; V128-N131 PolarHBondContact O-N 3.33Å; N131-G134 PolarHBondContact O-N 3.43Å; N131-G135 PolarHBondContact O-N 3.45Å; N131-M204 WeakPolarHBondContact OD1-CA 3.21Å; N131-G205 PolarHBondContact ND2-O 3.02Å; N131-G205 PolarHBondContact OD1-N 2.92Å; N131-G205 PolarHBondContact OD1-O 3.2Å |
| 132 | L | 87.9 | Confident | 86.2 | Confident | 22 Ų | 22 | 48.8 Ų | 48.8 | 12% | 0.115 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.1 | -45.5 | 176.9 | -168.3 | 66.4 | 0 | 0 | 0 | 111.4 | T42 P46 V128 A129 A130 G134 G135 Y136 | T42-L132 HydrophobicContact CG2-CD2 4.3Å; P46-L132 HydrophobicContact CG-CB 4.49Å; P46-L132 HydrophobicContact CG-CD1 4.05Å; V128-L132 WeakPolarHBondContact O-CB 3.38Å; V128-L132 PolarHBondContact O-N 2.91Å; A129-L132 PolarHBondContact O-N 2.91Å; A130-L132 PolarHBondContact O-N 3.22Å; L132-G134 VanDerWaalsContact C-N 3.34Å; L132-G134 PolarHBondContact O-N 3Å; L132-G135 PolarHBondContact O-N 3Å; L132-Y136 HydrophobicContact CD1-CE1 4.15Å; L132-Y136 HydrophobicContact CD1-CE2 4.09Å; L132-Y136 WeakPolarHBondContact CD1-OH 3.16Å; L132-Y136 HydrophobicContact CD2-CE2 3.94Å; L132-Y136 HydrophobicContact CG-CD2 4.29Å; L132-Y136 HydrophobicContact CG-CE1 4.47Å; L132-Y136 HydrophobicContact CG-CE2 3.53Å; L132-Y136 WeakPolarHBondContact O-CD2 3.22Å; L132-Y136 PolarHBondContact O-N 3.01Å |
| 133 | A | 89.1 | Confident | 87.6 | Confident | 39 Ų | 39 | 47.3 Ų | 47.3 | 32% | 0.322 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.7 | -43.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A129 A130 G135 Y136 M137 | A129-A133 WeakPolarHBondContact O-CB 3.39Å; A129-A133 PolarHBondContact O-N 3.35Å; A130-A133 PolarHBondContact O-N 2.97Å; A133-G135 PolarHBondContact O-N 3.39Å; A133-Y136 PolarHBondContact O-N 2.99Å; A133-M137 HydrophobicContact CB-CE 4.15Å; A133-M137 VanDerWaalsContact O-CG 3.29Å; A133-M137 WeakPolarHBondContact O-CG 3.48Å; A133-M137 PolarHBondContact O-N 3.3Å |
| 134 | G | 90.7 | Very high | 88.9 | Confident | 2 Ų | 2 | 49 Ų | 49 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.1 | -44.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A130 N131 L132 M137 M138 | A130-G134 PolarHBondContact O-N 2.89Å; N131-G134 PolarHBondContact O-N 3.43Å; L132-G134 VanDerWaalsContact C-N 3.34Å; L132-G134 PolarHBondContact O-N 3Å; G134-M137 PolarHBondContact O-N 3.42Å; G134-M138 VanDerWaalsContact O-CG 3.31Å; G134-M138 WeakPolarHBondContact O-CG 3.41Å; G134-M138 PolarHBondContact O-N 3.25Å |
| 135 | G | 91.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.3 | -45.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | N131 L132 A133 M138 F139 | N131-G135 PolarHBondContact O-N 3.45Å; L132-G135 PolarHBondContact O-N 3Å; A133-G135 PolarHBondContact O-N 3.39Å; G135-M138 PolarHBondContact O-N 2.92Å; G135-F139 WeakPolarHBondContact O-CB 3.41Å; G135-F139 PolarHBondContact O-N 3.24Å |
| 136 | Y | 92.4 | Very high | 90.7 | Very high | 68 Ų | 68 | 35.1 Ų | 35.1 | 27% | 0.267 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -67.9 | -38.8 | 177.2 | -61.5 | -33.5 | 0 | 0 | 0 | 113.5 | L41 W49 L132 A133 M138 F139 G140 | L41-Y136 WeakPolarHBondContact CA-OH 3.27Å; L41-Y136 VanDerWaalsContact CB-OH 3.24Å; L41-Y136 WeakPolarHBondContact CB-OH 3.47Å; L41-Y136 HydrophobicContact CD2-CE1 4.16Å; L41-Y136 PolarHBondContact O-OH 3.34Å; W49-Y136 HydrophobicContact CB-CD1 4.43Å; W49-Y136 AromaticContact CD1-CE1 3.63Å; W49-Y136 HydrophobicContact CD2-CD1 4.07Å; W49-Y136 AromaticContact CD2-CE1 4Å; W49-Y136 HydrophobicContact CD2-CE1 4Å; W49-Y136 AromaticContact CE2-CE1 3.76Å; W49-Y136 AromaticContact CG-CD1 3.94Å; W49-Y136 HydrophobicContact CG-CD1 3.94Å; W49-Y136 AromaticContact CG-CE1 3.92Å; W49-Y136 HydrophobicContact CG-CE1 3.92Å; W49-Y136 HydrophobicContact CZ2-CE1 4.42Å; W49-Y136 AromaticContact NE1-CE1 3.53Å; L132-Y136 HydrophobicContact CD1-CE1 4.15Å; L132-Y136 HydrophobicContact CD1-CE2 4.09Å; L132-Y136 WeakPolarHBondContact CD1-OH 3.16Å; L132-Y136 HydrophobicContact CD2-CE2 3.94Å; L132-Y136 HydrophobicContact CG-CD2 4.29Å; L132-Y136 HydrophobicContact CG-CE1 4.47Å; L132-Y136 HydrophobicContact CG-CE2 3.53Å; L132-Y136 WeakPolarHBondContact O-CD2 3.22Å; L132-Y136 PolarHBondContact O-N 3.01Å; A133-Y136 PolarHBondContact O-N 2.99Å; Y136-M138 VanDerWaalsContact C-N 3.34Å; Y136-F139 PolarHBondContact O-N 3.3Å; Y136-G140 PolarHBondContact O-N 3.41Å |
| 137 | M | 93.4 | Very high | 91.5 | Very high | 68 Ų | 68 | 29.5 Ų | 29.5 | 34% | 0.335 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62.3 | -43 | 175 | -71.9 | 179 | -150.6 | 0 | 0 | 111.2 | A133 G134 G140 A141 V198 A202 | A133-M137 HydrophobicContact CB-CE 4.15Å; A133-M137 VanDerWaalsContact O-CG 3.29Å; A133-M137 WeakPolarHBondContact O-CG 3.48Å; A133-M137 PolarHBondContact O-N 3.3Å; G134-M137 PolarHBondContact O-N 3.42Å; M137-G140 PolarHBondContact O-N 3.49Å; M137-A141 VanDerWaalsContact O-CB 3.25Å; M137-A141 WeakPolarHBondContact O-CB 3.34Å; M137-A141 PolarHBondContact O-N 3.48Å; M137-V198 HydrophobicContact CB-CG1 4.02Å; M137-V198 HydrophobicContact CG-CG1 4.39Å; M137-V198 WeakPolarHBondContact O-CG1 3.37Å; M137-A202 HydrophobicContact CB-CB 3.93Å; M137-A202 HydrophobicContact SD-CB 4.05Å |
| 138 | M | 93.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67 | -39.3 | 177.4 | -70.3 | -169.8 | -153.8 | 0 | 0 | 112.6 | S50 I111 K114 Q115 G134 G135 Y136 G142 A202 M204 | S50-M138 PolarHBondContact OG-SD 3.4Å; I111-M138 HydrophobicContact CG2-CB 3.75Å; I111-M138 HydrophobicContact CG2-CG 3.86Å; I111-M138 HydrophobicContact CG2-SD 3.81Å; K114-M138 HydrophobicContact CB-CE 3.37Å; K114-M138 HydrophobicContact CB-SD 4.21Å; K114-M138 HydrophobicContact CD-CE 4.41Å; Q115-M138 HydrophobicContact CG-SD 4.41Å; G134-M138 VanDerWaalsContact O-CG 3.31Å; G134-M138 WeakPolarHBondContact O-CG 3.41Å; G134-M138 PolarHBondContact O-N 3.25Å; G135-M138 PolarHBondContact O-N 2.92Å; Y136-M138 VanDerWaalsContact C-N 3.34Å; M138-G142 PolarHBondContact O-N 2.85Å; M138-A202 HydrophobicContact CE-CB 4.08Å; M138-A202 HydrophobicContact CG-CB 4.33Å; M138-M204 HydrophobicContact CE-CE 3.4Å; M138-M204 VanDerWaalsContact CE-CE 3.4Å; M138-M204 HydrophobicContact CE-CG 4.09Å; M138-M204 HydrophobicContact SD-CE 3.3Å; M138-M204 WeakPolarHBondContact SD-CE 3.36Å |
| 139 | F | 94.8 | Very high | 93 | Very high | 44 Ų | 44 | 27.4 Ų | 27.4 | 19% | 0.193 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -60.3 | -52.1 | 172.4 | 179 | -106.4 | 0 | 0 | 0 | 111.9 | W49 L52 F56 G135 Y136 A141 G142 L143 | W49-F139 HydrophobicContact CB-CB 4.21Å; W49-F139 HydrophobicContact CE3-CB 4.16Å; W49-F139 AromaticContact CE3-CD1 3.77Å; W49-F139 HydrophobicContact CE3-CD1 3.77Å; W49-F139 AromaticContact CE3-CD2 3.74Å; W49-F139 HydrophobicContact CE3-CD2 3.74Å; W49-F139 HydrophobicContact CE3-CE1 4.06Å; W49-F139 HydrophobicContact CE3-CE2 4.01Å; W49-F139 AromaticContact CE3-CG 3.6Å; W49-F139 HydrophobicContact CE3-CG 3.6Å; W49-F139 HydrophobicContact CE3-CZ 4.17Å; W49-F139 AromaticContact CZ3-CD1 3.9Å; W49-F139 HydrophobicContact CZ3-CD1 3.9Å; W49-F139 HydrophobicContact CZ3-CD2 4.24Å; W49-F139 AromaticContact CZ3-CE1 3.74Å; W49-F139 HydrophobicContact CZ3-CE1 3.74Å; W49-F139 HydrophobicContact CZ3-CE2 4.06Å; W49-F139 HydrophobicContact CZ3-CG 4.16Å; W49-F139 AromaticContact CZ3-CZ 3.82Å; W49-F139 HydrophobicContact CZ3-CZ 3.82Å; W49-F139 WeakPolarHBondContact O-CB 3.24Å; W49-F139 WeakPolarHBondContact O-CD2 3.46Å; L52-F139 HydrophobicContact CB-CD2 4.01Å; L52-F139 HydrophobicContact CB-CE2 4.07Å; F56-F139 AromaticContact CD2-CE2 3.83Å; F56-F139 HydrophobicContact CD2-CE2 3.83Å; F56-F139 AromaticContact CE2-CE2 3.77Å; F56-F139 HydrophobicContact CE2-CE2 3.77Å; F56-F139 HydrophobicContact CE2-CZ 4.36Å; G135-F139 WeakPolarHBondContact O-CB 3.41Å; G135-F139 PolarHBondContact O-N 3.24Å; Y136-F139 PolarHBondContact O-N 3.3Å; F139-A141 VanDerWaalsContact C-N 3.34Å; F139-A141 PolarHBondContact O-N 2.88Å; F139-G142 PolarHBondContact O-N 2.63Å; F139-L143 HydrophobicContact CE1-CD2 4.18Å; F139-L143 HydrophobicContact CZ-CD2 4.3Å; F139-L143 WeakPolarHBondContact O-CB 3.41Å; F139-L143 PolarHBondContact O-N 2.91Å |
| 140 | G | 94.7 | Very high | 93.6 | Very high | 26 Ų | 26 | 27.5 Ų | 27.5 | 27% | 0.268 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -62.3 | -39.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y136 M137 T144 | Y136-G140 PolarHBondContact O-N 3.41Å; M137-G140 PolarHBondContact O-N 3.49Å; G140-T144 VanDerWaalsContact O-CB 3.3Å; G140-T144 WeakPolarHBondContact O-CB 3.48Å; G140-T144 PolarHBondContact O-N 2.9Å; G140-T144 PolarHBondContact O-OG1 3.34Å |
| 141 | A | 95.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.2 | -48.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | I111 M137 F139 L143 T144 V145 V198 T199 | I111-A141 HydrophobicContact CD1-CB 4.33Å; M137-A141 VanDerWaalsContact O-CB 3.25Å; M137-A141 WeakPolarHBondContact O-CB 3.34Å; M137-A141 PolarHBondContact O-N 3.48Å; F139-A141 VanDerWaalsContact C-N 3.34Å; F139-A141 PolarHBondContact O-N 2.88Å; A141-L143 VanDerWaalsContact C-N 3.35Å; A141-L143 PolarHBondContact O-N 3.39Å; A141-T144 PolarHBondContact O-N 2.93Å; A141-V145 VanDerWaalsContact O-CG2 3.27Å; A141-V145 WeakPolarHBondContact O-CG2 3.3Å; A141-V145 PolarHBondContact O-N 3.32Å; A141-V198 HydrophobicContact CB-CB 4.27Å; A141-V198 HydrophobicContact CB-CG1 4.18Å; A141-T199 HydrophobicContact CB-CG2 3.35Å |
| 142 | G | 96 | Very high | 94.5 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.6 | -40.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | G53 A57 M138 F139 G146 | G53-G142 WeakPolarHBondContact O-CA 3.32Å; A57-G142 WeakPolarHBondContact CA-O 3.38Å; M138-G142 PolarHBondContact O-N 2.85Å; F139-G142 PolarHBondContact O-N 2.63Å; G142-G146 PolarHBondContact O-N 3.39Å |
| 143 | L | 96.5 | Very high | 94.9 | Very high | 55 Ų | 55 | 27.8 Ų | 27.8 | 29% | 0.288 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -66.6 | -44 | 176.4 | -173.1 | 64.5 | 0 | 0 | 0 | 112.2 | F56 L60 F139 A141 G146 L147 | F56-L143 HydrophobicContact CD2-CD1 4.44Å; L60-L143 HydrophobicContact CD1-CD1 4.29Å; F139-L143 HydrophobicContact CE1-CD2 4.18Å; F139-L143 HydrophobicContact CZ-CD2 4.3Å; F139-L143 WeakPolarHBondContact O-CB 3.41Å; F139-L143 PolarHBondContact O-N 2.91Å; A141-L143 VanDerWaalsContact C-N 3.35Å; A141-L143 PolarHBondContact O-N 3.39Å; L143-G146 PolarHBondContact O-N 3.44Å; L143-L147 HydrophobicContact CD1-CD1 3.87Å; L143-L147 HydrophobicContact CD1-CG 4.12Å; L143-L147 HydrophobicContact CG-CD1 3.91Å; L143-L147 HydrophobicContact CG-CG 4.47Å; L143-L147 WeakPolarHBondContact O-CB 3.25Å; L143-L147 WeakPolarHBondContact O-CG 3.19Å; L143-L147 PolarHBondContact O-N 3.34Å |
| 144 | T | 96 | Very high | 95.2 | Very high | 63 Ų | 63 | 27.8 Ų | 27.8 | 39% | 0.387 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -61.8 | -48.7 | 178.8 | -59.9 | 0 | 0 | 0 | 0 | 111.1 | G140 A141 S148 V194 | G140-T144 VanDerWaalsContact O-CB 3.3Å; G140-T144 WeakPolarHBondContact O-CB 3.48Å; G140-T144 PolarHBondContact O-N 2.9Å; G140-T144 PolarHBondContact O-OG1 3.34Å; A141-T144 PolarHBondContact O-N 2.93Å; T144-S148 WeakPolarHBondContact O-CB 3.37Å; T144-S148 PolarHBondContact O-N 2.94Å; T144-V194 HydrophobicContact CG2-CG1 4.18Å |
| 145 | V | 96.6 | Very high | 95.4 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.1 | -50 | 177.2 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | M107 A141 L147 S148 N149 G191 V192 | M107-V145 HydrophobicContact CB-CG1 3.98Å; M107-V145 HydrophobicContact CB-CG2 4.44Å; M107-V145 HydrophobicContact CE-CG2 4.15Å; M107-V145 HydrophobicContact CG-CB 4.47Å; M107-V145 HydrophobicContact CG-CG1 3.79Å; M107-V145 HydrophobicContact CG-CG2 3.96Å; A141-V145 VanDerWaalsContact O-CG2 3.27Å; A141-V145 WeakPolarHBondContact O-CG2 3.3Å; A141-V145 PolarHBondContact O-N 3.32Å; V145-L147 PolarHBondContact O-N 3.5Å; V145-S148 PolarHBondContact O-N 2.94Å; V145-N149 WeakPolarHBondContact CG1-ND2 3.39Å; V145-N149 VanDerWaalsContact O-CB 3.24Å; V145-N149 WeakPolarHBondContact O-CB 3.46Å; V145-N149 VanDerWaalsContact O-CG 3.28Å; V145-N149 PolarHBondContact O-N 2.91Å; V145-G191 WeakPolarHBondContact CG2-O 3.49Å; V145-V192 HydrophobicContact CG1-CG2 4.46Å |
| 146 | G | 96.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.4 | -46.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113 | L60 G142 L143 L150 | L60-G146 WeakPolarHBondContact CB-O 3.31Å; G142-G146 PolarHBondContact O-N 3.39Å; L143-G146 PolarHBondContact O-N 3.44Å; G146-L150 VanDerWaalsContact O-CB 3.31Å; G146-L150 WeakPolarHBondContact O-CB 3.47Å; G146-L150 PolarHBondContact O-N 2.89Å |
| 147 | L | 97 | Very high | 95.8 | Very high | 88 Ų | 88 | 26.7 Ų | 26.7 | 46% | 0.461 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -70.3 | -39.3 | 177.9 | -70 | 174.8 | 0 | 0 | 0 | 112.7 | L60 L143 V145 N149 L150 A151 | L60-L147 HydrophobicContact CD1-CD2 4.01Å; L60-L147 HydrophobicContact CD1-CG 4.14Å; L143-L147 HydrophobicContact CD1-CD1 3.87Å; L143-L147 HydrophobicContact CD1-CG 4.12Å; L143-L147 HydrophobicContact CG-CD1 3.91Å; L143-L147 HydrophobicContact CG-CG 4.47Å; L143-L147 WeakPolarHBondContact O-CB 3.25Å; L143-L147 WeakPolarHBondContact O-CG 3.19Å; L143-L147 PolarHBondContact O-N 3.34Å; V145-L147 PolarHBondContact O-N 3.5Å; L147-N149 VanDerWaalsContact C-N 3.35Å; L147-L150 HydrophobicContact CD2-CD2 4.4Å; L147-L150 PolarHBondContact O-N 2.92Å; L147-A151 PolarHBondContact O-N 3.02Å |
| 148 | S | 96.4 | Very high | 95.9 | Very high | 25 Ų | 25 | 28.4 Ų | 28.4 | 18% | 0.175 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.5 | -44 | 176 | -167.7 | 0 | 0 | 0 | 0 | 111.2 | T144 V145 A151 C152 I187 | T144-S148 WeakPolarHBondContact O-CB 3.37Å; T144-S148 PolarHBondContact O-N 2.94Å; V145-S148 PolarHBondContact O-N 2.94Å; S148-A151 PolarHBondContact O-N 3.48Å; S148-C152 WeakPolarHBondContact O-CB 3.41Å; S148-C152 PolarHBondContact O-N 3.41Å; S148-I187 PolarHBondContact OG-O 2.64Å |
| 149 | N | 96.7 | Very high | 96 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.5 | -40.2 | 176.5 | -76.6 | -11.4 | 0 | 0 | 0 | 111.9 | S61 V100 V145 L147 A151 C152 G153 G188 | S61-N149 VanDerWaalsContact OG-CB 3.31Å; S61-N149 WeakPolarHBondContact OG-CB 3.43Å; S61-N149 PolarHBondContact OG-ND2 2.9Å; V100-N149 HydrophobicContact CG1-CB 3.47Å; V100-N149 VanDerWaalsContact CG1-CB 3.47Å; V100-N149 WeakPolarHBondContact CG1-O 3.37Å; V145-N149 WeakPolarHBondContact CG1-ND2 3.39Å; V145-N149 VanDerWaalsContact O-CB 3.24Å; V145-N149 WeakPolarHBondContact O-CB 3.46Å; V145-N149 VanDerWaalsContact O-CG 3.28Å; V145-N149 PolarHBondContact O-N 2.91Å; L147-N149 VanDerWaalsContact C-N 3.35Å; N149-A151 PolarHBondContact O-N 3.45Å; N149-C152 PolarHBondContact O-N 2.89Å; N149-G153 PolarHBondContact O-N 2.73Å; N149-G188 WeakPolarHBondContact OD1-CA 3.3Å |
| 150 | L | 96.7 | Very high | 96 | Very high | 46 Ų | 46 | 27.6 Ų | 27.6 | 24% | 0.241 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56 | -51.7 | 173 | 179.6 | 67.1 | 0 | 0 | 0 | 111.3 | V63 G146 L147 G153 V154 | V63-L150 HydrophobicContact CB-CD1 4.23Å; V63-L150 HydrophobicContact CG1-CD1 3.81Å; G146-L150 VanDerWaalsContact O-CB 3.31Å; G146-L150 WeakPolarHBondContact O-CB 3.47Å; G146-L150 PolarHBondContact O-N 2.89Å; L147-L150 HydrophobicContact CD2-CD2 4.4Å; L147-L150 PolarHBondContact O-N 2.92Å; L150-G153 PolarHBondContact O-N 2.91Å; L150-V154 WeakPolarHBondContact O-CG2 3.5Å; L150-V154 PolarHBondContact O-N 2.73Å |
| 151 | A | 96.2 | Very high | 96 | Very high | 59 Ų | 59 | 27.7 Ų | 27.7 | 49% | 0.488 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -64.1 | -42.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L147 S148 N149 C155 | L147-A151 PolarHBondContact O-N 3.02Å; S148-A151 PolarHBondContact O-N 3.48Å; N149-A151 PolarHBondContact O-N 3.45Å; A151-C155 VanDerWaalsContact O-CB 3.3Å; A151-C155 WeakPolarHBondContact O-CB 3.36Å; A151-C155 PolarHBondContact O-N 3.46Å |
| 152 | C | 95.9 | Very high | 96 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.4 | -49.5 | 176.6 | -178.6 | 0 | 0 | 0 | 0 | 111.8 | V100 S148 N149 V154 C155 V156 A184 I187 G188 | V100-C152 HydrophobicContact CG2-CB 4.48Å; S148-C152 WeakPolarHBondContact O-CB 3.41Å; S148-C152 PolarHBondContact O-N 3.41Å; N149-C152 PolarHBondContact O-N 2.89Å; C152-V154 VanDerWaalsContact C-N 3.35Å; C152-V154 PolarHBondContact O-N 3.37Å; C152-C155 PolarHBondContact O-N 2.91Å; C152-V156 WeakPolarHBondContact O-CG2 3.32Å; C152-V156 PolarHBondContact O-N 3.42Å; C152-A184 PolarHBondContact SG-O 3.23Å; C152-I187 HydrophobicContact CB-CB 4.29Å; C152-I187 HydrophobicContact CB-CG2 4.44Å; C152-G188 PolarHBondContact SG-N 2.92Å |
| 153 | G | 95.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.8 | -40.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G68 N149 L150 G157 | G68-G153 WeakPolarHBondContact CA-O 3.39Å; N149-G153 PolarHBondContact O-N 2.73Å; L150-G153 PolarHBondContact O-N 2.91Å; G153-G157 PolarHBondContact O-N 3.33Å |
| 154 | V | 96.4 | Very high | 95.7 | Very high | 40 Ų | 40 | 26.7 Ų | 26.7 | 24% | 0.242 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.7 | -44.6 | 173.5 | 175.8 | 0 | 0 | 0 | 0 | 111.1 | W67 L150 C152 G157 I158 | W67-V154 HydrophobicContact CB-CG2 4.23Å; W67-V154 HydrophobicContact CG-CG2 4.03Å; L150-V154 WeakPolarHBondContact O-CG2 3.5Å; L150-V154 PolarHBondContact O-N 2.73Å; C152-V154 VanDerWaalsContact C-N 3.35Å; C152-V154 PolarHBondContact O-N 3.37Å; V154-G157 PolarHBondContact O-N 2.88Å; V154-I158 HydrophobicContact CG1-CD1 3.92Å; V154-I158 VanDerWaalsContact O-CG1 3.32Å; V154-I158 WeakPolarHBondContact O-CG1 3.39Å; V154-I158 PolarHBondContact O-N 3.48Å |
| 155 | C | 95.9 | Very high | 95.5 | Very high | 47 Ų | 47 | 27.9 Ų | 27.9 | 32% | 0.318 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.8 | -52.2 | 179.1 | -176.6 | 0 | 0 | 0 | 0 | 112 | A151 C152 G157 I158 V159 | A151-C155 VanDerWaalsContact O-CB 3.3Å; A151-C155 WeakPolarHBondContact O-CB 3.36Å; A151-C155 PolarHBondContact O-N 3.46Å; C152-C155 PolarHBondContact O-N 2.91Å; C155-G157 VanDerWaalsContact C-N 3.28Å; C155-G157 PolarHBondContact O-N 3.34Å; C155-I158 PolarHBondContact O-N 3.34Å; C155-V159 WeakPolarHBondContact O-CG2 3.44Å; C155-V159 PolarHBondContact O-N 3.49Å |
| 156 | V | 95.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -59.3 | -40.7 | 176.9 | 175.3 | 0 | 0 | 0 | 0 | 110.5 | F96 C152 I158 V159 G160 A184 | F96-V156 HydrophobicContact CB-CG1 3.76Å; C152-V156 WeakPolarHBondContact O-CG2 3.32Å; C152-V156 PolarHBondContact O-N 3.42Å; V156-I158 PolarHBondContact O-N 3.12Å; V156-V159 PolarHBondContact O-N 3.2Å; V156-G160 PolarHBondContact O-N 2.85Å; V156-A184 HydrophobicContact CG2-CB 3.75Å |
| 157 | G | 95.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64 | -36.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | T72 G153 V154 C155 S161 | T72-G157 WeakPolarHBondContact OG1-CA 3.17Å; T72-G157 PolarHBondContact OG1-O 3.03Å; G153-G157 PolarHBondContact O-N 3.33Å; V154-G157 PolarHBondContact O-N 2.88Å; C155-G157 VanDerWaalsContact C-N 3.28Å; C155-G157 PolarHBondContact O-N 3.34Å; G157-S161 WeakPolarHBondContact O-CB 3.22Å; G157-S161 PolarHBondContact O-N 3.38Å |
| 158 | I | 96.4 | Very high | 94.9 | Very high | 103 Ų | 103 | 25.9 Ų | 25.9 | 53% | 0.528 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -69.7 | -45.5 | 175.2 | -67.2 | 168 | 0 | 0 | 0 | 110.3 | L71 V154 C155 V156 G160 S161 G162 | L71-I158 HydrophobicContact CD1-CG1 3.78Å; V154-I158 HydrophobicContact CG1-CD1 3.92Å; V154-I158 VanDerWaalsContact O-CG1 3.32Å; V154-I158 WeakPolarHBondContact O-CG1 3.39Å; V154-I158 PolarHBondContact O-N 3.48Å; C155-I158 PolarHBondContact O-N 3.34Å; V156-I158 PolarHBondContact O-N 3.12Å; I158-G160 VanDerWaalsContact C-N 3.34Å; I158-S161 WeakPolarHBondContact O-CB 3.38Å; I158-S161 PolarHBondContact O-N 2.95Å; I158-G162 PolarHBondContact O-N 3.46Å; I158-G162 VanDerWaalsContact O-N 3.12Å |
| 159 | V | 95.5 | Very high | 94.8 | Very high | 28 Ų | 28 | 32.8 Ų | 32.8 | 17% | 0.17 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.9 | -41.6 | 178 | 179.4 | 0 | 0 | 0 | 0 | 110.6 | C155 V156 G162 A163 I177 I180 E181 | C155-V159 WeakPolarHBondContact O-CG2 3.44Å; C155-V159 PolarHBondContact O-N 3.49Å; V156-V159 PolarHBondContact O-N 3.2Å; V159-G162 CarbonylContact O-C 3.59Å; V159-G162 WeakPolarHBondContact O-CA 3.25Å; V159-G162 PolarHBondContact O-N 3.11Å; V159-G162 VanDerWaalsContact O-N 3.12Å; V159-A163 PolarHBondContact O-N 2.86Å; V159-I177 HydrophobicContact CG1-CG2 4.02Å; V159-I180 HydrophobicContact CG1-CB 4.02Å; V159-I180 HydrophobicContact CG1-CG2 3.89Å; V159-I180 HydrophobicContact CG2-CG2 4.12Å; V159-E181 HydrophobicContact CB-CG 4.21Å; V159-E181 HydrophobicContact CG1-CG 3.57Å |
| 160 | G | 94.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.1 | -37 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | V156 I158 A163 A164 E181 | V156-G160 PolarHBondContact O-N 2.85Å; I158-G160 VanDerWaalsContact C-N 3.34Å; G160-A163 PolarHBondContact O-N 3.24Å; G160-A164 WeakPolarHBondContact O-CB 3.33Å; G160-A164 PolarHBondContact O-N 3.4Å; G160-E181 WeakPolarHBondContact CA-OE1 3.32Å |
| 161 | S | 94.8 | Very high | 94.2 | Very high | 27 Ų | 27 | 36.2 Ų | 36.2 | 19% | 0.189 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.5 | -47.4 | 168.3 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | S75 G157 I158 A163 A164 L165 | S75-S161 WeakPolarHBondContact OG-CB 3.26Å; S75-S161 PolarHBondContact OG-OG 3.08Å; G157-S161 WeakPolarHBondContact O-CB 3.22Å; G157-S161 PolarHBondContact O-N 3.38Å; I158-S161 WeakPolarHBondContact O-CB 3.38Å; I158-S161 PolarHBondContact O-N 2.95Å; S161-A163 PolarHBondContact O-N 3.35Å; S161-A164 PolarHBondContact O-N 3.02Å; S161-L165 WeakPolarHBondContact O-CG 3.26Å; S161-L165 PolarHBondContact O-N 2.8Å; S161-L165 VanDerWaalsContact O-N 3.13Å |
| 162 | G | 93.6 | Very high | 94 | Very high | 35 Ų | 35 | 36.6 Ų | 36.6 | 36% | 0.361 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.1 | -41.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | I158 V159 L165 A166 | I158-G162 PolarHBondContact O-N 3.46Å; I158-G162 VanDerWaalsContact O-N 3.12Å; V159-G162 CarbonylContact O-C 3.59Å; V159-G162 WeakPolarHBondContact O-CA 3.25Å; V159-G162 PolarHBondContact O-N 3.11Å; V159-G162 VanDerWaalsContact O-N 3.12Å; G162-L165 PolarHBondContact O-N 3Å; G162-A166 VanDerWaalsContact O-CB 3.31Å; G162-A166 WeakPolarHBondContact O-CB 3.28Å; G162-A166 PolarHBondContact O-N 2.97Å |
| 163 | A | 93.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.8 | -41.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | V159 G160 S161 D167 I177 | V159-A163 PolarHBondContact O-N 2.86Å; G160-A163 PolarHBondContact O-N 3.24Å; S161-A163 PolarHBondContact O-N 3.35Å; A163-D167 WeakPolarHBondContact O-CB 3.41Å; A163-D167 PolarHBondContact O-N 2.97Å; A163-I177 HydrophobicContact CB-CB 4.22Å; A163-I177 HydrophobicContact CB-CG2 3.64Å |
| 164 | A | 93.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.8 | -43.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | I76 N90 G160 S161 A168 | I76-A164 HydrophobicContact CG1-CB 3.81Å; N90-A164 WeakPolarHBondContact ND2-CA 3.31Å; N90-A164 PolarHBondContact ND2-N 2.94Å; G160-A164 WeakPolarHBondContact O-CB 3.33Å; G160-A164 PolarHBondContact O-N 3.4Å; S161-A164 PolarHBondContact O-N 3.02Å; A164-A168 PolarHBondContact O-N 3.45Å; A164-A168 VanDerWaalsContact O-N 3.14Å |
| 165 | L | 93.2 | Very high | 93.2 | Very high | 88 Ų | 88 | 42.5 Ų | 42.5 | 46% | 0.461 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -69.7 | -38.3 | 178.8 | -66.2 | 174.4 | 0 | 0 | 0 | 112.2 | S161 G162 A168 Q169 | S161-L165 WeakPolarHBondContact O-CG 3.26Å; S161-L165 PolarHBondContact O-N 2.8Å; S161-L165 VanDerWaalsContact O-N 3.13Å; G162-L165 PolarHBondContact O-N 3Å; L165-A168 WeakPolarHBondContact O-CB 3.39Å; L165-Q169 PolarHBondContact O-N 3.48Å |
| 166 | A | 93.4 | Very high | 93 | Very high | 18 Ų | 18 | 47.4 Ų | 47.4 | 15% | 0.149 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -68.8 | -41.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G162 A168 Q169 N170 L173 I177 | G162-A166 VanDerWaalsContact O-CB 3.31Å; G162-A166 WeakPolarHBondContact O-CB 3.28Å; G162-A166 PolarHBondContact O-N 2.97Å; A166-A168 VanDerWaalsContact C-N 3.28Å; A166-A168 PolarHBondContact O-N 3.09Å; A166-Q169 PolarHBondContact O-N 2.94Å; A166-Q169 VanDerWaalsContact O-N 3.14Å; A166-N170 PolarHBondContact O-N 3.39Å; A166-L173 HydrophobicContact CB-CB 4.38Å; A166-L173 HydrophobicContact CB-CD1 4.22Å; A166-I177 HydrophobicContact CB-CD1 3.46Å; A166-I177 VanDerWaalsContact CB-CD1 3.46Å |
| 167 | D | 92.8 | Very high | 92.9 | Very high | 1 Ų | 1 | 49.1 Ų | 49.1 | 1% | 0.005 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.7 | -31.5 | 177.2 | -167.7 | 70.1 | 0 | 0 | 0 | 112 | I86 K89 A163 Q169 N170 A171 F174 | I86-D167 HydrophobicContact CG2-CB 4.35Å; I86-D167 WeakPolarHBondContact CG2-OD2 3.5Å; K89-D167 IonicContact NZ-OD1 2.77Å; K89-D167 PolarHBondContact NZ-OD1 3.5Å; A163-D167 WeakPolarHBondContact O-CB 3.41Å; A163-D167 PolarHBondContact O-N 2.97Å; D167-Q169 VanDerWaalsContact C-N 3.26Å; D167-Q169 PolarHBondContact O-N 2.97Å; D167-N170 CarbonylContact O-C 3.6Å; D167-A171 VanDerWaalsContact OD1-CA 3.23Å; D167-A171 WeakPolarHBondContact OD1-CA 3.36Å; D167-F174 HydrophobicContact CB-CB 4.23Å; D167-F174 VanDerWaalsContact OD1-CB 3.27Å; D167-F174 WeakPolarHBondContact OD1-CB 3.35Å |
| 168 | A | 91.7 | Very high | 92.7 | Very high | 26 Ų | 26 | 50.9 Ų | 50.9 | 22% | 0.215 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61 | -35.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A83 I86 A164 L165 A166 | A83-A168 HydrophobicContact CB-CB 4.32Å; I86-A168 HydrophobicContact CD1-CB 4.24Å; I86-A168 HydrophobicContact CG2-CB 4.24Å; A164-A168 PolarHBondContact O-N 3.45Å; A164-A168 VanDerWaalsContact O-N 3.14Å; L165-A168 WeakPolarHBondContact O-CB 3.39Å; A166-A168 VanDerWaalsContact C-N 3.28Å; A166-A168 PolarHBondContact O-N 3.09Å |
| 169 | Q | 92.6 | Very high | 92.6 | Very high | 171 Ų | 171 | 49.5 Ų | 49.5 | 80% | 0.799 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -81.9 | -50.4 | 175.7 | -65 | -174.7 | -16.5 | 0 | 0 | 112.3 | L165 A166 D167 | L165-Q169 PolarHBondContact O-N 3.48Å; A166-Q169 PolarHBondContact O-N 2.94Å; A166-Q169 VanDerWaalsContact O-N 3.14Å; D167-Q169 VanDerWaalsContact C-N 3.26Å; D167-Q169 PolarHBondContact O-N 2.97Å |
| 170 | N | 92.5 | Very high | 92.5 | Very high | 78 Ų | 78 | 52.7 Ų | 52.7 | 42% | 0.417 | 30% | 0.299 | S | S | . | . | trans | -143.3 | 114.3 | -177.9 | -176.8 | -14.6 | 0 | 0 | 0 | 111.3 | A166 D167 S172 L173 | A166-N170 PolarHBondContact O-N 3.39Å; D167-N170 CarbonylContact O-C 3.6Å; N170-S172 VanDerWaalsContact CG-OG 3.27Å; N170-S172 PolarHBondContact ND2-OG 3.35Å; N170-S172 PolarHBondContact O-N 2.68Å; N170-S172 VanDerWaalsContact O-N 3.09Å; N170-S172 WeakPolarHBondContact OD1-CB 3.22Å; N170-S172 PolarHBondContact OD1-N 2.89Å; N170-S172 PolarHBondContact OD1-OG 2.9Å; N170-L173 HydrophobicContact CB-CD1 3.95Å; N170-L173 HydrophobicContact CB-CG 4.15Å; N170-L173 PolarHBondContact O-N 3.32Å; N170-L173 VanDerWaalsContact O-N 3.14Å | ||
| 171 | A | 89.8 | Confident | 92.5 | Very high | 39 Ų | 39 | 52.7 Ų | 52.7 | 32% | 0.322 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -17.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | K89 D167 L173 | K89-A171 PolarHBondContact NZ-O 3.49Å; D167-A171 VanDerWaalsContact OD1-CA 3.23Å; D167-A171 WeakPolarHBondContact OD1-CA 3.36Å; A171-L173 VanDerWaalsContact C-N 3.27Å; A171-L173 PolarHBondContact O-N 2.8Å |
| 172 | S | 91.9 | Very high | 92.5 | Very high | 67 Ų | 67 | 55.6 Ų | 55.6 | 47% | 0.469 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -13.1 | 177.8 | 66.9 | 0 | 0 | 0 | 0 | 113.7 | N170 | N170-S172 VanDerWaalsContact CG-OG 3.27Å; N170-S172 PolarHBondContact ND2-OG 3.35Å; N170-S172 PolarHBondContact O-N 2.68Å; N170-S172 VanDerWaalsContact O-N 3.09Å; N170-S172 WeakPolarHBondContact OD1-CB 3.22Å; N170-S172 PolarHBondContact OD1-N 2.89Å; N170-S172 PolarHBondContact OD1-OG 2.9Å |
| 173 | L | 91.3 | Very high | 92.5 | Very high | 58 Ų | 58 | 61.2 Ų | 61.2 | 30% | 0.304 | 33% | 0.327 | S | S | . | . | S | Bend | trans | -82.4 | -26 | -176.7 | -65.1 | 175.7 | 0 | 0 | 0 | 113.4 | A166 N170 A171 V175 K176 I177 | A166-L173 HydrophobicContact CB-CB 4.38Å; A166-L173 HydrophobicContact CB-CD1 4.22Å; N170-L173 HydrophobicContact CB-CD1 3.95Å; N170-L173 HydrophobicContact CB-CG 4.15Å; N170-L173 PolarHBondContact O-N 3.32Å; N170-L173 VanDerWaalsContact O-N 3.14Å; A171-L173 VanDerWaalsContact C-N 3.27Å; A171-L173 PolarHBondContact O-N 2.8Å; L173-V175 PolarHBondContact O-N 2.84Å; L173-K176 WeakPolarHBondContact O-CB 3.42Å; L173-K176 PolarHBondContact O-N 3.49Å; L173-K176 VanDerWaalsContact O-N 3.08Å; L173-I177 HydrophobicContact CB-CD1 4.38Å; L173-I177 PolarHBondContact O-N 3.47Å; L173-I177 VanDerWaalsContact O-N 3.1Å |
| 174 | F | 88.6 | Confident | 92.5 | Very high | 12 Ų | 12 | 61.6 Ų | 61.6 | 5% | 0.053 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -54.6 | -49.8 | -174.7 | 177 | -100 | 0 | 0 | 0 | 113.5 | K89 N90 D167 K176 I177 L178 | K89-F174 HydrophobicContact CD-CB 4.36Å; K89-F174 HydrophobicContact CD-CD1 4.03Å; K89-F174 HydrophobicContact CD-CE1 4.47Å; K89-F174 HydrophobicContact CD-CG 4.08Å; K89-F174 HydrophobicContact CG-CD1 3.94Å; K89-F174 HydrophobicContact CG-CE1 3.87Å; K89-F174 HydrophobicContact CG-CG 4.26Å; K89-F174 HydrophobicContact CG-CZ 4.17Å; K89-F174 VanDerWaalsContact O-CZ 3.27Å; K89-F174 WeakPolarHBondContact O-CZ 3.44Å; N90-F174 HydrophobicContact CB-CE2 4.39Å; N90-F174 WeakPolarHBondContact ND2-CD2 3.44Å; N90-F174 WeakPolarHBondContact ND2-CE2 3.49Å; D167-F174 HydrophobicContact CB-CB 4.23Å; D167-F174 VanDerWaalsContact OD1-CB 3.27Å; D167-F174 WeakPolarHBondContact OD1-CB 3.35Å; F174-K176 PolarHBondContact O-N 2.88Å; F174-I177 PolarHBondContact O-N 2.81Å; F174-I177 VanDerWaalsContact O-N 3.17Å; F174-L178 HydrophobicContact CE1-CD1 4.49Å; F174-L178 HydrophobicContact CE1-CD2 4.34Å; F174-L178 HydrophobicContact CZ-CD1 4.2Å; F174-L178 WeakPolarHBondContact O-CB 3.49Å; F174-L178 PolarHBondContact O-N 3.4Å |
| 175 | V | 90.5 | Very high | 92.5 | Very high | 95 Ų | 95 | 62.3 Ų | 62.3 | 58% | 0.576 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -63.4 | -32.4 | -177.7 | -178.4 | 0 | 0 | 0 | 0 | 111.3 | L173 | L173-V175 PolarHBondContact O-N 2.84Å |
| 176 | K | 92.8 | Very high | 92.5 | Very high | 149 Ų | 149 | 59.3 Ų | 59.3 | 65% | 0.648 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -71.2 | -38.6 | 178 | -60.2 | -177.9 | -178.5 | -179.5 | 0 | 111.8 | L173 F174 | L173-K176 WeakPolarHBondContact O-CB 3.42Å; L173-K176 PolarHBondContact O-N 3.49Å; L173-K176 VanDerWaalsContact O-N 3.08Å; F174-K176 PolarHBondContact O-N 2.88Å |
| 177 | I | 92 | Very high | 92.6 | Very high | 36 Ų | 36 | 61.9 Ų | 61.9 | 19% | 0.185 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -77.2 | -32.3 | 178.9 | -59.6 | 169.8 | 0 | 0 | 0 | 111 | V159 A163 A166 L173 F174 V179 I180 E181 | V159-I177 HydrophobicContact CG1-CG2 4.02Å; A163-I177 HydrophobicContact CB-CB 4.22Å; A163-I177 HydrophobicContact CB-CG2 3.64Å; A166-I177 HydrophobicContact CB-CD1 3.46Å; A166-I177 VanDerWaalsContact CB-CD1 3.46Å; L173-I177 HydrophobicContact CB-CD1 4.38Å; L173-I177 PolarHBondContact O-N 3.47Å; L173-I177 VanDerWaalsContact O-N 3.1Å; F174-I177 PolarHBondContact O-N 2.81Å; F174-I177 VanDerWaalsContact O-N 3.17Å; I177-V179 PolarHBondContact O-N 3.49Å; I177-V179 VanDerWaalsContact O-N 3.16Å; I177-I180 WeakPolarHBondContact O-CA 3.32Å; I177-I180 VanDerWaalsContact O-CB 3.27Å; I177-I180 WeakPolarHBondContact O-CB 3.3Å; I177-I180 PolarHBondContact O-N 3.43Å; I177-E181 PolarHBondContact O-N 2.95Å |
| 178 | L | 92.1 | Very high | 92.6 | Very high | 37 Ų | 37 | 61.8 Ų | 61.8 | 19% | 0.194 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -55 | -34 | 176.6 | -172 | 70.8 | 0 | 0 | 0 | 112.5 | V92 F96 F174 I180 E181 I182 | V92-L178 HydrophobicContact CG1-CD1 4Å; F96-L178 HydrophobicContact CE2-CD1 3.86Å; F174-L178 HydrophobicContact CE1-CD1 4.49Å; F174-L178 HydrophobicContact CE1-CD2 4.34Å; F174-L178 HydrophobicContact CZ-CD1 4.2Å; F174-L178 WeakPolarHBondContact O-CB 3.49Å; F174-L178 PolarHBondContact O-N 3.4Å; L178-I180 PolarHBondContact O-N 3.14Å; L178-E181 WeakPolarHBondContact O-CB 3.36Å; L178-E181 PolarHBondContact O-N 2.94Å; L178-E181 VanDerWaalsContact O-N 3.11Å; L178-I182 WeakPolarHBondContact O-CG1 3.29Å; L178-I182 PolarHBondContact O-N 3.42Å |
| 179 | V | 94.2 | Very high | 92.7 | Very high | 75 Ų | 75 | 64 Ų | 64 | 46% | 0.455 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -58.5 | -36.9 | 174.6 | 178.6 | 0 | 0 | 0 | 0 | 111.5 | I177 I182 F183 | I177-V179 PolarHBondContact O-N 3.49Å; I177-V179 VanDerWaalsContact O-N 3.16Å; V179-I182 PolarHBondContact O-N 2.95Å; V179-F183 HydrophobicContact CG1-CD2 4.05Å; V179-F183 HydrophobicContact CG1-CE2 3.67Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 3.46Å |
| 180 | I | 94.3 | Very high | 92.8 | Very high | 95 Ų | 95 | 62.2 Ų | 62.2 | 49% | 0.487 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -69.1 | -39.7 | 176.9 | -52.5 | 177.2 | 0 | 0 | 0 | 110.3 | V159 I177 L178 I182 F183 A184 | V159-I180 HydrophobicContact CG1-CB 4.02Å; V159-I180 HydrophobicContact CG1-CG2 3.89Å; V159-I180 HydrophobicContact CG2-CG2 4.12Å; I177-I180 WeakPolarHBondContact O-CA 3.32Å; I177-I180 VanDerWaalsContact O-CB 3.27Å; I177-I180 WeakPolarHBondContact O-CB 3.3Å; I177-I180 PolarHBondContact O-N 3.43Å; L178-I180 PolarHBondContact O-N 3.14Å; I180-I182 VanDerWaalsContact C-N 3.3Å; I180-I182 PolarHBondContact O-N 3.37Å; I180-F183 PolarHBondContact O-N 2.9Å; I180-A184 WeakPolarHBondContact O-CB 3.4Å; I180-A184 PolarHBondContact O-N 3.38Å |
| 181 | E | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60.7 | -39.7 | 175.3 | -65.1 | -174.9 | -175.9 | 0 | 0 | 112 | S93 F96 V159 G160 I177 L178 A184 S185 | S93-E181 VanDerWaalsContact OG-CD 3.28Å; S93-E181 PolarHBondContact OG-OE1 3.5Å; S93-E181 PolarHBondContact OG-OE2 2.89Å; S93-E181 VanDerWaalsContact OG-OE2 3.06Å; F96-E181 HydrophobicContact CD2-CB 4.25Å; F96-E181 HydrophobicContact CE2-CB 4.39Å; V159-E181 HydrophobicContact CB-CG 4.21Å; V159-E181 HydrophobicContact CG1-CG 3.57Å; G160-E181 WeakPolarHBondContact CA-OE1 3.32Å; I177-E181 PolarHBondContact O-N 2.95Å; L178-E181 WeakPolarHBondContact O-CB 3.36Å; L178-E181 PolarHBondContact O-N 2.94Å; L178-E181 VanDerWaalsContact O-N 3.11Å; E181-A184 PolarHBondContact O-N 3.07Å; E181-S185 WeakPolarHBondContact O-CB 3.39Å; E181-S185 PolarHBondContact O-N 3.41Å |
| 182 | I | 94.2 | Very high | 93.1 | Very high | 87 Ų | 87 | 57.7 Ų | 57.7 | 45% | 0.446 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62 | -47.2 | 176.7 | -65.2 | 168 | 0 | 0 | 0 | 110.5 | F96 L178 V179 I180 A184 S185 A186 | F96-I182 HydrophobicContact CZ-CG1 4.31Å; L178-I182 WeakPolarHBondContact O-CG1 3.29Å; L178-I182 PolarHBondContact O-N 3.42Å; V179-I182 PolarHBondContact O-N 2.95Å; I180-I182 VanDerWaalsContact C-N 3.3Å; I180-I182 PolarHBondContact O-N 3.37Å; I182-A184 VanDerWaalsContact C-N 3.34Å; I182-A184 PolarHBondContact O-N 2.96Å; I182-S185 PolarHBondContact O-N 3.4Å; I182-S185 PolarHBondContact O-OG 3.27Å; I182-A186 PolarHBondContact O-N 2.72Å |
| 183 | F | 93.9 | Very high | 93.3 | Very high | 154 Ų | 154 | 59.6 Ų | 59.6 | 68% | 0.675 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -63.9 | -38.1 | 176.8 | -75.4 | -62.2 | 0 | 0 | 0 | 112.8 | V179 I180 S185 A186 | V179-F183 HydrophobicContact CG1-CD2 4.05Å; V179-F183 HydrophobicContact CG1-CE2 3.67Å; V179-F183 WeakPolarHBondContact O-CD2 3.33Å; V179-F183 PolarHBondContact O-N 3.46Å; I180-F183 PolarHBondContact O-N 2.9Å; F183-S185 VanDerWaalsContact C-N 3.34Å; F183-A186 WeakPolarHBondContact O-CB 3.36Å; F183-A186 PolarHBondContact O-N 3.47Å |
| 184 | A | 93.2 | Very high | 93.5 | Very high | 7 Ų | 7 | 60.1 Ų | 60.1 | 6% | 0.058 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | C152 V156 I180 E181 I182 A186 I187 | C152-A184 PolarHBondContact SG-O 3.23Å; V156-A184 HydrophobicContact CG2-CB 3.75Å; I180-A184 WeakPolarHBondContact O-CB 3.4Å; I180-A184 PolarHBondContact O-N 3.38Å; E181-A184 PolarHBondContact O-N 3.07Å; I182-A184 VanDerWaalsContact C-N 3.34Å; I182-A184 PolarHBondContact O-N 2.96Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 2.9Å; A184-I187 WeakPolarHBondContact O-CB 3.24Å; A184-I187 WeakPolarHBondContact O-CG1 3.4Å; A184-I187 PolarHBondContact O-N 3.29Å |
| 185 | S | 93.1 | Very high | 93.8 | Very high | 16 Ų | 16 | 59.5 Ų | 59.5 | 11% | 0.112 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.7 | -25.4 | 179.1 | 77.6 | 0 | 0 | 0 | 0 | 113.9 | E181 I182 F183 I187 G188 | E181-S185 WeakPolarHBondContact O-CB 3.39Å; E181-S185 PolarHBondContact O-N 3.41Å; I182-S185 PolarHBondContact O-N 3.4Å; I182-S185 PolarHBondContact O-OG 3.27Å; F183-S185 VanDerWaalsContact C-N 3.34Å; S185-I187 PolarHBondContact O-N 3.04Å; S185-G188 PolarHBondContact O-N 3.48Å |
| 186 | A | 94.5 | Very high | 93.9 | Very high | 25 Ų | 25 | 58.1 Ų | 58.1 | 21% | 0.207 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.8 | -25.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | I182 F183 A184 G188 L189 F190 | I182-A186 PolarHBondContact O-N 2.72Å; F183-A186 WeakPolarHBondContact O-CB 3.36Å; F183-A186 PolarHBondContact O-N 3.47Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 2.9Å; A186-G188 VanDerWaalsContact C-N 3.31Å; A186-G188 PolarHBondContact O-N 3.48Å; A186-L189 PolarHBondContact O-N 3.29Å; A186-F190 WeakPolarHBondContact O-CG 3.26Å; A186-F190 PolarHBondContact O-N 3.49Å |
| 187 | I | 94.1 | Very high | 94 | Very high | 71 Ų | 71 | 56.6 Ų | 56.6 | 36% | 0.364 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.8 | -41.8 | 176.8 | -57 | 171.5 | 0 | 0 | 0 | 110.6 | S148 C152 A184 S185 F190 G191 | S148-I187 PolarHBondContact OG-O 2.64Å; C152-I187 HydrophobicContact CB-CB 4.29Å; C152-I187 HydrophobicContact CB-CG2 4.44Å; A184-I187 WeakPolarHBondContact O-CB 3.24Å; A184-I187 WeakPolarHBondContact O-CG1 3.4Å; A184-I187 PolarHBondContact O-N 3.29Å; S185-I187 PolarHBondContact O-N 3.04Å; I187-F190 PolarHBondContact O-N 3.14Å; I187-G191 PolarHBondContact O-N 3.4Å |
| 188 | G | 93 | Very high | 94 | Very high | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | N149 C152 S185 A186 F190 G191 V192 | N149-G188 WeakPolarHBondContact OD1-CA 3.3Å; C152-G188 PolarHBondContact SG-N 2.92Å; S185-G188 PolarHBondContact O-N 3.48Å; A186-G188 VanDerWaalsContact C-N 3.31Å; A186-G188 PolarHBondContact O-N 3.48Å; G188-F190 PolarHBondContact O-N 3.4Å; G188-G191 PolarHBondContact O-N 2.8Å; G188-V192 WeakPolarHBondContact O-CG2 3.48Å; G188-V192 PolarHBondContact O-N 3.16Å; G188-V192 VanDerWaalsContact O-N 3.1Å |
| 189 | L | 94 | Very high | 94 | Very high | 73 Ų | 73 | 55.7 Ų | 55.7 | 38% | 0.382 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62 | -39.9 | 177.5 | -70.1 | 174.1 | 0 | 0 | 0 | 112.6 | Y103 A186 G191 V192 I193 | Y103-L189 HydrophobicContact CD1-CD2 4.46Å; Y103-L189 HydrophobicContact CE1-CD2 3.8Å; Y103-L189 HydrophobicContact CE2-CD2 4.01Å; Y103-L189 HydrophobicContact CE2-CG 4.21Å; A186-L189 PolarHBondContact O-N 3.29Å; L189-G191 VanDerWaalsContact C-N 3.33Å; L189-G191 PolarHBondContact O-N 3.23Å; L189-V192 PolarHBondContact O-N 3.29Å; L189-I193 VanDerWaalsContact O-CG1 3.31Å; L189-I193 WeakPolarHBondContact O-CG1 3.12Å; L189-I193 PolarHBondContact O-N 3.08Å |
| 190 | F | 95 | Very high | 93.8 | Very high | 133 Ų | 133 | 56.5 Ų | 56.5 | 58% | 0.583 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -61.7 | -41.3 | 174.9 | -65.4 | -20.1 | 0 | 0 | 0 | 112.2 | A186 I187 G188 V192 I193 V194 | A186-F190 WeakPolarHBondContact O-CG 3.26Å; A186-F190 PolarHBondContact O-N 3.49Å; I187-F190 PolarHBondContact O-N 3.14Å; G188-F190 PolarHBondContact O-N 3.4Å; F190-V192 VanDerWaalsContact C-N 3.34Å; F190-V192 PolarHBondContact O-N 3.11Å; F190-I193 HydrophobicContact CD1-CD1 4.47Å; F190-I193 PolarHBondContact O-N 3.2Å; F190-V194 WeakPolarHBondContact O-CG2 3.48Å; F190-V194 PolarHBondContact O-N 3.23Å |
| 191 | G | 94.2 | Very high | 93.3 | Very high | 4 Ų | 4 | 58.4 Ų | 58.4 | 4% | 0.041 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -58.3 | -44.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V145 I187 G188 L189 V194 G195 | V145-G191 WeakPolarHBondContact CG2-O 3.49Å; I187-G191 PolarHBondContact O-N 3.4Å; G188-G191 PolarHBondContact O-N 2.8Å; L189-G191 VanDerWaalsContact C-N 3.33Å; L189-G191 PolarHBondContact O-N 3.23Å; G191-V194 PolarHBondContact O-N 3.28Å; G191-G195 PolarHBondContact O-N 3.19Å |
| 192 | V | 95 | Very high | 92.8 | Very high | 18 Ų | 18 | 58.5 Ų | 58.5 | 11% | 0.109 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.1 | -48 | 176.6 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | Y103 M107 V145 G188 L189 F190 V194 G195 I196 | Y103-V192 HydrophobicContact CG-CG2 4.07Å; M107-V192 HydrophobicContact CG-CG1 4.08Å; M107-V192 HydrophobicContact CG-CG2 4.22Å; M107-V192 HydrophobicContact SD-CG1 3.83Å; V145-V192 HydrophobicContact CG1-CG2 4.46Å; G188-V192 WeakPolarHBondContact O-CG2 3.48Å; G188-V192 PolarHBondContact O-N 3.16Å; G188-V192 VanDerWaalsContact O-N 3.1Å; L189-V192 PolarHBondContact O-N 3.29Å; F190-V192 VanDerWaalsContact C-N 3.34Å; F190-V192 PolarHBondContact O-N 3.11Å; V192-V194 VanDerWaalsContact C-N 3.33Å; V192-V194 PolarHBondContact O-N 3.39Å; V192-G195 PolarHBondContact O-N 3.03Å; V192-G195 VanDerWaalsContact O-N 3.15Å; V192-I196 HydrophobicContact CG1-CD1 3.87Å; V192-I196 HydrophobicContact CG1-CG1 4.42Å; V192-I196 WeakPolarHBondContact O-CG1 3.23Å; V192-I196 PolarHBondContact O-N 3.02Å |
| 193 | I | 95.6 | Very high | 92.1 | Very high | 107 Ų | 107 | 61.2 Ų | 61.2 | 55% | 0.549 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -57.8 | -46.9 | 179.7 | -68.6 | 164.8 | 0 | 0 | 0 | 110.7 | L189 F190 I196 L197 | L189-I193 VanDerWaalsContact O-CG1 3.31Å; L189-I193 WeakPolarHBondContact O-CG1 3.12Å; L189-I193 PolarHBondContact O-N 3.08Å; F190-I193 HydrophobicContact CD1-CD1 4.47Å; F190-I193 PolarHBondContact O-N 3.2Å; I193-I196 PolarHBondContact O-N 3.32Å; I193-L197 WeakPolarHBondContact O-CB 3.5Å; I193-L197 PolarHBondContact O-N 2.95Å |
| 194 | V | 95.5 | Very high | 91.5 | Very high | 68 Ų | 68 | 54.5 Ų | 54.5 | 41% | 0.412 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 177.3 | 175 | 0 | 0 | 0 | 0 | 110.9 | T144 F190 G191 V192 I196 L197 V198 | T144-V194 HydrophobicContact CG2-CG1 4.18Å; F190-V194 WeakPolarHBondContact O-CG2 3.48Å; F190-V194 PolarHBondContact O-N 3.23Å; G191-V194 PolarHBondContact O-N 3.28Å; V192-V194 VanDerWaalsContact C-N 3.33Å; V192-V194 PolarHBondContact O-N 3.39Å; V194-I196 PolarHBondContact O-N 2.89Å; V194-L197 PolarHBondContact O-N 3.43Å; V194-V198 HydrophobicContact CG1-CG2 4.37Å; V194-V198 WeakPolarHBondContact O-CG2 3.17Å; V194-V198 PolarHBondContact O-N 2.83Å |
| 195 | G | 94 | Very high | 90.8 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59.9 | -42 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | G191 V192 T199 | G191-G195 PolarHBondContact O-N 3.19Å; V192-G195 PolarHBondContact O-N 3.03Å; V192-G195 VanDerWaalsContact O-N 3.15Å; G195-T199 VanDerWaalsContact O-CG2 3.31Å; G195-T199 WeakPolarHBondContact O-CG2 3.21Å; G195-T199 PolarHBondContact O-N 2.95Å; G195-T199 PolarHBondContact O-OG1 2.76Å |
| 196 | I | 94.4 | Very high | 89.5 | Confident | 66 Ų | 66 | 58 Ų | 58 | 34% | 0.338 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.9 | -46.2 | 174.5 | -65.5 | 171.2 | 0 | 0 | 0 | 110.2 | M107 V192 I193 V194 V198 T199 N200 | M107-I196 HydrophobicContact CE-CG1 3.93Å; M107-I196 HydrophobicContact SD-CD1 4.1Å; M107-I196 HydrophobicContact SD-CG1 3.5Å; M107-I196 WeakPolarHBondContact SD-CG1 3.48Å; V192-I196 HydrophobicContact CG1-CD1 3.87Å; V192-I196 HydrophobicContact CG1-CG1 4.42Å; V192-I196 WeakPolarHBondContact O-CG1 3.23Å; V192-I196 PolarHBondContact O-N 3.02Å; I193-I196 PolarHBondContact O-N 3.32Å; V194-I196 PolarHBondContact O-N 2.89Å; I196-V198 VanDerWaalsContact C-N 3.33Å; I196-V198 PolarHBondContact O-N 2.89Å; I196-T199 PolarHBondContact O-N 3.4Å; I196-T199 VanDerWaalsContact O-N 3.14Å; I196-T199 PolarHBondContact O-OG1 3.03Å; I196-T199 VanDerWaalsContact O-OG1 3.05Å; I196-N200 PolarHBondContact O-N 3.1Å; I196-N200 PolarHBondContact O-OD1 2.92Å |
| 197 | L | 94.7 | Very high | 87.9 | Confident | 117 Ų | 117 | 66.3 Ų | 66.3 | 61% | 0.613 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -58.6 | -43.5 | -179.5 | -176.1 | 65.4 | 0 | 0 | 0 | 112.4 | I193 V194 T199 | I193-L197 WeakPolarHBondContact O-CB 3.5Å; I193-L197 PolarHBondContact O-N 2.95Å; V194-L197 PolarHBondContact O-N 3.43Å; L197-T199 VanDerWaalsContact C-N 3.34Å |
| 198 | V | 92.3 | Very high | 86.2 | Confident | 54 Ų | 54 | 67.5 Ų | 67.5 | 33% | 0.327 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.6 | -38.1 | 178.1 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | M137 A141 V194 I196 | M137-V198 HydrophobicContact CB-CG1 4.02Å; M137-V198 HydrophobicContact CG-CG1 4.39Å; M137-V198 WeakPolarHBondContact O-CG1 3.37Å; A141-V198 HydrophobicContact CB-CB 4.27Å; A141-V198 HydrophobicContact CB-CG1 4.18Å; V194-V198 HydrophobicContact CG1-CG2 4.37Å; V194-V198 WeakPolarHBondContact O-CG2 3.17Å; V194-V198 PolarHBondContact O-N 2.83Å; I196-V198 VanDerWaalsContact C-N 3.33Å; I196-V198 PolarHBondContact O-N 2.89Å |
| 199 | T | 91.2 | Very high | 85.8 | Confident | 0 Ų | 0 | 70.9 Ų | 70.9 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -83.1 | -14.7 | -176.8 | 55.3 | 0 | 0 | 0 | 0 | 113.8 | I111 K114 A141 G195 I196 L197 N201 A202 | I111-T199 HydrophobicContact CG1-CG2 3.98Å; K114-T199 WeakPolarHBondContact CE-O 3.32Å; K114-T199 PolarHBondContact NZ-O 2.76Å; A141-T199 HydrophobicContact CB-CG2 3.35Å; G195-T199 VanDerWaalsContact O-CG2 3.31Å; G195-T199 WeakPolarHBondContact O-CG2 3.21Å; G195-T199 PolarHBondContact O-N 2.95Å; G195-T199 PolarHBondContact O-OG1 2.76Å; I196-T199 PolarHBondContact O-N 3.4Å; I196-T199 VanDerWaalsContact O-N 3.14Å; I196-T199 PolarHBondContact O-OG1 3.03Å; I196-T199 VanDerWaalsContact O-OG1 3.05Å; L197-T199 VanDerWaalsContact C-N 3.34Å; T199-N201 VanDerWaalsContact C-N 3.29Å; T199-N201 PolarHBondContact O-N 3.34Å; T199-A202 WeakPolarHBondContact O-CB 3.3Å; T199-A202 PolarHBondContact O-N 2.72Å; T199-A202 VanDerWaalsContact O-N 3.09Å |
| 200 | N | 90.2 | Very high | 85.4 | Confident | 91 Ų | 91 | 70.8 Ų | 70.8 | 49% | 0.487 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.2 | -41.9 | 178.4 | -79.5 | -18.2 | 0 | 0 | 0 | 112.5 | I196 | I196-N200 PolarHBondContact O-N 3.1Å; I196-N200 PolarHBondContact O-OD1 2.92Å |
| 201 | N | 84 | Confident | 84.9 | Confident | 136 Ų | 136 | 67.3 Ų | 67.3 | 73% | 0.727 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | -6.4 | 179.2 | -64.9 | -28.2 | 0 | 0 | 0 | 113.5 | T199 K203 | T199-N201 VanDerWaalsContact C-N 3.29Å; T199-N201 PolarHBondContact O-N 3.34Å; N201-K203 PolarHBondContact O-N 3.11Å |
| 202 | A | 83.5 | Confident | 84.3 | Confident | 2 Ų | 2 | 71.1 Ų | 71.1 | 2% | 0.017 | 37% | 0.368 | C | S | . | . | trans | -75.8 | 121.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | M137 M138 T199 | M137-A202 HydrophobicContact CB-CB 3.93Å; M137-A202 HydrophobicContact SD-CB 4.05Å; M138-A202 HydrophobicContact CE-CB 4.08Å; M138-A202 HydrophobicContact CG-CB 4.33Å; T199-A202 WeakPolarHBondContact O-CB 3.3Å; T199-A202 PolarHBondContact O-N 2.72Å; T199-A202 VanDerWaalsContact O-N 3.09Å | ||
| 203 | K | 80 | Confident | 83.6 | Confident | 143 Ų | 143 | 74.4 Ų | 74.4 | 62% | 0.622 | 38% | 0.384 | S | S | * | . | trans | -123.4 | 137.4 | 171.7 | -65.4 | -176.8 | 178.2 | -177.2 | 0 | 108.6 | N201 I208 | N201-K203 PolarHBondContact O-N 3.11Å; K203-I208 HydrophobicContact CB-CD1 4.17Å; K203-I208 HydrophobicContact CB-CG2 4.06Å; K203-I208 HydrophobicContact CD-CG2 4.14Å | ||
| 204 | M | 79.5 | Confident | 82.8 | Confident | 13 Ų | 13 | 72.2 Ų | 72.2 | 6% | 0.064 | 37% | 0.373 | C | S | . | . | trans | -128.5 | 147.9 | 167.8 | -78.7 | -159 | -81.3 | 0 | 0 | 109.2 | S50 Q115 Q116 N131 M138 | S50-M204 VanDerWaalsContact CB-CE 3.45Å; S50-M204 VanDerWaalsContact OG-CE 3.25Å; S50-M204 WeakPolarHBondContact OG-CE 3.36Å; Q115-M204 HydrophobicContact CB-CE 4.33Å; Q115-M204 HydrophobicContact CG-CE 3.89Å; Q116-M204 WeakPolarHBondContact CB-O 3.32Å; Q116-M204 WeakPolarHBondContact CG-O 3.37Å; N131-M204 WeakPolarHBondContact OD1-CA 3.21Å; M138-M204 HydrophobicContact CE-CE 3.4Å; M138-M204 VanDerWaalsContact CE-CE 3.4Å; M138-M204 HydrophobicContact CE-CG 4.09Å; M138-M204 HydrophobicContact SD-CE 3.3Å; M138-M204 WeakPolarHBondContact SD-CE 3.36Å | ||
| 205 | G | 78.4 | Confident | 81.9 | Confident | 9 Ų | 9 | 72.5 Ų | 72.5 | 9% | 0.093 | 37% | 0.37 | C | S | . | . | S | Bend | trans | 146.2 | 171.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | N131 I208 | N131-G205 PolarHBondContact ND2-O 3.02Å; N131-G205 PolarHBondContact OD1-N 2.92Å; N131-G205 PolarHBondContact OD1-O 3.2Å; G205-I208 WeakPolarHBondContact O-CD1 3.43Å; G205-I208 WeakPolarHBondContact O-CG1 3.39Å |
| 206 | N | 66.4 | Low | 81 | Confident | 88 Ų | 88 | 78.1 Ų | 78.1 | 47% | 0.471 | 40% | 0.399 | S | S | . | . | S | Bend | trans | -80.9 | -20.1 | 178.3 | -73.4 | -27 | 0 | 0 | 0 | 113.5 | F118 D119 | F118-N206 WeakPolarHBondContact CA-OD1 3.33Å; F118-N206 WeakPolarHBondContact CD2-OD1 3.11Å; D119-N206 PolarHBondContact N-OD1 2.97Å |
| 207 | E | 61.2 | Low | 79.9 | Confident | 199 Ų | 199 | 79.1 Ų | 79.1 | 93% | 0.93 | 40% | 0.404 | S | S | * | . | trans | -106.8 | 27.4 | -169.5 | -58.9 | -175.5 | 169.2 | 0 | 0 | 113.9 | ||||
| 208 | I | 57.6 | Low | 78.5 | Confident | 97 Ų | 97 | 75.6 Ų | 75.6 | 50% | 0.497 | 39% | 0.385 | S | S | . | . | trans | -88 | 0 | -178.2 | -29.7 | 170.9 | 0 | 0 | 0 | 112.2 | A130 K203 G205 | A130-I208 HydrophobicContact CB-CB 4.42Å; A130-I208 HydrophobicContact CB-CD1 4.16Å; A130-I208 HydrophobicContact CB-CG2 4.37Å; K203-I208 HydrophobicContact CB-CD1 4.17Å; K203-I208 HydrophobicContact CB-CG2 4.06Å; K203-I208 HydrophobicContact CD-CG2 4.14Å; G205-I208 WeakPolarHBondContact O-CD1 3.43Å; G205-I208 WeakPolarHBondContact O-CG1 3.39Å |
Retrieved 208 of 208 residues in 140 ms
(Link to these results)