| 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 | 48.1 | Very low | 77.9 | Confident | 214 Ų | 214 | 86.7 Ų | 86.7 | 100% | 1.054 | 51% | 0.506 | S | S | * | . | 0 | 131.5 | 0 | -86.5 | 149.9 | 53 | 0 | 0 | 108.9 | S3 | M1-S3 PolarHBondContact O-N 3.14Š| |||
| 2 | K | 54.8 | Low | 78.8 | Confident | 215 Ų | 215 | 84.3 Ų | 84.3 | 94% | 0.935 | 49% | 0.489 | S | S | * | . | trans | -68.8 | 115.7 | 171.7 | -80.8 | -178.8 | 177.7 | 178.1 | 0 | 107.8 | S4 | K2-S4 PolarHBondContact O-N 3.26Š| ||
| 3 | S | 63.7 | Low | 79.6 | Confident | 27 Ų | 27 | 87.9 Ų | 87.9 | 19% | 0.189 | 50% | 0.504 | C | S | . | . | trans | -53.7 | 133.4 | 176.9 | -40.4 | 0 | 0 | 0 | 0 | 109.7 | M1 L298 | M1-S3 PolarHBondContact O-N 3.14Å; S3-L298 WeakPolarHBondContact OG-CD2 3.1Å | ||
| 4 | S | 82.4 | Confident | 80.4 | Confident | 66 Ų | 66 | 87.1 Ų | 87.1 | 46% | 0.462 | 50% | 0.502 | S | S | . | . | trans | -56.2 | 140.3 | 175.2 | 173.6 | 0 | 0 | 0 | 0 | 110.1 | K2 G6 I7 Q8 | K2-S4 PolarHBondContact O-N 3.26Å; S4-G6 PolarHBondContact O-N 3.17Å; S4-I7 WeakPolarHBondContact O-CB 3.3Å; S4-I7 PolarHBondContact O-N 2.86Å; S4-Q8 PolarHBondContact O-N 3.34Å; S4-Q8 VanDerWaalsContact O-N 3.16Å | ||
| 5 | P | 84.2 | Confident | 81 | Confident | 104 Ų | 104 | 81.3 Ų | 81.3 | 68% | 0.675 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -51.4 | -33.2 | 178.1 | -27 | 33.7 | 0 | 0 | 0 | 113.6 | A9 | P5-A9 WeakPolarHBondContact O-CB 3.37Å; P5-A9 PolarHBondContact O-N 3.48Å |
| 6 | G | 86.8 | Confident | 81.5 | Confident | 50 Ų | 50 | 78.2 Ų | 78.2 | 52% | 0.515 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.3 | -35.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | S4 A10 | S4-G6 PolarHBondContact O-N 3.17Å; G6-A10 WeakPolarHBondContact O-CB 3.34Å; G6-A10 PolarHBondContact O-N 3.32Å |
| 7 | I | 85.8 | Confident | 82 | Confident | 71 Ų | 71 | 77 Ų | 77 | 36% | 0.364 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -70.1 | -43.1 | 176.8 | -64.8 | 174.8 | 0 | 0 | 0 | 109.8 | S4 A9 A10 I11 L298 | S4-I7 WeakPolarHBondContact O-CB 3.3Å; S4-I7 PolarHBondContact O-N 2.86Å; I7-A9 VanDerWaalsContact C-N 3.34Å; I7-A9 PolarHBondContact O-N 2.95Å; I7-A10 PolarHBondContact O-N 3.04Å; I7-I11 HydrophobicContact CG2-CD1 3.95Å; I7-I11 HydrophobicContact CG2-CG1 4.47Å; I7-I11 VanDerWaalsContact O-CG1 3.31Å; I7-I11 WeakPolarHBondContact O-CG1 3.46Å; I7-I11 PolarHBondContact O-N 3.3Å; I7-L298 HydrophobicContact CG2-CD1 3.58Å; I7-L298 HydrophobicContact CG2-CD2 3.93Å; I7-L298 HydrophobicContact CG2-CG 4.42Å |
| 8 | Q | 86.1 | Confident | 82.6 | Confident | 86 Ų | 86 | 74.6 Ų | 74.6 | 40% | 0.402 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.9 | -44.8 | 175.9 | -67.4 | -174.7 | -14.3 | 0 | 0 | 111.4 | S4 A10 I11 D12 | S4-Q8 PolarHBondContact O-N 3.34Å; S4-Q8 VanDerWaalsContact O-N 3.16Å; Q8-A10 VanDerWaalsContact C-N 3.33Å; Q8-A10 PolarHBondContact O-N 3.42Å; Q8-I11 PolarHBondContact O-N 3.47Å; Q8-D12 WeakPolarHBondContact O-CB 3.38Å; Q8-D12 PolarHBondContact O-N 3.18Å |
| 9 | A | 86.8 | Confident | 83.1 | Confident | 59 Ų | 59 | 70.7 Ų | 70.7 | 49% | 0.488 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60 | -41.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | P5 I7 L13 | P5-A9 WeakPolarHBondContact O-CB 3.37Å; P5-A9 PolarHBondContact O-N 3.48Å; I7-A9 VanDerWaalsContact C-N 3.34Å; I7-A9 PolarHBondContact O-N 2.95Å; A9-L13 WeakPolarHBondContact O-CB 3.37Å; A9-L13 PolarHBondContact O-N 2.91Å |
| 10 | A | 88.8 | Confident | 83.5 | Confident | 51 Ų | 51 | 67.3 Ų | 67.3 | 42% | 0.421 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.5 | -39.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | G6 I7 Q8 T14 | G6-A10 WeakPolarHBondContact O-CB 3.34Å; G6-A10 PolarHBondContact O-N 3.32Å; I7-A10 PolarHBondContact O-N 3.04Å; Q8-A10 VanDerWaalsContact C-N 3.33Å; Q8-A10 PolarHBondContact O-N 3.42Å; A10-T14 WeakPolarHBondContact O-CB 3.19Å; A10-T14 PolarHBondContact O-N 2.79Å; A10-T14 PolarHBondContact O-OG1 3.47Å |
| 11 | I | 89.6 | Confident | 83.9 | Confident | 11 Ų | 11 | 67 Ų | 67 | 6% | 0.056 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.7 | -50.8 | 174.9 | -70.2 | 172.5 | 0 | 0 | 0 | 110.1 | I7 Q8 L13 T14 A15 R291 M294 M295 | I7-I11 HydrophobicContact CG2-CD1 3.95Å; I7-I11 HydrophobicContact CG2-CG1 4.47Å; I7-I11 VanDerWaalsContact O-CG1 3.31Å; I7-I11 WeakPolarHBondContact O-CG1 3.46Å; I7-I11 PolarHBondContact O-N 3.3Å; Q8-I11 PolarHBondContact O-N 3.47Å; I11-L13 VanDerWaalsContact C-N 3.3Å; I11-L13 PolarHBondContact O-N 3.41Å; I11-T14 PolarHBondContact O-N 2.78Å; I11-A15 WeakPolarHBondContact O-CB 3.19Å; I11-A15 PolarHBondContact O-N 2.95Å; I11-R291 HydrophobicContact CG2-CG 4.03Å; I11-M294 HydrophobicContact CD1-CB 4.33Å; I11-M294 HydrophobicContact CG1-CB 4.08Å; I11-M294 HydrophobicContact CG1-SD 4.42Å; I11-M294 HydrophobicContact CG2-CB 4.01Å; I11-M294 HydrophobicContact CG2-CE 4.01Å; I11-M294 HydrophobicContact CG2-SD 4.38Å; I11-M294 WeakPolarHBondContact O-CE 3.44Å; I11-M295 HydrophobicContact CD1-CG 4.39Å; I11-M295 HydrophobicContact CD1-SD 3.76Å; I11-M295 HydrophobicContact CG2-CG 4.38Å |
| 12 | D | 88.6 | Confident | 86.1 | Confident | 57 Ų | 57 | 57.8 Ų | 57.8 | 31% | 0.305 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.5 | -36.6 | -178.9 | -70.4 | -31.1 | 0 | 0 | 0 | 111.4 | Q8 G16 R291 | Q8-D12 WeakPolarHBondContact O-CB 3.38Å; Q8-D12 PolarHBondContact O-N 3.18Å; D12-G16 PolarHBondContact O-N 3.48Å; D12-R291 WeakPolarHBondContact OD1-CD 3.32Å; D12-R291 IonicContact OD1-CZ 3.48Å; D12-R291 IonicContact OD1-NE 2.86Å; D12-R291 PolarHBondContact OD1-NE 3.34Å |
| 13 | L | 88.8 | Confident | 87.9 | Confident | 132 Ų | 132 | 48.2 Ų | 48.2 | 69% | 0.691 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63 | -47 | 173.8 | -179.2 | 67.9 | 0 | 0 | 0 | 111.7 | A9 I11 G16 A17 | A9-L13 WeakPolarHBondContact O-CB 3.37Å; A9-L13 PolarHBondContact O-N 2.91Å; I11-L13 VanDerWaalsContact C-N 3.3Å; I11-L13 PolarHBondContact O-N 3.41Å; L13-G16 PolarHBondContact O-N 3.28Å; L13-A17 WeakPolarHBondContact O-CB 3.14Å; L13-A17 PolarHBondContact O-N 3.07Å |
| 14 | T | 90.5 | Very high | 89.2 | Confident | 77 Ų | 77 | 47.7 Ų | 47.7 | 47% | 0.472 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -67.7 | -43.6 | -178.6 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | A10 I11 G16 A17 A18 M294 | A10-T14 WeakPolarHBondContact O-CB 3.19Å; A10-T14 PolarHBondContact O-N 2.79Å; A10-T14 PolarHBondContact O-OG1 3.47Å; I11-T14 PolarHBondContact O-N 2.78Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.46Å; T14-A17 PolarHBondContact O-N 3.14Å; T14-A18 PolarHBondContact O-N 3.46Å; T14-M294 HydrophobicContact CG2-CE 4.06Å; T14-M294 HydrophobicContact CG2-SD 3.93Å |
| 15 | A | 89.8 | Confident | 89.7 | Confident | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | I11 A18 G19 Y287 R291 M294 | I11-A15 WeakPolarHBondContact O-CB 3.19Å; I11-A15 PolarHBondContact O-N 2.95Å; A15-A18 PolarHBondContact O-N 3.46Å; A15-G19 PolarHBondContact O-N 2.94Å; A15-Y287 HydrophobicContact CB-CD2 3.74Å; A15-Y287 HydrophobicContact CB-CE2 3.86Å; A15-Y287 HydrophobicContact CB-CG 4.47Å; A15-R291 HydrophobicContact CB-CB 3.86Å; A15-M294 HydrophobicContact CB-CE 3.94Å |
| 16 | G | 89.3 | Confident | 90.2 | Very high | 31 Ų | 31 | 45.3 Ų | 45.3 | 32% | 0.32 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.3 | -42.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | D12 L13 T14 G19 G20 | D12-G16 PolarHBondContact O-N 3.48Å; L13-G16 PolarHBondContact O-N 3.28Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.46Å; G16-G19 PolarHBondContact O-N 2.9Å; G16-G20 PolarHBondContact O-N 3.42Å |
| 17 | A | 90.8 | Very high | 90.4 | Very high | 58 Ų | 58 | 43 Ų | 43 | 48% | 0.479 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L13 T14 T21 | L13-A17 WeakPolarHBondContact O-CB 3.14Å; L13-A17 PolarHBondContact O-N 3.07Å; T14-A17 PolarHBondContact O-N 3.14Å; A17-T21 WeakPolarHBondContact O-CB 3.42Å; A17-T21 PolarHBondContact O-N 2.98Å; A17-T21 PolarHBondContact O-OG1 3.13Å |
| 18 | A | 92.1 | Very high | 90.7 | Very high | 33 Ų | 33 | 39.6 Ų | 39.6 | 27% | 0.273 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | T14 A15 T21 A22 | T14-A18 PolarHBondContact O-N 3.46Å; A15-A18 PolarHBondContact O-N 3.46Å; A18-T21 PolarHBondContact O-N 3.35Å; A18-A22 WeakPolarHBondContact O-CB 3.43Å; A18-A22 PolarHBondContact O-N 3.27Å |
| 19 | G | 91.9 | Very high | 91.1 | Very high | 2 Ų | 2 | 36.6 Ų | 36.6 | 2% | 0.021 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.5 | -49 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A15 G16 T21 A22 C23 | A15-G19 PolarHBondContact O-N 2.94Å; G16-G19 PolarHBondContact O-N 2.9Å; G19-T21 VanDerWaalsContact C-N 3.34Å; G19-T21 PolarHBondContact O-N 3.44Å; G19-A22 PolarHBondContact O-N 3.47Å; G19-C23 WeakPolarHBondContact O-CB 3.3Å; G19-C23 PolarHBondContact O-N 2.97Å |
| 20 | G | 90.5 | Very high | 91.4 | Very high | 2 Ų | 2 | 36 Ų | 36 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.5 | -42 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G16 C23 V24 | G16-G20 PolarHBondContact O-N 3.42Å; G20-C23 WeakPolarHBondContact O-CB 3.36Å; G20-C23 PolarHBondContact O-N 3.42Å; G20-V24 WeakPolarHBondContact O-CG2 3.3Å; G20-V24 PolarHBondContact O-N 3.3Å |
| 21 | T | 92.9 | Very high | 91.5 | Very high | 60 Ų | 60 | 35 Ų | 35 | 37% | 0.368 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64.1 | -46.1 | 177.1 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | A17 A18 G19 C23 V24 L25 L71 | A17-T21 WeakPolarHBondContact O-CB 3.42Å; A17-T21 PolarHBondContact O-N 2.98Å; A17-T21 PolarHBondContact O-OG1 3.13Å; A18-T21 PolarHBondContact O-N 3.35Å; G19-T21 VanDerWaalsContact C-N 3.34Å; G19-T21 PolarHBondContact O-N 3.44Å; T21-C23 VanDerWaalsContact C-N 3.33Å; T21-C23 PolarHBondContact O-N 2.96Å; T21-V24 PolarHBondContact O-N 2.98Å; T21-L25 HydrophobicContact CG2-CD1 3.89Å; T21-L25 HydrophobicContact CG2-CG 4.35Å; T21-L25 WeakPolarHBondContact O-CB 3.36Å; T21-L25 VanDerWaalsContact O-CG 3.31Å; T21-L25 WeakPolarHBondContact O-CG 3.28Å; T21-L25 PolarHBondContact O-N 3.4Å; T21-L71 HydrophobicContact CG2-CD2 4.31Å |
| 22 | A | 93.8 | Very high | 91.6 | Very high | 22 Ų | 22 | 34.5 Ų | 34.5 | 18% | 0.182 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.5 | -41.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A18 G19 L25 T26 A282 A286 | A18-A22 WeakPolarHBondContact O-CB 3.43Å; A18-A22 PolarHBondContact O-N 3.27Å; G19-A22 PolarHBondContact O-N 3.47Å; A22-L25 PolarHBondContact O-N 3.32Å; A22-T26 WeakPolarHBondContact O-CB 3.3Å; A22-T26 WeakPolarHBondContact O-CG2 3.25Å; A22-T26 PolarHBondContact O-N 3.06Å; A22-T26 PolarHBondContact O-OG1 2.99Å; A22-A282 HydrophobicContact CB-CB 4.23Å; A22-A286 HydrophobicContact CB-CB 3.63Å |
| 23 | C | 92.6 | Very high | 91.7 | Very high | 14 Ų | 14 | 32 Ų | 32 | 10% | 0.095 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.8 | -50.5 | 175.1 | -173.4 | 0 | 0 | 0 | 0 | 112 | G19 G20 T21 T26 G27 L283 | G19-C23 WeakPolarHBondContact O-CB 3.3Å; G19-C23 PolarHBondContact O-N 2.97Å; G20-C23 WeakPolarHBondContact O-CB 3.36Å; G20-C23 PolarHBondContact O-N 3.42Å; T21-C23 VanDerWaalsContact C-N 3.33Å; T21-C23 PolarHBondContact O-N 2.96Å; C23-T26 PolarHBondContact O-OG1 3.22Å; C23-G27 PolarHBondContact O-N 3.25Å; C23-L283 HydrophobicContact CB-CB 3.94Å; C23-L283 HydrophobicContact CB-CD1 3.92Å; C23-L283 HydrophobicContact CB-CG 4.35Å |
| 24 | V | 91.5 | Very high | 91.9 | Very high | 16 Ų | 16 | 26.7 Ų | 26.7 | 10% | 0.097 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.1 | -45.8 | -179.4 | 172.9 | 0 | 0 | 0 | 0 | 110.6 | G20 T21 T26 G27 Q28 A70 L71 Y74 | G20-V24 WeakPolarHBondContact O-CG2 3.3Å; G20-V24 PolarHBondContact O-N 3.3Å; T21-V24 PolarHBondContact O-N 2.98Å; V24-T26 PolarHBondContact O-N 3.21Å; V24-G27 PolarHBondContact O-N 3.11Å; V24-Q28 WeakPolarHBondContact O-CB 3.42Å; V24-Q28 PolarHBondContact O-N 2.65Å; V24-A70 HydrophobicContact CG1-CB 3.9Å; V24-L71 HydrophobicContact CB-CD2 3.66Å; V24-L71 HydrophobicContact CB-CG 4.41Å; V24-L71 HydrophobicContact CG1-CD2 3.74Å; V24-L71 HydrophobicContact CG1-CG 3.92Å; V24-L71 HydrophobicContact CG2-CD2 3.98Å; V24-Y74 HydrophobicContact CG2-CD2 4.47Å; V24-Y74 HydrophobicContact CG2-CG 4.24Å |
| 25 | L | 93.3 | Very high | 91.9 | Very high | 70 Ų | 70 | 23.3 Ų | 23.3 | 37% | 0.366 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -63.9 | -39.8 | -178.3 | -71.3 | 175.3 | 0 | 0 | 0 | 113.1 | T21 A22 Y64 T67 | T21-L25 HydrophobicContact CG2-CD1 3.89Å; T21-L25 HydrophobicContact CG2-CG 4.35Å; T21-L25 WeakPolarHBondContact O-CB 3.36Å; T21-L25 VanDerWaalsContact O-CG 3.31Å; T21-L25 WeakPolarHBondContact O-CG 3.28Å; T21-L25 PolarHBondContact O-N 3.4Å; A22-L25 PolarHBondContact O-N 3.32Å; L25-Y64 HydrophobicContact CD2-CE1 4.45Å; L25-Y64 VanDerWaalsContact O-CE1 3.27Å; L25-Y64 WeakPolarHBondContact O-CE1 3.33Å; L25-T67 HydrophobicContact CD2-CG2 3.7Å |
| 26 | T | 93.8 | Very high | 91.9 | Very high | 50 Ų | 50 | 23.5 Ų | 23.5 | 31% | 0.307 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -77.6 | -31.1 | 178.4 | 53.9 | 0 | 0 | 0 | 0 | 112.3 | A22 C23 V24 A279 A282 | A22-T26 WeakPolarHBondContact O-CB 3.3Å; A22-T26 WeakPolarHBondContact O-CG2 3.25Å; A22-T26 PolarHBondContact O-N 3.06Å; A22-T26 PolarHBondContact O-OG1 2.99Å; C23-T26 PolarHBondContact O-OG1 3.22Å; V24-T26 PolarHBondContact O-N 3.21Å; T26-A279 WeakPolarHBondContact OG1-CA 3.49Å; T26-A282 HydrophobicContact CG2-CB 3.63Å; T26-A282 WeakPolarHBondContact OG1-CB 3.4Å |
| 27 | G | 92.1 | Very high | 91.9 | Very high | 1 Ų | 1 | 22.8 Ų | 22.8 | 1% | 0.01 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -80 | -28.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | C23 V24 P29 F30 D31 R275 | C23-G27 PolarHBondContact O-N 3.25Å; V24-G27 PolarHBondContact O-N 3.11Å; G27-P29 VanDerWaalsContact C-CD 3.49Å; G27-F30 PolarHBondContact O-N 3.06Å; G27-F30 VanDerWaalsContact O-N 3.08Å; G27-D31 PolarHBondContact O-N 3.25Å; G27-D31 VanDerWaalsContact O-N 3.12Å; G27-R275 WeakPolarHBondContact O-CD 3.1Å |
| 28 | Q | 91.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -55.4 | -41.3 | -171.2 | -175.4 | 72.3 | 7 | 0 | 0 | 114.5 | V24 F30 D31 T32 F63 Y64 K65 | V24-Q28 WeakPolarHBondContact O-CB 3.42Å; V24-Q28 PolarHBondContact O-N 2.65Å; Q28-F30 VanDerWaalsContact C-N 3.28Å; Q28-F30 PolarHBondContact O-N 2.87Å; Q28-D31 PolarHBondContact O-N 2.92Å; Q28-T32 PolarHBondContact O-N 3.37Å; Q28-T32 PolarHBondContact O-OG1 2.67Å; Q28-T32 VanDerWaalsContact O-OG1 3.13Å; Q28-F63 WeakPolarHBondContact CG-O 3.46Å; Q28-Y64 HydrophobicContact CB-CD1 4.43Å; Q28-Y64 HydrophobicContact CG-CD1 4.41Å; Q28-K65 PolarHBondContact NE2-O 3.05Å; Q28-K65 VanDerWaalsContact NE2-O 3.14Å |
| 29 | P | 93.7 | Very high | 91.4 | Very high | 22 Ų | 22 | 18.9 Ų | 18.9 | 14% | 0.143 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -58.2 | -40.5 | 177.7 | -26.1 | 35.9 | 0 | 0 | 0 | 113.1 | G27 T32 I33 F63 Y64 | G27-P29 VanDerWaalsContact C-CD 3.49Å; P29-T32 PolarHBondContact O-N 3.3Å; P29-I33 WeakPolarHBondContact O-CD1 3.4Å; P29-I33 VanDerWaalsContact O-CG1 3.26Å; P29-I33 WeakPolarHBondContact O-CG1 3.41Å; P29-I33 PolarHBondContact O-N 3.18Å; P29-I33 VanDerWaalsContact O-N 3.08Å; P29-F63 HydrophobicContact CB-CB 4.02Å; P29-F63 HydrophobicContact CB-CD1 4.21Å; P29-F63 HydrophobicContact CB-CG 4.3Å; P29-F63 HydrophobicContact CG-CB 4.28Å; P29-Y64 HydrophobicContact CG-CE1 4.45Å; P29-Y64 HydrophobicContact CG-CE2 4.34Å |
| 30 | F | 93.8 | Very high | 91.1 | Very high | 48 Ų | 48 | 19.3 Ų | 19.3 | 21% | 0.211 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -71.9 | -38.3 | 178.1 | -60.2 | -78.5 | 0 | 0 | 0 | 112 | G27 Q28 T32 I33 K34 I274 R275 P278 | G27-F30 PolarHBondContact O-N 3.06Å; G27-F30 VanDerWaalsContact O-N 3.08Å; Q28-F30 VanDerWaalsContact C-N 3.28Å; Q28-F30 PolarHBondContact O-N 2.87Å; F30-T32 VanDerWaalsContact C-N 3.33Å; F30-I33 PolarHBondContact O-N 3.21Å; F30-K34 VanDerWaalsContact O-CB 3.28Å; F30-K34 WeakPolarHBondContact O-CB 3.24Å; F30-K34 PolarHBondContact O-N 3.07Å; F30-I274 HydrophobicContact CD1-CB 4.44Å; F30-I274 HydrophobicContact CD1-CG2 4.19Å; F30-I274 HydrophobicContact CE1-CB 4.14Å; F30-I274 HydrophobicContact CE1-CG2 3.43Å; F30-I274 VanDerWaalsContact CE1-CG2 3.43Å; F30-I274 HydrophobicContact CZ-CG2 3.77Å; F30-R275 HydrophobicContact CB-CB 3.61Å; F30-R275 HydrophobicContact CB-CG 3.76Å; F30-R275 HydrophobicContact CD2-CB 4Å; F30-R275 HydrophobicContact CD2-CG 3.97Å; F30-R275 HydrophobicContact CG-CB 3.84Å; F30-R275 HydrophobicContact CG-CG 4.14Å; F30-P278 HydrophobicContact CE2-CG 4.04Å |
| 31 | D | 90.6 | Very high | 90.7 | Very high | 30 Ų | 30 | 20.8 Ų | 20.8 | 16% | 0.16 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.4 | -44.5 | 173.6 | -76.7 | -3.1 | 0 | 0 | 0 | 111.3 | G27 Q28 K34 V35 K131 R275 | G27-D31 PolarHBondContact O-N 3.25Å; G27-D31 VanDerWaalsContact O-N 3.12Å; Q28-D31 PolarHBondContact O-N 2.92Å; D31-K34 WeakPolarHBondContact O-CB 3.14Å; D31-K34 PolarHBondContact O-N 3.44Å; D31-V35 WeakPolarHBondContact O-CG2 3.31Å; D31-V35 PolarHBondContact O-N 3.35Å; D31-K131 IonicContact OD2-NZ 4Å; D31-K131 PolarHBondContact OD2-NZ 2.7Å; D31-R275 WeakPolarHBondContact OD1-CD 3.48Å; D31-R275 IonicContact OD1-NE 3.14Å; D31-R275 PolarHBondContact OD1-NE 3.16Å |
| 32 | T | 90.7 | Very high | 90.3 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.8 | -45 | 178 | -62.5 | 0 | 0 | 0 | 0 | 111.1 | Q28 P29 F30 V35 K36 F63 Q135 | Q28-T32 PolarHBondContact O-N 3.37Å; Q28-T32 PolarHBondContact O-OG1 2.67Å; Q28-T32 VanDerWaalsContact O-OG1 3.13Å; P29-T32 PolarHBondContact O-N 3.3Å; F30-T32 VanDerWaalsContact C-N 3.33Å; T32-V35 PolarHBondContact O-N 3.19Å; T32-K36 HydrophobicContact CG2-CD 4.3Å; T32-K36 WeakPolarHBondContact O-CB 3.35Å; T32-K36 VanDerWaalsContact O-CG 3.3Å; T32-K36 WeakPolarHBondContact O-CG 3.24Å; T32-K36 PolarHBondContact O-N 2.81Å; T32-F63 PolarHBondContact OG1-O 3.19Å; T32-Q135 HydrophobicContact CG2-CB 4.42Å; T32-Q135 HydrophobicContact CG2-CG 4.31Å; T32-Q135 PolarHBondContact OG1-NE2 3.47Å |
| 33 | I | 92.3 | Very high | 89.9 | Confident | 4 Ų | 4 | 27.5 Ų | 27.5 | 2% | 0.021 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -62.9 | -45.2 | 176.8 | -67.9 | 162.4 | 0 | 0 | 0 | 111 | P29 F30 V35 K36 M37 L47 C50 F51 F63 A271 | P29-I33 WeakPolarHBondContact O-CD1 3.4Å; P29-I33 VanDerWaalsContact O-CG1 3.26Å; P29-I33 WeakPolarHBondContact O-CG1 3.41Å; P29-I33 PolarHBondContact O-N 3.18Å; P29-I33 VanDerWaalsContact O-N 3.08Å; F30-I33 PolarHBondContact O-N 3.21Å; I33-V35 PolarHBondContact O-N 2.92Å; I33-K36 PolarHBondContact O-N 2.99Å; I33-M37 HydrophobicContact CG2-CG 4.23Å; I33-M37 HydrophobicContact CG2-SD 3.79Å; I33-M37 WeakPolarHBondContact O-CB 3.47Å; I33-M37 VanDerWaalsContact O-CG 3.3Å; I33-M37 WeakPolarHBondContact O-CG 3.42Å; I33-M37 PolarHBondContact O-N 2.89Å; I33-L47 HydrophobicContact CG2-CD1 3.65Å; I33-L47 HydrophobicContact CG2-CG 4.46Å; I33-C50 HydrophobicContact CG2-CB 3.99Å; I33-F51 HydrophobicContact CD1-CB 4.2Å; I33-F51 HydrophobicContact CD1-CD2 3.88Å; I33-F63 HydrophobicContact CD1-CD1 4.34Å; I33-F63 HydrophobicContact CD1-CE1 3.92Å; I33-F63 HydrophobicContact CG1-CD1 4.26Å; I33-F63 HydrophobicContact CG1-CE1 3.93Å; I33-A271 HydrophobicContact CG2-CB 4.49Å |
| 34 | K | 92.6 | Very high | 89.7 | Confident | 20 Ų | 20 | 27 Ų | 27 | 9% | 0.087 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -54.3 | -54.9 | 176.5 | 176 | -152.5 | 170.7 | -166.4 | 0 | 110.8 | F30 D31 K36 M37 Q38 D231 A271 | F30-K34 VanDerWaalsContact O-CB 3.28Å; F30-K34 WeakPolarHBondContact O-CB 3.24Å; F30-K34 PolarHBondContact O-N 3.07Å; D31-K34 WeakPolarHBondContact O-CB 3.14Å; D31-K34 PolarHBondContact O-N 3.44Å; K34-K36 VanDerWaalsContact C-N 3.33Å; K34-K36 PolarHBondContact O-N 3.07Å; K34-M37 PolarHBondContact O-N 3.49Å; K34-Q38 VanDerWaalsContact CE-NE2 3.33Å; K34-Q38 WeakPolarHBondContact O-CB 3.11Å; K34-Q38 WeakPolarHBondContact O-CG 3.3Å; K34-Q38 PolarHBondContact O-N 3.46Å; K34-D231 WeakPolarHBondContact CE-OD2 3.25Å; K34-D231 IonicContact NZ-OD1 2.93Å; K34-D231 PolarHBondContact NZ-OD1 2.82Å; K34-D231 IonicContact NZ-OD2 3.89Å; K34-D231 PolarHBondContact NZ-OD2 3.28Å; K34-A271 HydrophobicContact CB-CB 4.22Å |
| 35 | V | 89.3 | Confident | 89.3 | Confident | 7 Ų | 7 | 35.6 Ų | 35.6 | 4% | 0.042 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.7 | -40.2 | -177 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | D31 T32 I33 Q38 T39 C132 Q135 T136 | D31-V35 WeakPolarHBondContact O-CG2 3.31Å; D31-V35 PolarHBondContact O-N 3.35Å; T32-V35 PolarHBondContact O-N 3.19Å; I33-V35 PolarHBondContact O-N 2.92Å; V35-Q38 PolarHBondContact O-N 3.29Å; V35-T39 WeakPolarHBondContact O-CB 3.46Å; V35-T39 PolarHBondContact O-N 2.91Å; V35-T39 PolarHBondContact O-OG1 3.36Å; V35-C132 HydrophobicContact CG1-CB 4.32Å; V35-Q135 HydrophobicContact CG1-CB 4.43Å; V35-T136 HydrophobicContact CG1-CG2 3.67Å |
| 36 | K | 90.5 | Very high | 89 | Confident | 4 Ų | 4 | 33.2 Ų | 33.2 | 2% | 0.017 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.6 | -46.6 | 175.3 | -75 | -176.2 | 178.7 | -156.5 | 0 | 112.4 | T32 I33 K34 Q38 T39 F40 Y44 T54 Q135 E139 | T32-K36 HydrophobicContact CG2-CD 4.3Å; T32-K36 WeakPolarHBondContact O-CB 3.35Å; T32-K36 VanDerWaalsContact O-CG 3.3Å; T32-K36 WeakPolarHBondContact O-CG 3.24Å; T32-K36 PolarHBondContact O-N 2.81Å; I33-K36 PolarHBondContact O-N 2.99Å; K34-K36 VanDerWaalsContact C-N 3.33Å; K34-K36 PolarHBondContact O-N 3.07Å; K36-Q38 VanDerWaalsContact C-N 3.34Å; K36-Q38 PolarHBondContact O-N 2.92Å; K36-T39 PolarHBondContact O-N 3.28Å; K36-F40 PolarHBondContact O-N 3.02Å; K36-Y44 HydrophobicContact CB-CD2 4.22Å; K36-Y44 HydrophobicContact CB-CE2 3.8Å; K36-Y44 HydrophobicContact CD-CE2 4.4Å; K36-Y44 HydrophobicContact CG-CE2 4.48Å; K36-T54 PolarHBondContact NZ-OG1 2.62Å; K36-T54 VanDerWaalsContact NZ-OG1 3.15Å; K36-Q135 WeakPolarHBondContact CE-O 3.15Å; K36-E139 WeakPolarHBondContact CE-OE1 3.33Å; K36-E139 IonicContact NZ-OE1 2.78Å; K36-E139 PolarHBondContact NZ-OE1 2.92Å; K36-E139 IonicContact NZ-OE2 2.7Å |
| 37 | M | 90.2 | Very high | 88.8 | Confident | 16 Ų | 16 | 32.8 Ų | 32.8 | 8% | 0.079 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.9 | -34.5 | 177.7 | -72.7 | -177.2 | 65.2 | 0 | 0 | 113 | I33 K34 L47 C50 S267 | I33-M37 HydrophobicContact CG2-CG 4.23Å; I33-M37 HydrophobicContact CG2-SD 3.79Å; I33-M37 WeakPolarHBondContact O-CB 3.47Å; I33-M37 VanDerWaalsContact O-CG 3.3Å; I33-M37 WeakPolarHBondContact O-CG 3.42Å; I33-M37 PolarHBondContact O-N 2.89Å; K34-M37 PolarHBondContact O-N 3.49Å; M37-L47 HydrophobicContact SD-CB 4.43Å; M37-C50 HydrophobicContact CG-CB 3.92Å; M37-C50 HydrophobicContact SD-CB 4.32Å; M37-S267 PolarHBondContact O-OG 3.4Å; M37-S267 VanDerWaalsContact O-OG 3.06Å |
| 38 | Q | 86.4 | Confident | 88.8 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -72 | -31.4 | 176.1 | -74.8 | 176.4 | -28.4 | 0 | 0 | 112.2 | K34 V35 K36 D231 C232 S235 R236 S267 | K34-Q38 VanDerWaalsContact CE-NE2 3.33Å; K34-Q38 WeakPolarHBondContact O-CB 3.11Å; K34-Q38 WeakPolarHBondContact O-CG 3.3Å; K34-Q38 PolarHBondContact O-N 3.46Å; V35-Q38 PolarHBondContact O-N 3.29Å; K36-Q38 VanDerWaalsContact C-N 3.34Å; K36-Q38 PolarHBondContact O-N 2.92Å; Q38-D231 PolarHBondContact NE2-OD2 3.47Å; Q38-D231 PolarHBondContact OE1-OD2 3.41Å; Q38-C232 HydrophobicContact CG-CB 4.41Å; Q38-S235 PolarHBondContact OE1-OG 3.17Å; Q38-R236 WeakPolarHBondContact O-CG 3.49Å; Q38-R236 PolarHBondContact O-NE 3.47Å; Q38-R236 PolarHBondContact O-NH2 3.46Å; Q38-S267 WeakPolarHBondContact CG-O 3.4Å |
| 39 | T | 84.9 | Confident | 88.8 | Confident | 8 Ų | 8 | 39.6 Ų | 39.6 | 5% | 0.049 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -90.2 | -36.3 | -175.8 | -52.7 | 0 | 0 | 0 | 0 | 112.7 | V35 K36 P41 T136 M140 V239 | V35-T39 WeakPolarHBondContact O-CB 3.46Å; V35-T39 PolarHBondContact O-N 2.91Å; V35-T39 PolarHBondContact O-OG1 3.36Å; K36-T39 PolarHBondContact O-N 3.28Å; T39-P41 VanDerWaalsContact C-CD 3.42Å; T39-P41 WeakPolarHBondContact O-CD 3.48Å; T39-T136 HydrophobicContact CG2-CG2 4.37Å; T39-M140 HydrophobicContact CG2-CE 3.99Å; T39-V239 HydrophobicContact CG2-CB 3.94Å; T39-V239 HydrophobicContact CG2-CG1 3.41Å; T39-V239 VanDerWaalsContact CG2-CG1 3.41Å |
| 40 | F | 86.4 | Confident | 88.7 | Confident | 11 Ų | 11 | 38.5 Ų | 38.5 | 5% | 0.048 | 20% | 0.202 | C | C | . | . | trans | -124.7 | 68.5 | -174.5 | -53.3 | -82.3 | 0 | 0 | 0 | 111.4 | K36 D42 L43 Y44 T136 E139 M140 | K36-F40 PolarHBondContact O-N 3.02Å; F40-D42 VanDerWaalsContact C-N 3.27Å; F40-D42 PolarHBondContact O-N 2.92Å; F40-L43 HydrophobicContact CB-CB 3.81Å; F40-L43 HydrophobicContact CB-CD2 4.39Å; F40-L43 PolarHBondContact O-N 3.07Å; F40-Y44 HydrophobicContact CB-CD2 4.13Å; F40-Y44 HydrophobicContact CB-CE2 4.22Å; F40-Y44 PolarHBondContact O-N 3.31Å; F40-T136 HydrophobicContact CE2-CG2 3.93Å; F40-E139 HydrophobicContact CD1-CB 4.42Å; F40-E139 HydrophobicContact CD2-CB 3.82Å; F40-E139 HydrophobicContact CD2-CG 4.05Å; F40-E139 HydrophobicContact CE1-CB 4Å; F40-E139 HydrophobicContact CE2-CB 3.34Å; F40-E139 HydrophobicContact CE2-CG 3.94Å; F40-E139 HydrophobicContact CG-CB 4.33Å; F40-E139 HydrophobicContact CZ-CB 3.42Å; F40-E139 VanDerWaalsContact CZ-CB 3.42Å; F40-E139 HydrophobicContact CZ-CG 4.47Å; F40-M140 HydrophobicContact CE1-CE 3.72Å; F40-M140 HydrophobicContact CE1-SD 3.79Å; F40-M140 HydrophobicContact CE2-CE 4.43Å; F40-M140 HydrophobicContact CZ-CE 3.42Å; F40-M140 VanDerWaalsContact CZ-CE 3.42Å; F40-M140 HydrophobicContact CZ-CG 3.86Å; F40-M140 HydrophobicContact CZ-SD 3.66Å | ||
| 41 | P | 82.6 | Confident | 88.7 | Confident | 34 Ų | 34 | 40.6 Ų | 40.6 | 22% | 0.221 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -36.5 | -179.2 | 27.5 | -37.7 | 0 | 0 | 0 | 112.3 | T39 L43 E260 | T39-P41 VanDerWaalsContact C-CD 3.42Å; T39-P41 WeakPolarHBondContact O-CD 3.48Å; P41-L43 VanDerWaalsContact C-N 3.3Å; P41-L43 PolarHBondContact O-N 2.97Å; P41-E260 VanDerWaalsContact CG-OE2 3.3Å; P41-E260 WeakPolarHBondContact CG-OE2 3.48Å |
| 42 | D | 84.4 | Confident | 88.8 | Confident | 155 Ų | 155 | 44.1 Ų | 44.1 | 83% | 0.829 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -26.2 | -180 | -55.2 | -48.8 | 0 | 0 | 0 | 113 | F40 | F40-D42 VanDerWaalsContact C-N 3.27Å; F40-D42 PolarHBondContact O-N 2.92Å |
| 43 | L | 85 | Confident | 88.9 | Confident | 67 Ų | 67 | 47 Ų | 47 | 35% | 0.351 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | -29.3 | -177.1 | -169.8 | 62.1 | 0 | 0 | 0 | 112.1 | F40 P41 K53 E139 | F40-L43 HydrophobicContact CB-CB 3.81Å; F40-L43 HydrophobicContact CB-CD2 4.39Å; F40-L43 PolarHBondContact O-N 3.07Å; P41-L43 VanDerWaalsContact C-N 3.3Å; P41-L43 PolarHBondContact O-N 2.97Å; L43-K53 PolarHBondContact O-NZ 3.4Å; L43-E139 HydrophobicContact CD2-CB 4.4Å; L43-E139 HydrophobicContact CD2-CG 3.96Å |
| 44 | Y | 87.1 | Confident | 88.8 | Confident | 5 Ų | 5 | 46.8 Ų | 46.8 | 2% | 0.02 | 24% | 0.241 | C | C | . | . | trans | -127 | 109.5 | -172 | -59.8 | -61.4 | 0 | 0 | 0 | 111.9 | K36 F40 G46 C50 K53 E139 | K36-Y44 HydrophobicContact CB-CD2 4.22Å; K36-Y44 HydrophobicContact CB-CE2 3.8Å; K36-Y44 HydrophobicContact CD-CE2 4.4Å; K36-Y44 HydrophobicContact CG-CE2 4.48Å; F40-Y44 HydrophobicContact CB-CD2 4.13Å; F40-Y44 HydrophobicContact CB-CE2 4.22Å; F40-Y44 PolarHBondContact O-N 3.31Å; Y44-G46 PolarHBondContact O-N 2.88Å; Y44-C50 VanDerWaalsContact CD1-CA 3.45Å; Y44-C50 HydrophobicContact CD1-CB 3.68Å; Y44-C50 HydrophobicContact CE1-CB 4.26Å; Y44-C50 HydrophobicContact CG-CB 3.87Å; Y44-K53 HydrophobicContact CD1-CD 3.94Å; Y44-K53 HydrophobicContact CE1-CB 3.97Å; Y44-K53 HydrophobicContact CE1-CD 3.9Å; Y44-E139 HydrophobicContact CE2-CG 4.2Å; Y44-E139 VanDerWaalsContact OH-CG 3.31Å; Y44-E139 WeakPolarHBondContact OH-CG 3.21Å; Y44-E139 PolarHBondContact OH-OE1 3.44Å; Y44-E139 VanDerWaalsContact OH-OE1 3.07Å | ||
| 45 | K | 83.1 | Confident | 88.8 | Confident | 196 Ų | 196 | 51.5 Ų | 51.5 | 85% | 0.852 | 26% | 0.259 | S | S | * | . | S | Bend | trans | -75.1 | -14 | -178.6 | -62.6 | -176 | 179.8 | -178.1 | 0 | 113.5 | D49 | K45-D49 PolarHBondContact N-OD2 3.03Š|
| 46 | G | 87.8 | Confident | 88.8 | Confident | 19 Ų | 19 | 56.4 Ų | 56.4 | 20% | 0.196 | 29% | 0.289 | C | S | . | . | S | Bend | trans | 176.7 | 179.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y44 T48 D49 C50 | Y44-G46 PolarHBondContact O-N 2.88Å; G46-T48 PolarHBondContact O-N 2.83Å; G46-D49 PolarHBondContact O-N 3.24Å; G46-C50 WeakPolarHBondContact O-CB 3.36Å; G46-C50 PolarHBondContact O-N 2.82Å |
| 47 | L | 90.4 | Very high | 88.7 | Confident | 41 Ų | 41 | 60.1 Ų | 60.1 | 22% | 0.215 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -57.3 | -50.1 | -178.1 | -174.8 | 86.4 | 0 | 0 | 0 | 112.3 | I33 M37 C50 F51 A271 I274 | I33-L47 HydrophobicContact CG2-CD1 3.65Å; I33-L47 HydrophobicContact CG2-CG 4.46Å; M37-L47 HydrophobicContact SD-CB 4.43Å; L47-C50 PolarHBondContact O-N 3.28Å; L47-F51 WeakPolarHBondContact O-CB 3.33Å; L47-F51 PolarHBondContact O-N 3.42Å; L47-A271 HydrophobicContact CD1-CB 3.37Å; L47-I274 HydrophobicContact CD2-CD1 3.71Å |
| 48 | T | 91.6 | Very high | 88.4 | Confident | 103 Ų | 103 | 62 Ų | 62 | 63% | 0.632 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -67.4 | -42.2 | -176.6 | 49.1 | 0 | 0 | 0 | 0 | 111.8 | G46 F51 L52 | G46-T48 PolarHBondContact O-N 2.83Å; T48-F51 PolarHBondContact O-N 2.9Å; T48-L52 WeakPolarHBondContact O-CB 3.27Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 3.48Å |
| 49 | D | 92.4 | Very high | 88.6 | Confident | 41 Ų | 41 | 63 Ų | 63 | 22% | 0.219 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.2 | -46.3 | 174.8 | -178.3 | 50.7 | 0 | 0 | 0 | 111.2 | K45 G46 F51 L52 K53 | K45-D49 PolarHBondContact N-OD2 3.03Å; G46-D49 PolarHBondContact O-N 3.24Å; D49-F51 PolarHBondContact O-N 2.75Å; D49-L52 PolarHBondContact O-N 3.29Å; D49-K53 VanDerWaalsContact CG-NZ 3.35Å; D49-K53 WeakPolarHBondContact O-CB 3.13Å; D49-K53 WeakPolarHBondContact O-CG 3.38Å; D49-K53 PolarHBondContact O-N 3.01Å; D49-K53 WeakPolarHBondContact OD1-CE 3.29Å; D49-K53 IonicContact OD1-NZ 2.62Å; D49-K53 PolarHBondContact OD1-NZ 3.43Å; D49-K53 VanDerWaalsContact OD1-NZ 3.14Å; D49-K53 IonicContact OD2-NZ 3.82Å; D49-K53 PolarHBondContact OD2-NZ 3Å |
| 50 | C | 91.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 67.9 Ų | 67.9 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62.7 | -41.1 | 176.2 | -172.6 | 0 | 0 | 0 | 0 | 112.7 | I33 M37 Y44 G46 L47 T54 | I33-C50 HydrophobicContact CG2-CB 3.99Å; M37-C50 HydrophobicContact CG-CB 3.92Å; M37-C50 HydrophobicContact SD-CB 4.32Å; Y44-C50 VanDerWaalsContact CD1-CA 3.45Å; Y44-C50 HydrophobicContact CD1-CB 3.68Å; Y44-C50 HydrophobicContact CE1-CB 4.26Å; Y44-C50 HydrophobicContact CG-CB 3.87Å; G46-C50 WeakPolarHBondContact O-CB 3.36Å; G46-C50 PolarHBondContact O-N 2.82Å; L47-C50 PolarHBondContact O-N 3.28Å; C50-T54 VanDerWaalsContact O-CB 3.24Å; C50-T54 WeakPolarHBondContact O-CB 3.5Å; C50-T54 PolarHBondContact O-N 3.4Å; C50-T54 PolarHBondContact O-OG1 3.45Å |
| 51 | F | 93.3 | Very high | 88.7 | Confident | 91 Ų | 91 | 78 Ų | 78 | 40% | 0.399 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.1 | -53.8 | 176.5 | 179.6 | -89.8 | 0 | 0 | 0 | 111.2 | I33 L47 T48 D49 K53 T54 Y55 F63 | I33-F51 HydrophobicContact CD1-CB 4.2Å; I33-F51 HydrophobicContact CD1-CD2 3.88Å; L47-F51 WeakPolarHBondContact O-CB 3.33Å; L47-F51 PolarHBondContact O-N 3.42Å; T48-F51 PolarHBondContact O-N 2.9Å; D49-F51 PolarHBondContact O-N 2.75Å; F51-K53 PolarHBondContact O-N 3.35Å; F51-T54 PolarHBondContact O-N 3.39Å; F51-Y55 WeakPolarHBondContact O-CB 3.42Å; F51-Y55 PolarHBondContact O-N 3.5Å; F51-F63 AromaticContact CD2-CE1 3.76Å; F51-F63 HydrophobicContact CD2-CE1 3.76Å; F51-F63 AromaticContact CD2-CZ 3.6Å; F51-F63 HydrophobicContact CD2-CZ 3.6Å; F51-F63 HydrophobicContact CE2-CE1 4.13Å; F51-F63 HydrophobicContact CE2-CE2 4.22Å; F51-F63 AromaticContact CE2-CZ 3.73Å; F51-F63 HydrophobicContact CE2-CZ 3.73Å; F51-F63 HydrophobicContact CG-CZ 4.17Å; F51-F63 HydrophobicContact CZ-CZ 4.39Å |
| 52 | L | 93.1 | Very high | 88.9 | Confident | 105 Ų | 105 | 76.5 Ų | 76.5 | 55% | 0.55 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.3 | -47.6 | -177.7 | -72.7 | 169.3 | 0 | 0 | 0 | 111.3 | T48 D49 T54 Y55 T56 | T48-L52 WeakPolarHBondContact O-CB 3.27Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 3.48Å; D49-L52 PolarHBondContact O-N 3.29Å; L52-T54 PolarHBondContact O-N 2.91Å; L52-Y55 PolarHBondContact O-N 3.14Å; L52-T56 WeakPolarHBondContact O-CG2 3.36Å; L52-T56 PolarHBondContact O-N 3.14Å; L52-T56 PolarHBondContact O-OG1 2.89Å; L52-T56 VanDerWaalsContact O-OG1 3.07Å |
| 53 | K | 91.8 | Very high | 89.1 | Confident | 60 Ų | 60 | 69.3 Ų | 69.3 | 26% | 0.261 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 176.7 | -76.5 | 172.5 | 174.3 | 162.5 | 0 | 112.4 | L43 Y44 D49 F51 Y55 T56 Q57 | L43-K53 PolarHBondContact O-NZ 3.4Å; Y44-K53 HydrophobicContact CD1-CD 3.94Å; Y44-K53 HydrophobicContact CE1-CB 3.97Å; Y44-K53 HydrophobicContact CE1-CD 3.9Å; D49-K53 VanDerWaalsContact CG-NZ 3.35Å; D49-K53 WeakPolarHBondContact O-CB 3.13Å; D49-K53 WeakPolarHBondContact O-CG 3.38Å; D49-K53 PolarHBondContact O-N 3.01Å; D49-K53 WeakPolarHBondContact OD1-CE 3.29Å; D49-K53 IonicContact OD1-NZ 2.62Å; D49-K53 PolarHBondContact OD1-NZ 3.43Å; D49-K53 VanDerWaalsContact OD1-NZ 3.14Å; D49-K53 IonicContact OD2-NZ 3.82Å; D49-K53 PolarHBondContact OD2-NZ 3Å; F51-K53 PolarHBondContact O-N 3.35Å; K53-Y55 VanDerWaalsContact C-N 3.33Å; K53-Y55 PolarHBondContact O-N 2.92Å; K53-T56 PolarHBondContact O-N 3.48Å; K53-T56 PolarHBondContact O-OG1 3.48Å; K53-T56 VanDerWaalsContact O-OG1 3.14Å; K53-Q57 WeakPolarHBondContact O-CB 3.16Å; K53-Q57 WeakPolarHBondContact O-CG 3.11Å; K53-Q57 PolarHBondContact O-N 2.86Å; K53-Q57 PolarHBondContact O-OE1 3.37Å |
| 54 | T | 90.2 | Very high | 89.3 | Confident | 0 Ų | 0 | 71.2 Ų | 71.2 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 178.3 | -63.2 | 0 | 0 | 0 | 0 | 111.1 | K36 C50 F51 L52 V58 G59 F63 | K36-T54 PolarHBondContact NZ-OG1 2.62Å; K36-T54 VanDerWaalsContact NZ-OG1 3.15Å; C50-T54 VanDerWaalsContact O-CB 3.24Å; C50-T54 WeakPolarHBondContact O-CB 3.5Å; C50-T54 PolarHBondContact O-N 3.4Å; C50-T54 PolarHBondContact O-OG1 3.45Å; F51-T54 PolarHBondContact O-N 3.39Å; L52-T54 PolarHBondContact O-N 2.91Å; T54-V58 PolarHBondContact O-N 3.36Å; T54-G59 PolarHBondContact O-N 3.06Å; T54-F63 HydrophobicContact CG2-CD1 4.04Å; T54-F63 HydrophobicContact CG2-CD2 4.44Å; T54-F63 HydrophobicContact CG2-CE1 3.68Å; T54-F63 HydrophobicContact CG2-CE2 4.12Å; T54-F63 HydrophobicContact CG2-CG 4.41Å; T54-F63 HydrophobicContact CG2-CZ 3.74Å |
| 55 | Y | 92.3 | Very high | 89.2 | Confident | 119 Ų | 119 | 73.1 Ų | 73.1 | 47% | 0.467 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.8 | -42.8 | 178.2 | -175.9 | -97.1 | 0 | 0 | 0 | 112 | F51 L52 K53 G59 L60 F63 | F51-Y55 WeakPolarHBondContact O-CB 3.42Å; F51-Y55 PolarHBondContact O-N 3.5Å; L52-Y55 PolarHBondContact O-N 3.14Å; K53-Y55 VanDerWaalsContact C-N 3.33Å; K53-Y55 PolarHBondContact O-N 2.92Å; Y55-G59 WeakPolarHBondContact O-CA 3.15Å; Y55-G59 PolarHBondContact O-N 2.97Å; Y55-L60 HydrophobicContact CD2-CD2 4.03Å; Y55-L60 HydrophobicContact CD2-CG 4.41Å; Y55-L60 HydrophobicContact CE2-CD2 3.78Å; Y55-L60 HydrophobicContact CE2-CG 3.91Å; Y55-F63 HydrophobicContact CD2-CE2 4.28Å |
| 56 | T | 90.1 | Very high | 89.2 | Confident | 110 Ų | 110 | 64.2 Ų | 64.2 | 68% | 0.675 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -73.4 | -33.1 | 179.9 | 55.5 | 0 | 0 | 0 | 0 | 113.2 | L52 K53 | L52-T56 WeakPolarHBondContact O-CG2 3.36Å; L52-T56 PolarHBondContact O-N 3.14Å; L52-T56 PolarHBondContact O-OG1 2.89Å; L52-T56 VanDerWaalsContact O-OG1 3.07Å; K53-T56 PolarHBondContact O-N 3.48Å; K53-T56 PolarHBondContact O-OG1 3.48Å; K53-T56 VanDerWaalsContact O-OG1 3.14Å |
| 57 | Q | 87.4 | Confident | 89.3 | Confident | 81 Ų | 81 | 64.3 Ų | 64.3 | 38% | 0.379 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -82.6 | -41.4 | -176.6 | -71.2 | 172.2 | -17.7 | 0 | 0 | 113.8 | K53 Y138 | K53-Q57 WeakPolarHBondContact O-CB 3.16Å; K53-Q57 WeakPolarHBondContact O-CG 3.11Å; K53-Q57 PolarHBondContact O-N 2.86Å; K53-Q57 PolarHBondContact O-OE1 3.37Å; Q57-Y138 HydrophobicContact CB-CE1 3.85Å; Q57-Y138 HydrophobicContact CG-CE1 4.33Å |
| 58 | V | 85.4 | Confident | 89.2 | Confident | 55 Ų | 55 | 64 Ų | 64 | 33% | 0.333 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -124.7 | -15.5 | -171.4 | -169.6 | 0 | 0 | 0 | 0 | 112.2 | T54 Y138 | T54-V58 PolarHBondContact O-N 3.36Å; V58-Y138 HydrophobicContact CG2-CD1 3.83Å; V58-Y138 HydrophobicContact CG2-CD2 3.93Å; V58-Y138 HydrophobicContact CG2-CE1 3.94Å; V58-Y138 HydrophobicContact CG2-CE2 4.02Å; V58-Y138 HydrophobicContact CG2-CG 3.82Å |
| 59 | G | 89 | Confident | 89.1 | Confident | 22 Ų | 22 | 59.1 Ų | 59.1 | 23% | 0.227 | 29% | 0.294 | C | S | . | . | trans | 74.2 | -166.8 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T54 Y55 R61 G62 | T54-G59 PolarHBondContact O-N 3.06Å; Y55-G59 WeakPolarHBondContact O-CA 3.15Å; Y55-G59 PolarHBondContact O-N 2.97Å; G59-R61 PolarHBondContact O-N 3.37Å; G59-G62 PolarHBondContact O-N 3.33Å | ||
| 60 | L | 88.5 | Confident | 88.9 | Confident | 110 Ų | 110 | 57.4 Ų | 57.4 | 58% | 0.576 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -58.5 | -31.9 | -178.1 | -70.2 | 175.7 | 0 | 0 | 0 | 113.3 | Y55 G62 F63 Y64 | Y55-L60 HydrophobicContact CD2-CD2 4.03Å; Y55-L60 HydrophobicContact CD2-CG 4.41Å; Y55-L60 HydrophobicContact CE2-CD2 3.78Å; Y55-L60 HydrophobicContact CE2-CG 3.91Å; L60-G62 PolarHBondContact O-N 3.37Å; L60-F63 PolarHBondContact O-N 3.32Å; L60-Y64 WeakPolarHBondContact O-CD2 3.33Å |
| 61 | R | 86.4 | Confident | 88.8 | Confident | 223 Ų | 223 | 59.8 Ų | 59.8 | 84% | 0.842 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -62.2 | -26.1 | 178 | -68.2 | -178.1 | 175.9 | 178.4 | -0.9 | 112.8 | G59 F63 Y64 K65 | G59-R61 PolarHBondContact O-N 3.37Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.08Å; R61-Y64 PolarHBondContact O-N 3.49Å; R61-K65 PolarHBondContact O-N 3.01Å |
| 62 | G | 85 | Confident | 88.6 | Confident | 4 Ų | 4 | 60.4 Ų | 60.4 | 4% | 0.041 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G59 L60 | G59-G62 PolarHBondContact O-N 3.33Å; L60-G62 PolarHBondContact O-N 3.37Å |
| 63 | F | 89.4 | Confident | 88.4 | Confident | 4 Ų | 4 | 55.7 Ų | 55.7 | 2% | 0.018 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -71.9 | -31.5 | -178.9 | -64.2 | -71.8 | 0 | 0 | 0 | 113.3 | Q28 P29 T32 I33 F51 T54 Y55 L60 R61 | Q28-F63 WeakPolarHBondContact CG-O 3.46Å; P29-F63 HydrophobicContact CB-CB 4.02Å; P29-F63 HydrophobicContact CB-CD1 4.21Å; P29-F63 HydrophobicContact CB-CG 4.3Å; P29-F63 HydrophobicContact CG-CB 4.28Å; T32-F63 PolarHBondContact OG1-O 3.19Å; I33-F63 HydrophobicContact CD1-CD1 4.34Å; I33-F63 HydrophobicContact CD1-CE1 3.92Å; I33-F63 HydrophobicContact CG1-CD1 4.26Å; I33-F63 HydrophobicContact CG1-CE1 3.93Å; F51-F63 AromaticContact CD2-CE1 3.76Å; F51-F63 HydrophobicContact CD2-CE1 3.76Å; F51-F63 AromaticContact CD2-CZ 3.6Å; F51-F63 HydrophobicContact CD2-CZ 3.6Å; F51-F63 HydrophobicContact CE2-CE1 4.13Å; F51-F63 HydrophobicContact CE2-CE2 4.22Å; F51-F63 AromaticContact CE2-CZ 3.73Å; F51-F63 HydrophobicContact CE2-CZ 3.73Å; F51-F63 HydrophobicContact CG-CZ 4.17Å; F51-F63 HydrophobicContact CZ-CZ 4.39Å; T54-F63 HydrophobicContact CG2-CD1 4.04Å; T54-F63 HydrophobicContact CG2-CD2 4.44Å; T54-F63 HydrophobicContact CG2-CE1 3.68Å; T54-F63 HydrophobicContact CG2-CE2 4.12Å; T54-F63 HydrophobicContact CG2-CG 4.41Å; T54-F63 HydrophobicContact CG2-CZ 3.74Å; Y55-F63 HydrophobicContact CD2-CE2 4.28Å; L60-F63 PolarHBondContact O-N 3.32Å; R61-F63 VanDerWaalsContact C-N 3.3Å; R61-F63 PolarHBondContact O-N 3.08Å |
| 64 | Y | 89.9 | Confident | 88.1 | Confident | 106 Ų | 106 | 56.5 Ų | 56.5 | 42% | 0.416 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.5 | 7.8 | -178.6 | -67.3 | -85 | 0 | 0 | 0 | 113.3 | L25 Q28 P29 L60 R61 G66 T67 | L25-Y64 HydrophobicContact CD2-CE1 4.45Å; L25-Y64 VanDerWaalsContact O-CE1 3.27Å; L25-Y64 WeakPolarHBondContact O-CE1 3.33Å; Q28-Y64 HydrophobicContact CB-CD1 4.43Å; Q28-Y64 HydrophobicContact CG-CD1 4.41Å; P29-Y64 HydrophobicContact CG-CE1 4.45Å; P29-Y64 HydrophobicContact CG-CE2 4.34Å; L60-Y64 WeakPolarHBondContact O-CD2 3.33Å; R61-Y64 PolarHBondContact O-N 3.49Å; Y64-G66 PolarHBondContact O-N 3.08Å; Y64-T67 PolarHBondContact O-N 3.15Å; Y64-T67 PolarHBondContact O-OG1 3.3Å |
| 65 | K | 84.2 | Confident | 88 | Confident | 46 Ų | 46 | 60.7 Ų | 60.7 | 20% | 0.2 | 31% | 0.308 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | 125.1 | 171.2 | -161.4 | 172.2 | 176.8 | -171.7 | 0 | 108.3 | Q28 R61 L134 Q135 N151 | Q28-K65 PolarHBondContact NE2-O 3.05Å; Q28-K65 VanDerWaalsContact NE2-O 3.14Å; R61-K65 PolarHBondContact O-N 3.01Å; K65-L134 WeakPolarHBondContact CD-O 3.38Å; K65-L134 WeakPolarHBondContact CE-O 3.28Å; K65-L134 HydrophobicContact CG-CB 4.47Å; K65-L134 PolarHBondContact NZ-O 2.98Å; K65-Q135 VanDerWaalsContact O-CG 3.28Å; K65-Q135 WeakPolarHBondContact O-CG 3.41Å; K65-N151 VanDerWaalsContact NZ-CG 3.3Å; K65-N151 PolarHBondContact NZ-OD1 3.49Å |
| 66 | G | 83.4 | Confident | 87.8 | Confident | 9 Ų | 9 | 56.4 Ų | 56.4 | 9% | 0.093 | 30% | 0.297 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 92.9 | 2.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | Y64 G68 P69 A70 | Y64-G66 PolarHBondContact O-N 3.08Å; G66-G68 VanDerWaalsContact C-N 3.32Å; G66-G68 PolarHBondContact O-N 3.27Å; G66-P69 WeakPolarHBondContact O-CD 3.34Å; G66-A70 WeakPolarHBondContact O-CB 3.12Å; G66-A70 PolarHBondContact O-N 3.03Å |
| 67 | T | 88.9 | Confident | 87.6 | Confident | 20 Ų | 20 | 53.9 Ų | 53.9 | 12% | 0.123 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -57.3 | -41.1 | 177.3 | -57.9 | 0 | 0 | 0 | 0 | 112.9 | L25 Y64 A70 L71 | L25-T67 HydrophobicContact CD2-CG2 3.7Å; Y64-T67 PolarHBondContact O-N 3.15Å; Y64-T67 PolarHBondContact O-OG1 3.3Å; T67-A70 WeakPolarHBondContact O-CB 3.08Å; T67-A70 PolarHBondContact O-N 3.05Å; T67-L71 HydrophobicContact CG2-CD1 4.04Å; T67-L71 HydrophobicContact CG2-CG 4.32Å; T67-L71 WeakPolarHBondContact O-CG 3.23Å; T67-L71 PolarHBondContact O-N 3.26Å |
| 68 | G | 89.5 | Confident | 87.6 | Confident | 34 Ų | 34 | 52 Ų | 52 | 35% | 0.351 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.3 | -57 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G66 A70 L71 M72 | G66-G68 VanDerWaalsContact C-N 3.32Å; G66-G68 PolarHBondContact O-N 3.27Å; G68-A70 VanDerWaalsContact C-N 3.26Å; G68-A70 PolarHBondContact O-N 3.21Å; G68-L71 PolarHBondContact O-N 3.42Å; G68-M72 PolarHBondContact O-N 2.96Å |
| 69 | P | 88.6 | Confident | 87.7 | Confident | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.006 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -56.3 | -35.7 | 171.8 | -29.6 | 37.3 | 0 | 0 | 0 | 114 | G66 M72 A73 V130 K131 L134 I153 | G66-P69 WeakPolarHBondContact O-CD 3.34Å; P69-M72 HydrophobicContact CB-CE 4.46Å; P69-M72 HydrophobicContact CG-CE 4.38Å; P69-M72 PolarHBondContact O-N 2.91Å; P69-A73 WeakPolarHBondContact O-CB 3.28Å; P69-A73 PolarHBondContact O-N 3.29Å; P69-V130 HydrophobicContact CB-CG1 4.36Å; P69-V130 HydrophobicContact CG-CG1 3.95Å; P69-K131 HydrophobicContact CB-CB 4Å; P69-L134 HydrophobicContact CG-CD1 3.86Å; P69-I153 HydrophobicContact CG-CD1 4.12Å; P69-I153 HydrophobicContact CG-CG1 4.04Å; P69-I153 HydrophobicContact CG-CG2 4.35Å |
| 70 | A | 87.9 | Confident | 87.7 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 5% | 0.05 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65 | -41.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | V24 G66 T67 G68 A73 Y74 K131 | V24-A70 HydrophobicContact CG1-CB 3.9Å; G66-A70 WeakPolarHBondContact O-CB 3.12Å; G66-A70 PolarHBondContact O-N 3.03Å; T67-A70 WeakPolarHBondContact O-CB 3.08Å; T67-A70 PolarHBondContact O-N 3.05Å; G68-A70 VanDerWaalsContact C-N 3.26Å; G68-A70 PolarHBondContact O-N 3.21Å; A70-A73 WeakPolarHBondContact O-CB 3.45Å; A70-A73 PolarHBondContact O-N 3Å; A70-Y74 WeakPolarHBondContact O-CB 3.48Å; A70-Y74 PolarHBondContact O-N 3.02Å; A70-K131 HydrophobicContact CB-CD 3.71Å; A70-K131 HydrophobicContact CB-CG 4.34Å |
| 71 | L | 90.5 | Very high | 87.6 | Confident | 50 Ų | 50 | 49.6 Ų | 49.6 | 26% | 0.262 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -66.4 | -44.4 | 175 | -72.4 | 169.1 | 0 | 0 | 0 | 111.1 | T21 V24 T67 G68 A73 Y74 V75 | T21-L71 HydrophobicContact CG2-CD2 4.31Å; V24-L71 HydrophobicContact CB-CD2 3.66Å; V24-L71 HydrophobicContact CB-CG 4.41Å; V24-L71 HydrophobicContact CG1-CD2 3.74Å; V24-L71 HydrophobicContact CG1-CG 3.92Å; V24-L71 HydrophobicContact CG2-CD2 3.98Å; T67-L71 HydrophobicContact CG2-CD1 4.04Å; T67-L71 HydrophobicContact CG2-CG 4.32Å; T67-L71 WeakPolarHBondContact O-CG 3.23Å; T67-L71 PolarHBondContact O-N 3.26Å; G68-L71 PolarHBondContact O-N 3.42Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.18Å; L71-Y74 PolarHBondContact O-N 3.47Å; L71-V75 WeakPolarHBondContact O-CG2 3.47Å; L71-V75 PolarHBondContact O-N 3Å |
| 72 | M | 89.6 | Confident | 87.6 | Confident | 103 Ų | 103 | 46.3 Ų | 46.3 | 51% | 0.507 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61.6 | -42 | 175.9 | -70.5 | -171.3 | -65.2 | 0 | 0 | 111.9 | G68 P69 V75 A76 T127 | G68-M72 PolarHBondContact O-N 2.96Å; P69-M72 HydrophobicContact CB-CE 4.46Å; P69-M72 HydrophobicContact CG-CE 4.38Å; P69-M72 PolarHBondContact O-N 2.91Å; M72-V75 PolarHBondContact O-N 3.34Å; M72-A76 VanDerWaalsContact O-CB 3.23Å; M72-A76 WeakPolarHBondContact O-CB 3.49Å; M72-A76 PolarHBondContact O-N 3.36Å; M72-T127 HydrophobicContact CB-CG2 4.24Å |
| 73 | A | 87.5 | Confident | 87.7 | Confident | 7 Ų | 7 | 52.8 Ų | 52.8 | 6% | 0.058 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -56.4 | -50.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | P69 A70 L71 V75 A76 E77 L124 T127 | P69-A73 WeakPolarHBondContact O-CB 3.28Å; P69-A73 PolarHBondContact O-N 3.29Å; A70-A73 WeakPolarHBondContact O-CB 3.45Å; A70-A73 PolarHBondContact O-N 3Å; L71-A73 VanDerWaalsContact C-N 3.32Å; L71-A73 PolarHBondContact O-N 3.18Å; A73-V75 PolarHBondContact O-N 3.13Å; A73-A76 PolarHBondContact O-N 3.22Å; A73-E77 WeakPolarHBondContact O-CB 3.28Å; A73-E77 PolarHBondContact O-N 2.99Å; A73-L124 HydrophobicContact CB-CD1 3.7Å; A73-T127 VanDerWaalsContact CA-OG1 3.27Å; A73-T127 WeakPolarHBondContact CA-OG1 3.37Å; A73-T127 VanDerWaalsContact CB-OG1 3.23Å; A73-T127 WeakPolarHBondContact CB-OG1 3.47Å |
| 74 | Y | 86.7 | Confident | 87.7 | Confident | 76 Ų | 76 | 53.4 Ų | 53.4 | 30% | 0.298 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.4 | -45.3 | 179.4 | -177.9 | -95.5 | 0 | 0 | 0 | 112.5 | V24 A70 L71 N78 | V24-Y74 HydrophobicContact CG2-CD2 4.47Å; V24-Y74 HydrophobicContact CG2-CG 4.24Å; A70-Y74 WeakPolarHBondContact O-CB 3.48Å; A70-Y74 PolarHBondContact O-N 3.02Å; L71-Y74 PolarHBondContact O-N 3.47Å; Y74-N78 WeakPolarHBondContact CE2-ND2 3.48Å; Y74-N78 WeakPolarHBondContact O-CB 3.45Å; Y74-N78 PolarHBondContact O-N 3.17Å; Y74-N78 VanDerWaalsContact O-N 3.17Å; Y74-N78 PolarHBondContact O-ND2 3.45Å |
| 75 | V | 88.2 | Confident | 87.5 | Confident | 89 Ų | 89 | 51.7 Ų | 51.7 | 54% | 0.539 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -65.4 | -48.7 | 178 | 176.3 | 0 | 0 | 0 | 0 | 110.7 | L71 M72 A73 E77 N78 S79 | L71-V75 WeakPolarHBondContact O-CG2 3.47Å; L71-V75 PolarHBondContact O-N 3Å; M72-V75 PolarHBondContact O-N 3.34Å; A73-V75 PolarHBondContact O-N 3.13Å; V75-E77 PolarHBondContact O-N 3.43Å; V75-N78 PolarHBondContact O-N 2.94Å; V75-S79 WeakPolarHBondContact O-CB 3.24Å; V75-S79 PolarHBondContact O-N 2.94Å; V75-S79 PolarHBondContact O-OG 2.83Å |
| 76 | A | 88.1 | Confident | 87.6 | Confident | 29 Ų | 29 | 51.1 Ų | 51.1 | 24% | 0.24 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.7 | -44.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | M72 A73 S79 V80 A123 | M72-A76 VanDerWaalsContact O-CB 3.23Å; M72-A76 WeakPolarHBondContact O-CB 3.49Å; M72-A76 PolarHBondContact O-N 3.36Å; A73-A76 PolarHBondContact O-N 3.22Å; A76-S79 PolarHBondContact O-N 3.42Å; A76-V80 WeakPolarHBondContact O-CB 3.43Å; A76-V80 WeakPolarHBondContact O-CG2 3.24Å; A76-V80 PolarHBondContact O-N 3.49Å; A76-A123 HydrophobicContact CB-CB 4.33Å |
| 77 | E | 86.4 | Confident | 87.8 | Confident | 56 Ų | 56 | 56.8 Ų | 56.8 | 26% | 0.262 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.5 | -54 | 177.4 | -176.9 | -174.9 | 175.1 | 0 | 0 | 111 | A73 V75 S79 V80 L81 A120 | A73-E77 WeakPolarHBondContact O-CB 3.28Å; A73-E77 PolarHBondContact O-N 2.99Å; V75-E77 PolarHBondContact O-N 3.43Å; E77-S79 PolarHBondContact O-N 3.05Å; E77-V80 PolarHBondContact O-N 3.37Å; E77-L81 VanDerWaalsContact O-CB 3.23Å; E77-L81 WeakPolarHBondContact O-CB 3.49Å; E77-L81 PolarHBondContact O-N 3.39Å; E77-A120 HydrophobicContact CG-CB 4.19Å |
| 78 | N | 86.1 | Confident | 87.7 | Confident | 42 Ų | 42 | 56 Ų | 56 | 23% | 0.225 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.6 | -41.8 | -179 | -77.5 | -75.4 | 0 | 0 | 0 | 111.9 | Y74 V75 V80 L81 F82 | Y74-N78 WeakPolarHBondContact CE2-ND2 3.48Å; Y74-N78 WeakPolarHBondContact O-CB 3.45Å; Y74-N78 PolarHBondContact O-N 3.17Å; Y74-N78 VanDerWaalsContact O-N 3.17Å; Y74-N78 PolarHBondContact O-ND2 3.45Å; V75-N78 PolarHBondContact O-N 2.94Å; N78-V80 PolarHBondContact O-N 3.31Å; N78-L81 PolarHBondContact O-N 2.96Å; N78-F82 HydrophobicContact CB-CE2 4.46Å; N78-F82 WeakPolarHBondContact O-CD2 3.26Å; N78-F82 PolarHBondContact O-N 2.97Å |
| 79 | S | 87.9 | Confident | 87.6 | Confident | 71 Ų | 71 | 56.2 Ų | 56.2 | 50% | 0.497 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.1 | -47.4 | 177.6 | -66.5 | 0 | 0 | 0 | 0 | 112.1 | V75 A76 E77 M83 | V75-S79 WeakPolarHBondContact O-CB 3.24Å; V75-S79 PolarHBondContact O-N 2.94Å; V75-S79 PolarHBondContact O-OG 2.83Å; A76-S79 PolarHBondContact O-N 3.42Å; E77-S79 PolarHBondContact O-N 3.05Å; S79-M83 VanDerWaalsContact O-CB 3.3Å; S79-M83 WeakPolarHBondContact O-CB 3.49Å; S79-M83 PolarHBondContact O-N 3.4Å |
| 80 | V | 88.9 | Confident | 87.5 | Confident | 30 Ų | 30 | 62.5 Ų | 62.5 | 18% | 0.182 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -70.4 | -39.5 | 179.9 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | A76 E77 N78 F82 M83 C84 F119 A120 A123 | A76-V80 WeakPolarHBondContact O-CB 3.43Å; A76-V80 WeakPolarHBondContact O-CG2 3.24Å; A76-V80 PolarHBondContact O-N 3.49Å; E77-V80 PolarHBondContact O-N 3.37Å; N78-V80 PolarHBondContact O-N 3.31Å; V80-F82 PolarHBondContact O-N 3.38Å; V80-M83 PolarHBondContact O-N 2.92Å; V80-C84 WeakPolarHBondContact O-CB 2.9Å; V80-C84 PolarHBondContact O-N 3.49Å; V80-C84 PolarHBondContact O-SG 2.93Å; V80-F119 HydrophobicContact CG1-CB 3.91Å; V80-A120 HydrophobicContact CG1-CB 4.45Å; V80-A123 HydrophobicContact CB-CB 4.38Å; V80-A123 HydrophobicContact CG2-CB 3.7Å |
| 81 | L | 87.1 | Confident | 87.5 | Confident | 35 Ų | 35 | 66.9 Ų | 66.9 | 18% | 0.183 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -55.9 | -54.8 | 175.5 | -173.6 | 73.2 | 0 | 0 | 0 | 110.4 | E77 N78 M83 C84 Y85 A116 A120 | E77-L81 VanDerWaalsContact O-CB 3.23Å; E77-L81 WeakPolarHBondContact O-CB 3.49Å; E77-L81 PolarHBondContact O-N 3.39Å; N78-L81 PolarHBondContact O-N 2.96Å; L81-M83 PolarHBondContact O-N 3.28Å; L81-C84 PolarHBondContact O-N 3.29Å; L81-Y85 WeakPolarHBondContact O-CA 3.43Å; L81-Y85 WeakPolarHBondContact O-CB 3.3Å; L81-Y85 PolarHBondContact O-N 3.4Å; L81-A116 HydrophobicContact CD1-CB 3.85Å; L81-A120 HydrophobicContact CB-CB 4.36Å |
| 82 | F | 85.4 | Confident | 87.3 | Confident | 154 Ų | 154 | 65.1 Ų | 65.1 | 68% | 0.675 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -63.4 | -39 | -179.7 | -76 | -61.3 | 0 | 0 | 0 | 113.2 | N78 V80 | N78-F82 HydrophobicContact CB-CE2 4.46Å; N78-F82 WeakPolarHBondContact O-CD2 3.26Å; N78-F82 PolarHBondContact O-N 2.97Å; V80-F82 PolarHBondContact O-N 3.38Å |
| 83 | M | 88.5 | Confident | 87.1 | Confident | 141 Ų | 141 | 62.1 Ų | 62.1 | 70% | 0.695 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.8 | -46.1 | 177.1 | -176.4 | -176.4 | 72.1 | 0 | 0 | 111.8 | S79 V80 L81 | S79-M83 VanDerWaalsContact O-CB 3.3Å; S79-M83 WeakPolarHBondContact O-CB 3.49Å; S79-M83 PolarHBondContact O-N 3.4Å; V80-M83 PolarHBondContact O-N 2.92Å; L81-M83 PolarHBondContact O-N 3.28Å |
| 84 | C | 88.2 | Confident | 87 | Confident | 16 Ų | 16 | 70.1 Ų | 70.1 | 11% | 0.108 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -83.9 | -19.9 | -175.7 | -67.9 | 0 | 0 | 0 | 0 | 113 | V80 L81 G86 F87 C88 A116 F119 | V80-C84 WeakPolarHBondContact O-CB 2.9Å; V80-C84 PolarHBondContact O-N 3.49Å; V80-C84 PolarHBondContact O-SG 2.93Å; L81-C84 PolarHBondContact O-N 3.29Å; C84-G86 PolarHBondContact O-N 2.94Å; C84-F87 PolarHBondContact O-N 3.44Å; C84-C88 PolarHBondContact O-N 2.91Å; C84-C88 PolarHBondContact O-SG 3.41Å; C84-A116 HydrophobicContact CB-CB 4.44Å; C84-F119 HydrophobicContact CB-CB 4.1Å; C84-F119 HydrophobicContact CB-CD2 4.06Å; C84-F119 HydrophobicContact CB-CG 4.23Å |
| 85 | Y | 86.4 | Confident | 87 | Confident | 70 Ų | 70 | 71.7 Ų | 71.7 | 28% | 0.275 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.5 | -47.1 | -174.2 | -174 | -122.9 | 0 | 0 | 0 | 112.7 | L81 F87 C88 Q89 T109 A116 | L81-Y85 WeakPolarHBondContact O-CA 3.43Å; L81-Y85 WeakPolarHBondContact O-CB 3.3Å; L81-Y85 PolarHBondContact O-N 3.4Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; Y85-F87 PolarHBondContact O-N 2.98Å; Y85-C88 PolarHBondContact O-N 2.85Å; Y85-Q89 HydrophobicContact CD2-CG 4.49Å; Y85-Q89 HydrophobicContact CE1-CG 4.33Å; Y85-Q89 HydrophobicContact CE2-CG 4.26Å; Y85-Q89 WeakPolarHBondContact O-CG 3.33Å; Y85-Q89 PolarHBondContact O-N 3.29Å; Y85-Q89 PolarHBondContact OH-NE2 3.33Å; Y85-T109 WeakPolarHBondContact OH-CG2 3.32Å; Y85-A116 HydrophobicContact CD2-CB 4.23Å |
| 86 | G | 85.4 | Confident | 86.8 | Confident | 34 Ų | 34 | 69.7 Ų | 69.7 | 35% | 0.351 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.2 | -40.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | C84 Q89 Q90 | C84-G86 PolarHBondContact O-N 2.94Å; G86-Q89 PolarHBondContact O-N 3.18Å; G86-Q90 WeakPolarHBondContact O-CG 3.42Å; G86-Q90 PolarHBondContact O-N 3.13Å; G86-Q90 VanDerWaalsContact O-N 3.15Å |
| 87 | F | 87.7 | Confident | 86.5 | Confident | 129 Ų | 129 | 71.7 Ų | 71.7 | 57% | 0.566 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -64.1 | -46.5 | 174.9 | 173.9 | -97.3 | 0 | 0 | 0 | 111.8 | C84 Y85 Q89 Q90 F91 | C84-F87 PolarHBondContact O-N 3.44Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; Y85-F87 PolarHBondContact O-N 2.98Å; F87-Q89 VanDerWaalsContact C-N 3.31Å; F87-Q89 PolarHBondContact O-N 3.21Å; F87-Q90 PolarHBondContact O-N 3.31Å; F87-Q90 VanDerWaalsContact O-N 3.15Å; F87-F91 PolarHBondContact O-N 3.21Å |
| 88 | C | 88.1 | Confident | 86.3 | Confident | 3 Ų | 3 | 71.7 Ų | 71.7 | 2% | 0.02 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.6 | -37.5 | 179.3 | -64.6 | 0 | 0 | 0 | 0 | 111.8 | C84 Y85 F91 V92 A112 F115 A116 | C84-C88 PolarHBondContact O-N 2.91Å; C84-C88 PolarHBondContact O-SG 3.41Å; Y85-C88 PolarHBondContact O-N 2.85Å; C88-F91 PolarHBondContact O-N 3.5Å; C88-V92 WeakPolarHBondContact O-CG2 3.47Å; C88-V92 PolarHBondContact O-N 2.94Å; C88-A112 HydrophobicContact CB-CB 4.27Å; C88-A112 VanDerWaalsContact CB-O 3.23Å; C88-A112 WeakPolarHBondContact CB-O 3.42Å; C88-F115 HydrophobicContact CB-CB 4.1Å; C88-A116 HydrophobicContact CB-CB 4.3Å; C88-A116 PolarHBondContact SG-N 2.95Å |
| 89 | Q | 86.7 | Confident | 85.9 | Confident | 39 Ų | 39 | 76.2 Ų | 76.2 | 18% | 0.182 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 173.6 | -73.3 | -172 | -17.1 | 0 | 0 | 112.2 | Y85 G86 F87 F91 V92 R93 L104 A112 | Y85-Q89 HydrophobicContact CD2-CG 4.49Å; Y85-Q89 HydrophobicContact CE1-CG 4.33Å; Y85-Q89 HydrophobicContact CE2-CG 4.26Å; Y85-Q89 WeakPolarHBondContact O-CG 3.33Å; Y85-Q89 PolarHBondContact O-N 3.29Å; Y85-Q89 PolarHBondContact OH-NE2 3.33Å; G86-Q89 PolarHBondContact O-N 3.18Å; F87-Q89 VanDerWaalsContact C-N 3.31Å; F87-Q89 PolarHBondContact O-N 3.21Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; Q89-V92 PolarHBondContact O-N 3.41Å; Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 3.25Å; Q89-R93 PolarHBondContact O-NH1 2.96Å; Q89-L104 HydrophobicContact CB-CD1 3.82Å; Q89-L104 HydrophobicContact CG-CD1 3.8Å; Q89-A112 HydrophobicContact CB-CB 4.36Å; Q89-A112 HydrophobicContact CG-CB 3.84Å |
| 90 | Q | 86.5 | Confident | 85.1 | Confident | 132 Ų | 132 | 82.1 Ų | 82.1 | 62% | 0.617 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.3 | -40.2 | 175.8 | -70.8 | -178.1 | 5.1 | 0 | 0 | 111.9 | G86 F87 R93 K94 | G86-Q90 WeakPolarHBondContact O-CG 3.42Å; G86-Q90 PolarHBondContact O-N 3.13Å; G86-Q90 VanDerWaalsContact O-N 3.15Å; F87-Q90 PolarHBondContact O-N 3.31Å; F87-Q90 VanDerWaalsContact O-N 3.15Å; Q90-R93 PolarHBondContact O-N 2.98Å; Q90-K94 PolarHBondContact O-N 3.5Å |
| 91 | F | 87.9 | Confident | 84.3 | Confident | 99 Ų | 99 | 89.7 Ų | 89.7 | 43% | 0.434 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.5 | -48.8 | 175.7 | -179.7 | -100.8 | 0 | 0 | 0 | 111.7 | F87 C88 Q89 R93 K94 V95 | F87-F91 PolarHBondContact O-N 3.21Å; C88-F91 PolarHBondContact O-N 3.5Å; Q89-F91 VanDerWaalsContact C-N 3.34Å; F91-R93 PolarHBondContact O-N 2.71Å; F91-K94 WeakPolarHBondContact O-CB 3.46Å; F91-K94 PolarHBondContact O-N 3.19Å; F91-V95 HydrophobicContact CD1-CG2 4.33Å; F91-V95 HydrophobicContact CE1-CG2 3.91Å; F91-V95 HydrophobicContact CE2-CG2 4.2Å; F91-V95 HydrophobicContact CZ-CG2 3.84Å; F91-V95 WeakPolarHBondContact O-CG2 3.5Å; F91-V95 PolarHBondContact O-N 2.77Å |
| 92 | V | 85.6 | Confident | 83.8 | Confident | 12 Ų | 12 | 89.4 Ų | 89.4 | 7% | 0.073 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -61.7 | -42.1 | 178.1 | 173.6 | 0 | 0 | 0 | 0 | 111.7 | C88 Q89 K94 V95 A96 L104 Q108 T111 A112 F115 | C88-V92 WeakPolarHBondContact O-CG2 3.47Å; C88-V92 PolarHBondContact O-N 2.94Å; Q89-V92 PolarHBondContact O-N 3.41Å; V92-K94 VanDerWaalsContact C-N 3.31Å; V92-K94 PolarHBondContact O-N 3.41Å; V92-V95 PolarHBondContact O-N 3.13Å; V92-A96 VanDerWaalsContact O-CB 3.3Å; V92-A96 WeakPolarHBondContact O-CB 3.48Å; V92-A96 PolarHBondContact O-N 2.97Å; V92-L104 HydrophobicContact CB-CD2 4.36Å; V92-L104 HydrophobicContact CG1-CD2 3.84Å; V92-Q108 HydrophobicContact CG1-CB 3.81Å; V92-Q108 HydrophobicContact CG1-CG 4.33Å; V92-T111 HydrophobicContact CG2-CG2 4.1Å; V92-A112 HydrophobicContact CB-CB 4.44Å; V92-A112 HydrophobicContact CG2-CB 3.93Å; V92-F115 HydrophobicContact CG2-CD2 4.2Å; V92-F115 HydrophobicContact CG2-CE2 4.47Å |
| 93 | R | 84.8 | Confident | 83.4 | Confident | 41 Ų | 41 | 91.5 Ų | 91.5 | 16% | 0.155 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -58.2 | -43.4 | 175 | -72.1 | -179.1 | -168.2 | 100.1 | -0.2 | 111.9 | Q89 Q90 F91 A96 G97 M98 A102 L104 | Q89-R93 WeakPolarHBondContact O-CG 3.22Å; Q89-R93 PolarHBondContact O-N 3.25Å; Q89-R93 PolarHBondContact O-NH1 2.96Å; Q90-R93 PolarHBondContact O-N 2.98Å; F91-R93 PolarHBondContact O-N 2.71Å; R93-A96 PolarHBondContact O-N 3.47Å; R93-G97 PolarHBondContact O-N 3.31Å; R93-M98 HydrophobicContact CB-CB 4.5Å; R93-M98 PolarHBondContact O-N 3.29Å; R93-A102 PolarHBondContact NE-O 3.06Å; R93-L104 HydrophobicContact CG-CD1 4.38Å; R93-L104 HydrophobicContact CG-CD2 3.83Å; R93-L104 HydrophobicContact CG-CG 4.06Å |
| 94 | K | 87.2 | Confident | 82.8 | Confident | 175 Ų | 175 | 85.8 Ų | 85.8 | 76% | 0.761 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.9 | -43.8 | 179.3 | -171.9 | -179.9 | 179.3 | -177.1 | 0 | 111.9 | Q90 F91 V92 A96 G97 | Q90-K94 PolarHBondContact O-N 3.5Å; F91-K94 WeakPolarHBondContact O-CB 3.46Å; F91-K94 PolarHBondContact O-N 3.19Å; V92-K94 VanDerWaalsContact C-N 3.31Å; V92-K94 PolarHBondContact O-N 3.41Å; K94-A96 VanDerWaalsContact C-N 3.33Å; K94-G97 PolarHBondContact O-N 3.03Å |
| 95 | V | 86.3 | Confident | 82.3 | Confident | 109 Ų | 109 | 88.2 Ų | 88.2 | 66% | 0.661 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -67.2 | -36 | 178.2 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | F91 V92 G97 | F91-V95 HydrophobicContact CD1-CG2 4.33Å; F91-V95 HydrophobicContact CE1-CG2 3.91Å; F91-V95 HydrophobicContact CE2-CG2 4.2Å; F91-V95 HydrophobicContact CZ-CG2 3.84Å; F91-V95 WeakPolarHBondContact O-CG2 3.5Å; F91-V95 PolarHBondContact O-N 2.77Å; V92-V95 PolarHBondContact O-N 3.13Å; V95-G97 PolarHBondContact O-N 3Å |
| 96 | A | 83.3 | Confident | 81.8 | Confident | 47 Ų | 47 | 89 Ų | 89 | 39% | 0.388 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78 | 0 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | V92 R93 K94 M98 | V92-A96 VanDerWaalsContact O-CB 3.3Å; V92-A96 WeakPolarHBondContact O-CB 3.48Å; V92-A96 PolarHBondContact O-N 2.97Å; R93-A96 PolarHBondContact O-N 3.47Å; K94-A96 VanDerWaalsContact C-N 3.33Å; A96-M98 HydrophobicContact CB-CG 3.83Å; A96-M98 HydrophobicContact CB-SD 3.82Å; A96-M98 PolarHBondContact O-N 2.9Å |
| 97 | G | 82.9 | Confident | 81.3 | Confident | 71 Ų | 71 | 92.5 Ų | 92.5 | 73% | 0.732 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.2 | 24.7 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | R93 K94 V95 | R93-G97 PolarHBondContact O-N 3.31Å; K94-G97 PolarHBondContact O-N 3.03Å; V95-G97 PolarHBondContact O-N 3Å |
| 98 | M | 81.3 | Confident | 80.9 | Confident | 56 Ų | 56 | 88.4 Ų | 88.4 | 28% | 0.276 | 46% | 0.46 | S | S | . | . | trans | -92.6 | 152.9 | -175.7 | -61.6 | 173.5 | 78.9 | 0 | 0 | 112.1 | R93 A96 A102 K103 Q108 | R93-M98 HydrophobicContact CB-CB 4.5Å; R93-M98 PolarHBondContact O-N 3.29Å; A96-M98 HydrophobicContact CB-CG 3.83Å; A96-M98 HydrophobicContact CB-SD 3.82Å; A96-M98 PolarHBondContact O-N 2.9Å; M98-A102 HydrophobicContact CB-CB 4.14Å; M98-A102 HydrophobicContact CE-CB 3.75Å; M98-K103 WeakPolarHBondContact CE-O 3.38Å; M98-Q108 VanDerWaalsContact SD-CD 3.56Å; M98-Q108 PolarHBondContact SD-NE2 3.44Å; M98-Q108 PolarHBondContact SD-OE1 3.31Å | ||
| 99 | D | 78.6 | Confident | 80.6 | Confident | 136 Ų | 136 | 90 Ų | 90 | 73% | 0.727 | 47% | 0.47 | S | S | * | . | trans | -58.3 | 148 | 169.9 | -82.8 | -46.6 | 0 | 0 | 0 | 112.2 | Q101 A102 | D99-Q101 PolarHBondContact O-N 3.18Å; D99-A102 HydrophobicContact CB-CB 4.36Å; D99-A102 WeakPolarHBondContact O-CB 3.35Å; D99-A102 PolarHBondContact O-N 2.76Å | ||
| 100 | K | 70.1 | Confident | 80.1 | Confident | 196 Ų | 196 | 88.4 Ų | 88.4 | 85% | 0.852 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | -22.8 | -175.7 | -71.5 | -176 | -179.7 | 177.5 | 0 | 114 | ||
| 101 | Q | 72.9 | Confident | 79.8 | Confident | 188 Ų | 188 | 84.7 Ų | 84.7 | 88% | 0.879 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.7 | 3.6 | 178.8 | -62.2 | -152.7 | 2.8 | 0 | 0 | 114.3 | D99 K103 | D99-Q101 PolarHBondContact O-N 3.18Å; Q101-K103 PolarHBondContact O-N 3.37Å |
| 102 | A | 76.4 | Confident | 79.6 | Confident | 29 Ų | 29 | 80 Ų | 80 | 24% | 0.24 | 43% | 0.429 | C | S | . | . | P | Polyproline II helix | trans | -63.2 | 136.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | R93 M98 D99 L104 | R93-A102 PolarHBondContact NE-O 3.06Å; M98-A102 HydrophobicContact CB-CB 4.14Å; M98-A102 HydrophobicContact CE-CB 3.75Å; D99-A102 HydrophobicContact CB-CB 4.36Å; D99-A102 WeakPolarHBondContact O-CB 3.35Å; D99-A102 PolarHBondContact O-N 2.76Å; A102-L104 PolarHBondContact O-N 3.42Å |
| 103 | K | 77.1 | Confident | 79.5 | Confident | 199 Ų | 199 | 79.9 Ų | 79.9 | 87% | 0.865 | 43% | 0.43 | S | S | * | . | P | Polyproline II helix | trans | -63.3 | 125.4 | 171.2 | -79.7 | -175.1 | 176.3 | -179.4 | 0 | 108.2 | M98 Q101 | M98-K103 WeakPolarHBondContact CE-O 3.38Å; Q101-K103 PolarHBondContact O-N 3.37Å |
| 104 | L | 74.9 | Confident | 79.4 | Confident | 21 Ų | 21 | 78.7 Ų | 78.7 | 11% | 0.11 | 43% | 0.428 | C | S | . | . | P | Polyproline II helix | trans | -68.4 | 137.9 | 174.3 | -75.7 | 150.3 | 0 | 0 | 0 | 108.7 | Q89 V92 R93 A102 Q108 T109 | Q89-L104 HydrophobicContact CB-CD1 3.82Å; Q89-L104 HydrophobicContact CG-CD1 3.8Å; V92-L104 HydrophobicContact CB-CD2 4.36Å; V92-L104 HydrophobicContact CG1-CD2 3.84Å; R93-L104 HydrophobicContact CG-CD1 4.38Å; R93-L104 HydrophobicContact CG-CD2 3.83Å; R93-L104 HydrophobicContact CG-CG 4.06Å; A102-L104 PolarHBondContact O-N 3.42Å; L104-Q108 HydrophobicContact CB-CB 4.13Å; L104-Q108 HydrophobicContact CD2-CB 3.44Å; L104-Q108 VanDerWaalsContact CD2-CB 3.44Å; L104-Q108 HydrophobicContact CD2-CG 4.42Å; L104-Q108 HydrophobicContact CG-CB 4.41Å; L104-T109 VanDerWaalsContact CB-OG1 3.26Å; L104-T109 WeakPolarHBondContact CB-OG1 3.3Å |
| 105 | S | 79.2 | Confident | 79.2 | Confident | 67 Ų | 67 | 74.9 Ų | 74.9 | 47% | 0.469 | 41% | 0.412 | S | S | . | . | P | Polyproline II helix | trans | -60.2 | 156.2 | 165.3 | 170.7 | 0 | 0 | 0 | 0 | 110.1 | L107 Q108 T109 | S105-L107 PolarHBondContact O-N 3.17Å; S105-Q108 PolarHBondContact O-N 2.96Å; S105-T109 PolarHBondContact O-N 2.88Å; S105-T109 PolarHBondContact O-OG1 3.41Å; S105-T109 VanDerWaalsContact O-OG1 3.06Å |
| 106 | D | 74 | Confident | 79.2 | Confident | 85 Ų | 85 | 69.7 Ų | 69.7 | 46% | 0.455 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -50.8 | -40.9 | 176.1 | -63.9 | -28 | 0 | 0 | 0 | 111.9 | T109 A110 R195 | D106-T109 PolarHBondContact O-N 3.03Å; D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.26Å; D106-A110 PolarHBondContact O-N 2.78Å; D106-R195 IonicContact OD2-NH1 2.67Å |
| 107 | L | 74.9 | Confident | 79.3 | Confident | 108 Ų | 108 | 67.6 Ų | 67.6 | 57% | 0.565 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -68.5 | -35.6 | 178 | -175 | 63.5 | 0 | 0 | 0 | 113 | S105 A110 T111 | S105-L107 PolarHBondContact O-N 3.17Å; L107-A110 WeakPolarHBondContact O-CB 3.43Å; L107-T111 WeakPolarHBondContact O-CB 3.47Å; L107-T111 PolarHBondContact O-N 3.45Å; L107-T111 PolarHBondContact O-OG1 3.14Å |
| 108 | Q | 81.1 | Confident | 79.5 | Confident | 43 Ų | 43 | 65.5 Ų | 65.5 | 20% | 0.201 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -75.2 | -36.5 | 178.2 | -63.5 | 173.4 | -35.3 | 0 | 0 | 111.1 | V92 M98 L104 S105 T111 A112 | V92-Q108 HydrophobicContact CG1-CB 3.81Å; V92-Q108 HydrophobicContact CG1-CG 4.33Å; M98-Q108 VanDerWaalsContact SD-CD 3.56Å; M98-Q108 PolarHBondContact SD-NE2 3.44Å; M98-Q108 PolarHBondContact SD-OE1 3.31Å; L104-Q108 HydrophobicContact CB-CB 4.13Å; L104-Q108 HydrophobicContact CD2-CB 3.44Å; L104-Q108 VanDerWaalsContact CD2-CB 3.44Å; L104-Q108 HydrophobicContact CD2-CG 4.42Å; L104-Q108 HydrophobicContact CG-CB 4.41Å; S105-Q108 PolarHBondContact O-N 2.96Å; Q108-T111 PolarHBondContact O-N 2.9Å; Q108-A112 WeakPolarHBondContact O-CB 3.01Å; Q108-A112 PolarHBondContact O-N 3.1Å |
| 109 | T | 80.6 | Confident | 79.8 | Confident | 37 Ų | 37 | 67 Ų | 67 | 23% | 0.227 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 172 | -57.8 | 0 | 0 | 0 | 0 | 110.6 | Y85 L104 S105 D106 T111 A112 G113 | Y85-T109 WeakPolarHBondContact OH-CG2 3.32Å; L104-T109 VanDerWaalsContact CB-OG1 3.26Å; L104-T109 WeakPolarHBondContact CB-OG1 3.3Å; S105-T109 PolarHBondContact O-N 2.88Å; S105-T109 PolarHBondContact O-OG1 3.41Å; S105-T109 VanDerWaalsContact O-OG1 3.06Å; D106-T109 PolarHBondContact O-N 3.03Å; T109-T111 PolarHBondContact O-N 3.03Å; T109-A112 PolarHBondContact O-N 3.03Å; T109-G113 PolarHBondContact O-N 3.28Å |
| 110 | A | 77.2 | Confident | 80.3 | Confident | 5 Ų | 5 | 60.7 Ų | 60.7 | 4% | 0.041 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59 | -43.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | D106 L107 G113 S114 F188 | D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.26Å; D106-A110 PolarHBondContact O-N 2.78Å; L107-A110 WeakPolarHBondContact O-CB 3.43Å; A110-G113 PolarHBondContact O-N 3.04Å; A110-S114 PolarHBondContact O-N 3.43Å; A110-S114 PolarHBondContact O-OG 3.36Å; A110-F188 HydrophobicContact CB-CB 4.2Å; A110-F188 HydrophobicContact CB-CD1 4.12Å; A110-F188 HydrophobicContact CB-CD2 3.14Å; A110-F188 HydrophobicContact CB-CE1 4.28Å; A110-F188 HydrophobicContact CB-CE2 3.32Å; A110-F188 HydrophobicContact CB-CG 3.58Å; A110-F188 HydrophobicContact CB-CZ 3.91Å |
| 111 | T | 79.7 | Confident | 81.1 | Confident | 54 Ų | 54 | 51.4 Ų | 51.4 | 33% | 0.331 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.8 | -44 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 110.9 | V92 L107 Q108 T109 G113 S114 F115 | V92-T111 HydrophobicContact CG2-CG2 4.1Å; L107-T111 WeakPolarHBondContact O-CB 3.47Å; L107-T111 PolarHBondContact O-N 3.45Å; L107-T111 PolarHBondContact O-OG1 3.14Å; Q108-T111 PolarHBondContact O-N 2.9Å; T109-T111 PolarHBondContact O-N 3.03Å; T111-G113 VanDerWaalsContact C-N 3.33Å; T111-G113 PolarHBondContact O-N 2.91Å; T111-S114 PolarHBondContact O-N 3.48Å; T111-F115 HydrophobicContact CG2-CD2 3.88Å; T111-F115 HydrophobicContact CG2-CE2 3.54Å; T111-F115 WeakPolarHBondContact O-CD2 3.36Å; T111-F115 PolarHBondContact O-N 3.31Å |
| 112 | A | 84.3 | Confident | 81.9 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.3 | -40.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | C88 Q89 V92 Q108 T109 F115 A116 | C88-A112 HydrophobicContact CB-CB 4.27Å; C88-A112 VanDerWaalsContact CB-O 3.23Å; C88-A112 WeakPolarHBondContact CB-O 3.42Å; Q89-A112 HydrophobicContact CB-CB 4.36Å; Q89-A112 HydrophobicContact CG-CB 3.84Å; V92-A112 HydrophobicContact CB-CB 4.44Å; V92-A112 HydrophobicContact CG2-CB 3.93Å; Q108-A112 WeakPolarHBondContact O-CB 3.01Å; Q108-A112 PolarHBondContact O-N 3.1Å; T109-A112 PolarHBondContact O-N 3.03Å; A112-F115 PolarHBondContact O-N 2.9Å; A112-A116 WeakPolarHBondContact O-CB 3.33Å; A112-A116 PolarHBondContact O-N 2.78Å |
| 113 | G | 82.6 | Confident | 82.5 | Confident | 10 Ų | 10 | 46 Ų | 46 | 10% | 0.103 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.7 | -41.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T109 A110 T111 A116 S117 | T109-G113 PolarHBondContact O-N 3.28Å; A110-G113 PolarHBondContact O-N 3.04Å; T111-G113 VanDerWaalsContact C-N 3.33Å; T111-G113 PolarHBondContact O-N 2.91Å; G113-A116 PolarHBondContact O-N 3.22Å; G113-S117 PolarHBondContact O-N 3.12Å |
| 114 | S | 82 | Confident | 83 | Confident | 16 Ų | 16 | 37.1 Ų | 37.1 | 11% | 0.112 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67 | -37.1 | 177.8 | -54.9 | 0 | 0 | 0 | 0 | 112.5 | A110 T111 S117 A118 Y184 | A110-S114 PolarHBondContact O-N 3.43Å; A110-S114 PolarHBondContact O-OG 3.36Å; T111-S114 PolarHBondContact O-N 3.48Å; S114-S117 WeakPolarHBondContact CA-OG 3.4Å; S114-S117 PolarHBondContact O-OG 3.32Å; S114-A118 PolarHBondContact O-N 3.13Å; S114-Y184 VanDerWaalsContact OG-CB 3.3Å; S114-Y184 WeakPolarHBondContact OG-CB 3.19Å |
| 115 | F | 84.2 | Confident | 83.7 | Confident | 96 Ų | 96 | 36.1 Ų | 36.1 | 42% | 0.421 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -68.2 | -40.5 | 171.3 | -77 | -63.7 | 0 | 0 | 0 | 111.6 | C88 V92 T111 A112 S117 A118 F119 | C88-F115 HydrophobicContact CB-CB 4.1Å; V92-F115 HydrophobicContact CG2-CD2 4.2Å; V92-F115 HydrophobicContact CG2-CE2 4.47Å; T111-F115 HydrophobicContact CG2-CD2 3.88Å; T111-F115 HydrophobicContact CG2-CE2 3.54Å; T111-F115 WeakPolarHBondContact O-CD2 3.36Å; T111-F115 PolarHBondContact O-N 3.31Å; A112-F115 PolarHBondContact O-N 2.9Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.32Å; F115-A118 WeakPolarHBondContact O-CB 2.83Å; F115-A118 PolarHBondContact O-N 3.5Å; F115-F119 WeakPolarHBondContact O-CD2 3.36Å |
| 116 | A | 86.6 | Confident | 84.2 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -64.7 | -37 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | L81 C84 Y85 C88 A112 G113 A118 F119 A120 | L81-A116 HydrophobicContact CD1-CB 3.85Å; C84-A116 HydrophobicContact CB-CB 4.44Å; Y85-A116 HydrophobicContact CD2-CB 4.23Å; C88-A116 HydrophobicContact CB-CB 4.3Å; C88-A116 PolarHBondContact SG-N 2.95Å; A112-A116 WeakPolarHBondContact O-CB 3.33Å; A112-A116 PolarHBondContact O-N 2.78Å; G113-A116 PolarHBondContact O-N 3.22Å; A116-A118 VanDerWaalsContact C-N 3.29Å; A116-A118 PolarHBondContact O-N 3.21Å; A116-F119 WeakPolarHBondContact O-CB 3.27Å; A116-F119 PolarHBondContact O-N 3.31Å; A116-F119 VanDerWaalsContact O-N 3.14Å; A116-A120 PolarHBondContact O-N 2.91Å |
| 117 | S | 84.3 | Confident | 85 | Confident | 2 Ų | 2 | 31.7 Ų | 31.7 | 1% | 0.014 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.7 | -27.8 | 177.3 | 68.7 | 0 | 0 | 0 | 0 | 112.6 | G113 S114 F115 F119 A120 A121 | G113-S117 PolarHBondContact O-N 3.12Å; S114-S117 WeakPolarHBondContact CA-OG 3.4Å; S114-S117 PolarHBondContact O-OG 3.32Å; F115-S117 VanDerWaalsContact C-N 3.33Å; F115-S117 PolarHBondContact O-N 3.32Å; S117-F119 VanDerWaalsContact C-N 3.3Å; S117-F119 PolarHBondContact O-N 3.01Å; S117-A120 PolarHBondContact O-N 3.14Å; S117-A121 WeakPolarHBondContact O-CB 3.39Å; S117-A121 PolarHBondContact O-N 2.96Å |
| 118 | A | 86.9 | Confident | 85.6 | Confident | 27 Ų | 27 | 28 Ų | 28 | 22% | 0.223 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.2 | -37.3 | 171 | 0 | 0 | 0 | 0 | 0 | 112.4 | S114 F115 A116 L177 | S114-A118 PolarHBondContact O-N 3.13Å; F115-A118 WeakPolarHBondContact O-CB 2.83Å; F115-A118 PolarHBondContact O-N 3.5Å; A116-A118 VanDerWaalsContact C-N 3.29Å; A116-A118 PolarHBondContact O-N 3.21Å; A118-L177 HydrophobicContact CB-CD2 3.77Å |
| 119 | F | 88.9 | Confident | 86 | Confident | 89 Ų | 89 | 26 Ų | 26 | 39% | 0.39 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -71.2 | -42 | 172.4 | -64.7 | -79.9 | 0 | 0 | 0 | 111.5 | V80 C84 F115 A116 S117 A121 L122 | V80-F119 HydrophobicContact CG1-CB 3.91Å; C84-F119 HydrophobicContact CB-CB 4.1Å; C84-F119 HydrophobicContact CB-CD2 4.06Å; C84-F119 HydrophobicContact CB-CG 4.23Å; F115-F119 WeakPolarHBondContact O-CD2 3.36Å; A116-F119 WeakPolarHBondContact O-CB 3.27Å; A116-F119 PolarHBondContact O-N 3.31Å; A116-F119 VanDerWaalsContact O-N 3.14Å; S117-F119 VanDerWaalsContact C-N 3.3Å; S117-F119 PolarHBondContact O-N 3.01Å; F119-A121 VanDerWaalsContact C-N 3.25Å; F119-A121 PolarHBondContact O-N 3.33Å; F119-L122 WeakPolarHBondContact O-CB 3.43Å; F119-L122 PolarHBondContact O-N 2.84Å; F119-L122 VanDerWaalsContact O-N 3.13Å |
| 120 | A | 87.7 | Confident | 86.4 | Confident | 3 Ų | 3 | 24.6 Ų | 24.6 | 3% | 0.025 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -59.8 | -37.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E77 V80 L81 A116 S117 L122 A123 L124 | E77-A120 HydrophobicContact CG-CB 4.19Å; V80-A120 HydrophobicContact CG1-CB 4.45Å; L81-A120 HydrophobicContact CB-CB 4.36Å; A116-A120 PolarHBondContact O-N 2.91Å; S117-A120 PolarHBondContact O-N 3.14Å; A120-L122 PolarHBondContact O-N 3.24Å; A120-A123 PolarHBondContact O-N 3.28Å; A120-L124 WeakPolarHBondContact O-CB 3.36Å; A120-L124 PolarHBondContact O-N 2.91Å |
| 121 | A | 87.9 | Confident | 87 | Confident | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.008 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -58.8 | -32.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S117 F119 L124 C125 T176 L177 | S117-A121 WeakPolarHBondContact O-CB 3.39Å; S117-A121 PolarHBondContact O-N 2.96Å; F119-A121 VanDerWaalsContact C-N 3.25Å; F119-A121 PolarHBondContact O-N 3.33Å; A121-L124 PolarHBondContact O-N 2.85Å; A121-C125 VanDerWaalsContact O-CB 3.27Å; A121-C125 WeakPolarHBondContact O-CB 3.23Å; A121-C125 PolarHBondContact O-N 3.28Å; A121-T176 HydrophobicContact CB-CG2 3.7Å; A121-L177 HydrophobicContact CB-CD2 3.89Å |
| 122 | L | 89.3 | Confident | 87.4 | Confident | 75 Ų | 75 | 23.3 Ų | 23.3 | 39% | 0.393 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -67.2 | -37.4 | 176.1 | -65.6 | 170.1 | 0 | 0 | 0 | 111.9 | F119 A120 P126 Y170 L173 | F119-L122 WeakPolarHBondContact O-CB 3.43Å; F119-L122 PolarHBondContact O-N 2.84Å; F119-L122 VanDerWaalsContact O-N 3.13Å; A120-L122 PolarHBondContact O-N 3.24Å; L122-P126 VanDerWaalsContact O-CD 3.29Å; L122-P126 WeakPolarHBondContact O-CD 3.48Å; L122-Y170 HydrophobicContact CD2-CE1 4.43Å; L122-Y170 WeakPolarHBondContact O-CE1 3.21Å; L122-L173 HydrophobicContact CD2-CD1 3.86Å; L122-L173 HydrophobicContact CD2-CD2 3.71Å; L122-L173 HydrophobicContact CD2-CG 4.43Å |
| 123 | A | 88.9 | Confident | 87.6 | Confident | 28 Ų | 28 | 23.8 Ų | 23.8 | 23% | 0.231 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -80.1 | -30.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A76 V80 A120 P126 | A76-A123 HydrophobicContact CB-CB 4.33Å; V80-A123 HydrophobicContact CB-CB 4.38Å; V80-A123 HydrophobicContact CG2-CB 3.7Å; A120-A123 PolarHBondContact O-N 3.28Å; A123-P126 WeakPolarHBondContact O-CD 3.2Å; A123-P126 WeakPolarHBondContact O-CG 3.18Å |
| 124 | L | 87.9 | Confident | 87.7 | Confident | 13 Ų | 13 | 23.5 Ų | 23.5 | 7% | 0.068 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -73.6 | -43.7 | 179.1 | 178.8 | 63.7 | 0 | 0 | 0 | 112.5 | A73 A120 A121 T127 E128 | A73-L124 HydrophobicContact CB-CD1 3.7Å; A120-L124 WeakPolarHBondContact O-CB 3.36Å; A120-L124 PolarHBondContact O-N 2.91Å; A121-L124 PolarHBondContact O-N 2.85Å; L124-T127 PolarHBondContact O-N 3.39Å; L124-T127 VanDerWaalsContact O-N 3.12Å; L124-T127 PolarHBondContact O-OG1 2.95Å; L124-E128 HydrophobicContact CD1-CB 4.29Å; L124-E128 HydrophobicContact CG-CB 4.33Å; L124-E128 WeakPolarHBondContact O-CB 3.23Å; L124-E128 PolarHBondContact O-N 3.14Å |
| 125 | C | 89.5 | Confident | 87.9 | Confident | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -49.3 | -49.5 | -174 | -168.9 | 0 | 0 | 0 | 0 | 114.9 | A121 T127 L129 F169 Y170 L173 | A121-C125 VanDerWaalsContact O-CB 3.27Å; A121-C125 WeakPolarHBondContact O-CB 3.23Å; A121-C125 PolarHBondContact O-N 3.28Å; C125-T127 PolarHBondContact O-N 3.08Å; C125-L129 VanDerWaalsContact O-CB 3.25Å; C125-L129 WeakPolarHBondContact O-CB 3.19Å; C125-L129 PolarHBondContact O-N 3.21Å; C125-F169 PolarHBondContact SG-O 2.9Å; C125-Y170 HydrophobicContact CB-CD1 4.35Å; C125-L173 HydrophobicContact CB-CD1 4.25Å |
| 126 | P | 90.3 | Very high | 87.9 | Confident | 32 Ų | 32 | 18.3 Ų | 18.3 | 21% | 0.208 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.1 | -41.1 | -179.9 | 22.9 | -34.6 | 0 | 0 | 0 | 113.2 | L122 A123 V130 F169 | L122-P126 VanDerWaalsContact O-CD 3.29Å; L122-P126 WeakPolarHBondContact O-CD 3.48Å; A123-P126 WeakPolarHBondContact O-CD 3.2Å; A123-P126 WeakPolarHBondContact O-CG 3.18Å; P126-V130 VanDerWaalsContact O-CG2 3.32Å; P126-V130 WeakPolarHBondContact O-CG2 3.44Å; P126-V130 PolarHBondContact O-N 3.44Å; P126-F169 HydrophobicContact CB-CB 3.99Å; P126-F169 HydrophobicContact CB-CD1 4.23Å; P126-F169 HydrophobicContact CB-CG 4.43Å |
| 127 | T | 90.3 | Very high | 87.6 | Confident | 26 Ų | 26 | 18.7 Ų | 18.7 | 16% | 0.16 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -74.7 | -40 | -175.9 | 51.4 | 0 | 0 | 0 | 0 | 111.2 | M72 A73 L124 C125 V130 K131 | M72-T127 HydrophobicContact CB-CG2 4.24Å; A73-T127 VanDerWaalsContact CA-OG1 3.27Å; A73-T127 WeakPolarHBondContact CA-OG1 3.37Å; A73-T127 VanDerWaalsContact CB-OG1 3.23Å; A73-T127 WeakPolarHBondContact CB-OG1 3.47Å; L124-T127 PolarHBondContact O-N 3.39Å; L124-T127 VanDerWaalsContact O-N 3.12Å; L124-T127 PolarHBondContact O-OG1 2.95Å; C125-T127 PolarHBondContact O-N 3.08Å; T127-V130 PolarHBondContact O-N 3.42Å; T127-K131 PolarHBondContact O-N 2.55Å |
| 128 | E | 87.3 | Confident | 87.4 | Confident | 31 Ų | 31 | 21.6 Ų | 21.6 | 15% | 0.145 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -66.9 | -42.6 | 175.6 | -168.4 | 179.8 | -172.9 | 0 | 0 | 112.1 | L124 V130 K131 C132 K234 | L124-E128 HydrophobicContact CD1-CB 4.29Å; L124-E128 HydrophobicContact CG-CB 4.33Å; L124-E128 WeakPolarHBondContact O-CB 3.23Å; L124-E128 PolarHBondContact O-N 3.14Å; E128-V130 VanDerWaalsContact C-N 3.29Å; E128-V130 PolarHBondContact O-N 2.81Å; E128-K131 WeakPolarHBondContact O-CB 3.26Å; E128-K131 PolarHBondContact O-N 3Å; E128-K131 VanDerWaalsContact O-N 3.15Å; E128-C132 PolarHBondContact O-N 3.47Å; E128-C132 PolarHBondContact O-SG 2.91Å; E128-C132 VanDerWaalsContact O-SG 3.4Å; E128-K234 VanDerWaalsContact CD-CE 3.49Å; E128-K234 WeakPolarHBondContact OE1-CE 3.25Å; E128-K234 IonicContact OE1-NZ 2.79Å; E128-K234 PolarHBondContact OE1-NZ 3.35Å; E128-K234 WeakPolarHBondContact OE2-CE 3.32Å; E128-K234 IonicContact OE2-NZ 2.65Å; E128-K234 PolarHBondContact OE2-NZ 2.86Å |
| 129 | L | 89.3 | Confident | 87.2 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -55.3 | -47 | 174.3 | 178.1 | 71.4 | 0 | 0 | 0 | 111 | C125 R133 I160 G168 H171 Q238 | C125-L129 VanDerWaalsContact O-CB 3.25Å; C125-L129 WeakPolarHBondContact O-CB 3.19Å; C125-L129 PolarHBondContact O-N 3.21Å; L129-R133 WeakPolarHBondContact O-CB 3.43Å; L129-R133 VanDerWaalsContact O-CG 3.29Å; L129-R133 WeakPolarHBondContact O-CG 3.15Å; L129-R133 PolarHBondContact O-N 3.28Å; L129-I160 HydrophobicContact CD2-CD1 4.06Å; L129-G168 VanDerWaalsContact CD2-O 3.25Å; L129-G168 WeakPolarHBondContact CD2-O 3.4Å; L129-H171 HydrophobicContact CD1-CB 4.42Å; L129-Q238 HydrophobicContact CD1-CB 3.61Å; L129-Q238 HydrophobicContact CD1-CG 3.75Å; L129-Q238 VanDerWaalsContact CD1-O 3.3Å; L129-Q238 WeakPolarHBondContact CD1-O 3.26Å |
| 130 | V | 89.9 | Confident | 86.7 | Confident | 9 Ų | 9 | 16.2 Ų | 16.2 | 6% | 0.055 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -65.3 | -41.4 | 178.6 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | P69 P126 T127 E128 L134 I153 V156 V157 I160 F169 | P69-V130 HydrophobicContact CB-CG1 4.36Å; P69-V130 HydrophobicContact CG-CG1 3.95Å; P126-V130 VanDerWaalsContact O-CG2 3.32Å; P126-V130 WeakPolarHBondContact O-CG2 3.44Å; P126-V130 PolarHBondContact O-N 3.44Å; T127-V130 PolarHBondContact O-N 3.42Å; E128-V130 VanDerWaalsContact C-N 3.29Å; E128-V130 PolarHBondContact O-N 2.81Å; V130-L134 HydrophobicContact CG1-CD1 3.81Å; V130-L134 HydrophobicContact CG1-CG 4.47Å; V130-L134 WeakPolarHBondContact O-CB 3.47Å; V130-L134 WeakPolarHBondContact O-CD1 3.21Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 2.98Å; V130-L134 PolarHBondContact O-N 3.05Å; V130-I153 HydrophobicContact CG1-CG2 4.1Å; V130-V156 HydrophobicContact CG1-CG1 4.25Å; V130-V156 HydrophobicContact CG2-CG1 4.47Å; V130-V157 HydrophobicContact CG2-CG2 4.1Å; V130-I160 HydrophobicContact CG2-CD1 4.02Å; V130-F169 HydrophobicContact CG2-CD1 4.46Å; V130-F169 HydrophobicContact CG2-CE1 4.15Å |
| 131 | K | 89.8 | Confident | 86.5 | Confident | 29 Ų | 29 | 17.6 Ų | 17.6 | 13% | 0.126 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -56.5 | -55.5 | 174.2 | -179.2 | -169.9 | 175.1 | 179.3 | 0 | 111.2 | D31 P69 A70 T127 E128 R133 L134 Q135 | D31-K131 IonicContact OD2-NZ 4Å; D31-K131 PolarHBondContact OD2-NZ 2.7Å; P69-K131 HydrophobicContact CB-CB 4Å; A70-K131 HydrophobicContact CB-CD 3.71Å; A70-K131 HydrophobicContact CB-CG 4.34Å; T127-K131 PolarHBondContact O-N 2.55Å; E128-K131 WeakPolarHBondContact O-CB 3.26Å; E128-K131 PolarHBondContact O-N 3Å; E128-K131 VanDerWaalsContact O-N 3.15Å; K131-R133 PolarHBondContact O-N 3.38Å; K131-L134 PolarHBondContact O-N 3.41Å; K131-Q135 WeakPolarHBondContact O-CG 3.15Å; K131-Q135 PolarHBondContact O-N 3.34Å |
| 132 | C | 86.6 | Confident | 85.9 | Confident | 3 Ų | 3 | 23.5 Ų | 23.5 | 2% | 0.02 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.4 | -41.6 | -176.2 | -69.4 | 0 | 0 | 0 | 0 | 112.1 | V35 E128 Q135 T136 V239 | V35-C132 HydrophobicContact CG1-CB 4.32Å; E128-C132 PolarHBondContact O-N 3.47Å; E128-C132 PolarHBondContact O-SG 2.91Å; E128-C132 VanDerWaalsContact O-SG 3.4Å; C132-Q135 PolarHBondContact O-N 3.26Å; C132-T136 WeakPolarHBondContact O-CG2 3.2Å; C132-T136 PolarHBondContact O-N 2.95Å; C132-T136 PolarHBondContact O-OG1 3.43Å; C132-V239 HydrophobicContact CB-CG2 3.99Å |
| 133 | R | 88.6 | Confident | 85.3 | Confident | 9 Ų | 9 | 22.8 Ų | 22.8 | 3% | 0.034 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -60.3 | -50.9 | 173.8 | -71.6 | -172.8 | 174.2 | -163.9 | 5.6 | 110.7 | L129 K131 Q135 T136 M137 V156 D164 Q238 S241 M242 | L129-R133 WeakPolarHBondContact O-CB 3.43Å; L129-R133 VanDerWaalsContact O-CG 3.29Å; L129-R133 WeakPolarHBondContact O-CG 3.15Å; L129-R133 PolarHBondContact O-N 3.28Å; K131-R133 PolarHBondContact O-N 3.38Å; R133-Q135 VanDerWaalsContact C-N 3.33Å; R133-Q135 PolarHBondContact O-N 2.91Å; R133-T136 PolarHBondContact O-N 3.47Å; R133-T136 VanDerWaalsContact O-N 3.14Å; R133-T136 PolarHBondContact O-OG1 3.32Å; R133-M137 WeakPolarHBondContact O-CG 3.43Å; R133-M137 PolarHBondContact O-N 3.01Å; R133-V156 HydrophobicContact CB-CG1 4.01Å; R133-D164 IonicContact NH2-OD2 3.37Å; R133-Q238 PolarHBondContact NE-O 2.99Å; R133-Q238 VanDerWaalsContact NE-O 3.12Å; R133-S241 PolarHBondContact NH2-OG 3.44Å; R133-M242 HydrophobicContact CB-CE 4.47Å; R133-M242 HydrophobicContact CB-SD 3.64Å; R133-M242 HydrophobicContact CG-CG 3.77Å; R133-M242 HydrophobicContact CG-SD 3.47Å; R133-M242 WeakPolarHBondContact CG-SD 3.36Å |
| 134 | L | 86.5 | Confident | 84.5 | Confident | 4 Ų | 4 | 24.5 Ų | 24.5 | 2% | 0.021 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -57.9 | -40.8 | 179 | -76.9 | 165.8 | 0 | 0 | 0 | 113.5 | K65 P69 V130 K131 T136 M137 I153 V156 | K65-L134 WeakPolarHBondContact CD-O 3.38Å; K65-L134 WeakPolarHBondContact CE-O 3.28Å; K65-L134 HydrophobicContact CG-CB 4.47Å; K65-L134 PolarHBondContact NZ-O 2.98Å; P69-L134 HydrophobicContact CG-CD1 3.86Å; V130-L134 HydrophobicContact CG1-CD1 3.81Å; V130-L134 HydrophobicContact CG1-CG 4.47Å; V130-L134 WeakPolarHBondContact O-CB 3.47Å; V130-L134 WeakPolarHBondContact O-CD1 3.21Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 2.98Å; V130-L134 PolarHBondContact O-N 3.05Å; K131-L134 PolarHBondContact O-N 3.41Å; L134-T136 PolarHBondContact O-N 3.45Å; L134-M137 HydrophobicContact CD2-SD 3.84Å; L134-I153 HydrophobicContact CD1-CB 4.37Å; L134-I153 HydrophobicContact CD1-CG1 3.63Å; L134-V156 HydrophobicContact CD2-CG2 3.65Å; L134-V156 HydrophobicContact CG-CG2 4.01Å |
| 135 | Q | 85.2 | Confident | 83.7 | Confident | 4 Ų | 4 | 27.7 Ų | 27.7 | 2% | 0.019 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65 | -24 | -180 | -76.3 | 174.4 | -39.2 | 0 | 0 | 113.5 | T32 V35 K36 K65 K131 C132 R133 | T32-Q135 HydrophobicContact CG2-CB 4.42Å; T32-Q135 HydrophobicContact CG2-CG 4.31Å; T32-Q135 PolarHBondContact OG1-NE2 3.47Å; V35-Q135 HydrophobicContact CG1-CB 4.43Å; K36-Q135 WeakPolarHBondContact CE-O 3.15Å; K65-Q135 VanDerWaalsContact O-CG 3.28Å; K65-Q135 WeakPolarHBondContact O-CG 3.41Å; K131-Q135 WeakPolarHBondContact O-CG 3.15Å; K131-Q135 PolarHBondContact O-N 3.34Å; C132-Q135 PolarHBondContact O-N 3.26Å; R133-Q135 VanDerWaalsContact C-N 3.33Å; R133-Q135 PolarHBondContact O-N 2.91Å |
| 136 | T | 83.3 | Confident | 82.9 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -110.9 | -3.4 | -175.5 | 55.3 | 0 | 0 | 0 | 0 | 113.8 | V35 T39 F40 C132 R133 L134 Y138 E139 M140 V239 | V35-T136 HydrophobicContact CG1-CG2 3.67Å; T39-T136 HydrophobicContact CG2-CG2 4.37Å; F40-T136 HydrophobicContact CE2-CG2 3.93Å; C132-T136 WeakPolarHBondContact O-CG2 3.2Å; C132-T136 PolarHBondContact O-N 2.95Å; C132-T136 PolarHBondContact O-OG1 3.43Å; R133-T136 PolarHBondContact O-N 3.47Å; R133-T136 VanDerWaalsContact O-N 3.14Å; R133-T136 PolarHBondContact O-OG1 3.32Å; L134-T136 PolarHBondContact O-N 3.45Å; T136-Y138 VanDerWaalsContact C-N 3.28Å; T136-Y138 PolarHBondContact O-N 3.14Å; T136-E139 WeakPolarHBondContact CA-OE2 3.31Å; T136-E139 PolarHBondContact O-N 3.38Å; T136-M140 WeakPolarHBondContact O-CG 3.19Å; T136-M140 PolarHBondContact O-N 2.94Å; T136-V239 HydrophobicContact CG2-CG1 4.09Å; T136-V239 HydrophobicContact CG2-CG2 3.95Å; T136-V239 VanDerWaalsContact OG1-CG1 3.23Å; T136-V239 WeakPolarHBondContact OG1-CG1 3.24Å |
| 137 | M | 82 | Confident | 81.9 | Confident | 8 Ų | 8 | 31.8 Ų | 31.8 | 4% | 0.039 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59.2 | -38.2 | -175 | -75.3 | -170.5 | 80.5 | 0 | 0 | 112.9 | R133 L134 M140 E141 I146 N151 V156 M242 | R133-M137 WeakPolarHBondContact O-CG 3.43Å; R133-M137 PolarHBondContact O-N 3.01Å; L134-M137 HydrophobicContact CD2-SD 3.84Å; M137-M140 PolarHBondContact O-N 2.91Å; M137-E141 WeakPolarHBondContact O-CG 3.23Å; M137-E141 PolarHBondContact O-N 3.48Å; M137-I146 HydrophobicContact CE-CD1 4.47Å; M137-N151 WeakPolarHBondContact CB-OD1 3.37Å; M137-N151 WeakPolarHBondContact CE-OD1 3.27Å; M137-N151 PolarHBondContact SD-OD1 3.33Å; M137-V156 HydrophobicContact CE-CG2 4.1Å; M137-V156 HydrophobicContact SD-CG2 3.41Å; M137-V156 WeakPolarHBondContact SD-CG2 3.21Å; M137-M242 HydrophobicContact CG-CE 4.26Å |
| 138 | Y | 79.6 | Confident | 80.8 | Confident | 62 Ų | 62 | 39.7 Ų | 39.7 | 24% | 0.243 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64 | -45.1 | -178.3 | 178 | -96.7 | 0 | 0 | 0 | 110.9 | Q57 V58 T136 M140 E141 M142 | Q57-Y138 HydrophobicContact CB-CE1 3.85Å; Q57-Y138 HydrophobicContact CG-CE1 4.33Å; V58-Y138 HydrophobicContact CG2-CD1 3.83Å; V58-Y138 HydrophobicContact CG2-CD2 3.93Å; V58-Y138 HydrophobicContact CG2-CE1 3.94Å; V58-Y138 HydrophobicContact CG2-CE2 4.02Å; V58-Y138 HydrophobicContact CG2-CG 3.82Å; T136-Y138 VanDerWaalsContact C-N 3.28Å; T136-Y138 PolarHBondContact O-N 3.14Å; Y138-M140 VanDerWaalsContact C-N 3.32Å; Y138-M140 PolarHBondContact O-N 3.41Å; Y138-E141 PolarHBondContact O-N 3.14Å; Y138-M142 HydrophobicContact CD1-CG 4.22Å; Y138-M142 HydrophobicContact CE1-CG 3.77Å; Y138-M142 HydrophobicContact CE2-CG 4.22Å; Y138-M142 WeakPolarHBondContact O-CB 3.41Å; Y138-M142 WeakPolarHBondContact O-CG 3.31Å; Y138-M142 PolarHBondContact O-N 2.81Å |
| 139 | E | 81.9 | Confident | 79.6 | Confident | 3 Ų | 3 | 41.4 Ų | 41.4 | 1% | 0.014 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -65.4 | -37.2 | 177.5 | -66.9 | 68.2 | -149.5 | 0 | 0 | 111.4 | K36 F40 L43 Y44 T136 M142 S143 | K36-E139 WeakPolarHBondContact CE-OE1 3.33Å; K36-E139 IonicContact NZ-OE1 2.78Å; K36-E139 PolarHBondContact NZ-OE1 2.92Å; K36-E139 IonicContact NZ-OE2 2.7Å; F40-E139 HydrophobicContact CD1-CB 4.42Å; F40-E139 HydrophobicContact CD2-CB 3.82Å; F40-E139 HydrophobicContact CD2-CG 4.05Å; F40-E139 HydrophobicContact CE1-CB 4Å; F40-E139 HydrophobicContact CE2-CB 3.34Å; F40-E139 HydrophobicContact CE2-CG 3.94Å; F40-E139 HydrophobicContact CG-CB 4.33Å; F40-E139 HydrophobicContact CZ-CB 3.42Å; F40-E139 VanDerWaalsContact CZ-CB 3.42Å; F40-E139 HydrophobicContact CZ-CG 4.47Å; L43-E139 HydrophobicContact CD2-CB 4.4Å; L43-E139 HydrophobicContact CD2-CG 3.96Å; Y44-E139 HydrophobicContact CE2-CG 4.2Å; Y44-E139 VanDerWaalsContact OH-CG 3.31Å; Y44-E139 WeakPolarHBondContact OH-CG 3.21Å; Y44-E139 PolarHBondContact OH-OE1 3.44Å; Y44-E139 VanDerWaalsContact OH-OE1 3.07Å; T136-E139 WeakPolarHBondContact CA-OE2 3.31Å; T136-E139 PolarHBondContact O-N 3.38Å; E139-M142 PolarHBondContact O-N 2.96Å; E139-S143 VanDerWaalsContact O-CB 3.24Å; E139-S143 WeakPolarHBondContact O-CB 3.23Å; E139-S143 PolarHBondContact O-N 2.71Å; E139-S143 PolarHBondContact O-OG 3.04Å |
| 140 | M | 78.6 | Confident | 78.1 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.7 | -40.3 | 174.9 | -72.4 | -58.9 | 177.9 | 0 | 0 | 112.6 | T39 F40 T136 M137 Y138 G144 K145 I146 V239 L240 | T39-M140 HydrophobicContact CG2-CE 3.99Å; F40-M140 HydrophobicContact CE1-CE 3.72Å; F40-M140 HydrophobicContact CE1-SD 3.79Å; F40-M140 HydrophobicContact CE2-CE 4.43Å; F40-M140 HydrophobicContact CZ-CE 3.42Å; F40-M140 VanDerWaalsContact CZ-CE 3.42Å; F40-M140 HydrophobicContact CZ-CG 3.86Å; F40-M140 HydrophobicContact CZ-SD 3.66Å; T136-M140 WeakPolarHBondContact O-CG 3.19Å; T136-M140 PolarHBondContact O-N 2.94Å; M137-M140 PolarHBondContact O-N 2.91Å; Y138-M140 VanDerWaalsContact C-N 3.32Å; Y138-M140 PolarHBondContact O-N 3.41Å; M140-G144 PolarHBondContact O-N 2.97Å; M140-K145 PolarHBondContact O-N 3.16Å; M140-K145 HydrophobicContact SD-CB 4Å; M140-K145 HydrophobicContact SD-CD 3.81Å; M140-I146 HydrophobicContact CB-CD1 3.46Å; M140-I146 VanDerWaalsContact CB-CD1 3.46Å; M140-I146 HydrophobicContact CB-CG1 3.66Å; M140-I146 HydrophobicContact CB-CG2 4.31Å; M140-I146 HydrophobicContact CG-CD1 4.48Å; M140-I146 PolarHBondContact O-N 3.36Å; M140-V239 HydrophobicContact CE-CG1 3.24Å; M140-L240 HydrophobicContact CE-CD2 4Å |
| 141 | E | 82.7 | Confident | 77.1 | Confident | 32 Ų | 32 | 51.3 Ų | 51.3 | 15% | 0.15 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.9 | -45.2 | 175.5 | -74.3 | 177.4 | 158 | 0 | 0 | 110.9 | M137 Y138 S143 G144 I146 S149 N151 | M137-E141 WeakPolarHBondContact O-CG 3.23Å; M137-E141 PolarHBondContact O-N 3.48Å; Y138-E141 PolarHBondContact O-N 3.14Å; E141-S143 VanDerWaalsContact C-N 3.34Å; E141-S143 PolarHBondContact O-N 3.32Å; E141-G144 PolarHBondContact O-N 3.38Å; E141-I146 HydrophobicContact CB-CG1 4.48Å; E141-I146 HydrophobicContact CG-CD1 3.91Å; E141-I146 HydrophobicContact CG-CG1 3.76Å; E141-S149 PolarHBondContact OE1-N 2.91Å; E141-N151 PolarHBondContact OE1-ND2 3.3Å; E141-N151 PolarHBondContact OE2-ND2 2.88Å |
| 142 | M | 77.3 | Confident | 76.7 | Confident | 126 Ų | 126 | 53.1 Ų | 53.1 | 62% | 0.621 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -67.9 | -31.9 | 178.9 | -72.2 | -59.1 | -61.4 | 0 | 0 | 113 | Y138 E139 G144 | Y138-M142 HydrophobicContact CD1-CG 4.22Å; Y138-M142 HydrophobicContact CE1-CG 3.77Å; Y138-M142 HydrophobicContact CE2-CG 4.22Å; Y138-M142 WeakPolarHBondContact O-CB 3.41Å; Y138-M142 WeakPolarHBondContact O-CG 3.31Å; Y138-M142 PolarHBondContact O-N 2.81Å; E139-M142 PolarHBondContact O-N 2.96Å; M142-G144 PolarHBondContact O-N 2.94Å |
| 143 | S | 76.1 | Confident | 76.7 | Confident | 59 Ų | 59 | 56.6 Ų | 56.6 | 41% | 0.413 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -1.7 | 176 | -55.8 | 0 | 0 | 0 | 0 | 113.3 | E139 E141 K145 | E139-S143 VanDerWaalsContact O-CB 3.24Å; E139-S143 WeakPolarHBondContact O-CB 3.23Å; E139-S143 PolarHBondContact O-N 2.71Å; E139-S143 PolarHBondContact O-OG 3.04Å; E141-S143 VanDerWaalsContact C-N 3.34Å; E141-S143 PolarHBondContact O-N 3.32Å; S143-K145 PolarHBondContact O-N 3.49Å |
| 144 | G | 72.8 | Confident | 76.6 | Confident | 64 Ų | 64 | 64.9 Ų | 64.9 | 66% | 0.66 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.5 | 11.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | M140 E141 M142 | M140-G144 PolarHBondContact O-N 2.97Å; E141-G144 PolarHBondContact O-N 3.38Å; M142-G144 PolarHBondContact O-N 2.94Å |
| 145 | K | 70.8 | Confident | 76.5 | Confident | 80 Ų | 80 | 66 Ų | 66 | 35% | 0.348 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -77.3 | -26.3 | -179.7 | -69.6 | -179.5 | -179.9 | 175.8 | 0 | 111.6 | M140 S143 Y243 | M140-K145 PolarHBondContact O-N 3.16Å; M140-K145 HydrophobicContact SD-CB 4Å; M140-K145 HydrophobicContact SD-CD 3.81Å; S143-K145 PolarHBondContact O-N 3.49Å; K145-Y243 HydrophobicContact CB-CD2 3.83Å; K145-Y243 HydrophobicContact CB-CE2 4.13Å; K145-Y243 HydrophobicContact CB-CG 4.35Å; K145-Y243 HydrophobicContact CG-CD2 4.33Å; K145-Y243 HydrophobicContact CG-CE2 4.33Å; K145-Y243 WeakPolarHBondContact O-CD2 3.41Å; K145-Y243 WeakPolarHBondContact O-CE2 3.47Å |
| 146 | I | 71.6 | Confident | 76.6 | Confident | 33 Ų | 33 | 66.2 Ų | 66.2 | 17% | 0.169 | 36% | 0.355 | C | S | . | . | S | Bend | trans | -130.4 | 150.3 | 173.7 | 66.3 | -179 | 0 | 0 | 0 | 110.7 | M137 M140 E141 M242 | M137-I146 HydrophobicContact CE-CD1 4.47Å; M140-I146 HydrophobicContact CB-CD1 3.46Å; M140-I146 VanDerWaalsContact CB-CD1 3.46Å; M140-I146 HydrophobicContact CB-CG1 3.66Å; M140-I146 HydrophobicContact CB-CG2 4.31Å; M140-I146 HydrophobicContact CG-CD1 4.48Å; M140-I146 PolarHBondContact O-N 3.36Å; E141-I146 HydrophobicContact CB-CG1 4.48Å; E141-I146 HydrophobicContact CG-CD1 3.91Å; E141-I146 HydrophobicContact CG-CG1 3.76Å; I146-M242 HydrophobicContact CD1-CE 3.93Å |
| 147 | A | 70.1 | Confident | 76.9 | Confident | 86 Ų | 86 | 67.8 Ų | 67.8 | 71% | 0.711 | 36% | 0.364 | S | S | * | . | trans | -64.3 | 143.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | S149 | A147-S149 PolarHBondContact O-N 3.3Š| ||
| 148 | K | 66.1 | Low | 77.3 | Confident | 191 Ų | 191 | 73.6 Ų | 73.6 | 83% | 0.83 | 39% | 0.39 | S | S | * | . | trans | -53.2 | 115.5 | 172 | -79.5 | -176.8 | 177.1 | 178.8 | 0 | 108.9 | ||||
| 149 | S | 62.1 | Low | 77.5 | Confident | 67 Ų | 67 | 72.5 Ų | 72.5 | 47% | 0.469 | 40% | 0.397 | S | S | . | . | trans | -130.7 | 159.5 | -177.2 | -163.8 | 0 | 0 | 0 | 0 | 110.4 | E141 A147 N151 | E141-S149 PolarHBondContact OE1-N 2.91Å; A147-S149 PolarHBondContact O-N 3.3Å; S149-N151 PolarHBondContact O-N 3.05Å; S149-N151 VanDerWaalsContact O-N 3.08Å | ||
| 150 | H | 58.9 | Low | 77.8 | Confident | 157 Ų | 157 | 72.3 Ų | 72.3 | 73% | 0.727 | 40% | 0.396 | S | S | * | . | trans | -60.2 | 119.4 | 171.8 | -80.8 | -82 | 0 | 0 | 0 | 109 | T152 S155 | H150-T152 PolarHBondContact O-N 2.9Å; H150-S155 WeakPolarHBondContact O-CB 3.45Å; H150-S155 PolarHBondContact O-OG 3.5Å | ||
| 151 | N | 68.4 | Low | 78.4 | Confident | 60 Ų | 60 | 76.7 Ų | 76.7 | 32% | 0.321 | 42% | 0.419 | S | S | . | . | trans | -81 | 51.9 | -173 | -86.4 | -66.3 | 0 | 0 | 0 | 112.4 | K65 M137 E141 S149 | K65-N151 VanDerWaalsContact NZ-CG 3.3Å; K65-N151 PolarHBondContact NZ-OD1 3.49Å; M137-N151 WeakPolarHBondContact CB-OD1 3.37Å; M137-N151 WeakPolarHBondContact CE-OD1 3.27Å; M137-N151 PolarHBondContact SD-OD1 3.33Å; E141-N151 PolarHBondContact OE1-ND2 3.3Å; E141-N151 PolarHBondContact OE2-ND2 2.88Å; S149-N151 PolarHBondContact O-N 3.05Å; S149-N151 VanDerWaalsContact O-N 3.08Å | ||
| 152 | T | 82 | Confident | 78.6 | Confident | 68 Ų | 68 | 84.1 Ų | 84.1 | 42% | 0.417 | 45% | 0.451 | S | S | . | . | trans | -106.7 | 156.6 | -177.4 | 66.1 | 0 | 0 | 0 | 0 | 112 | H150 W154 S155 V156 | H150-T152 PolarHBondContact O-N 2.9Å; T152-W154 PolarHBondContact O-N 3.32Å; T152-S155 PolarHBondContact N-OG 2.84Å; T152-S155 PolarHBondContact O-N 2.94Å; T152-S155 PolarHBondContact O-OG 2.91Å; T152-S155 PolarHBondContact OG1-N 2.62Å; T152-S155 PolarHBondContact OG1-OG 3.12Å; T152-V156 PolarHBondContact O-N 3.11Å | ||
| 153 | I | 85.3 | Confident | 79 | Confident | 75 Ų | 75 | 83.1 Ų | 83.1 | 39% | 0.385 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -56.4 | -42.9 | 175.3 | -63.5 | 160.9 | 0 | 0 | 0 | 110.1 | P69 V130 L134 S155 V156 V157 | P69-I153 HydrophobicContact CG-CD1 4.12Å; P69-I153 HydrophobicContact CG-CG1 4.04Å; P69-I153 HydrophobicContact CG-CG2 4.35Å; V130-I153 HydrophobicContact CG1-CG2 4.1Å; L134-I153 HydrophobicContact CD1-CB 4.37Å; L134-I153 HydrophobicContact CD1-CG1 3.63Å; I153-S155 PolarHBondContact O-N 2.94Å; I153-V156 PolarHBondContact O-N 3.29Å; I153-V157 HydrophobicContact CG2-CG2 4.4Å; I153-V157 WeakPolarHBondContact O-CG2 2.93Å; I153-V157 PolarHBondContact O-N 2.71Å |
| 154 | W | 86.9 | Confident | 79.3 | Confident | 184 Ų | 184 | 82.8 Ų | 82.8 | 70% | 0.697 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -65.1 | -37.4 | -179.2 | -173.1 | -113.8 | 0 | 0 | 0 | 113.4 | T152 V156 V157 K158 | T152-W154 PolarHBondContact O-N 3.32Å; W154-V156 VanDerWaalsContact C-N 3.34Å; W154-V157 PolarHBondContact O-N 2.9Å; W154-K158 VanDerWaalsContact O-CB 3.26Å; W154-K158 WeakPolarHBondContact O-CB 3.15Å; W154-K158 PolarHBondContact O-N 3.4Å |
| 155 | S | 85.9 | Confident | 80.1 | Confident | 28 Ų | 28 | 80.7 Ų | 80.7 | 20% | 0.196 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 177.6 | 70.8 | 0 | 0 | 0 | 0 | 111.6 | H150 T152 I153 G159 | H150-S155 WeakPolarHBondContact O-CB 3.45Å; H150-S155 PolarHBondContact O-OG 3.5Å; T152-S155 PolarHBondContact N-OG 2.84Å; T152-S155 PolarHBondContact O-N 2.94Å; T152-S155 PolarHBondContact O-OG 2.91Å; T152-S155 PolarHBondContact OG1-N 2.62Å; T152-S155 PolarHBondContact OG1-OG 3.12Å; I153-S155 PolarHBondContact O-N 2.94Å; S155-G159 PolarHBondContact O-N 3.01Å |
| 156 | V | 86.6 | Confident | 80.9 | Confident | 8 Ų | 8 | 81.4 Ų | 81.4 | 5% | 0.048 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -64.8 | -47.3 | 175.7 | 176.4 | 0 | 0 | 0 | 0 | 110.6 | V130 R133 L134 M137 T152 I153 W154 G159 I160 | V130-V156 HydrophobicContact CG1-CG1 4.25Å; V130-V156 HydrophobicContact CG2-CG1 4.47Å; R133-V156 HydrophobicContact CB-CG1 4.01Å; L134-V156 HydrophobicContact CD2-CG2 3.65Å; L134-V156 HydrophobicContact CG-CG2 4.01Å; M137-V156 HydrophobicContact CE-CG2 4.1Å; M137-V156 HydrophobicContact SD-CG2 3.41Å; M137-V156 WeakPolarHBondContact SD-CG2 3.21Å; T152-V156 PolarHBondContact O-N 3.11Å; I153-V156 PolarHBondContact O-N 3.29Å; W154-V156 VanDerWaalsContact C-N 3.34Å; V156-G159 PolarHBondContact O-N 3.07Å; V156-I160 HydrophobicContact CG1-CD1 4Å; V156-I160 WeakPolarHBondContact O-CG1 3.38Å; V156-I160 PolarHBondContact O-N 3.27Å |
| 157 | V | 89.8 | Confident | 81.7 | Confident | 32 Ų | 32 | 86.5 Ų | 86.5 | 19% | 0.194 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -59.2 | -51.1 | 177 | 169 | 0 | 0 | 0 | 0 | 110.9 | V130 I153 W154 G159 I160 L161 F169 | V130-V157 HydrophobicContact CG2-CG2 4.1Å; I153-V157 HydrophobicContact CG2-CG2 4.4Å; I153-V157 WeakPolarHBondContact O-CG2 2.93Å; I153-V157 PolarHBondContact O-N 2.71Å; W154-V157 PolarHBondContact O-N 2.9Å; V157-G159 VanDerWaalsContact C-N 3.27Å; V157-G159 PolarHBondContact O-N 2.87Å; V157-I160 PolarHBondContact O-N 2.95Å; V157-L161 HydrophobicContact CG1-CD1 3.96Å; V157-L161 PolarHBondContact O-N 3.5Å; V157-F169 HydrophobicContact CB-CZ 4.45Å; V157-F169 HydrophobicContact CG1-CE1 4.44Å; V157-F169 HydrophobicContact CG1-CZ 3.93Å; V157-F169 HydrophobicContact CG2-CE1 4.42Å |
| 158 | K | 89.1 | Confident | 82.4 | Confident | 131 Ų | 131 | 82.4 Ų | 82.4 | 57% | 0.57 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -62.5 | -36.4 | 178.1 | -171.4 | 176.6 | -177.5 | 178 | 0 | 111.9 | W154 L161 K162 | W154-K158 VanDerWaalsContact O-CB 3.26Å; W154-K158 WeakPolarHBondContact O-CB 3.15Å; W154-K158 PolarHBondContact O-N 3.4Å; K158-L161 PolarHBondContact O-N 2.78Å; K158-K162 VanDerWaalsContact O-CB 3.32Å; K158-K162 WeakPolarHBondContact O-CB 3.22Å; K158-K162 PolarHBondContact O-N 3.25Å |
| 159 | G | 85.6 | Confident | 83.5 | Confident | 38 Ų | 38 | 74.8 Ų | 74.8 | 39% | 0.392 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S155 V156 V157 K162 K163 | S155-G159 PolarHBondContact O-N 3.01Å; V156-G159 PolarHBondContact O-N 3.07Å; V157-G159 VanDerWaalsContact C-N 3.27Å; V157-G159 PolarHBondContact O-N 2.87Å; G159-K162 PolarHBondContact O-N 3.34Å; G159-K163 VanDerWaalsContact O-CB 3.28Å; G159-K163 WeakPolarHBondContact O-CB 3.13Å; G159-K163 PolarHBondContact O-N 3.4Å |
| 160 | I | 87.8 | Confident | 84.7 | Confident | 0 Ų | 0 | 76.4 Ų | 76.4 | 0% | 0 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.2 | -53.1 | 174.3 | -66.5 | 158.1 | 0 | 0 | 0 | 110.1 | L129 V130 V156 V157 K162 K163 D164 G165 F169 | L129-I160 HydrophobicContact CD2-CD1 4.06Å; V130-I160 HydrophobicContact CG2-CD1 4.02Å; V156-I160 HydrophobicContact CG1-CD1 4Å; V156-I160 WeakPolarHBondContact O-CG1 3.38Å; V156-I160 PolarHBondContact O-N 3.27Å; V157-I160 PolarHBondContact O-N 2.95Å; I160-K162 VanDerWaalsContact C-N 3.3Å; I160-K162 PolarHBondContact O-N 3.15Å; I160-K163 PolarHBondContact O-N 3.06Å; I160-D164 PolarHBondContact O-N 3.31Å; I160-G165 PolarHBondContact O-N 3.27Å; I160-F169 HydrophobicContact CB-CE1 4.07Å; I160-F169 HydrophobicContact CB-CE2 4.27Å; I160-F169 HydrophobicContact CB-CZ 3.85Å; I160-F169 HydrophobicContact CD1-CD1 3.99Å; I160-F169 HydrophobicContact CD1-CE1 3.58Å; I160-F169 HydrophobicContact CD1-CZ 4.22Å; I160-F169 HydrophobicContact CG1-CE1 4.42Å; I160-F169 HydrophobicContact CG2-CD1 4.08Å; I160-F169 HydrophobicContact CG2-CD2 3.87Å; I160-F169 HydrophobicContact CG2-CE1 3.95Å; I160-F169 HydrophobicContact CG2-CE2 3.73Å; I160-F169 HydrophobicContact CG2-CG 4.03Å; I160-F169 HydrophobicContact CG2-CZ 3.75Å |
| 161 | L | 90.1 | Very high | 86 | Confident | 91 Ų | 91 | 72.3 Ų | 72.3 | 48% | 0.476 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -56.9 | -41.9 | -179.2 | -102.2 | 125.8 | 0 | 0 | 0 | 112.8 | V157 K158 G165 F169 | V157-L161 HydrophobicContact CG1-CD1 3.96Å; V157-L161 PolarHBondContact O-N 3.5Å; K158-L161 PolarHBondContact O-N 2.78Å; L161-G165 VanDerWaalsContact O-CA 3.29Å; L161-G165 WeakPolarHBondContact O-CA 3.47Å; L161-G165 PolarHBondContact O-N 2.82Å; L161-F169 HydrophobicContact CD1-CE2 3.67Å; L161-F169 HydrophobicContact CD1-CZ 3.8Å; L161-F169 HydrophobicContact CG-CE2 3.95Å; L161-F169 HydrophobicContact CG-CZ 4.44Å |
| 162 | K | 88.2 | Confident | 86.7 | Confident | 189 Ų | 189 | 69.8 Ų | 69.8 | 82% | 0.822 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -73.7 | -34.9 | -178.4 | -171.8 | 176.9 | 178.4 | -176.8 | 0 | 112.8 | K158 G159 I160 | K158-K162 VanDerWaalsContact O-CB 3.32Å; K158-K162 WeakPolarHBondContact O-CB 3.22Å; K158-K162 PolarHBondContact O-N 3.25Å; G159-K162 PolarHBondContact O-N 3.34Å; I160-K162 VanDerWaalsContact C-N 3.3Å; I160-K162 PolarHBondContact O-N 3.15Å |
| 163 | K | 85.1 | Confident | 86.9 | Confident | 105 Ų | 105 | 68.3 Ų | 68.3 | 46% | 0.457 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -87.9 | -49.8 | -174.1 | -170.5 | -170.4 | 177.3 | -173.1 | 0 | 112.6 | G159 I160 S241 M242 | G159-K163 VanDerWaalsContact O-CB 3.28Å; G159-K163 WeakPolarHBondContact O-CB 3.13Å; G159-K163 PolarHBondContact O-N 3.4Å; I160-K163 PolarHBondContact O-N 3.06Å; K163-S241 PolarHBondContact NZ-O 3.29Å; K163-M242 PolarHBondContact NZ-O 2.89Å |
| 164 | D | 83.2 | Confident | 86.9 | Confident | 52 Ų | 52 | 68.5 Ų | 68.5 | 28% | 0.278 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -116.9 | -4.6 | -167.2 | -55.1 | -44.9 | 0 | 0 | 0 | 112 | R133 I160 | R133-D164 IonicContact NH2-OD2 3.37Å; I160-D164 PolarHBondContact O-N 3.31Å |
| 165 | G | 88.3 | Confident | 86.8 | Confident | 19 Ų | 19 | 59.7 Ų | 59.7 | 20% | 0.196 | 32% | 0.317 | C | S | . | . | trans | 71.7 | -169.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | I160 L161 L167 G168 | I160-G165 PolarHBondContact O-N 3.27Å; L161-G165 VanDerWaalsContact O-CA 3.29Å; L161-G165 WeakPolarHBondContact O-CA 3.47Å; L161-G165 PolarHBondContact O-N 2.82Å; G165-L167 VanDerWaalsContact C-N 3.28Å; G165-L167 PolarHBondContact O-N 2.96Å; G165-G168 PolarHBondContact O-N 3.37Å; G165-G168 VanDerWaalsContact O-N 3.16Å | ||
| 166 | P | 87.9 | Confident | 86.8 | Confident | 95 Ų | 95 | 58.4 Ų | 58.4 | 62% | 0.617 | 31% | 0.308 | S | S | * | . | G | 310 helix | trans | -66.9 | -27.6 | -179.4 | 26.4 | -34.2 | 0 | 0 | 0 | 113.2 | G168 F169 | P166-G168 PolarHBondContact O-N 3.45Å; P166-F169 WeakPolarHBondContact O-CD2 3.2Å; P166-F169 PolarHBondContact O-N 3.25Å |
| 167 | L | 87.4 | Confident | 86.8 | Confident | 140 Ų | 140 | 60.8 Ų | 60.8 | 73% | 0.733 | 32% | 0.32 | S | S | * | . | G | 310 helix | trans | -71 | -18.9 | 175.9 | -66.7 | 176.4 | 0 | 0 | 0 | 112.6 | G165 F169 Y170 | G165-L167 VanDerWaalsContact C-N 3.28Å; G165-L167 PolarHBondContact O-N 2.96Å; L167-F169 PolarHBondContact O-N 3.03Å; L167-Y170 PolarHBondContact O-N 3.48Å |
| 168 | G | 85.8 | Confident | 86.7 | Confident | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.01 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -59.6 | -25.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | L129 G165 P166 Y170 H171 | L129-G168 VanDerWaalsContact CD2-O 3.25Å; L129-G168 WeakPolarHBondContact CD2-O 3.4Å; G165-G168 PolarHBondContact O-N 3.37Å; G165-G168 VanDerWaalsContact O-N 3.16Å; P166-G168 PolarHBondContact O-N 3.45Å; G168-Y170 PolarHBondContact O-N 3.45Å; G168-H171 WeakPolarHBondContact O-CB 3.44Å; G168-H171 PolarHBondContact O-CD2 3.19Å; G168-H171 PolarHBondContact O-N 3.05Å |
| 169 | F | 88.3 | Confident | 86.5 | Confident | 30 Ų | 30 | 57.7 Ų | 57.7 | 13% | 0.132 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -67.2 | -17.5 | 175.9 | -71.6 | -77.8 | 0 | 0 | 0 | 114.1 | C125 P126 V130 V157 I160 L161 P166 L167 | C125-F169 PolarHBondContact SG-O 2.9Å; P126-F169 HydrophobicContact CB-CB 3.99Å; P126-F169 HydrophobicContact CB-CD1 4.23Å; P126-F169 HydrophobicContact CB-CG 4.43Å; V130-F169 HydrophobicContact CG2-CD1 4.46Å; V130-F169 HydrophobicContact CG2-CE1 4.15Å; V157-F169 HydrophobicContact CB-CZ 4.45Å; V157-F169 HydrophobicContact CG1-CE1 4.44Å; V157-F169 HydrophobicContact CG1-CZ 3.93Å; V157-F169 HydrophobicContact CG2-CE1 4.42Å; I160-F169 HydrophobicContact CB-CE1 4.07Å; I160-F169 HydrophobicContact CB-CE2 4.27Å; I160-F169 HydrophobicContact CB-CZ 3.85Å; I160-F169 HydrophobicContact CD1-CD1 3.99Å; I160-F169 HydrophobicContact CD1-CE1 3.58Å; I160-F169 HydrophobicContact CD1-CZ 4.22Å; I160-F169 HydrophobicContact CG1-CE1 4.42Å; I160-F169 HydrophobicContact CG2-CD1 4.08Å; I160-F169 HydrophobicContact CG2-CD2 3.87Å; I160-F169 HydrophobicContact CG2-CE1 3.95Å; I160-F169 HydrophobicContact CG2-CE2 3.73Å; I160-F169 HydrophobicContact CG2-CG 4.03Å; I160-F169 HydrophobicContact CG2-CZ 3.75Å; L161-F169 HydrophobicContact CD1-CE2 3.67Å; L161-F169 HydrophobicContact CD1-CZ 3.8Å; L161-F169 HydrophobicContact CG-CE2 3.95Å; L161-F169 HydrophobicContact CG-CZ 4.44Å; P166-F169 WeakPolarHBondContact O-CD2 3.2Å; P166-F169 PolarHBondContact O-N 3.25Å; L167-F169 PolarHBondContact O-N 3.03Å |
| 170 | Y | 88.6 | Confident | 86.3 | Confident | 101 Ų | 101 | 57.2 Ų | 57.2 | 40% | 0.396 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -98.8 | 13 | 179.4 | -63.5 | -83.7 | 0 | 0 | 0 | 112.7 | L122 C125 L167 G168 G172 L173 | L122-Y170 HydrophobicContact CD2-CE1 4.43Å; L122-Y170 WeakPolarHBondContact O-CE1 3.21Å; C125-Y170 HydrophobicContact CB-CD1 4.35Å; L167-Y170 PolarHBondContact O-N 3.48Å; G168-Y170 PolarHBondContact O-N 3.45Å; Y170-G172 PolarHBondContact O-N 2.72Å; Y170-G172 VanDerWaalsContact O-N 3.16Å; Y170-L173 HydrophobicContact CD1-CD2 4.02Å; Y170-L173 VanDerWaalsContact O-CB 3.26Å; Y170-L173 WeakPolarHBondContact O-CB 3.35Å; Y170-L173 PolarHBondContact O-N 3.43Å |
| 171 | H | 85.3 | Confident | 85.8 | Confident | 72 Ų | 72 | 60.6 Ų | 60.6 | 33% | 0.333 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | 119.9 | 169.1 | -82 | -52.7 | 0 | 0 | 0 | 110.5 | L129 G168 | L129-H171 HydrophobicContact CD1-CB 4.42Å; G168-H171 WeakPolarHBondContact O-CB 3.44Å; G168-H171 PolarHBondContact O-CD2 3.19Å; G168-H171 PolarHBondContact O-N 3.05Å |
| 172 | G | 82.9 | Confident | 85.3 | Confident | 7 Ų | 7 | 58.1 Ų | 58.1 | 7% | 0.072 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 95.1 | -1.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y170 S174 S175 T176 | Y170-G172 PolarHBondContact O-N 2.72Å; Y170-G172 VanDerWaalsContact O-N 3.16Å; G172-S174 VanDerWaalsContact C-N 3.3Å; G172-S174 PolarHBondContact O-N 3.33Å; G172-S175 CarbonylContact O-C 3.56Å; G172-S175 WeakPolarHBondContact O-CA 3.38Å; G172-S175 WeakPolarHBondContact O-CB 3.45Å; G172-S175 PolarHBondContact O-N 3.03Å; G172-T176 PolarHBondContact O-N 3.37Å; G172-T176 PolarHBondContact O-OG1 3.01Å; G172-T176 VanDerWaalsContact O-OG1 3.11Å |
| 173 | L | 87.2 | Confident | 85 | Confident | 36 Ų | 36 | 49.2 Ų | 49.2 | 19% | 0.188 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -55.3 | -42.6 | 179.9 | 177.2 | 65 | 0 | 0 | 0 | 112.8 | L122 C125 Y170 S175 T176 L177 | L122-L173 HydrophobicContact CD2-CD1 3.86Å; L122-L173 HydrophobicContact CD2-CD2 3.71Å; L122-L173 HydrophobicContact CD2-CG 4.43Å; C125-L173 HydrophobicContact CB-CD1 4.25Å; Y170-L173 HydrophobicContact CD1-CD2 4.02Å; Y170-L173 VanDerWaalsContact O-CB 3.26Å; Y170-L173 WeakPolarHBondContact O-CB 3.35Å; Y170-L173 PolarHBondContact O-N 3.43Å; L173-S175 VanDerWaalsContact C-N 3.26Å; L173-S175 PolarHBondContact O-N 3.45Å; L173-T176 WeakPolarHBondContact O-CB 3.4Å; L173-T176 PolarHBondContact O-N 2.92Å; L173-L177 HydrophobicContact CD1-CD1 4.37Å; L173-L177 HydrophobicContact CD1-CG 4.27Å; L173-L177 HydrophobicContact CG-CD1 4.2Å; L173-L177 HydrophobicContact CG-CG 4.5Å; L173-L177 WeakPolarHBondContact O-CG 3.42Å; L173-L177 PolarHBondContact O-N 3.46Å |
| 174 | S | 85.9 | Confident | 84.6 | Confident | 79 Ų | 79 | 47.4 Ų | 47.4 | 55% | 0.552 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -62.1 | -36 | 176.4 | 56.2 | 0 | 0 | 0 | 0 | 112.3 | G172 L178 | G172-S174 VanDerWaalsContact C-N 3.3Å; G172-S174 PolarHBondContact O-N 3.33Å; S174-L178 WeakPolarHBondContact O-CB 3.06Å; S174-L178 PolarHBondContact O-N 3.31Å |
| 175 | S | 84.9 | Confident | 84.5 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -71.6 | -38.5 | 175.5 | -45.1 | 0 | 0 | 0 | 0 | 111.2 | G172 L173 L178 Q179 V230 F249 | G172-S175 CarbonylContact O-C 3.56Å; G172-S175 WeakPolarHBondContact O-CA 3.38Å; G172-S175 WeakPolarHBondContact O-CB 3.45Å; G172-S175 PolarHBondContact O-N 3.03Å; L173-S175 VanDerWaalsContact C-N 3.26Å; L173-S175 PolarHBondContact O-N 3.45Å; S175-L178 PolarHBondContact O-N 2.83Å; S175-Q179 WeakPolarHBondContact O-CB 3.37Å; S175-Q179 PolarHBondContact O-N 3.49Å; S175-V230 VanDerWaalsContact O-CG1 3.31Å; S175-V230 WeakPolarHBondContact O-CG1 3.27Å; S175-F249 WeakPolarHBondContact OG-CD2 3.28Å |
| 176 | T | 85.8 | Confident | 84.3 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.2 | -51.6 | 173.1 | -50 | 0 | 0 | 0 | 0 | 110.9 | A121 G172 L173 L178 Q179 E180 K234 | A121-T176 HydrophobicContact CB-CG2 3.7Å; G172-T176 PolarHBondContact O-N 3.37Å; G172-T176 PolarHBondContact O-OG1 3.01Å; G172-T176 VanDerWaalsContact O-OG1 3.11Å; L173-T176 WeakPolarHBondContact O-CB 3.4Å; L173-T176 PolarHBondContact O-N 2.92Å; T176-L178 VanDerWaalsContact C-N 3.31Å; T176-L178 PolarHBondContact O-N 3.25Å; T176-Q179 WeakPolarHBondContact O-CB 3.31Å; T176-Q179 PolarHBondContact O-N 3.32Å; T176-E180 HydrophobicContact CG2-CG 4.39Å; T176-E180 WeakPolarHBondContact O-CG 3.33Å; T176-E180 PolarHBondContact O-N 3.23Å; T176-K234 WeakPolarHBondContact OG1-CE 3.32Å |
| 177 | L | 86.8 | Confident | 84.2 | Confident | 59 Ų | 59 | 53.7 Ų | 53.7 | 31% | 0.309 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.3 | -40.1 | 178.7 | -70 | 173 | 0 | 0 | 0 | 112.2 | A118 A121 L173 Q179 E180 V181 | A118-L177 HydrophobicContact CB-CD2 3.77Å; A121-L177 HydrophobicContact CB-CD2 3.89Å; L173-L177 HydrophobicContact CD1-CD1 4.37Å; L173-L177 HydrophobicContact CD1-CG 4.27Å; L173-L177 HydrophobicContact CG-CD1 4.2Å; L173-L177 HydrophobicContact CG-CG 4.5Å; L173-L177 WeakPolarHBondContact O-CG 3.42Å; L173-L177 PolarHBondContact O-N 3.46Å; L177-Q179 PolarHBondContact O-N 2.96Å; L177-E180 PolarHBondContact O-N 3.34Å; L177-V181 PolarHBondContact O-N 2.88Å |
| 178 | L | 86.1 | Confident | 83.9 | Confident | 77 Ų | 77 | 49.7 Ų | 49.7 | 40% | 0.403 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -67.7 | -23.3 | 176.1 | -173.1 | 64.3 | 0 | 0 | 0 | 112.9 | S174 S175 T176 P182 V230 F249 | S174-L178 WeakPolarHBondContact O-CB 3.06Å; S174-L178 PolarHBondContact O-N 3.31Å; S175-L178 PolarHBondContact O-N 2.83Å; T176-L178 VanDerWaalsContact C-N 3.31Å; T176-L178 PolarHBondContact O-N 3.25Å; L178-P182 WeakPolarHBondContact O-CD 3.44Å; L178-P182 WeakPolarHBondContact O-CG 3.32Å; L178-V230 HydrophobicContact CB-CG1 4.23Å; L178-V230 HydrophobicContact CD2-CG1 4.35Å; L178-V230 HydrophobicContact CG-CG1 4.28Å; L178-F249 HydrophobicContact CD2-CD1 4.03Å; L178-F249 HydrophobicContact CD2-CD2 4.5Å; L178-F249 HydrophobicContact CD2-CE1 3.6Å; L178-F249 HydrophobicContact CD2-CE2 4.1Å; L178-F249 HydrophobicContact CD2-CG 4.46Å; L178-F249 HydrophobicContact CD2-CZ 3.64Å |
| 179 | Q | 85.3 | Confident | 83.9 | Confident | 20 Ų | 20 | 51 Ų | 51 | 9% | 0.093 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -81.6 | -46.7 | 174.8 | 147 | 167 | 14 | 0 | 0 | 111 | S175 T176 L177 G183 V227 V230 | S175-Q179 WeakPolarHBondContact O-CB 3.37Å; S175-Q179 PolarHBondContact O-N 3.49Å; T176-Q179 WeakPolarHBondContact O-CB 3.31Å; T176-Q179 PolarHBondContact O-N 3.32Å; L177-Q179 PolarHBondContact O-N 2.96Å; Q179-G183 PolarHBondContact O-N 2.7Å; Q179-G183 VanDerWaalsContact O-N 3.14Å; Q179-V227 HydrophobicContact CB-CG1 4.26Å; Q179-V227 HydrophobicContact CG-CG1 3.51Å; Q179-V230 HydrophobicContact CB-CB 4.24Å; Q179-V230 HydrophobicContact CB-CG1 3.73Å |
| 180 | E | 81.6 | Confident | 83.7 | Confident | 28 Ų | 28 | 49.9 Ų | 49.9 | 13% | 0.131 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.8 | -51.8 | -174.5 | -68.7 | -58.8 | 130.8 | 0 | 0 | 112 | T176 L177 G183 Y184 | T176-E180 HydrophobicContact CG2-CG 4.39Å; T176-E180 WeakPolarHBondContact O-CG 3.33Å; T176-E180 PolarHBondContact O-N 3.23Å; L177-E180 PolarHBondContact O-N 3.34Å; E180-G183 PolarHBondContact O-N 2.67Å; E180-Y184 VanDerWaalsContact O-CD2 3.31Å; E180-Y184 WeakPolarHBondContact O-CD2 3.2Å; E180-Y184 PolarHBondContact O-N 2.87Å; E180-Y184 VanDerWaalsContact O-N 3.15Å |
| 181 | V | 78.5 | Confident | 83.6 | Confident | 71 Ų | 71 | 47.7 Ų | 47.7 | 43% | 0.43 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.3 | -51.9 | -170.1 | 176.1 | 0 | 0 | 0 | 0 | 112.9 | L177 G183 F185 | L177-V181 PolarHBondContact O-N 2.88Å; V181-G183 VanDerWaalsContact C-N 3.3Å; V181-G183 PolarHBondContact O-N 3.5Å; V181-F185 PolarHBondContact O-N 3.3Å |
| 182 | P | 79.3 | Confident | 83.4 | Confident | 40 Ų | 40 | 46.1 Ų | 46.1 | 26% | 0.26 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.5 | -34 | 175.4 | -19 | 35.1 | 0 | 0 | 0 | 111.8 | L178 Y184 F185 F186 | L178-P182 WeakPolarHBondContact O-CD 3.44Å; L178-P182 WeakPolarHBondContact O-CG 3.32Å; P182-Y184 PolarHBondContact O-N 2.97Å; P182-F185 WeakPolarHBondContact O-CB 3.41Å; P182-F185 PolarHBondContact O-N 3.23Å; P182-F185 VanDerWaalsContact O-N 3.14Å; P182-F186 HydrophobicContact CB-CD2 4.45Å; P182-F186 HydrophobicContact CB-CE2 4.5Å; P182-F186 VanDerWaalsContact O-CD2 3.23Å; P182-F186 WeakPolarHBondContact O-CD2 3.3Å; P182-F186 PolarHBondContact O-N 3.4Å |
| 183 | G | 80.7 | Confident | 83.6 | Confident | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.01 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -55 | -51.7 | 180 | 0 | 0 | 0 | 0 | 0 | 112 | Q179 E180 V181 F185 F186 Y187 L223 V227 | Q179-G183 PolarHBondContact O-N 2.7Å; Q179-G183 VanDerWaalsContact O-N 3.14Å; E180-G183 PolarHBondContact O-N 2.67Å; V181-G183 VanDerWaalsContact C-N 3.3Å; V181-G183 PolarHBondContact O-N 3.5Å; G183-F185 VanDerWaalsContact C-N 3.34Å; G183-F185 PolarHBondContact O-N 2.89Å; G183-F186 PolarHBondContact O-N 3.49Å; G183-Y187 WeakPolarHBondContact O-CB 3.49Å; G183-Y187 PolarHBondContact O-N 3.47Å; G183-L223 WeakPolarHBondContact O-CD1 3.33Å; G183-V227 VanDerWaalsContact CA-CG2 3.43Å |
| 184 | Y | 77.1 | Confident | 83.6 | Confident | 67 Ų | 67 | 50.8 Ų | 50.8 | 26% | 0.263 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 176.7 | -85.2 | -75.5 | 0 | 0 | 0 | 112.7 | S114 E180 P182 F186 Y187 F188 | S114-Y184 VanDerWaalsContact OG-CB 3.3Å; S114-Y184 WeakPolarHBondContact OG-CB 3.19Å; E180-Y184 VanDerWaalsContact O-CD2 3.31Å; E180-Y184 WeakPolarHBondContact O-CD2 3.2Å; E180-Y184 PolarHBondContact O-N 2.87Å; E180-Y184 VanDerWaalsContact O-N 3.15Å; P182-Y184 PolarHBondContact O-N 2.97Å; Y184-F186 PolarHBondContact O-N 3.21Å; Y184-Y187 PolarHBondContact O-N 3.38Å; Y184-F188 HydrophobicContact CD1-CD2 4.3Å; Y184-F188 AromaticContact CD1-CE2 3.7Å; Y184-F188 HydrophobicContact CD1-CE2 3.7Å; Y184-F188 HydrophobicContact CE1-CE2 4.46Å; Y184-F188 WeakPolarHBondContact O-CD2 3.25Å; Y184-F188 PolarHBondContact O-N 3.01Å |
| 185 | F | 80.6 | Confident | 83.5 | Confident | 132 Ų | 132 | 48.2 Ų | 48.2 | 58% | 0.579 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -58 | -48.4 | 177.3 | -179.4 | -94.5 | 0 | 0 | 0 | 112.3 | V181 P182 G183 G189 | V181-F185 PolarHBondContact O-N 3.3Å; P182-F185 WeakPolarHBondContact O-CB 3.41Å; P182-F185 PolarHBondContact O-N 3.23Å; P182-F185 VanDerWaalsContact O-N 3.14Å; G183-F185 VanDerWaalsContact C-N 3.34Å; G183-F185 PolarHBondContact O-N 2.89Å; F185-G189 PolarHBondContact O-N 3.11Å |
| 186 | F | 85.2 | Confident | 83.5 | Confident | 87 Ų | 87 | 50.9 Ų | 50.9 | 38% | 0.382 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -72.4 | -31 | 179.4 | -76.1 | -77.4 | 0 | 0 | 0 | 113.2 | P182 G183 Y184 G190 V226 | P182-F186 HydrophobicContact CB-CD2 4.45Å; P182-F186 HydrophobicContact CB-CE2 4.5Å; P182-F186 VanDerWaalsContact O-CD2 3.23Å; P182-F186 WeakPolarHBondContact O-CD2 3.3Å; P182-F186 PolarHBondContact O-N 3.4Å; G183-F186 PolarHBondContact O-N 3.49Å; Y184-F186 PolarHBondContact O-N 3.21Å; F186-G190 PolarHBondContact O-N 2.98Å; F186-V226 HydrophobicContact CB-CG2 4.38Å; F186-V226 HydrophobicContact CD1-CG2 3.99Å; F186-V226 HydrophobicContact CD2-CB 4.02Å; F186-V226 HydrophobicContact CD2-CG1 3.68Å; F186-V226 HydrophobicContact CD2-CG2 3.84Å; F186-V226 HydrophobicContact CE1-CG2 4.2Å; F186-V226 HydrophobicContact CE2-CB 4.42Å; F186-V226 HydrophobicContact CE2-CG1 3.75Å; F186-V226 HydrophobicContact CE2-CG2 4.09Å; F186-V226 HydrophobicContact CG-CB 4.32Å; F186-V226 HydrophobicContact CG-CG1 4.45Å; F186-V226 HydrophobicContact CG-CG2 3.8Å; F186-V226 HydrophobicContact CZ-CG2 4.26Å |
| 187 | Y | 85.8 | Confident | 83.5 | Confident | 79 Ų | 79 | 58.1 Ų | 58.1 | 31% | 0.31 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -60.6 | -56.4 | 172.1 | -177.7 | -94 | 0 | 0 | 0 | 110.8 | G183 Y184 G189 G190 Y191 A219 L223 | G183-Y187 WeakPolarHBondContact O-CB 3.49Å; G183-Y187 PolarHBondContact O-N 3.47Å; Y184-Y187 PolarHBondContact O-N 3.38Å; Y187-G189 PolarHBondContact O-N 3.14Å; Y187-G190 PolarHBondContact O-N 3.15Å; Y187-Y191 WeakPolarHBondContact O-CB 3.28Å; Y187-Y191 PolarHBondContact O-N 2.95Å; Y187-A219 HydrophobicContact CD1-CB 4.5Å; Y187-A219 HydrophobicContact CD2-CB 3.8Å; Y187-A219 HydrophobicContact CE1-CB 4.45Å; Y187-A219 HydrophobicContact CE2-CB 3.75Å; Y187-A219 HydrophobicContact CG-CB 4.19Å; Y187-A219 WeakPolarHBondContact O-CB 3.34Å; Y187-L223 HydrophobicContact CD2-CB 4.1Å; Y187-L223 HydrophobicContact CD2-CD2 4.04Å |
| 188 | F | 81.6 | Confident | 83.4 | Confident | 56 Ų | 56 | 58.3 Ų | 58.3 | 25% | 0.246 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.5 | -38.1 | -179.1 | -75.6 | -70.7 | 0 | 0 | 0 | 112.5 | A110 Y184 Y191 E192 | A110-F188 HydrophobicContact CB-CB 4.2Å; A110-F188 HydrophobicContact CB-CD1 4.12Å; A110-F188 HydrophobicContact CB-CD2 3.14Å; A110-F188 HydrophobicContact CB-CE1 4.28Å; A110-F188 HydrophobicContact CB-CE2 3.32Å; A110-F188 HydrophobicContact CB-CG 3.58Å; A110-F188 HydrophobicContact CB-CZ 3.91Å; Y184-F188 HydrophobicContact CD1-CD2 4.3Å; Y184-F188 AromaticContact CD1-CE2 3.7Å; Y184-F188 HydrophobicContact CD1-CE2 3.7Å; Y184-F188 HydrophobicContact CE1-CE2 4.46Å; Y184-F188 WeakPolarHBondContact O-CD2 3.25Å; Y184-F188 PolarHBondContact O-N 3.01Å; F188-Y191 PolarHBondContact O-N 3.42Å; F188-E192 WeakPolarHBondContact O-CB 3.29Å; F188-E192 PolarHBondContact O-N 3.37Å |
| 189 | G | 83.8 | Confident | 83.3 | Confident | 29 Ų | 29 | 55.1 Ų | 55.1 | 30% | 0.299 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -58.7 | -48.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112 | F185 Y187 Y191 E192 L193 | F185-G189 PolarHBondContact O-N 3.11Å; Y187-G189 PolarHBondContact O-N 3.14Å; G189-Y191 VanDerWaalsContact C-N 3.35Å; G189-Y191 PolarHBondContact O-N 3.01Å; G189-E192 PolarHBondContact O-N 2.93Å; G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.45Å; G189-L193 WeakPolarHBondContact O-CG 3.39Å; G189-L193 PolarHBondContact O-N 3.2Å |
| 190 | G | 85.6 | Confident | 82.9 | Confident | 7 Ų | 7 | 59.1 Ų | 59.1 | 7% | 0.072 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.3 | -40.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | F186 Y187 S194 | F186-G190 PolarHBondContact O-N 2.98Å; Y187-G190 PolarHBondContact O-N 3.15Å; G190-S194 WeakPolarHBondContact O-CB 3.12Å; G190-S194 PolarHBondContact O-N 2.86Å |
| 191 | Y | 85.4 | Confident | 82.3 | Confident | 55 Ų | 55 | 61.9 Ų | 61.9 | 22% | 0.216 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.9 | -51.4 | 176.7 | -172.7 | -108.1 | 0 | 0 | 0 | 112.1 | Y187 F188 G189 S194 R195 A219 | Y187-Y191 WeakPolarHBondContact O-CB 3.28Å; Y187-Y191 PolarHBondContact O-N 2.95Å; F188-Y191 PolarHBondContact O-N 3.42Å; G189-Y191 VanDerWaalsContact C-N 3.35Å; G189-Y191 PolarHBondContact O-N 3.01Å; Y191-S194 PolarHBondContact O-N 3.27Å; Y191-R195 HydrophobicContact CE1-CG 4.3Å; Y191-R195 WeakPolarHBondContact O-CG 3.5Å; Y191-R195 PolarHBondContact O-N 2.99Å; Y191-A219 HydrophobicContact CD2-CB 4.31Å |
| 192 | E | 82.7 | Confident | 82.1 | Confident | 38 Ų | 38 | 67.9 Ų | 67.9 | 18% | 0.178 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -70.8 | -36.7 | -176.5 | -78.6 | -57.8 | 123 | 0 | 0 | 113 | F188 G189 R195 S196 K204 | F188-E192 WeakPolarHBondContact O-CB 3.29Å; F188-E192 PolarHBondContact O-N 3.37Å; G189-E192 PolarHBondContact O-N 2.93Å; E192-R195 IonicContact OE1-CZ 3.52Å; E192-R195 IonicContact OE1-NH1 3.83Å; E192-R195 PolarHBondContact OE1-NH1 2.89Å; E192-S196 VanDerWaalsContact O-CB 3.31Å; E192-S196 WeakPolarHBondContact O-CB 3.42Å; E192-S196 PolarHBondContact O-N 3.11Å; E192-S196 PolarHBondContact O-OG 3.48Å; E192-K204 IonicContact OE2-NZ 3.36Å; E192-K204 PolarHBondContact OE2-NZ 3.5Å |
| 193 | L | 86.2 | Confident | 81.9 | Confident | 130 Ų | 130 | 68.8 Ų | 68.8 | 68% | 0.681 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -63.9 | -44.5 | 173.2 | -72.7 | 172 | 0 | 0 | 0 | 111.1 | G189 S196 F197 | G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.45Å; G189-L193 WeakPolarHBondContact O-CG 3.39Å; G189-L193 PolarHBondContact O-N 3.2Å; L193-S196 PolarHBondContact O-N 3.18Å; L193-F197 WeakPolarHBondContact O-CB 3.47Å; L193-F197 PolarHBondContact O-N 3.25Å |
| 194 | S | 86.3 | Confident | 81.4 | Confident | 12 Ų | 12 | 72.3 Ų | 72.3 | 8% | 0.084 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.7 | -43.9 | 178.2 | -165.5 | 0 | 0 | 0 | 0 | 111.9 | G190 Y191 S196 F197 F198 S215 | G190-S194 WeakPolarHBondContact O-CB 3.12Å; G190-S194 PolarHBondContact O-N 2.86Å; Y191-S194 PolarHBondContact O-N 3.27Å; S194-S196 VanDerWaalsContact C-N 3.34Å; S194-S196 PolarHBondContact O-N 2.92Å; S194-F197 WeakPolarHBondContact O-CB 3.41Å; S194-F197 PolarHBondContact O-N 3.25Å; S194-F198 WeakPolarHBondContact O-CD2 3.29Å; S194-F198 PolarHBondContact O-N 3.46Å; S194-F198 VanDerWaalsContact OG-CE2 3.26Å; S194-F198 WeakPolarHBondContact OG-CE2 3.43Å; S194-S215 WeakPolarHBondContact OG-CA 3.42Å |
| 195 | R | 83.9 | Confident | 81.1 | Confident | 25 Ų | 25 | 75.9 Ų | 75.9 | 9% | 0.094 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -60.4 | -42.4 | 172.9 | -75.6 | 180 | 69.7 | -166 | 11.7 | 112.4 | D106 Y191 E192 F197 F198 A199 K204 L207 | D106-R195 IonicContact OD2-NH1 2.67Å; Y191-R195 HydrophobicContact CE1-CG 4.3Å; Y191-R195 WeakPolarHBondContact O-CG 3.5Å; Y191-R195 PolarHBondContact O-N 2.99Å; E192-R195 IonicContact OE1-CZ 3.52Å; E192-R195 IonicContact OE1-NH1 3.83Å; E192-R195 PolarHBondContact OE1-NH1 2.89Å; R195-F197 VanDerWaalsContact C-N 3.3Å; R195-F197 PolarHBondContact O-N 3.03Å; R195-F198 PolarHBondContact O-N 3.16Å; R195-A199 WeakPolarHBondContact O-CB 3.49Å; R195-A199 PolarHBondContact O-N 3.37Å; R195-K204 PolarHBondContact NH2-O 3.01Å; R195-L207 HydrophobicContact CB-CD2 4.34Å; R195-L207 HydrophobicContact CG-CD2 4.25Å |
| 196 | S | 84.9 | Confident | 80.9 | Confident | 55 Ų | 55 | 76.3 Ų | 76.3 | 39% | 0.385 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65.3 | -36.8 | 179.5 | -56.6 | 0 | 0 | 0 | 0 | 111.6 | E192 L193 S194 S200 K204 | E192-S196 VanDerWaalsContact O-CB 3.31Å; E192-S196 WeakPolarHBondContact O-CB 3.42Å; E192-S196 PolarHBondContact O-N 3.11Å; E192-S196 PolarHBondContact O-OG 3.48Å; L193-S196 PolarHBondContact O-N 3.18Å; S194-S196 VanDerWaalsContact C-N 3.34Å; S194-S196 PolarHBondContact O-N 2.92Å; S196-S200 PolarHBondContact O-N 3.31Å; S196-K204 VanDerWaalsContact OG-CE 3.26Å; S196-K204 WeakPolarHBondContact OG-CE 3.42Å; S196-K204 PolarHBondContact OG-NZ 3.24Å |
| 197 | F | 86.8 | Confident | 80.6 | Confident | 152 Ų | 152 | 73.1 Ų | 73.1 | 67% | 0.667 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -64.1 | -51.3 | 173.1 | -177.5 | -97 | 0 | 0 | 0 | 111.8 | L193 S194 R195 A199 S200 | L193-F197 WeakPolarHBondContact O-CB 3.47Å; L193-F197 PolarHBondContact O-N 3.25Å; S194-F197 WeakPolarHBondContact O-CB 3.41Å; S194-F197 PolarHBondContact O-N 3.25Å; R195-F197 VanDerWaalsContact C-N 3.3Å; R195-F197 PolarHBondContact O-N 3.03Å; F197-A199 VanDerWaalsContact C-N 3.33Å; F197-A199 PolarHBondContact O-N 3.18Å; F197-S200 PolarHBondContact O-N 2.87Å; F197-S200 PolarHBondContact O-OG 2.93Å |
| 198 | F | 85.3 | Confident | 80.5 | Confident | 64 Ų | 64 | 70.7 Ų | 70.7 | 28% | 0.281 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -68.2 | -29.1 | 179.4 | -69.8 | -52.7 | 0 | 0 | 0 | 113.9 | S194 R195 S200 L207 H211 L214 S215 | S194-F198 WeakPolarHBondContact O-CD2 3.29Å; S194-F198 PolarHBondContact O-N 3.46Å; S194-F198 VanDerWaalsContact OG-CE2 3.26Å; S194-F198 WeakPolarHBondContact OG-CE2 3.43Å; R195-F198 PolarHBondContact O-N 3.16Å; F198-S200 VanDerWaalsContact C-N 3.26Å; F198-S200 PolarHBondContact O-N 2.86Å; F198-L207 HydrophobicContact CB-CD2 3.78Å; F198-H211 HydrophobicContact CB-CB 4.28Å; F198-H211 AromaticContact CD1-CD2 3.67Å; F198-H211 HydrophobicContact CD2-CB 4.35Å; F198-H211 HydrophobicContact CG-CB 4.3Å; F198-H211 AromaticContact CG-CD2 3.82Å; F198-L214 HydrophobicContact CE2-CB 3.86Å; F198-L214 HydrophobicContact CZ-CB 3.96Å; F198-L214 HydrophobicContact CZ-CD1 4.04Å; F198-S215 WeakPolarHBondContact CD2-OG 3.27Å |
| 199 | A | 82.8 | Confident | 80.7 | Confident | 9 Ų | 9 | 72.9 Ų | 72.9 | 7% | 0.074 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -63.7 | -33.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R195 F197 G201 R202 K204 L207 | R195-A199 WeakPolarHBondContact O-CB 3.49Å; R195-A199 PolarHBondContact O-N 3.37Å; F197-A199 VanDerWaalsContact C-N 3.33Å; F197-A199 PolarHBondContact O-N 3.18Å; A199-G201 PolarHBondContact O-N 3.12Å; A199-R202 WeakPolarHBondContact O-CB 3.38Å; A199-R202 PolarHBondContact O-N 3.26Å; A199-K204 HydrophobicContact CB-CG 4.42Å; A199-L207 HydrophobicContact CB-CD1 3.99Å |
| 200 | S | 77.1 | Confident | 80.8 | Confident | 105 Ų | 105 | 76 Ų | 76 | 73% | 0.734 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 45.2 | 39.6 | 175.4 | -70.8 | 0 | 0 | 0 | 0 | 113.9 | S196 F197 F198 | S196-S200 PolarHBondContact O-N 3.31Å; F197-S200 PolarHBondContact O-N 2.87Å; F197-S200 PolarHBondContact O-OG 2.93Å; F198-S200 VanDerWaalsContact C-N 3.26Å; F198-S200 PolarHBondContact O-N 2.86Å |
| 201 | G | 69.5 | Low | 80.9 | Confident | 86 Ų | 86 | 79.6 Ų | 79.6 | 89% | 0.887 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 92.7 | -0.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | A199 | A199-G201 PolarHBondContact O-N 3.12Š|
| 202 | R | 74.4 | Confident | 80.9 | Confident | 196 Ų | 196 | 79.8 Ų | 79.8 | 74% | 0.74 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -89.4 | 170.3 | 169.8 | -59.1 | -176.1 | -177.6 | 177.6 | 0.5 | 111.7 | A199 | A199-R202 WeakPolarHBondContact O-CB 3.38Å; A199-R202 PolarHBondContact O-N 3.26Å |
| 203 | S | 74.3 | Confident | 81 | Confident | 60 Ų | 60 | 84.9 Ų | 84.9 | 42% | 0.42 | 47% | 0.468 | S | S | . | . | trans | -65.1 | 137.4 | 174.7 | -177.2 | 0 | 0 | 0 | 0 | 111.1 | D205 E206 | S203-D205 PolarHBondContact O-N 2.97Å; S203-D205 VanDerWaalsContact O-N 3.11Å; S203-D205 PolarHBondContact OG-N 3.29Å; S203-E206 PolarHBondContact O-N 3.46Å; S203-E206 VanDerWaalsContact O-N 3.14Å | ||
| 204 | K | 70.4 | Confident | 81.1 | Confident | 74 Ų | 74 | 83 Ų | 83 | 32% | 0.322 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -14.3 | 178.1 | -69.8 | -176.1 | 176.5 | -175.9 | 0 | 113.7 | E192 R195 S196 A199 L207 | E192-K204 IonicContact OE2-NZ 3.36Å; E192-K204 PolarHBondContact OE2-NZ 3.5Å; R195-K204 PolarHBondContact NH2-O 3.01Å; S196-K204 VanDerWaalsContact OG-CE 3.26Å; S196-K204 WeakPolarHBondContact OG-CE 3.42Å; S196-K204 PolarHBondContact OG-NZ 3.24Å; A199-K204 HydrophobicContact CB-CG 4.42Å; K204-L207 VanDerWaalsContact CA-CD1 3.5Å; K204-L207 HydrophobicContact CB-CD1 4.45Å; K204-L207 VanDerWaalsContact O-CD1 3.27Å; K204-L207 WeakPolarHBondContact O-CD1 3.4Å |
| 205 | D | 71.8 | Confident | 81.1 | Confident | 143 Ų | 143 | 82.5 Ų | 82.5 | 77% | 0.765 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | -11.6 | -179.7 | -59.6 | -37.2 | 0 | 0 | 0 | 112.6 | S203 | S203-D205 PolarHBondContact O-N 2.97Å; S203-D205 VanDerWaalsContact O-N 3.11Å; S203-D205 PolarHBondContact OG-N 3.29Å |
| 206 | E | 75.3 | Confident | 81.2 | Confident | 140 Ų | 140 | 82.3 Ų | 82.3 | 65% | 0.654 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -90.4 | -0.1 | 177 | -64.6 | -179.4 | 171 | 0 | 0 | 113 | S203 G208 | S203-E206 PolarHBondContact O-N 3.46Å; S203-E206 VanDerWaalsContact O-N 3.14Å; E206-G208 PolarHBondContact O-N 3.25Å |
| 207 | L | 78.4 | Confident | 81.3 | Confident | 20 Ų | 20 | 81.5 Ų | 81.5 | 11% | 0.105 | 46% | 0.461 | C | S | . | . | trans | -67.2 | 118.2 | 179.4 | -84 | 86.7 | 0 | 0 | 0 | 110.3 | R195 F198 A199 K204 H211 L212 | R195-L207 HydrophobicContact CB-CD2 4.34Å; R195-L207 HydrophobicContact CG-CD2 4.25Å; F198-L207 HydrophobicContact CB-CD2 3.78Å; A199-L207 HydrophobicContact CB-CD1 3.99Å; K204-L207 VanDerWaalsContact CA-CD1 3.5Å; K204-L207 HydrophobicContact CB-CD1 4.45Å; K204-L207 VanDerWaalsContact O-CD1 3.27Å; K204-L207 WeakPolarHBondContact O-CD1 3.4Å; L207-H211 HydrophobicContact CB-CB 4.32Å; L207-H211 HydrophobicContact CD2-CB 3.82Å; L207-H211 HydrophobicContact CG-CB 4.28Å; L207-L212 HydrophobicContact CB-CD2 4.08Å; L207-L212 HydrophobicContact CB-CG 4.24Å | ||
| 208 | G | 84.6 | Confident | 81.3 | Confident | 29 Ų | 29 | 77.1 Ų | 77.1 | 30% | 0.299 | 45% | 0.447 | S | S | . | . | trans | -63.1 | 162.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | E206 V210 H211 L212 | E206-G208 PolarHBondContact O-N 3.25Å; G208-V210 PolarHBondContact O-N 2.95Å; G208-H211 PolarHBondContact O-N 3.01Å; G208-L212 PolarHBondContact O-N 3.46Å | ||
| 209 | P | 85.5 | Confident | 81.4 | Confident | 101 Ų | 101 | 74.1 Ų | 74.1 | 66% | 0.656 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -52.3 | -36.7 | -174.7 | -28.1 | 34.6 | 0 | 0 | 0 | 114.5 | L212 M213 | P209-L212 PolarHBondContact O-N 3.32Å; P209-M213 WeakPolarHBondContact O-CB 3.39Å; P209-M213 VanDerWaalsContact O-CG 3.25Å; P209-M213 WeakPolarHBondContact O-CG 3.35Å; P209-M213 PolarHBondContact O-N 2.94Å |
| 210 | V | 86.8 | Confident | 81.6 | Confident | 96 Ų | 96 | 74.5 Ų | 74.5 | 58% | 0.582 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -63.1 | -44.7 | 179.9 | 178.4 | 0 | 0 | 0 | 0 | 111.9 | G208 L212 M213 L214 | G208-V210 PolarHBondContact O-N 2.95Å; V210-L212 VanDerWaalsContact C-N 3.34Å; V210-L212 PolarHBondContact O-N 3.19Å; V210-M213 PolarHBondContact O-N 3.28Å; V210-L214 HydrophobicContact CG1-CD1 4.32Å; V210-L214 WeakPolarHBondContact O-CG 3.47Å; V210-L214 PolarHBondContact O-N 3.45Å |
| 211 | H | 85.9 | Confident | 82 | Confident | 82 Ų | 82 | 74 Ų | 74 | 38% | 0.38 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -69.7 | -34.2 | -180 | -60.8 | 98.9 | 0 | 0 | 0 | 111.6 | F198 L207 G208 L214 S215 | F198-H211 HydrophobicContact CB-CB 4.28Å; F198-H211 AromaticContact CD1-CD2 3.67Å; F198-H211 HydrophobicContact CD2-CB 4.35Å; F198-H211 HydrophobicContact CG-CB 4.3Å; F198-H211 AromaticContact CG-CD2 3.82Å; L207-H211 HydrophobicContact CB-CB 4.32Å; L207-H211 HydrophobicContact CD2-CB 3.82Å; L207-H211 HydrophobicContact CG-CB 4.28Å; G208-H211 PolarHBondContact O-N 3.01Å; H211-L214 PolarHBondContact O-N 3.48Å; H211-S215 WeakPolarHBondContact O-CB 3.31Å; H211-S215 PolarHBondContact O-N 2.83Å; H211-S215 PolarHBondContact O-OG 2.88Å |
| 212 | L | 85.4 | Confident | 82.9 | Confident | 59 Ų | 59 | 71.9 Ų | 71.9 | 31% | 0.309 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.4 | -42 | 172.5 | -64.6 | 175.2 | 0 | 0 | 0 | 111.4 | L207 G208 P209 V210 S215 G216 | L207-L212 HydrophobicContact CB-CD2 4.08Å; L207-L212 HydrophobicContact CB-CG 4.24Å; G208-L212 PolarHBondContact O-N 3.46Å; P209-L212 PolarHBondContact O-N 3.32Å; V210-L212 VanDerWaalsContact C-N 3.34Å; V210-L212 PolarHBondContact O-N 3.19Å; L212-S215 PolarHBondContact O-N 2.87Å; L212-G216 PolarHBondContact O-N 3.39Å |
| 213 | M | 85.3 | Confident | 83.6 | Confident | 144 Ų | 144 | 64.4 Ų | 64.4 | 71% | 0.709 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62 | -45.9 | 174.8 | -73 | 174.7 | 70.7 | 0 | 0 | 112 | P209 V210 S215 G216 G217 | P209-M213 WeakPolarHBondContact O-CB 3.39Å; P209-M213 VanDerWaalsContact O-CG 3.25Å; P209-M213 WeakPolarHBondContact O-CG 3.35Å; P209-M213 PolarHBondContact O-N 2.94Å; V210-M213 PolarHBondContact O-N 3.28Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.45Å; M213-G216 PolarHBondContact O-N 3.49Å; M213-G217 PolarHBondContact O-N 2.98Å |
| 214 | L | 87.9 | Confident | 84.2 | Confident | 92 Ų | 92 | 64.3 Ų | 64.3 | 48% | 0.482 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63 | -40.7 | 175.8 | -69.5 | 175.7 | 0 | 0 | 0 | 111.6 | F198 V210 H211 G216 G217 V218 | F198-L214 HydrophobicContact CE2-CB 3.86Å; F198-L214 HydrophobicContact CZ-CB 3.96Å; F198-L214 HydrophobicContact CZ-CD1 4.04Å; V210-L214 HydrophobicContact CG1-CD1 4.32Å; V210-L214 WeakPolarHBondContact O-CG 3.47Å; V210-L214 PolarHBondContact O-N 3.45Å; H211-L214 PolarHBondContact O-N 3.48Å; L214-G216 PolarHBondContact O-N 3.46Å; L214-G217 PolarHBondContact O-N 3.03Å; L214-V218 WeakPolarHBondContact O-CG2 3.45Å; L214-V218 PolarHBondContact O-N 3.37Å |
| 215 | S | 86.6 | Confident | 85 | Confident | 0 Ų | 0 | 64.8 Ų | 64.8 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 175.6 | -57.8 | 0 | 0 | 0 | 0 | 111.9 | S194 F198 H211 L212 M213 G217 V218 A219 | S194-S215 WeakPolarHBondContact OG-CA 3.42Å; F198-S215 WeakPolarHBondContact CD2-OG 3.27Å; H211-S215 WeakPolarHBondContact O-CB 3.31Å; H211-S215 PolarHBondContact O-N 2.83Å; H211-S215 PolarHBondContact O-OG 2.88Å; L212-S215 PolarHBondContact O-N 2.87Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.45Å; S215-G217 VanDerWaalsContact C-N 3.34Å; S215-V218 PolarHBondContact O-N 3.43Å; S215-A219 WeakPolarHBondContact O-CB 3.22Å; S215-A219 PolarHBondContact O-N 3.32Å |
| 216 | G | 85.9 | Confident | 85.8 | Confident | 21 Ų | 21 | 60.6 Ų | 60.6 | 22% | 0.216 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63 | -38 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L212 M213 L214 A219 G220 | L212-G216 PolarHBondContact O-N 3.39Å; M213-G216 PolarHBondContact O-N 3.49Å; L214-G216 PolarHBondContact O-N 3.46Å; G216-A219 WeakPolarHBondContact O-CB 3.45Å; G216-A219 PolarHBondContact O-N 3.01Å; G216-G220 PolarHBondContact O-N 3.21Å |
| 217 | G | 86.9 | Confident | 86.4 | Confident | 39 Ų | 39 | 54.3 Ų | 54.3 | 40% | 0.402 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.1 | -47.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.7 | M213 L214 S215 G220 I221 | M213-G217 PolarHBondContact O-N 2.98Å; L214-G217 PolarHBondContact O-N 3.03Å; S215-G217 VanDerWaalsContact C-N 3.34Å; G217-G220 PolarHBondContact O-N 2.89Å; G217-I221 WeakPolarHBondContact O-CG1 3.2Å; G217-I221 PolarHBondContact O-N 3.48Å |
| 218 | V | 87.9 | Confident | 87 | Confident | 60 Ų | 60 | 53.3 Ų | 53.3 | 36% | 0.364 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 175.8 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | L214 S215 G220 I221 C222 | L214-V218 WeakPolarHBondContact O-CG2 3.45Å; L214-V218 PolarHBondContact O-N 3.37Å; S215-V218 PolarHBondContact O-N 3.43Å; V218-G220 VanDerWaalsContact C-N 3.32Å; V218-G220 PolarHBondContact O-N 2.94Å; V218-I221 PolarHBondContact O-N 3.33Å; V218-I221 VanDerWaalsContact O-N 3.17Å; V218-C222 PolarHBondContact O-N 2.86Å; V218-C222 PolarHBondContact O-SG 2.94Å; V218-C222 VanDerWaalsContact O-SG 3.37Å |
| 219 | A | 86.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -54.9 | -46.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y187 Y191 S215 G216 C222 L223 | Y187-A219 HydrophobicContact CD1-CB 4.5Å; Y187-A219 HydrophobicContact CD2-CB 3.8Å; Y187-A219 HydrophobicContact CE1-CB 4.45Å; Y187-A219 HydrophobicContact CE2-CB 3.75Å; Y187-A219 HydrophobicContact CG-CB 4.19Å; Y187-A219 WeakPolarHBondContact O-CB 3.34Å; Y191-A219 HydrophobicContact CD2-CB 4.31Å; S215-A219 WeakPolarHBondContact O-CB 3.22Å; S215-A219 PolarHBondContact O-N 3.32Å; G216-A219 WeakPolarHBondContact O-CB 3.45Å; G216-A219 PolarHBondContact O-N 3.01Å; A219-C222 PolarHBondContact O-N 3.47Å; A219-L223 WeakPolarHBondContact O-CB 3.26Å; A219-L223 PolarHBondContact O-N 2.87Å |
| 220 | G | 86.1 | Confident | 87.5 | Confident | 17 Ų | 17 | 49.2 Ų | 49.2 | 18% | 0.175 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G216 G217 V218 L223 W224 | G216-G220 PolarHBondContact O-N 3.21Å; G217-G220 PolarHBondContact O-N 2.89Å; V218-G220 VanDerWaalsContact C-N 3.32Å; V218-G220 PolarHBondContact O-N 2.94Å; G220-L223 WeakPolarHBondContact O-CB 3.45Å; G220-L223 PolarHBondContact O-N 2.77Å; G220-W224 PolarHBondContact O-N 2.74Å |
| 221 | I | 87.2 | Confident | 87.6 | Confident | 96 Ų | 96 | 44.8 Ų | 44.8 | 49% | 0.492 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.5 | -47.5 | 177 | -67.6 | 165.7 | 0 | 0 | 0 | 110.5 | G217 V218 L223 W224 L225 | G217-I221 WeakPolarHBondContact O-CG1 3.2Å; G217-I221 PolarHBondContact O-N 3.48Å; V218-I221 PolarHBondContact O-N 3.33Å; V218-I221 VanDerWaalsContact O-N 3.17Å; I221-L223 VanDerWaalsContact C-N 3.35Å; I221-L223 PolarHBondContact O-N 3.18Å; I221-W224 PolarHBondContact O-N 2.94Å; I221-L225 HydrophobicContact CG2-CD1 3.79Å; I221-L225 HydrophobicContact CG2-CG 4.22Å; I221-L225 WeakPolarHBondContact O-CB 3.31Å; I221-L225 VanDerWaalsContact O-CG 3.27Å; I221-L225 WeakPolarHBondContact O-CG 3.3Å; I221-L225 PolarHBondContact O-N 3.01Å |
| 222 | C | 87.6 | Confident | 87.8 | Confident | 40 Ų | 40 | 40.9 Ų | 40.9 | 27% | 0.27 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -58.8 | -45.7 | 177.6 | -69.3 | 0 | 0 | 0 | 0 | 112.1 | V218 A219 L225 V226 | V218-C222 PolarHBondContact O-N 2.86Å; V218-C222 PolarHBondContact O-SG 2.94Å; V218-C222 VanDerWaalsContact O-SG 3.37Å; A219-C222 PolarHBondContact O-N 3.47Å; C222-L225 PolarHBondContact O-N 2.98Å; C222-V226 PolarHBondContact O-N 2.98Å |
| 223 | L | 89.2 | Confident | 88.1 | Confident | 40 Ų | 40 | 38.1 Ų | 38.1 | 21% | 0.209 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -54 | -57.7 | 173.9 | 170.2 | 74.7 | 0 | 0 | 0 | 110.9 | G183 Y187 A219 G220 I221 L225 V226 V227 | G183-L223 WeakPolarHBondContact O-CD1 3.33Å; Y187-L223 HydrophobicContact CD2-CB 4.1Å; Y187-L223 HydrophobicContact CD2-CD2 4.04Å; A219-L223 WeakPolarHBondContact O-CB 3.26Å; A219-L223 PolarHBondContact O-N 2.87Å; G220-L223 WeakPolarHBondContact O-CB 3.45Å; G220-L223 PolarHBondContact O-N 2.77Å; I221-L223 VanDerWaalsContact C-N 3.35Å; I221-L223 PolarHBondContact O-N 3.18Å; L223-L225 VanDerWaalsContact C-N 3.34Å; L223-L225 PolarHBondContact O-N 3.48Å; L223-V226 PolarHBondContact O-N 3.48Å; L223-V227 HydrophobicContact CD1-CG2 3.79Å; L223-V227 HydrophobicContact CG-CG2 4.41Å; L223-V227 VanDerWaalsContact O-CB 3.3Å; L223-V227 WeakPolarHBondContact O-CB 3.27Å; L223-V227 WeakPolarHBondContact O-CG2 3.2Å; L223-V227 PolarHBondContact O-N 2.88Å |
| 224 | W | 87.8 | Confident | 88.3 | Confident | 57 Ų | 57 | 31.3 Ų | 31.3 | 22% | 0.216 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.2 | -36.9 | -174.5 | -75.1 | 112.6 | 0 | 0 | 0 | 112 | G220 I221 V226 V227 F228 L269 T272 M273 | G220-W224 PolarHBondContact O-N 2.74Å; I221-W224 PolarHBondContact O-N 2.94Å; W224-V226 VanDerWaalsContact C-N 3.27Å; W224-V226 PolarHBondContact O-N 3.43Å; W224-V227 PolarHBondContact O-N 3.27Å; W224-F228 HydrophobicContact CE3-CD2 4.11Å; W224-F228 WeakPolarHBondContact O-CB 3.44Å; W224-F228 PolarHBondContact O-N 3.31Å; W224-L269 HydrophobicContact CB-CD1 4.37Å; W224-T272 HydrophobicContact CD2-CG2 3.97Å; W224-T272 HydrophobicContact CE3-CG2 3.93Å; W224-T272 HydrophobicContact CH2-CG2 3.59Å; W224-T272 HydrophobicContact CZ2-CG2 3.61Å; W224-T272 HydrophobicContact CZ3-CG2 3.75Å; W224-M273 HydrophobicContact CB-CE 4.08Å; W224-M273 VanDerWaalsContact CD1-CE 3.49Å; W224-M273 HydrophobicContact CD2-CE 4.15Å; W224-M273 HydrophobicContact CG-CE 3.64Å |
| 225 | L | 86.9 | Confident | 88.2 | Confident | 85 Ų | 85 | 27 Ų | 27 | 45% | 0.445 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -60 | -36.4 | 178.4 | -75.2 | 173.5 | 0 | 0 | 0 | 113.5 | I221 C222 L223 Y266 | I221-L225 HydrophobicContact CG2-CD1 3.79Å; I221-L225 HydrophobicContact CG2-CG 4.22Å; I221-L225 WeakPolarHBondContact O-CB 3.31Å; I221-L225 VanDerWaalsContact O-CG 3.27Å; I221-L225 WeakPolarHBondContact O-CG 3.3Å; I221-L225 PolarHBondContact O-N 3.01Å; C222-L225 PolarHBondContact O-N 2.98Å; L223-L225 VanDerWaalsContact C-N 3.34Å; L223-L225 PolarHBondContact O-N 3.48Å; L225-Y266 PolarHBondContact O-OH 2.9Å; L225-Y266 VanDerWaalsContact O-OH 3.07Å |
| 226 | V | 87 | Confident | 88.2 | Confident | 55 Ų | 55 | 27.5 Ų | 27.5 | 33% | 0.333 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -86.3 | -40.1 | -179.4 | 177.3 | 0 | 0 | 0 | 0 | 112.1 | F186 C222 L223 W224 P229 | F186-V226 HydrophobicContact CB-CG2 4.38Å; F186-V226 HydrophobicContact CD1-CG2 3.99Å; F186-V226 HydrophobicContact CD2-CB 4.02Å; F186-V226 HydrophobicContact CD2-CG1 3.68Å; F186-V226 HydrophobicContact CD2-CG2 3.84Å; F186-V226 HydrophobicContact CE1-CG2 4.2Å; F186-V226 HydrophobicContact CE2-CB 4.42Å; F186-V226 HydrophobicContact CE2-CG1 3.75Å; F186-V226 HydrophobicContact CE2-CG2 4.09Å; F186-V226 HydrophobicContact CG-CB 4.32Å; F186-V226 HydrophobicContact CG-CG1 4.45Å; F186-V226 HydrophobicContact CG-CG2 3.8Å; F186-V226 HydrophobicContact CZ-CG2 4.26Å; C222-V226 PolarHBondContact O-N 2.98Å; L223-V226 PolarHBondContact O-N 3.48Å; W224-V226 VanDerWaalsContact C-N 3.27Å; W224-V226 PolarHBondContact O-N 3.43Å; V226-P229 WeakPolarHBondContact O-CD 3.37Å |
| 227 | V | 89.4 | Confident | 88.3 | Confident | 7 Ų | 7 | 27.1 Ų | 27.1 | 4% | 0.042 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -76.7 | -33.1 | -174.8 | 167 | 0 | 0 | 0 | 0 | 112.2 | Q179 G183 L223 W224 V230 D231 | Q179-V227 HydrophobicContact CB-CG1 4.26Å; Q179-V227 HydrophobicContact CG-CG1 3.51Å; G183-V227 VanDerWaalsContact CA-CG2 3.43Å; L223-V227 HydrophobicContact CD1-CG2 3.79Å; L223-V227 HydrophobicContact CG-CG2 4.41Å; L223-V227 VanDerWaalsContact O-CB 3.3Å; L223-V227 WeakPolarHBondContact O-CB 3.27Å; L223-V227 WeakPolarHBondContact O-CG2 3.2Å; L223-V227 PolarHBondContact O-N 2.88Å; W224-V227 PolarHBondContact O-N 3.27Å; V227-V230 WeakPolarHBondContact O-CB 3.43Å; V227-V230 PolarHBondContact O-N 2.86Å; V227-D231 HydrophobicContact CG1-CB 4.43Å; V227-D231 PolarHBondContact O-N 3.33Å |
| 228 | F | 89.6 | Confident | 88.2 | Confident | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | -168.5 | -158.7 | -82.2 | 0 | 0 | 0 | 114.5 | W224 V230 D231 C232 L265 Y266 S267 G268 L269 | W224-F228 HydrophobicContact CE3-CD2 4.11Å; W224-F228 WeakPolarHBondContact O-CB 3.44Å; W224-F228 PolarHBondContact O-N 3.31Å; F228-V230 VanDerWaalsContact C-N 3.35Å; F228-V230 PolarHBondContact O-N 2.89Å; F228-D231 PolarHBondContact O-N 3.22Å; F228-C232 PolarHBondContact O-N 2.85Å; F228-L265 WeakPolarHBondContact CD1-O 3.43Å; F228-L265 WeakPolarHBondContact CE1-O 3.21Å; F228-Y266 HydrophobicContact CB-CD1 4.27Å; F228-Y266 HydrophobicContact CB-CE1 4.35Å; F228-Y266 HydrophobicContact CD1-CD1 4.05Å; F228-Y266 HydrophobicContact CG-CD1 4.44Å; F228-S267 WeakPolarHBondContact CE1-O 3.17Å; F228-S267 WeakPolarHBondContact CZ-O 3.42Å; F228-G268 VanDerWaalsContact CZ-C 3.41Å; F228-L269 HydrophobicContact CD1-CB 4.38Å; F228-L269 HydrophobicContact CD2-CB 4.27Å; F228-L269 HydrophobicContact CD2-CD1 3.68Å; F228-L269 HydrophobicContact CE1-CB 4.11Å; F228-L269 VanDerWaalsContact CE2-CA 3.47Å; F228-L269 HydrophobicContact CE2-CB 3.98Å; F228-L269 HydrophobicContact CE2-CD1 4.05Å; F228-L269 HydrophobicContact CG-CB 4.47Å; F228-L269 HydrophobicContact CG-CD1 4.11Å; F228-L269 VanDerWaalsContact CZ-CA 3.47Å; F228-L269 HydrophobicContact CZ-CB 3.92Å |
| 229 | P | 90.8 | Very high | 87.9 | Confident | 22 Ų | 22 | 22.4 Ų | 22.4 | 14% | 0.143 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -57.8 | -43.5 | 170.2 | -27.4 | 36.2 | 0 | 0 | 0 | 113.7 | V226 D231 C232 I233 L265 Y266 | V226-P229 WeakPolarHBondContact O-CD 3.37Å; P229-D231 VanDerWaalsContact C-N 3.34Å; P229-C232 PolarHBondContact O-N 3.48Å; P229-I233 WeakPolarHBondContact O-CG1 3.38Å; P229-I233 PolarHBondContact O-N 2.8Å; P229-L265 HydrophobicContact CB-CB 4.15Å; P229-L265 HydrophobicContact CB-CD1 4.31Å; P229-L265 HydrophobicContact CG-CB 4.47Å; P229-Y266 HydrophobicContact CG-CE1 4.06Å; P229-Y266 HydrophobicContact CG-CE2 4.14Å; P229-Y266 WeakPolarHBondContact CG-OH 3.31Å |
| 230 | V | 91.3 | Very high | 87.6 | Confident | 21 Ų | 21 | 24 Ų | 24 | 13% | 0.127 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -65.2 | -42.7 | 179.1 | -175.7 | 0 | 0 | 0 | 0 | 110.2 | S175 L178 Q179 V227 F228 I233 K234 F249 | S175-V230 VanDerWaalsContact O-CG1 3.31Å; S175-V230 WeakPolarHBondContact O-CG1 3.27Å; L178-V230 HydrophobicContact CB-CG1 4.23Å; L178-V230 HydrophobicContact CD2-CG1 4.35Å; L178-V230 HydrophobicContact CG-CG1 4.28Å; Q179-V230 HydrophobicContact CB-CB 4.24Å; Q179-V230 HydrophobicContact CB-CG1 3.73Å; V227-V230 WeakPolarHBondContact O-CB 3.43Å; V227-V230 PolarHBondContact O-N 2.86Å; F228-V230 VanDerWaalsContact C-N 3.35Å; F228-V230 PolarHBondContact O-N 2.89Å; V230-I233 PolarHBondContact O-N 3.07Å; V230-K234 WeakPolarHBondContact O-CB 3.26Å; V230-K234 PolarHBondContact O-N 3.13Å; V230-F249 HydrophobicContact CB-CE2 4.42Å; V230-F249 HydrophobicContact CB-CZ 4.5Å; V230-F249 HydrophobicContact CG1-CE2 3.83Å; V230-F249 HydrophobicContact CG1-CZ 4.19Å; V230-F249 HydrophobicContact CG2-CZ 4.26Å |
| 231 | D | 89.3 | Confident | 87.2 | Confident | 4 Ų | 4 | 23.5 Ų | 23.5 | 2% | 0.021 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.5 | -39.4 | 177.8 | 176 | 101.2 | 0 | 0 | 0 | 112.6 | K34 Q38 V227 F228 P229 K234 S235 | K34-D231 WeakPolarHBondContact CE-OD2 3.25Å; K34-D231 IonicContact NZ-OD1 2.93Å; K34-D231 PolarHBondContact NZ-OD1 2.82Å; K34-D231 IonicContact NZ-OD2 3.89Å; K34-D231 PolarHBondContact NZ-OD2 3.28Å; Q38-D231 PolarHBondContact NE2-OD2 3.47Å; Q38-D231 PolarHBondContact OE1-OD2 3.41Å; V227-D231 HydrophobicContact CG1-CB 4.43Å; V227-D231 PolarHBondContact O-N 3.33Å; F228-D231 PolarHBondContact O-N 3.22Å; P229-D231 VanDerWaalsContact C-N 3.34Å; D231-K234 PolarHBondContact O-N 3.48Å; D231-S235 PolarHBondContact O-N 3.38Å; D231-S235 PolarHBondContact O-OG 2.87Å; D231-S235 VanDerWaalsContact O-OG 3.13Å |
| 232 | C | 89.2 | Confident | 86.5 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.4 | -45.3 | 174.1 | -175.4 | 0 | 0 | 0 | 0 | 111.7 | Q38 F228 P229 R236 L265 | Q38-C232 HydrophobicContact CG-CB 4.41Å; F228-C232 PolarHBondContact O-N 2.85Å; P229-C232 PolarHBondContact O-N 3.48Å; C232-R236 WeakPolarHBondContact O-CG 3.46Å; C232-R236 PolarHBondContact O-N 3.24Å; C232-L265 VanDerWaalsContact CB-O 3.29Å; C232-L265 WeakPolarHBondContact CB-O 3.2Å |
| 233 | I | 90.6 | Very high | 85.7 | Confident | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -66.4 | -41.4 | 177.4 | -62.1 | -53.8 | 0 | 0 | 0 | 111.5 | P229 V230 R236 I237 F249 T252 L253 V256 L265 | P229-I233 WeakPolarHBondContact O-CG1 3.38Å; P229-I233 PolarHBondContact O-N 2.8Å; V230-I233 PolarHBondContact O-N 3.07Å; I233-R236 PolarHBondContact O-N 3.25Å; I233-I237 HydrophobicContact CG2-CD1 3.77Å; I233-I237 HydrophobicContact CG2-CG1 4.4Å; I233-I237 WeakPolarHBondContact O-CG1 3.34Å; I233-I237 PolarHBondContact O-N 2.86Å; I233-F249 HydrophobicContact CB-CD2 4.16Å; I233-F249 HydrophobicContact CB-CE2 3.77Å; I233-F249 HydrophobicContact CG1-CE2 4.38Å; I233-F249 HydrophobicContact CG2-CD2 3.47Å; I233-F249 VanDerWaalsContact CG2-CD2 3.47Å; I233-F249 HydrophobicContact CG2-CE2 3.61Å; I233-F249 HydrophobicContact CG2-CG 4.27Å; I233-F249 HydrophobicContact CG2-CZ 4.49Å; I233-T252 HydrophobicContact CD1-CG2 4.21Å; I233-T252 HydrophobicContact CG2-CG2 3.94Å; I233-L253 HydrophobicContact CD1-CB 4.31Å; I233-L253 HydrophobicContact CD1-CD1 4.18Å; I233-L253 HydrophobicContact CG1-CB 4.31Å; I233-L253 HydrophobicContact CG1-CD1 4.01Å; I233-V256 HydrophobicContact CD1-CB 4.11Å; I233-V256 HydrophobicContact CD1-CG2 3.85Å; I233-L265 HydrophobicContact CD1-CD2 3.72Å; I233-L265 HydrophobicContact CG1-CD2 4.09Å |
| 234 | K | 89.7 | Confident | 84.7 | Confident | 1 Ų | 1 | 25 Ų | 25 | 0% | 0.004 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -57 | -51.8 | 175.6 | 177.5 | -172 | 171.8 | -172.2 | 0 | 111.4 | E128 T176 V230 D231 R236 I237 Q238 | E128-K234 VanDerWaalsContact CD-CE 3.49Å; E128-K234 WeakPolarHBondContact OE1-CE 3.25Å; E128-K234 IonicContact OE1-NZ 2.79Å; E128-K234 PolarHBondContact OE1-NZ 3.35Å; E128-K234 WeakPolarHBondContact OE2-CE 3.32Å; E128-K234 IonicContact OE2-NZ 2.65Å; E128-K234 PolarHBondContact OE2-NZ 2.86Å; T176-K234 WeakPolarHBondContact OG1-CE 3.32Å; V230-K234 WeakPolarHBondContact O-CB 3.26Å; V230-K234 PolarHBondContact O-N 3.13Å; D231-K234 PolarHBondContact O-N 3.48Å; K234-R236 VanDerWaalsContact C-N 3.27Å; K234-R236 PolarHBondContact O-N 3.4Å; K234-I237 PolarHBondContact O-N 2.81Å; K234-I237 VanDerWaalsContact O-N 3.13Å; K234-Q238 HydrophobicContact CG-CG 4.41Å; K234-Q238 WeakPolarHBondContact O-CB 3.23Å; K234-Q238 WeakPolarHBondContact O-CG 3.27Å; K234-Q238 PolarHBondContact O-N 3.42Å |
| 235 | S | 86.6 | Confident | 83.3 | Confident | 2 Ų | 2 | 32.7 Ų | 32.7 | 1% | 0.014 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.4 | -41.7 | 179.5 | -66.7 | 0 | 0 | 0 | 0 | 111.6 | Q38 D231 Q238 V239 | Q38-S235 PolarHBondContact OE1-OG 3.17Å; D231-S235 PolarHBondContact O-N 3.38Å; D231-S235 PolarHBondContact O-OG 2.87Å; D231-S235 VanDerWaalsContact O-OG 3.13Å; S235-Q238 PolarHBondContact O-N 3.4Å; S235-V239 WeakPolarHBondContact O-CB 3.32Å; S235-V239 VanDerWaalsContact O-CG2 3.27Å; S235-V239 WeakPolarHBondContact O-CG2 3.41Å; S235-V239 PolarHBondContact O-N 3.42Å |
| 236 | R | 87.4 | Confident | 82.2 | Confident | 11 Ų | 11 | 32.3 Ų | 32.3 | 4% | 0.042 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -64.4 | -44.5 | 175.5 | -71.4 | 174.6 | -178.2 | -109.6 | 3.1 | 112.6 | Q38 C232 I233 K234 V239 L240 T252 E260 | Q38-R236 WeakPolarHBondContact O-CG 3.49Å; Q38-R236 PolarHBondContact O-NE 3.47Å; Q38-R236 PolarHBondContact O-NH2 3.46Å; C232-R236 WeakPolarHBondContact O-CG 3.46Å; C232-R236 PolarHBondContact O-N 3.24Å; I233-R236 PolarHBondContact O-N 3.25Å; K234-R236 VanDerWaalsContact C-N 3.27Å; K234-R236 PolarHBondContact O-N 3.4Å; R236-V239 PolarHBondContact O-N 3.33Å; R236-L240 HydrophobicContact CB-CD1 4.12Å; R236-L240 WeakPolarHBondContact O-CA 3.42Å; R236-L240 WeakPolarHBondContact O-CB 3.17Å; R236-L240 VanDerWaalsContact O-CG 3.23Å; R236-L240 WeakPolarHBondContact O-CG 3.14Å; R236-L240 PolarHBondContact O-N 3.35Å; R236-T252 HydrophobicContact CB-CG2 4.22Å; R236-E260 IonicContact CZ-OE1 3.95Å; R236-E260 IonicContact CZ-OE2 3.28Å; R236-E260 IonicContact NH1-OE1 2.62Å; R236-E260 PolarHBondContact NH1-OE1 3.34Å; R236-E260 IonicContact NH1-OE2 2.77Å; R236-E260 PolarHBondContact NH1-OE2 3.04Å; R236-E260 IonicContact NH2-OE1 2.71Å; R236-E260 IonicContact NH2-OE2 2.71Å; R236-E260 PolarHBondContact NH2-OE2 3.49Å |
| 237 | I | 86.8 | Confident | 81 | Confident | 13 Ų | 13 | 32.2 Ų | 32.2 | 7% | 0.067 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.5 | -45.8 | 177.6 | -69.7 | 168.3 | 0 | 0 | 0 | 110.7 | I233 K234 V239 S241 F249 T252 | I233-I237 HydrophobicContact CG2-CD1 3.77Å; I233-I237 HydrophobicContact CG2-CG1 4.4Å; I233-I237 WeakPolarHBondContact O-CG1 3.34Å; I233-I237 PolarHBondContact O-N 2.86Å; K234-I237 PolarHBondContact O-N 2.81Å; K234-I237 VanDerWaalsContact O-N 3.13Å; I237-V239 VanDerWaalsContact C-N 3.29Å; I237-V239 PolarHBondContact O-N 2.88Å; I237-S241 VanDerWaalsContact O-CB 3.23Å; I237-S241 WeakPolarHBondContact O-CB 3.2Å; I237-S241 PolarHBondContact O-N 3.49Å; I237-S241 PolarHBondContact O-OG 2.99Å; I237-F249 HydrophobicContact CD1-CB 4.47Å; I237-T252 HydrophobicContact CG1-CG2 4.18Å |
| 238 | Q | 84.2 | Confident | 80.5 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.4 | -36.7 | -179 | -76.2 | -175.9 | -28.3 | 0 | 0 | 112.5 | L129 R133 K234 S235 S241 | L129-Q238 HydrophobicContact CD1-CB 3.61Å; L129-Q238 HydrophobicContact CD1-CG 3.75Å; L129-Q238 VanDerWaalsContact CD1-O 3.3Å; L129-Q238 WeakPolarHBondContact CD1-O 3.26Å; R133-Q238 PolarHBondContact NE-O 2.99Å; R133-Q238 VanDerWaalsContact NE-O 3.12Å; K234-Q238 HydrophobicContact CG-CG 4.41Å; K234-Q238 WeakPolarHBondContact O-CB 3.23Å; K234-Q238 WeakPolarHBondContact O-CG 3.27Å; K234-Q238 PolarHBondContact O-N 3.42Å; S235-Q238 PolarHBondContact O-N 3.4Å; Q238-S241 PolarHBondContact O-OG 2.93Å |
| 239 | V | 82.1 | Confident | 80.3 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -89.7 | -47.4 | -178.3 | 174.4 | 0 | 0 | 0 | 0 | 112.6 | T39 C132 T136 M140 S235 R236 I237 S241 M242 | T39-V239 HydrophobicContact CG2-CB 3.94Å; T39-V239 HydrophobicContact CG2-CG1 3.41Å; T39-V239 VanDerWaalsContact CG2-CG1 3.41Å; C132-V239 HydrophobicContact CB-CG2 3.99Å; T136-V239 HydrophobicContact CG2-CG1 4.09Å; T136-V239 HydrophobicContact CG2-CG2 3.95Å; T136-V239 VanDerWaalsContact OG1-CG1 3.23Å; T136-V239 WeakPolarHBondContact OG1-CG1 3.24Å; M140-V239 HydrophobicContact CE-CG1 3.24Å; S235-V239 WeakPolarHBondContact O-CB 3.32Å; S235-V239 VanDerWaalsContact O-CG2 3.27Å; S235-V239 WeakPolarHBondContact O-CG2 3.41Å; S235-V239 PolarHBondContact O-N 3.42Å; R236-V239 PolarHBondContact O-N 3.33Å; I237-V239 VanDerWaalsContact C-N 3.29Å; I237-V239 PolarHBondContact O-N 2.88Å; V239-S241 VanDerWaalsContact C-N 3.26Å; V239-S241 PolarHBondContact O-N 2.9Å; V239-M242 WeakPolarHBondContact O-CB 3.33Å; V239-M242 WeakPolarHBondContact O-CG 3.34Å; V239-M242 PolarHBondContact O-N 2.83Å |
| 240 | L | 80.3 | Confident | 80.2 | Confident | 34 Ų | 34 | 41 Ų | 41 | 18% | 0.178 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -71.3 | -18.8 | -176.8 | -62.9 | 174.5 | 0 | 0 | 0 | 113.4 | M140 R236 M242 Y243 Q246 | M140-L240 HydrophobicContact CE-CD2 4Å; R236-L240 HydrophobicContact CB-CD1 4.12Å; R236-L240 WeakPolarHBondContact O-CA 3.42Å; R236-L240 WeakPolarHBondContact O-CB 3.17Å; R236-L240 VanDerWaalsContact O-CG 3.23Å; R236-L240 WeakPolarHBondContact O-CG 3.14Å; R236-L240 PolarHBondContact O-N 3.35Å; L240-M242 PolarHBondContact O-N 3.48Å; L240-Y243 PolarHBondContact O-N 3.47Å; L240-Q246 HydrophobicContact CB-CG 3.8Å; L240-Q246 PolarHBondContact O-NE2 3.49Å |
| 241 | S | 78.4 | Confident | 80 | Confident | 6 Ų | 6 | 41.5 Ų | 41.5 | 4% | 0.042 | 23% | 0.228 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -19.6 | 168.6 | 54.3 | 0 | 0 | 0 | 0 | 112.9 | R133 K163 I237 Q238 V239 Y243 | R133-S241 PolarHBondContact NH2-OG 3.44Å; K163-S241 PolarHBondContact NZ-O 3.29Å; I237-S241 VanDerWaalsContact O-CB 3.23Å; I237-S241 WeakPolarHBondContact O-CB 3.2Å; I237-S241 PolarHBondContact O-N 3.49Å; I237-S241 PolarHBondContact O-OG 2.99Å; Q238-S241 PolarHBondContact O-OG 2.93Å; V239-S241 VanDerWaalsContact C-N 3.26Å; V239-S241 PolarHBondContact O-N 2.9Å; S241-Y243 VanDerWaalsContact C-N 3.29Å; S241-Y243 PolarHBondContact O-N 3.34Å |
| 242 | M | 72.8 | Confident | 79.9 | Confident | 31 Ų | 31 | 41.8 Ų | 41.8 | 15% | 0.153 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -36.3 | 170.8 | -65.4 | -179.1 | 70.4 | 0 | 0 | 112.6 | R133 M137 I146 K163 V239 L240 | R133-M242 HydrophobicContact CB-CE 4.47Å; R133-M242 HydrophobicContact CB-SD 3.64Å; R133-M242 HydrophobicContact CG-CG 3.77Å; R133-M242 HydrophobicContact CG-SD 3.47Å; R133-M242 WeakPolarHBondContact CG-SD 3.36Å; M137-M242 HydrophobicContact CG-CE 4.26Å; I146-M242 HydrophobicContact CD1-CE 3.93Å; K163-M242 PolarHBondContact NZ-O 2.89Å; V239-M242 WeakPolarHBondContact O-CB 3.33Å; V239-M242 WeakPolarHBondContact O-CG 3.34Å; V239-M242 PolarHBondContact O-N 2.83Å; L240-M242 PolarHBondContact O-N 3.48Å |
| 243 | Y | 70.3 | Confident | 80 | Confident | 148 Ų | 148 | 44.2 Ų | 44.2 | 58% | 0.58 | 24% | 0.243 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -89.3 | -25.5 | -173.5 | -176.4 | -119.9 | 0 | 0 | 0 | 113.7 | K145 L240 S241 | K145-Y243 HydrophobicContact CB-CD2 3.83Å; K145-Y243 HydrophobicContact CB-CE2 4.13Å; K145-Y243 HydrophobicContact CB-CG 4.35Å; K145-Y243 HydrophobicContact CG-CD2 4.33Å; K145-Y243 HydrophobicContact CG-CE2 4.33Å; K145-Y243 WeakPolarHBondContact O-CD2 3.41Å; K145-Y243 WeakPolarHBondContact O-CE2 3.47Å; L240-Y243 PolarHBondContact O-N 3.47Å; S241-Y243 VanDerWaalsContact C-N 3.29Å; S241-Y243 PolarHBondContact O-N 3.34Å |
| 244 | G | 68.1 | Low | 79.9 | Confident | 27 Ų | 27 | 49.5 Ų | 49.5 | 28% | 0.278 | 27% | 0.271 | S | S | . | . | S | Bend | trans | 176.7 | -176.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q246 | G244-Q246 PolarHBondContact O-N 2.96Š|
| 245 | K | 58.5 | Low | 79.8 | Confident | 219 Ų | 219 | 52.3 Ų | 52.3 | 95% | 0.952 | 29% | 0.29 | S | S | * | . | trans | -66 | 114.3 | 172.5 | -84.8 | -176.1 | 175.7 | 178.4 | 0 | 108.9 | ||||
| 246 | Q | 63.5 | Low | 79.9 | Confident | 77 Ų | 77 | 52.4 Ų | 52.4 | 36% | 0.36 | 29% | 0.291 | S | S | . | . | trans | -91 | 149.1 | 177.4 | -69.6 | -58.7 | -36.9 | 0 | 0 | 111.2 | L240 G244 | L240-Q246 HydrophobicContact CB-CG 3.8Å; L240-Q246 PolarHBondContact O-NE2 3.49Å; G244-Q246 PolarHBondContact O-N 2.96Å | ||
| 247 | A | 63.1 | Low | 80.1 | Confident | 53 Ų | 53 | 54.6 Ų | 54.6 | 44% | 0.438 | 31% | 0.305 | S | S | . | . | trans | -61.3 | 147.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | T252 | A247-T252 PolarHBondContact O-OG1 2.96Å; A247-T252 VanDerWaalsContact O-OG1 3.05Å | ||
| 248 | G | 78.6 | Confident | 80.2 | Confident | 54 Ų | 54 | 64.4 Ų | 64.4 | 56% | 0.557 | 34% | 0.342 | S | S | * | . | trans | -58.4 | 178.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | I250 G251 T252 | G248-I250 VanDerWaalsContact C-N 3.28Å; G248-I250 PolarHBondContact O-N 3.45Å; G248-I250 VanDerWaalsContact O-N 3.13Å; G248-G251 PolarHBondContact O-N 3.37Å; G248-T252 PolarHBondContact O-N 3.43Å; G248-T252 PolarHBondContact O-OG1 2.94Å | ||
| 249 | F | 85.6 | Confident | 80.4 | Confident | 38 Ų | 38 | 69.9 Ų | 69.9 | 17% | 0.167 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -44.7 | -50.8 | -177.7 | -178.9 | -95.2 | 0 | 0 | 0 | 113.6 | S175 L178 V230 I233 I237 G251 T252 L253 | S175-F249 WeakPolarHBondContact OG-CD2 3.28Å; L178-F249 HydrophobicContact CD2-CD1 4.03Å; L178-F249 HydrophobicContact CD2-CD2 4.5Å; L178-F249 HydrophobicContact CD2-CE1 3.6Å; L178-F249 HydrophobicContact CD2-CE2 4.1Å; L178-F249 HydrophobicContact CD2-CG 4.46Å; L178-F249 HydrophobicContact CD2-CZ 3.64Å; V230-F249 HydrophobicContact CB-CE2 4.42Å; V230-F249 HydrophobicContact CB-CZ 4.5Å; V230-F249 HydrophobicContact CG1-CE2 3.83Å; V230-F249 HydrophobicContact CG1-CZ 4.19Å; V230-F249 HydrophobicContact CG2-CZ 4.26Å; I233-F249 HydrophobicContact CB-CD2 4.16Å; I233-F249 HydrophobicContact CB-CE2 3.77Å; I233-F249 HydrophobicContact CG1-CE2 4.38Å; I233-F249 HydrophobicContact CG2-CD2 3.47Å; I233-F249 VanDerWaalsContact CG2-CD2 3.47Å; I233-F249 HydrophobicContact CG2-CE2 3.61Å; I233-F249 HydrophobicContact CG2-CG 4.27Å; I233-F249 HydrophobicContact CG2-CZ 4.49Å; I237-F249 HydrophobicContact CD1-CB 4.47Å; F249-G251 PolarHBondContact O-N 2.92Å; F249-T252 PolarHBondContact O-N 3.07Å; F249-L253 HydrophobicContact CE1-CD2 4.22Å; F249-L253 WeakPolarHBondContact O-CB 3.36Å; F249-L253 PolarHBondContact O-N 3.06Å |
| 250 | I | 88 | Confident | 80.6 | Confident | 123 Ų | 123 | 73 Ų | 73 | 63% | 0.631 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -63.1 | -43.8 | -178.6 | -61 | 175.9 | 0 | 0 | 0 | 111.7 | G248 L253 L254 | G248-I250 VanDerWaalsContact C-N 3.28Å; G248-I250 PolarHBondContact O-N 3.45Å; G248-I250 VanDerWaalsContact O-N 3.13Å; I250-L253 PolarHBondContact O-N 3.46Å; I250-L254 HydrophobicContact CG2-CD1 3.89Å; I250-L254 HydrophobicContact CG2-CG 4.33Å; I250-L254 WeakPolarHBondContact O-CB 3.33Å; I250-L254 VanDerWaalsContact O-CG 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.5Å; I250-L254 PolarHBondContact O-N 2.86Å |
| 251 | G | 87.5 | Confident | 81.1 | Confident | 30 Ų | 30 | 72.7 Ų | 72.7 | 31% | 0.309 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.4 | -38.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G248 F249 S255 | G248-G251 PolarHBondContact O-N 3.37Å; F249-G251 PolarHBondContact O-N 2.92Å; G251-S255 WeakPolarHBondContact O-CB 3.5Å; G251-S255 PolarHBondContact O-N 2.9Å |
| 252 | T | 87.1 | Confident | 81.6 | Confident | 10 Ų | 10 | 77.9 Ų | 77.9 | 6% | 0.061 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -67.3 | -42.5 | 174.3 | -56.4 | 0 | 0 | 0 | 0 | 111 | I233 R236 I237 A247 G248 F249 S255 V256 | I233-T252 HydrophobicContact CD1-CG2 4.21Å; I233-T252 HydrophobicContact CG2-CG2 3.94Å; R236-T252 HydrophobicContact CB-CG2 4.22Å; I237-T252 HydrophobicContact CG1-CG2 4.18Å; A247-T252 PolarHBondContact O-OG1 2.96Å; A247-T252 VanDerWaalsContact O-OG1 3.05Å; G248-T252 PolarHBondContact O-N 3.43Å; G248-T252 PolarHBondContact O-OG1 2.94Å; F249-T252 PolarHBondContact O-N 3.07Å; T252-S255 PolarHBondContact O-N 3.31Å; T252-V256 HydrophobicContact CG2-CG2 4.5Å; T252-V256 WeakPolarHBondContact O-CG2 3.41Å; T252-V256 PolarHBondContact O-N 3.46Å |
| 253 | L | 90.1 | Very high | 82.3 | Confident | 51 Ų | 51 | 82.4 Ų | 82.4 | 27% | 0.267 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -58.3 | -51.2 | 175.9 | 178 | 65.5 | 0 | 0 | 0 | 111.9 | I233 F249 I250 S255 V256 V257 L265 | I233-L253 HydrophobicContact CD1-CB 4.31Å; I233-L253 HydrophobicContact CD1-CD1 4.18Å; I233-L253 HydrophobicContact CG1-CB 4.31Å; I233-L253 HydrophobicContact CG1-CD1 4.01Å; F249-L253 HydrophobicContact CE1-CD2 4.22Å; F249-L253 WeakPolarHBondContact O-CB 3.36Å; F249-L253 PolarHBondContact O-N 3.06Å; I250-L253 PolarHBondContact O-N 3.46Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.99Å; L253-V256 PolarHBondContact O-N 2.89Å; L253-V257 HydrophobicContact CD1-CG2 4.2Å; L253-V257 WeakPolarHBondContact O-CG2 3.44Å; L253-V257 PolarHBondContact O-N 2.95Å; L253-L265 HydrophobicContact CD1-CD1 4.14Å; L253-L265 HydrophobicContact CD1-CD2 4.04Å |
| 254 | L | 89.2 | Confident | 83.1 | Confident | 112 Ų | 112 | 76.1 Ų | 76.1 | 59% | 0.586 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -61.7 | -39.3 | 178.9 | -71.1 | 172.8 | 0 | 0 | 0 | 111.8 | I250 R258 | I250-L254 HydrophobicContact CG2-CD1 3.89Å; I250-L254 HydrophobicContact CG2-CG 4.33Å; I250-L254 WeakPolarHBondContact O-CB 3.33Å; I250-L254 VanDerWaalsContact O-CG 3.3Å; I250-L254 WeakPolarHBondContact O-CG 3.5Å; I250-L254 PolarHBondContact O-N 2.86Å; L254-R258 WeakPolarHBondContact O-CB 3.29Å; L254-R258 PolarHBondContact O-N 3.48Å |
| 255 | S | 88.3 | Confident | 84.1 | Confident | 59 Ų | 59 | 75.4 Ų | 75.4 | 41% | 0.413 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.3 | -47.3 | 176.4 | -175.6 | 0 | 0 | 0 | 0 | 111.9 | G251 T252 L253 R258 N259 | G251-S255 WeakPolarHBondContact O-CB 3.5Å; G251-S255 PolarHBondContact O-N 2.9Å; T252-S255 PolarHBondContact O-N 3.31Å; L253-S255 VanDerWaalsContact C-N 3.3Å; L253-S255 PolarHBondContact O-N 2.99Å; S255-R258 PolarHBondContact O-N 3.43Å; S255-N259 VanDerWaalsContact O-CB 3.28Å; S255-N259 WeakPolarHBondContact O-CB 3.23Å; S255-N259 VanDerWaalsContact O-CG 3.28Å; S255-N259 PolarHBondContact O-N 3.43Å; S255-N259 PolarHBondContact O-ND2 3.21Å; S255-N259 PolarHBondContact OG-ND2 2.84Å |
| 256 | V | 88.3 | Confident | 85.6 | Confident | 4 Ų | 4 | 69.1 Ų | 69.1 | 2% | 0.024 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -64.6 | -47.6 | 179.3 | 173.5 | 0 | 0 | 0 | 0 | 110.8 | I233 T252 L253 R258 N259 E260 G261 A264 L265 | I233-V256 HydrophobicContact CD1-CB 4.11Å; I233-V256 HydrophobicContact CD1-CG2 3.85Å; T252-V256 HydrophobicContact CG2-CG2 4.5Å; T252-V256 WeakPolarHBondContact O-CG2 3.41Å; T252-V256 PolarHBondContact O-N 3.46Å; L253-V256 PolarHBondContact O-N 2.89Å; V256-R258 VanDerWaalsContact C-N 3.3Å; V256-R258 PolarHBondContact O-N 3.14Å; V256-N259 PolarHBondContact O-N 3.25Å; V256-E260 HydrophobicContact CG1-CB 4.48Å; V256-E260 WeakPolarHBondContact O-CA 3.2Å; V256-E260 WeakPolarHBondContact O-CB 3.29Å; V256-E260 PolarHBondContact O-N 3.42Å; V256-G261 PolarHBondContact O-N 2.89Å; V256-G261 VanDerWaalsContact O-N 3.17Å; V256-A264 HydrophobicContact CG1-CB 4.22Å; V256-L265 HydrophobicContact CB-CD2 4.42Å; V256-L265 HydrophobicContact CG1-CD2 3.79Å; V256-L265 HydrophobicContact CG1-CG 4.39Å |
| 257 | V | 90.9 | Very high | 86.7 | Confident | 57 Ų | 57 | 66.6 Ų | 66.6 | 35% | 0.345 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62 | -39.7 | -179.7 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | L253 G261 I262 L265 | L253-V257 HydrophobicContact CD1-CG2 4.2Å; L253-V257 WeakPolarHBondContact O-CG2 3.44Å; L253-V257 PolarHBondContact O-N 2.95Å; V257-G261 VanDerWaalsContact O-CA 3.3Å; V257-G261 WeakPolarHBondContact O-CA 3.41Å; V257-G261 PolarHBondContact O-N 3.35Å; V257-I262 HydrophobicContact CG1-CG1 4.12Å; V257-L265 HydrophobicContact CG2-CD1 4Å |
| 258 | R | 90 | Very high | 87.9 | Confident | 220 Ų | 220 | 64.3 Ų | 64.3 | 83% | 0.83 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -73.3 | -39.8 | -179.4 | -176.3 | 175.9 | 176.3 | 170.7 | -0.3 | 113.3 | L254 S255 V256 | L254-R258 WeakPolarHBondContact O-CB 3.29Å; L254-R258 PolarHBondContact O-N 3.48Å; S255-R258 PolarHBondContact O-N 3.43Å; V256-R258 VanDerWaalsContact C-N 3.3Å; V256-R258 PolarHBondContact O-N 3.14Å |
| 259 | N | 88.3 | Confident | 88.3 | Confident | 114 Ų | 114 | 63.6 Ų | 63.6 | 61% | 0.61 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -94.8 | -30.6 | -171.1 | -62.1 | -34.8 | 0 | 0 | 0 | 113.4 | S255 V256 | S255-N259 VanDerWaalsContact O-CB 3.28Å; S255-N259 WeakPolarHBondContact O-CB 3.23Å; S255-N259 VanDerWaalsContact O-CG 3.28Å; S255-N259 PolarHBondContact O-N 3.43Å; S255-N259 PolarHBondContact O-ND2 3.21Å; S255-N259 PolarHBondContact OG-ND2 2.84Å; V256-N259 PolarHBondContact O-N 3.25Å |
| 260 | E | 86.9 | Confident | 88.5 | Confident | 66 Ų | 66 | 69.6 Ų | 69.6 | 31% | 0.308 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -122.9 | -13.9 | -172 | -56.2 | 175 | -150.2 | 0 | 0 | 113.1 | P41 R236 V256 A264 | P41-E260 VanDerWaalsContact CG-OE2 3.3Å; P41-E260 WeakPolarHBondContact CG-OE2 3.48Å; R236-E260 IonicContact CZ-OE1 3.95Å; R236-E260 IonicContact CZ-OE2 3.28Å; R236-E260 IonicContact NH1-OE1 2.62Å; R236-E260 PolarHBondContact NH1-OE1 3.34Å; R236-E260 IonicContact NH1-OE2 2.77Å; R236-E260 PolarHBondContact NH1-OE2 3.04Å; R236-E260 IonicContact NH2-OE1 2.71Å; R236-E260 IonicContact NH2-OE2 2.71Å; R236-E260 PolarHBondContact NH2-OE2 3.49Å; V256-E260 HydrophobicContact CG1-CB 4.48Å; V256-E260 WeakPolarHBondContact O-CA 3.2Å; V256-E260 WeakPolarHBondContact O-CB 3.29Å; V256-E260 PolarHBondContact O-N 3.42Å; E260-A264 HydrophobicContact CB-CB 3.58Å |
| 261 | G | 89.3 | Confident | 88.6 | Confident | 28 Ų | 28 | 63.8 Ų | 63.8 | 29% | 0.289 | 34% | 0.337 | S | S | . | . | trans | 84.5 | 171.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | V256 V257 V263 A264 | V256-G261 PolarHBondContact O-N 2.89Å; V256-G261 VanDerWaalsContact O-N 3.17Å; V257-G261 VanDerWaalsContact O-CA 3.3Å; V257-G261 WeakPolarHBondContact O-CA 3.41Å; V257-G261 PolarHBondContact O-N 3.35Å; G261-V263 VanDerWaalsContact C-N 3.31Å; G261-V263 PolarHBondContact O-N 3.5Å; G261-A264 WeakPolarHBondContact O-CB 3.5Å; G261-A264 PolarHBondContact O-N 3.5Å | ||
| 262 | I | 88.7 | Confident | 88.7 | Confident | 115 Ų | 115 | 62.5 Ų | 62.5 | 59% | 0.59 | 32% | 0.323 | S | S | * | . | G | 310 helix | trans | -67.3 | -32.6 | -175.4 | -62.8 | 171.4 | 0 | 0 | 0 | 111.7 | V257 A264 L265 | V257-I262 HydrophobicContact CG1-CG1 4.12Å; I262-A264 PolarHBondContact O-N 2.99Å; I262-L265 VanDerWaalsContact O-CB 3.3Å; I262-L265 WeakPolarHBondContact O-CB 3.34Å; I262-L265 PolarHBondContact O-N 3.42Å; I262-L265 VanDerWaalsContact O-N 3.13Å |
| 263 | V | 88.5 | Confident | 88.8 | Confident | 126 Ų | 126 | 65.3 Ų | 65.3 | 76% | 0.764 | 34% | 0.336 | S | S | * | . | G | 310 helix | trans | -63.6 | -29.4 | -179.8 | 178.7 | 0 | 0 | 0 | 0 | 111.7 | G261 L265 Y266 | G261-V263 VanDerWaalsContact C-N 3.31Å; G261-V263 PolarHBondContact O-N 3.5Å; V263-L265 PolarHBondContact O-N 3.05Å; V263-Y266 PolarHBondContact O-N 3.48Å |
| 264 | A | 86.7 | Confident | 88.8 | Confident | 16 Ų | 16 | 66.7 Ų | 66.7 | 13% | 0.132 | 34% | 0.343 | C | S | . | . | G | 310 helix | trans | -63.2 | -26.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | V256 E260 G261 I262 Y266 S267 | V256-A264 HydrophobicContact CG1-CB 4.22Å; E260-A264 HydrophobicContact CB-CB 3.58Å; G261-A264 WeakPolarHBondContact O-CB 3.5Å; G261-A264 PolarHBondContact O-N 3.5Å; I262-A264 PolarHBondContact O-N 2.99Å; A264-Y266 PolarHBondContact O-N 2.9Å; A264-S267 VanDerWaalsContact O-CB 3.25Å; A264-S267 WeakPolarHBondContact O-CB 3.23Å; A264-S267 PolarHBondContact O-N 2.99Å; A264-S267 VanDerWaalsContact O-N 3.11Å |
| 265 | L | 89.2 | Confident | 89 | Confident | 12 Ų | 12 | 63.7 Ų | 63.7 | 6% | 0.063 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -63 | -23.6 | 174.1 | -62.1 | 172.7 | 0 | 0 | 0 | 112.2 | F228 P229 C232 I233 L253 V256 V257 I262 V263 | F228-L265 WeakPolarHBondContact CD1-O 3.43Å; F228-L265 WeakPolarHBondContact CE1-O 3.21Å; P229-L265 HydrophobicContact CB-CB 4.15Å; P229-L265 HydrophobicContact CB-CD1 4.31Å; P229-L265 HydrophobicContact CG-CB 4.47Å; C232-L265 VanDerWaalsContact CB-O 3.29Å; C232-L265 WeakPolarHBondContact CB-O 3.2Å; I233-L265 HydrophobicContact CD1-CD2 3.72Å; I233-L265 HydrophobicContact CG1-CD2 4.09Å; L253-L265 HydrophobicContact CD1-CD1 4.14Å; L253-L265 HydrophobicContact CD1-CD2 4.04Å; V256-L265 HydrophobicContact CB-CD2 4.42Å; V256-L265 HydrophobicContact CG1-CD2 3.79Å; V256-L265 HydrophobicContact CG1-CG 4.39Å; V257-L265 HydrophobicContact CG2-CD1 4Å; I262-L265 VanDerWaalsContact O-CB 3.3Å; I262-L265 WeakPolarHBondContact O-CB 3.34Å; I262-L265 PolarHBondContact O-N 3.42Å; I262-L265 VanDerWaalsContact O-N 3.13Å; V263-L265 PolarHBondContact O-N 3.05Å |
| 266 | Y | 90.2 | Very high | 88.9 | Confident | 87 Ų | 87 | 62.3 Ų | 62.3 | 34% | 0.341 | 32% | 0.316 | S | S | . | . | G | 310 helix | trans | -98.8 | 10.6 | 178.3 | -65.1 | -83.6 | 0 | 0 | 0 | 114 | L225 F228 P229 V263 A264 G268 L269 | L225-Y266 PolarHBondContact O-OH 2.9Å; L225-Y266 VanDerWaalsContact O-OH 3.07Å; F228-Y266 HydrophobicContact CB-CD1 4.27Å; F228-Y266 HydrophobicContact CB-CE1 4.35Å; F228-Y266 HydrophobicContact CD1-CD1 4.05Å; F228-Y266 HydrophobicContact CG-CD1 4.44Å; P229-Y266 HydrophobicContact CG-CE1 4.06Å; P229-Y266 HydrophobicContact CG-CE2 4.14Å; P229-Y266 WeakPolarHBondContact CG-OH 3.31Å; V263-Y266 PolarHBondContact O-N 3.48Å; A264-Y266 PolarHBondContact O-N 2.9Å; Y266-G268 PolarHBondContact O-N 2.86Å; Y266-L269 HydrophobicContact CD1-CD2 4.2Å; Y266-L269 WeakPolarHBondContact O-CB 3.32Å; Y266-L269 PolarHBondContact O-N 2.86Å |
| 267 | S | 87.1 | Confident | 89 | Confident | 23 Ų | 23 | 68.8 Ų | 68.8 | 16% | 0.161 | 35% | 0.349 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | 123.9 | 174.9 | -173.7 | 0 | 0 | 0 | 0 | 111.1 | M37 Q38 F228 A264 | M37-S267 PolarHBondContact O-OG 3.4Å; M37-S267 VanDerWaalsContact O-OG 3.06Å; Q38-S267 WeakPolarHBondContact CG-O 3.4Å; F228-S267 WeakPolarHBondContact CE1-O 3.17Å; F228-S267 WeakPolarHBondContact CZ-O 3.42Å; A264-S267 VanDerWaalsContact O-CB 3.25Å; A264-S267 WeakPolarHBondContact O-CB 3.23Å; A264-S267 PolarHBondContact O-N 2.99Å; A264-S267 VanDerWaalsContact O-N 3.11Å |
| 268 | G | 86.8 | Confident | 89 | Confident | 5 Ų | 5 | 68.5 Ų | 68.5 | 5% | 0.052 | 35% | 0.348 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 94.2 | -6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | F228 Y266 K270 A271 T272 | F228-G268 VanDerWaalsContact CZ-C 3.41Å; Y266-G268 PolarHBondContact O-N 2.86Å; G268-K270 PolarHBondContact O-N 3.23Å; G268-A271 WeakPolarHBondContact O-CA 3.09Å; G268-A271 VanDerWaalsContact O-CB 3.24Å; G268-A271 WeakPolarHBondContact O-CB 3.23Å; G268-A271 PolarHBondContact O-N 2.79Å; G268-T272 PolarHBondContact O-N 3.04Å; G268-T272 VanDerWaalsContact O-N 3.14Å; G268-T272 PolarHBondContact O-OG1 2.89Å |
| 269 | L | 88.8 | Confident | 89.1 | Confident | 40 Ų | 40 | 58 Ų | 58 | 21% | 0.209 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56.4 | -40.8 | -179.7 | 178.1 | 63.8 | 0 | 0 | 0 | 111.8 | W224 F228 Y266 A271 T272 M273 | W224-L269 HydrophobicContact CB-CD1 4.37Å; F228-L269 HydrophobicContact CD1-CB 4.38Å; F228-L269 HydrophobicContact CD2-CB 4.27Å; F228-L269 HydrophobicContact CD2-CD1 3.68Å; F228-L269 HydrophobicContact CE1-CB 4.11Å; F228-L269 VanDerWaalsContact CE2-CA 3.47Å; F228-L269 HydrophobicContact CE2-CB 3.98Å; F228-L269 HydrophobicContact CE2-CD1 4.05Å; F228-L269 HydrophobicContact CG-CB 4.47Å; F228-L269 HydrophobicContact CG-CD1 4.11Å; F228-L269 VanDerWaalsContact CZ-CA 3.47Å; F228-L269 HydrophobicContact CZ-CB 3.92Å; Y266-L269 HydrophobicContact CD1-CD2 4.2Å; Y266-L269 WeakPolarHBondContact O-CB 3.32Å; Y266-L269 PolarHBondContact O-N 2.86Å; L269-A271 VanDerWaalsContact C-N 3.29Å; L269-A271 PolarHBondContact O-N 3Å; L269-T272 WeakPolarHBondContact O-CB 3.48Å; L269-T272 PolarHBondContact O-N 3.09Å; L269-T272 VanDerWaalsContact O-N 3.14Å; L269-M273 HydrophobicContact CD1-CE 4.04Å; L269-M273 HydrophobicContact CD1-CG 4.3Å; L269-M273 HydrophobicContact CG-CG 4.36Å; L269-M273 WeakPolarHBondContact O-CG 3.14Å; L269-M273 PolarHBondContact O-N 3.47Å |
| 270 | K | 89.7 | Confident | 89.2 | Confident | 164 Ų | 164 | 56.3 Ų | 56.3 | 71% | 0.713 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -58 | -40.7 | 175.2 | -64.3 | -176.6 | -178.6 | -179 | 0 | 112.1 | G268 T272 M273 I274 | G268-K270 PolarHBondContact O-N 3.23Å; K270-T272 VanDerWaalsContact C-N 3.35Å; K270-M273 PolarHBondContact O-N 3.15Å; K270-I274 WeakPolarHBondContact O-CB 3.38Å; K270-I274 WeakPolarHBondContact O-CD1 3.26Å; K270-I274 VanDerWaalsContact O-CG1 3.24Å; K270-I274 WeakPolarHBondContact O-CG1 3.18Å; K270-I274 PolarHBondContact O-N 3.22Å |
| 271 | A | 90 | Very high | 89.3 | Confident | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | I33 K34 L47 G268 L269 I274 R275 | I33-A271 HydrophobicContact CG2-CB 4.49Å; K34-A271 HydrophobicContact CB-CB 4.22Å; L47-A271 HydrophobicContact CD1-CB 3.37Å; G268-A271 WeakPolarHBondContact O-CA 3.09Å; G268-A271 VanDerWaalsContact O-CB 3.24Å; G268-A271 WeakPolarHBondContact O-CB 3.23Å; G268-A271 PolarHBondContact O-N 2.79Å; L269-A271 VanDerWaalsContact C-N 3.29Å; L269-A271 PolarHBondContact O-N 3Å; A271-I274 PolarHBondContact O-N 3.45Å; A271-R275 VanDerWaalsContact O-CB 3.28Å; A271-R275 WeakPolarHBondContact O-CB 3.4Å; A271-R275 PolarHBondContact O-N 3.28Å |
| 272 | T | 88.9 | Confident | 89.5 | Confident | 3 Ų | 3 | 54.6 Ų | 54.6 | 2% | 0.018 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64 | -40.8 | 178.9 | -55.6 | 0 | 0 | 0 | 0 | 112.7 | W224 G268 L269 K270 R275 A276 | W224-T272 HydrophobicContact CD2-CG2 3.97Å; W224-T272 HydrophobicContact CE3-CG2 3.93Å; W224-T272 HydrophobicContact CH2-CG2 3.59Å; W224-T272 HydrophobicContact CZ2-CG2 3.61Å; W224-T272 HydrophobicContact CZ3-CG2 3.75Å; G268-T272 PolarHBondContact O-N 3.04Å; G268-T272 VanDerWaalsContact O-N 3.14Å; G268-T272 PolarHBondContact O-OG1 2.89Å; L269-T272 WeakPolarHBondContact O-CB 3.48Å; L269-T272 PolarHBondContact O-N 3.09Å; L269-T272 VanDerWaalsContact O-N 3.14Å; K270-T272 VanDerWaalsContact C-N 3.35Å; T272-R275 WeakPolarHBondContact O-CB 3.18Å; T272-R275 PolarHBondContact O-N 3.38Å; T272-A276 PolarHBondContact O-N 2.95Å |
| 273 | M | 88.6 | Confident | 89.7 | Confident | 70 Ų | 70 | 50.9 Ų | 50.9 | 35% | 0.345 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -66.3 | -46.2 | 176.7 | -65.5 | -59.1 | 93.3 | 0 | 0 | 111.7 | W224 L269 K270 R275 A276 | W224-M273 HydrophobicContact CB-CE 4.08Å; W224-M273 VanDerWaalsContact CD1-CE 3.49Å; W224-M273 HydrophobicContact CD2-CE 4.15Å; W224-M273 HydrophobicContact CG-CE 3.64Å; L269-M273 HydrophobicContact CD1-CE 4.04Å; L269-M273 HydrophobicContact CD1-CG 4.3Å; L269-M273 HydrophobicContact CG-CG 4.36Å; L269-M273 WeakPolarHBondContact O-CG 3.14Å; L269-M273 PolarHBondContact O-N 3.47Å; K270-M273 PolarHBondContact O-N 3.15Å; M273-R275 VanDerWaalsContact C-N 3.28Å; M273-R275 PolarHBondContact O-N 3.41Å; M273-A276 PolarHBondContact O-N 3.37Å |
| 274 | I | 91.4 | Very high | 89.9 | Confident | 80 Ų | 80 | 50.9 Ų | 50.9 | 41% | 0.41 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -64 | -36.9 | 177.7 | -65.4 | 165.8 | 0 | 0 | 0 | 110.6 | F30 L47 K270 A271 A276 P278 | F30-I274 HydrophobicContact CD1-CB 4.44Å; F30-I274 HydrophobicContact CD1-CG2 4.19Å; F30-I274 HydrophobicContact CE1-CB 4.14Å; F30-I274 HydrophobicContact CE1-CG2 3.43Å; F30-I274 VanDerWaalsContact CE1-CG2 3.43Å; F30-I274 HydrophobicContact CZ-CG2 3.77Å; L47-I274 HydrophobicContact CD2-CD1 3.71Å; K270-I274 WeakPolarHBondContact O-CB 3.38Å; K270-I274 WeakPolarHBondContact O-CD1 3.26Å; K270-I274 VanDerWaalsContact O-CG1 3.24Å; K270-I274 WeakPolarHBondContact O-CG1 3.18Å; K270-I274 PolarHBondContact O-N 3.22Å; A271-I274 PolarHBondContact O-N 3.45Å; I274-A276 VanDerWaalsContact C-N 3.3Å; I274-A276 PolarHBondContact O-N 3.11Å; I274-P278 WeakPolarHBondContact O-CD 3.49Å; I274-P278 WeakPolarHBondContact O-CG 3.5Å |
| 275 | R | 91.8 | Very high | 90.2 | Very high | 49 Ų | 49 | 55.1 Ų | 55.1 | 19% | 0.185 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.2 | -37 | 177.4 | -170 | -173.2 | 69.8 | 75.6 | -1.6 | 113.2 | G27 F30 D31 A271 T272 M273 I277 P278 A279 | G27-R275 WeakPolarHBondContact O-CD 3.1Å; F30-R275 HydrophobicContact CB-CB 3.61Å; F30-R275 HydrophobicContact CB-CG 3.76Å; F30-R275 HydrophobicContact CD2-CB 4Å; F30-R275 HydrophobicContact CD2-CG 3.97Å; F30-R275 HydrophobicContact CG-CB 3.84Å; F30-R275 HydrophobicContact CG-CG 4.14Å; D31-R275 WeakPolarHBondContact OD1-CD 3.48Å; D31-R275 IonicContact OD1-NE 3.14Å; D31-R275 PolarHBondContact OD1-NE 3.16Å; A271-R275 VanDerWaalsContact O-CB 3.28Å; A271-R275 WeakPolarHBondContact O-CB 3.4Å; A271-R275 PolarHBondContact O-N 3.28Å; T272-R275 WeakPolarHBondContact O-CB 3.18Å; T272-R275 PolarHBondContact O-N 3.38Å; M273-R275 VanDerWaalsContact C-N 3.28Å; M273-R275 PolarHBondContact O-N 3.41Å; R275-I277 VanDerWaalsContact C-N 3.32Å; R275-I277 PolarHBondContact O-N 3.4Å; R275-P278 VanDerWaalsContact O-CD 3.26Å; R275-P278 WeakPolarHBondContact O-CD 3.4Å; R275-P278 WeakPolarHBondContact O-CG 3.32Å; R275-A279 HydrophobicContact CG-CB 4.22Å; R275-A279 WeakPolarHBondContact O-CB 3.4Å; R275-A279 PolarHBondContact O-N 2.71Å |
| 276 | A | 87.4 | Confident | 90.4 | Very high | 30 Ų | 30 | 55.5 Ų | 55.5 | 25% | 0.248 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.1 | -42.4 | -169.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | T272 M273 I274 N280 | T272-A276 PolarHBondContact O-N 2.95Å; M273-A276 PolarHBondContact O-N 3.37Å; I274-A276 VanDerWaalsContact C-N 3.3Å; I274-A276 PolarHBondContact O-N 3.11Å; A276-N280 WeakPolarHBondContact O-CB 3.3Å; A276-N280 PolarHBondContact O-N 3.33Å; A276-N280 VanDerWaalsContact O-N 3.1Å; A276-N280 PolarHBondContact O-ND2 2.92Å; A276-N280 VanDerWaalsContact O-ND2 3.14Å |
| 277 | I | 89.2 | Confident | 90.5 | Very high | 139 Ų | 139 | 54.2 Ų | 54.2 | 71% | 0.713 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -65.8 | -59.6 | -178.4 | -59.6 | 172.4 | 0 | 0 | 0 | 112.3 | R275 A279 G281 | R275-I277 VanDerWaalsContact C-N 3.32Å; R275-I277 PolarHBondContact O-N 3.4Å; I277-A279 PolarHBondContact O-N 3.34Å; I277-G281 PolarHBondContact O-N 3.31Å |
| 278 | P | 92.4 | Very high | 90.7 | Very high | 52 Ų | 52 | 57.9 Ų | 57.9 | 34% | 0.338 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.2 | -37.2 | -178.5 | 26.8 | -34.4 | 0 | 0 | 0 | 112.6 | F30 I274 R275 A282 | F30-P278 HydrophobicContact CE2-CG 4.04Å; I274-P278 WeakPolarHBondContact O-CD 3.49Å; I274-P278 WeakPolarHBondContact O-CG 3.5Å; R275-P278 VanDerWaalsContact O-CD 3.26Å; R275-P278 WeakPolarHBondContact O-CD 3.4Å; R275-P278 WeakPolarHBondContact O-CG 3.32Å; P278-A282 VanDerWaalsContact O-CB 3.23Å; P278-A282 WeakPolarHBondContact O-CB 3.36Å; P278-A282 PolarHBondContact O-N 2.99Å |
| 279 | A | 90.7 | Very high | 91 | Very high | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67 | -48.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112 | T26 R275 I277 A282 L283 | T26-A279 WeakPolarHBondContact OG1-CA 3.49Å; R275-A279 HydrophobicContact CG-CB 4.22Å; R275-A279 WeakPolarHBondContact O-CB 3.4Å; R275-A279 PolarHBondContact O-N 2.71Å; I277-A279 PolarHBondContact O-N 3.34Å; A279-A282 PolarHBondContact O-N 3.44Å; A279-L283 PolarHBondContact O-N 2.95Å |
| 280 | N | 90.3 | Very high | 91.1 | Very high | 78 Ų | 78 | 64.9 Ų | 64.9 | 42% | 0.417 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -69 | -38.7 | 177.7 | -65.4 | -19.7 | 0 | 0 | 0 | 111.3 | A276 A282 L283 F284 | A276-N280 WeakPolarHBondContact O-CB 3.3Å; A276-N280 PolarHBondContact O-N 3.33Å; A276-N280 VanDerWaalsContact O-N 3.1Å; A276-N280 PolarHBondContact O-ND2 2.92Å; A276-N280 VanDerWaalsContact O-ND2 3.14Å; N280-A282 PolarHBondContact O-N 3.48Å; N280-L283 WeakPolarHBondContact O-CB 3.49Å; N280-L283 PolarHBondContact O-N 3.18Å; N280-F284 WeakPolarHBondContact O-CD2 3.3Å; N280-F284 PolarHBondContact O-N 3.39Å |
| 281 | G | 90.7 | Very high | 91.2 | Very high | 35 Ų | 35 | 61.4 Ų | 61.4 | 36% | 0.361 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59 | -46.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | I277 L283 F284 V285 | I277-G281 PolarHBondContact O-N 3.31Å; G281-L283 VanDerWaalsContact C-N 3.33Å; G281-L283 PolarHBondContact O-N 3.23Å; G281-F284 PolarHBondContact O-N 3.03Å; G281-V285 WeakPolarHBondContact O-CB 3.21Å; G281-V285 VanDerWaalsContact O-CG2 3.27Å; G281-V285 WeakPolarHBondContact O-CG2 3.45Å; G281-V285 PolarHBondContact O-N 3.42Å |
| 282 | A | 93.6 | Very high | 91.3 | Very high | 22 Ų | 22 | 69 Ų | 69 | 18% | 0.182 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.4 | -38 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A22 T26 P278 A279 N280 A286 | A22-A282 HydrophobicContact CB-CB 4.23Å; T26-A282 HydrophobicContact CG2-CB 3.63Å; T26-A282 WeakPolarHBondContact OG1-CB 3.4Å; P278-A282 VanDerWaalsContact O-CB 3.23Å; P278-A282 WeakPolarHBondContact O-CB 3.36Å; P278-A282 PolarHBondContact O-N 2.99Å; A279-A282 PolarHBondContact O-N 3.44Å; N280-A282 PolarHBondContact O-N 3.48Å; A282-A286 WeakPolarHBondContact O-CB 3.38Å; A282-A286 PolarHBondContact O-N 3.46Å |
| 283 | L | 92.4 | Very high | 91.4 | Very high | 38 Ų | 38 | 73 Ų | 73 | 20% | 0.199 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -57.1 | -54.8 | 174.2 | -174.2 | 151.2 | 0 | 0 | 0 | 111.2 | C23 A279 N280 G281 A286 Y287 | C23-L283 HydrophobicContact CB-CB 3.94Å; C23-L283 HydrophobicContact CB-CD1 3.92Å; C23-L283 HydrophobicContact CB-CG 4.35Å; A279-L283 PolarHBondContact O-N 2.95Å; N280-L283 WeakPolarHBondContact O-CB 3.49Å; N280-L283 PolarHBondContact O-N 3.18Å; G281-L283 VanDerWaalsContact C-N 3.33Å; G281-L283 PolarHBondContact O-N 3.23Å; L283-A286 PolarHBondContact O-N 3.32Å; L283-Y287 VanDerWaalsContact O-CB 3.24Å; L283-Y287 WeakPolarHBondContact O-CB 3.45Å; L283-Y287 PolarHBondContact O-N 2.97Å |
| 284 | F | 91.3 | Very high | 91.5 | Very high | 125 Ų | 125 | 71.6 Ų | 71.6 | 55% | 0.548 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.4 | -43.1 | -176.7 | -74 | -63.9 | 0 | 0 | 0 | 112 | N280 G281 A286 Y287 E288 | N280-F284 WeakPolarHBondContact O-CD2 3.3Å; N280-F284 PolarHBondContact O-N 3.39Å; G281-F284 PolarHBondContact O-N 3.03Å; F284-A286 PolarHBondContact O-N 3.42Å; F284-Y287 PolarHBondContact O-N 3.32Å; F284-E288 WeakPolarHBondContact O-CB 3.29Å; F284-E288 WeakPolarHBondContact O-CG 3.36Å; F284-E288 PolarHBondContact O-N 3.15Å |
| 285 | V | 93.8 | Very high | 91.3 | Very high | 105 Ų | 105 | 70 Ų | 70 | 64% | 0.636 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.7 | -48.2 | 177.9 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | G281 Y289 | G281-V285 WeakPolarHBondContact O-CB 3.21Å; G281-V285 VanDerWaalsContact O-CG2 3.27Å; G281-V285 WeakPolarHBondContact O-CG2 3.45Å; G281-V285 PolarHBondContact O-N 3.42Å; V285-Y289 WeakPolarHBondContact O-CB 3.44Å; V285-Y289 PolarHBondContact O-N 3.18Å |
| 286 | A | 93.8 | Very high | 91.1 | Very high | 21 Ų | 21 | 70.6 Ų | 70.6 | 17% | 0.174 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | A22 A282 L283 F284 S290 | A22-A286 HydrophobicContact CB-CB 3.63Å; A282-A286 WeakPolarHBondContact O-CB 3.38Å; A282-A286 PolarHBondContact O-N 3.46Å; L283-A286 PolarHBondContact O-N 3.32Å; F284-A286 PolarHBondContact O-N 3.42Å; A286-S290 WeakPolarHBondContact O-CB 3.41Å; A286-S290 PolarHBondContact O-N 3.15Å; A286-S290 PolarHBondContact O-OG 3.39Å |
| 287 | Y | 92.1 | Very high | 91 | Very high | 59 Ų | 59 | 75.3 Ų | 75.3 | 23% | 0.231 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.6 | -56 | 176.6 | 176.6 | -95.3 | 0 | 0 | 0 | 112.1 | A15 L283 F284 Y289 S290 R291 | A15-Y287 HydrophobicContact CB-CD2 3.74Å; A15-Y287 HydrophobicContact CB-CE2 3.86Å; A15-Y287 HydrophobicContact CB-CG 4.47Å; L283-Y287 VanDerWaalsContact O-CB 3.24Å; L283-Y287 WeakPolarHBondContact O-CB 3.45Å; L283-Y287 PolarHBondContact O-N 2.97Å; F284-Y287 PolarHBondContact O-N 3.32Å; Y287-Y289 PolarHBondContact O-N 3.2Å; Y287-S290 PolarHBondContact O-N 3.48Å; Y287-R291 WeakPolarHBondContact O-CB 3.48Å; Y287-R291 PolarHBondContact O-N 3.37Å |
| 288 | E | 90.9 | Very high | 90.7 | Very high | 100 Ų | 100 | 71.6 Ų | 71.6 | 47% | 0.467 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.9 | -43.6 | -175.8 | -71.4 | -63.4 | 158.8 | 0 | 0 | 111.7 | F284 K292 | F284-E288 WeakPolarHBondContact O-CB 3.29Å; F284-E288 WeakPolarHBondContact O-CG 3.36Å; F284-E288 PolarHBondContact O-N 3.15Å; E288-K292 WeakPolarHBondContact O-CB 3.32Å; E288-K292 PolarHBondContact O-N 2.9Å |
| 289 | Y | 93.1 | Very high | 90.2 | Very high | 166 Ų | 166 | 76.4 Ų | 76.4 | 65% | 0.651 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -68 | -45.5 | -179.7 | -168.1 | -95.1 | 0 | 0 | 0 | 111.9 | V285 Y287 R291 K292 M293 | V285-Y289 WeakPolarHBondContact O-CB 3.44Å; V285-Y289 PolarHBondContact O-N 3.18Å; Y287-Y289 PolarHBondContact O-N 3.2Å; Y289-R291 PolarHBondContact O-N 3.26Å; Y289-K292 PolarHBondContact O-N 3.44Å; Y289-M293 VanDerWaalsContact O-CB 3.31Å; Y289-M293 WeakPolarHBondContact O-CB 3.34Å; Y289-M293 PolarHBondContact O-N 3.39Å |
| 290 | S | 91.4 | Very high | 89.3 | Confident | 27 Ų | 27 | 80.5 Ų | 80.5 | 19% | 0.189 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 176.8 | -69.3 | 0 | 0 | 0 | 0 | 111.6 | A286 Y287 M293 M294 | A286-S290 WeakPolarHBondContact O-CB 3.41Å; A286-S290 PolarHBondContact O-N 3.15Å; A286-S290 PolarHBondContact O-OG 3.39Å; Y287-S290 PolarHBondContact O-N 3.48Å; S290-M293 PolarHBondContact O-N 3.16Å; S290-M294 WeakPolarHBondContact O-CE 3.44Å; S290-M294 WeakPolarHBondContact O-CG 3.46Å; S290-M294 PolarHBondContact O-N 2.93Å |
| 291 | R | 91.3 | Very high | 87.8 | Confident | 90 Ų | 90 | 88.5 Ų | 88.5 | 34% | 0.34 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63 | -48.4 | 177.6 | -174.9 | 172.1 | -179.9 | -113.1 | -2.9 | 111.9 | I11 D12 A15 Y287 Y289 M293 M294 M295 | I11-R291 HydrophobicContact CG2-CG 4.03Å; D12-R291 WeakPolarHBondContact OD1-CD 3.32Å; D12-R291 IonicContact OD1-CZ 3.48Å; D12-R291 IonicContact OD1-NE 2.86Å; D12-R291 PolarHBondContact OD1-NE 3.34Å; A15-R291 HydrophobicContact CB-CB 3.86Å; Y287-R291 WeakPolarHBondContact O-CB 3.48Å; Y287-R291 PolarHBondContact O-N 3.37Å; Y289-R291 PolarHBondContact O-N 3.26Å; R291-M293 VanDerWaalsContact C-N 3.35Å; R291-M293 PolarHBondContact O-N 2.95Å; R291-M294 PolarHBondContact O-N 3.24Å; R291-M295 WeakPolarHBondContact O-CB 3.5Å; R291-M295 VanDerWaalsContact O-CG 3.29Å; R291-M295 WeakPolarHBondContact O-CG 3.46Å; R291-M295 PolarHBondContact O-N 2.97Å |
| 292 | K | 91.6 | Very high | 87.7 | Confident | 160 Ų | 160 | 91.2 Ų | 91.2 | 70% | 0.696 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -60.5 | -43.6 | 178.6 | -174.2 | 177.4 | -179.2 | 179.7 | 0 | 111.9 | E288 Y289 M295 S296 | E288-K292 WeakPolarHBondContact O-CB 3.32Å; E288-K292 PolarHBondContact O-N 2.9Å; Y289-K292 PolarHBondContact O-N 3.44Å; K292-M295 PolarHBondContact O-N 3.48Å; K292-S296 WeakPolarHBondContact O-CB 3.31Å; K292-S296 PolarHBondContact O-N 3.02Å; K292-S296 PolarHBondContact O-OG 3.24Å |
| 293 | M | 91.8 | Very high | 87.4 | Confident | 88 Ų | 88 | 94.8 Ų | 94.8 | 43% | 0.433 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.6 | -49.3 | 178.1 | -174.2 | -178.2 | 72.3 | 0 | 0 | 111.5 | Y289 S290 R291 M295 S296 Q297 | Y289-M293 VanDerWaalsContact O-CB 3.31Å; Y289-M293 WeakPolarHBondContact O-CB 3.34Å; Y289-M293 PolarHBondContact O-N 3.39Å; S290-M293 PolarHBondContact O-N 3.16Å; R291-M293 VanDerWaalsContact C-N 3.35Å; R291-M293 PolarHBondContact O-N 2.95Å; M293-M295 PolarHBondContact O-N 3.27Å; M293-S296 PolarHBondContact O-N 3.05Å; M293-S296 PolarHBondContact O-OG 2.9Å; M293-Q297 PolarHBondContact O-N 3.07Å; M293-Q297 VanDerWaalsContact O-N 3.11Å |
| 294 | M | 90.3 | Very high | 87.1 | Confident | 40 Ų | 40 | 98 Ų | 98 | 20% | 0.197 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 179 | -72.9 | -177.5 | -79.8 | 0 | 0 | 112.5 | I11 T14 A15 S290 R291 Q297 L298 | I11-M294 HydrophobicContact CD1-CB 4.33Å; I11-M294 HydrophobicContact CG1-CB 4.08Å; I11-M294 HydrophobicContact CG1-SD 4.42Å; I11-M294 HydrophobicContact CG2-CB 4.01Å; I11-M294 HydrophobicContact CG2-CE 4.01Å; I11-M294 HydrophobicContact CG2-SD 4.38Å; I11-M294 WeakPolarHBondContact O-CE 3.44Å; T14-M294 HydrophobicContact CG2-CE 4.06Å; T14-M294 HydrophobicContact CG2-SD 3.93Å; A15-M294 HydrophobicContact CB-CE 3.94Å; S290-M294 WeakPolarHBondContact O-CE 3.44Å; S290-M294 WeakPolarHBondContact O-CG 3.46Å; S290-M294 PolarHBondContact O-N 2.93Å; R291-M294 PolarHBondContact O-N 3.24Å; M294-Q297 PolarHBondContact O-N 3.03Å; M294-L298 PolarHBondContact O-N 3.47Å; M294-L298 VanDerWaalsContact O-N 3.15Å |
| 295 | M | 88.4 | Confident | 86.8 | Confident | 46 Ų | 46 | 96.4 Ų | 96.4 | 23% | 0.227 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -63.4 | -42.8 | 175.2 | -72.1 | -70.3 | -73.2 | 0 | 0 | 111.6 | I11 R291 K292 M293 Q297 L298 E299 | I11-M295 HydrophobicContact CD1-CG 4.39Å; I11-M295 HydrophobicContact CD1-SD 3.76Å; I11-M295 HydrophobicContact CG2-CG 4.38Å; R291-M295 WeakPolarHBondContact O-CB 3.5Å; R291-M295 VanDerWaalsContact O-CG 3.29Å; R291-M295 WeakPolarHBondContact O-CG 3.46Å; R291-M295 PolarHBondContact O-N 2.97Å; K292-M295 PolarHBondContact O-N 3.48Å; M293-M295 PolarHBondContact O-N 3.27Å; M295-Q297 VanDerWaalsContact C-N 3.31Å; M295-Q297 PolarHBondContact O-N 3.23Å; M295-L298 WeakPolarHBondContact O-CB 3.38Å; M295-L298 PolarHBondContact O-N 2.96Å; M295-L298 VanDerWaalsContact O-N 3.09Å; M295-E299 PolarHBondContact O-N 2.99Å |
| 296 | S | 87.3 | Confident | 86.4 | Confident | 61 Ų | 61 | 95.9 Ų | 95.9 | 43% | 0.427 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -64 | -34.3 | 178.9 | 70.4 | 0 | 0 | 0 | 0 | 113.3 | K292 M293 L298 E299 A300 | K292-S296 WeakPolarHBondContact O-CB 3.31Å; K292-S296 PolarHBondContact O-N 3.02Å; K292-S296 PolarHBondContact O-OG 3.24Å; M293-S296 PolarHBondContact O-N 3.05Å; M293-S296 PolarHBondContact O-OG 2.9Å; S296-L298 VanDerWaalsContact C-N 3.33Å; S296-E299 PolarHBondContact O-N 3.33Å; S296-A300 PolarHBondContact O-N 3.23Å |
| 297 | Q | 84.9 | Confident | 85.9 | Confident | 130 Ų | 130 | 100.9 Ų | 100.9 | 61% | 0.607 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -71.2 | -31 | 174.3 | -70.7 | -158.7 | -27.8 | 0 | 0 | 112.3 | M293 M294 M295 E299 A300 | M293-Q297 PolarHBondContact O-N 3.07Å; M293-Q297 VanDerWaalsContact O-N 3.11Å; M294-Q297 PolarHBondContact O-N 3.03Å; M295-Q297 VanDerWaalsContact C-N 3.31Å; M295-Q297 PolarHBondContact O-N 3.23Å; Q297-E299 VanDerWaalsContact C-N 3.35Å; Q297-A300 PolarHBondContact O-N 3.41Å |
| 298 | L | 83.7 | Confident | 85.5 | Confident | 61 Ų | 61 | 103.9 Ų | 103.9 | 32% | 0.319 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -72.2 | -30.5 | 176.2 | -149.9 | 96.7 | 0 | 0 | 0 | 112.5 | S3 I7 M294 M295 S296 | S3-L298 WeakPolarHBondContact OG-CD2 3.1Å; I7-L298 HydrophobicContact CG2-CD1 3.58Å; I7-L298 HydrophobicContact CG2-CD2 3.93Å; I7-L298 HydrophobicContact CG2-CG 4.42Å; M294-L298 PolarHBondContact O-N 3.47Å; M294-L298 VanDerWaalsContact O-N 3.15Å; M295-L298 WeakPolarHBondContact O-CB 3.38Å; M295-L298 PolarHBondContact O-N 2.96Å; M295-L298 VanDerWaalsContact O-N 3.09Å; S296-L298 VanDerWaalsContact C-N 3.33Å |
| 299 | E | 80 | Confident | 85.1 | Confident | 152 Ų | 152 | 104.2 Ų | 104.2 | 71% | 0.71 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -79.4 | -20 | 176.4 | -70.9 | 175.2 | 177.5 | 0 | 0 | 112.9 | M295 S296 Q297 Y301 | M295-E299 PolarHBondContact O-N 2.99Å; S296-E299 PolarHBondContact O-N 3.33Å; Q297-E299 VanDerWaalsContact C-N 3.35Å; E299-Y301 VanDerWaalsContact C-N 3.31Å |
| 300 | A | 71.8 | Confident | 84.4 | Confident | 86 Ų | 86 | 99 Ų | 99 | 71% | 0.711 | 49% | 0.485 | S | S | * | . | trans | -81.1 | -7.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114 | S296 Q297 | S296-A300 PolarHBondContact O-N 3.23Å; Q297-A300 PolarHBondContact O-N 3.41Å | ||
| 301 | Y | 60.2 | Low | 83.7 | Confident | 247 Ų | 247 | 105.5 Ų | 105.5 | 97% | 0.969 | 51% | 0.512 | S | S | * | . | trans | -110.7 | 0 | 177.1 | -92.1 | -87.3 | 0 | 0 | 0 | 111.1 | E299 | E299-Y301 VanDerWaalsContact C-N 3.31Š|
Retrieved 301 of 301 residues in 67.7 ms
(Link to these results)