| 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 | 37.1 | Very low | 67.2 | Low | 236 Ų | 236 | 63.8 Ų | 63.8 | 100% | 1.163 | 37% | 0.371 | S | S | * | . | 0 | 108.8 | 0 | -59.5 | 160.3 | 73.7 | 0 | 0 | 105.5 | |||||
| 2 | C | 47.9 | Very low | 68.8 | Low | 97 Ų | 97 | 66.3 Ų | 66.3 | 66% | 0.655 | 38% | 0.379 | S | S | * | . | -175.3 | 40.8 | 70.7 | -84 | 0 | 0 | 0 | 0 | 111.3 | G4 G5 F6 | C2-G4 VanDerWaalsContact C-N 3.3Å; C2-G4 PolarHBondContact O-N 3.2Å; C2-G5 PolarHBondContact O-N 3.5Å; C2-F6 PolarHBondContact O-N 3.3Å | |||
| 3 | S | 56.1 | Low | 70.3 | Confident | 40 Ų | 40 | 65.5 Ų | 65.5 | 28% | 0.28 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.8 | -37.1 | -173.4 | -162.6 | 0 | 0 | 0 | 0 | 113.7 | A7 M88 | S3-A7 VanDerWaalsContact O-CB 3.29Å; S3-A7 WeakPolarHBondContact O-CB 3.47Å; S3-A7 PolarHBondContact O-N 3.27Å; S3-A7 VanDerWaalsContact O-N 3.08Å; S3-M88 WeakPolarHBondContact OG-CE 3.37Å |
| 4 | G | 59.5 | Low | 71.6 | Confident | 23 Ų | 23 | 60.8 Ų | 60.8 | 24% | 0.237 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -74.9 | -30.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | C2 K8 | C2-G4 VanDerWaalsContact C-N 3.3Å; C2-G4 PolarHBondContact O-N 3.2Å; G4-K8 PolarHBondContact O-N 2.72Å; G4-K8 VanDerWaalsContact O-N 3.13Å |
| 5 | G | 65.4 | Low | 72.8 | Confident | 36 Ų | 36 | 63.9 Ų | 63.9 | 37% | 0.371 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -71.3 | -42.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | C2 K8 C9 | C2-G5 PolarHBondContact O-N 3.5Å; G5-K8 PolarHBondContact O-N 3.15Å; G5-C9 PolarHBondContact O-N 3.25Å |
| 6 | F | 72.3 | Confident | 73.9 | Confident | 94 Ų | 94 | 64.1 Ų | 64.1 | 41% | 0.412 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -68.5 | -42.7 | 176.1 | -173.2 | -95 | 0 | 0 | 0 | 111.9 | C2 K8 C9 L10 V181 N185 | C2-F6 PolarHBondContact O-N 3.3Å; F6-K8 VanDerWaalsContact C-N 3.28Å; F6-K8 PolarHBondContact O-N 3.17Å; F6-C9 WeakPolarHBondContact O-CB 3.42Å; F6-C9 PolarHBondContact O-N 2.97Å; F6-C9 VanDerWaalsContact O-N 3.12Å; F6-L10 HydrophobicContact CD1-CD1 3.95Å; F6-L10 HydrophobicContact CD1-CG 4.12Å; F6-L10 HydrophobicContact CE1-CD1 3.63Å; F6-L10 HydrophobicContact CE1-CD2 3.95Å; F6-L10 HydrophobicContact CE1-CG 3.83Å; F6-L10 HydrophobicContact CZ-CD2 4.14Å; F6-L10 HydrophobicContact CZ-CG 4.43Å; F6-L10 WeakPolarHBondContact O-CG 3.17Å; F6-L10 PolarHBondContact O-N 3.13Å; F6-V181 HydrophobicContact CE1-CG1 3.49Å; F6-V181 VanDerWaalsContact CE1-CG1 3.49Å; F6-V181 HydrophobicContact CZ-CG1 3.76Å; F6-N185 WeakPolarHBondContact CD1-ND2 3.27Å; F6-N185 WeakPolarHBondContact CE1-ND2 3.41Å |
| 7 | A | 73.1 | Confident | 74.9 | Confident | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -58.9 | -38.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | S3 C9 L10 G11 F65 L68 | S3-A7 VanDerWaalsContact O-CB 3.29Å; S3-A7 WeakPolarHBondContact O-CB 3.47Å; S3-A7 PolarHBondContact O-N 3.27Å; S3-A7 VanDerWaalsContact O-N 3.08Å; A7-C9 PolarHBondContact O-N 3.41Å; A7-L10 WeakPolarHBondContact O-CB 3.47Å; A7-L10 PolarHBondContact O-N 3.11Å; A7-G11 PolarHBondContact O-N 3.12Å; A7-F65 WeakPolarHBondContact O-CB 3.34Å; A7-L68 HydrophobicContact CB-CD1 3.94Å |
| 8 | K | 76.6 | Confident | 75.8 | Confident | 89 Ų | 89 | 58.8 Ų | 58.8 | 39% | 0.387 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.3 | -44.4 | 174.1 | -178 | 173.1 | 177.7 | 172.4 | 0 | 112.1 | G4 G5 F6 L10 G11 I12 L66 K69 | G4-K8 PolarHBondContact O-N 2.72Å; G4-K8 VanDerWaalsContact O-N 3.13Å; G5-K8 PolarHBondContact O-N 3.15Å; F6-K8 VanDerWaalsContact C-N 3.28Å; F6-K8 PolarHBondContact O-N 3.17Å; K8-L10 VanDerWaalsContact C-N 3.31Å; K8-L10 PolarHBondContact O-N 3.39Å; K8-G11 PolarHBondContact O-N 3.2Å; K8-I12 HydrophobicContact CG-CD1 3.89Å; K8-I12 HydrophobicContact CG-CG1 4.38Å; K8-I12 VanDerWaalsContact O-CG1 3.27Å; K8-I12 WeakPolarHBondContact O-CG1 3.44Å; K8-I12 PolarHBondContact O-N 3.15Å; K8-L66 HydrophobicContact CG-CD2 4.1Å; K8-K69 HydrophobicContact CD-CD 4.1Å |
| 9 | C | 82.4 | Confident | 76.7 | Confident | 76 Ų | 76 | 60.6 Ų | 60.6 | 51% | 0.514 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 175.9 | -68.1 | 0 | 0 | 0 | 0 | 111.3 | G5 F6 A7 I12 S13 | G5-C9 PolarHBondContact O-N 3.25Å; F6-C9 WeakPolarHBondContact O-CB 3.42Å; F6-C9 PolarHBondContact O-N 2.97Å; F6-C9 VanDerWaalsContact O-N 3.12Å; A7-C9 PolarHBondContact O-N 3.41Å; C9-I12 PolarHBondContact O-N 2.8Å; C9-S13 PolarHBondContact O-N 2.67Å; C9-S13 PolarHBondContact O-OG 3.12Å; C9-S13 VanDerWaalsContact O-OG 3.12Å |
| 10 | L | 84.3 | Confident | 77.5 | Confident | 11 Ų | 11 | 60.2 Ų | 60.2 | 6% | 0.058 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -60 | -47.8 | 175.3 | -64.3 | -179.2 | 0 | 0 | 0 | 111.9 | F6 A7 K8 I12 S13 L14 F65 L178 Q182 | F6-L10 HydrophobicContact CD1-CD1 3.95Å; F6-L10 HydrophobicContact CD1-CG 4.12Å; F6-L10 HydrophobicContact CE1-CD1 3.63Å; F6-L10 HydrophobicContact CE1-CD2 3.95Å; F6-L10 HydrophobicContact CE1-CG 3.83Å; F6-L10 HydrophobicContact CZ-CD2 4.14Å; F6-L10 HydrophobicContact CZ-CG 4.43Å; F6-L10 WeakPolarHBondContact O-CG 3.17Å; F6-L10 PolarHBondContact O-N 3.13Å; A7-L10 WeakPolarHBondContact O-CB 3.47Å; A7-L10 PolarHBondContact O-N 3.11Å; K8-L10 VanDerWaalsContact C-N 3.31Å; K8-L10 PolarHBondContact O-N 3.39Å; L10-I12 PolarHBondContact O-N 2.94Å; L10-S13 PolarHBondContact O-N 3.28Å; L10-L14 VanDerWaalsContact O-CG 3.29Å; L10-L14 WeakPolarHBondContact O-CG 3.4Å; L10-L14 PolarHBondContact O-N 3.15Å; L10-F65 HydrophobicContact CB-CD2 4.16Å; L10-L178 HydrophobicContact CD2-CB 4.44Å; L10-L178 HydrophobicContact CD2-CD2 3.55Å; L10-Q182 HydrophobicContact CD1-CB 3.93Å |
| 11 | G | 84.6 | Confident | 78.1 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61 | -42 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | A7 K8 S13 L14 M15 | A7-G11 PolarHBondContact O-N 3.12Å; K8-G11 PolarHBondContact O-N 3.2Å; G11-S13 VanDerWaalsContact C-N 3.35Å; G11-S13 PolarHBondContact O-N 2.93Å; G11-L14 PolarHBondContact O-N 2.87Å; G11-M15 PolarHBondContact O-N 2.69Å |
| 12 | I | 86.6 | Confident | 80.7 | Confident | 93 Ų | 93 | 48.1 Ų | 48.1 | 48% | 0.477 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.2 | -41.1 | 175.5 | -67.2 | 170.7 | 0 | 0 | 0 | 110.9 | K8 C9 L10 P16 L66 | K8-I12 HydrophobicContact CG-CD1 3.89Å; K8-I12 HydrophobicContact CG-CG1 4.38Å; K8-I12 VanDerWaalsContact O-CG1 3.27Å; K8-I12 WeakPolarHBondContact O-CG1 3.44Å; K8-I12 PolarHBondContact O-N 3.15Å; C9-I12 PolarHBondContact O-N 2.8Å; L10-I12 PolarHBondContact O-N 2.94Å; I12-P16 WeakPolarHBondContact O-CD 3.29Å; I12-L66 HydrophobicContact CG1-CD2 3.68Å |
| 13 | S | 87.9 | Confident | 82.8 | Confident | 56 Ų | 56 | 48 Ų | 48 | 39% | 0.392 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -69.2 | -35.6 | 178.1 | -64.5 | 0 | 0 | 0 | 0 | 112.7 | C9 L10 G11 M15 P16 L17 | C9-S13 PolarHBondContact O-N 2.67Å; C9-S13 PolarHBondContact O-OG 3.12Å; C9-S13 VanDerWaalsContact O-OG 3.12Å; L10-S13 PolarHBondContact O-N 3.28Å; G11-S13 VanDerWaalsContact C-N 3.35Å; G11-S13 PolarHBondContact O-N 2.93Å; S13-M15 VanDerWaalsContact C-N 3.33Å; S13-M15 PolarHBondContact O-N 3.22Å; S13-P16 VanDerWaalsContact O-CD 3.25Å; S13-P16 WeakPolarHBondContact O-CD 3.39Å; S13-P16 VanDerWaalsContact O-CG 3.32Å; S13-P16 WeakPolarHBondContact O-CG 3.21Å; S13-L17 WeakPolarHBondContact O-CD1 3.29Å |
| 14 | L | 87.9 | Confident | 84.4 | Confident | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.8 | -30.7 | -179.1 | -74.5 | 170.6 | 0 | 0 | 0 | 113.5 | L10 G11 L17 A18 M58 A62 F65 Q175 L178 | L10-L14 VanDerWaalsContact O-CG 3.29Å; L10-L14 WeakPolarHBondContact O-CG 3.4Å; L10-L14 PolarHBondContact O-N 3.15Å; G11-L14 PolarHBondContact O-N 2.87Å; L14-L17 WeakPolarHBondContact O-CB 3.34Å; L14-L17 PolarHBondContact O-N 2.98Å; L14-A18 WeakPolarHBondContact O-CB 3.48Å; L14-A18 PolarHBondContact O-N 3.22Å; L14-M58 HydrophobicContact CB-CG 4.49Å; L14-M58 HydrophobicContact CD1-SD 4.31Å; L14-M58 HydrophobicContact CD2-CG 4.24Å; L14-M58 HydrophobicContact CD2-SD 3.77Å; L14-A62 HydrophobicContact CB-CB 4.1Å; L14-F65 HydrophobicContact CD1-CD2 3.76Å; L14-F65 HydrophobicContact CD1-CE2 3.61Å; L14-Q175 HydrophobicContact CD2-CB 4.35Å; L14-Q175 HydrophobicContact CD2-CG 4.02Å; L14-L178 HydrophobicContact CD2-CB 4.03Å; L14-L178 HydrophobicContact CD2-CD1 3.71Å; L14-L178 HydrophobicContact CG-CD1 4.18Å |
| 15 | M | 89.8 | Confident | 85.9 | Confident | 107 Ų | 107 | 45.7 Ų | 45.7 | 53% | 0.527 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.1 | -53.6 | -177.8 | -159.8 | 172 | -158.6 | 0 | 0 | 114.2 | G11 S13 L17 A18 I19 | G11-M15 PolarHBondContact O-N 2.69Å; S13-M15 VanDerWaalsContact C-N 3.33Å; S13-M15 PolarHBondContact O-N 3.22Å; M15-L17 VanDerWaalsContact C-N 3.28Å; M15-L17 PolarHBondContact O-N 3.23Å; M15-A18 PolarHBondContact O-N 3.2Å; M15-I19 WeakPolarHBondContact O-CG1 3.26Å; M15-I19 PolarHBondContact O-N 3.11Å; M15-I19 VanDerWaalsContact O-N 3.12Å |
| 16 | P | 91.2 | Very high | 87 | Confident | 67 Ų | 67 | 47.6 Ų | 47.6 | 44% | 0.435 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -64.5 | -33.3 | 175.1 | 26.6 | -34.6 | 0 | 0 | 0 | 112 | I12 S13 I19 V20 | I12-P16 WeakPolarHBondContact O-CD 3.29Å; S13-P16 VanDerWaalsContact O-CD 3.25Å; S13-P16 WeakPolarHBondContact O-CD 3.39Å; S13-P16 VanDerWaalsContact O-CG 3.32Å; S13-P16 WeakPolarHBondContact O-CG 3.21Å; P16-I19 PolarHBondContact O-N 2.93Å; P16-V20 WeakPolarHBondContact O-CG2 3.49Å; P16-V20 PolarHBondContact O-N 2.94Å |
| 17 | L | 90.4 | Very high | 87.7 | Confident | 25 Ų | 25 | 46.7 Ų | 46.7 | 13% | 0.131 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 176.1 | -92.7 | 71.6 | 0 | 0 | 0 | 111.2 | S13 L14 M15 V20 C21 M171 I174 Q175 L178 | S13-L17 WeakPolarHBondContact O-CD1 3.29Å; L14-L17 WeakPolarHBondContact O-CB 3.34Å; L14-L17 PolarHBondContact O-N 2.98Å; M15-L17 VanDerWaalsContact C-N 3.28Å; M15-L17 PolarHBondContact O-N 3.23Å; L17-V20 PolarHBondContact O-N 3.14Å; L17-C21 PolarHBondContact O-N 3.4Å; L17-C21 PolarHBondContact O-SG 3.34Å; L17-M171 HydrophobicContact CB-CE 4.1Å; L17-M171 HydrophobicContact CD1-CE 4.12Å; L17-M171 HydrophobicContact CG-CE 3.55Å; L17-M171 HydrophobicContact CG-SD 4.14Å; L17-I174 HydrophobicContact CD2-CB 3.99Å; L17-I174 HydrophobicContact CD2-CG2 3.58Å; L17-Q175 HydrophobicContact CB-CG 4.33Å; L17-Q175 HydrophobicContact CD2-CG 3.94Å; L17-L178 HydrophobicContact CD2-CD1 4.22Å |
| 18 | A | 91.7 | Very high | 88.3 | Confident | 8 Ų | 8 | 47 Ų | 47 | 7% | 0.066 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L14 M15 C21 V22 M58 | L14-A18 WeakPolarHBondContact O-CB 3.48Å; L14-A18 PolarHBondContact O-N 3.22Å; M15-A18 PolarHBondContact O-N 3.2Å; A18-C21 PolarHBondContact O-N 2.75Å; A18-V22 WeakPolarHBondContact O-CG2 3.42Å; A18-V22 PolarHBondContact O-N 2.03Å; A18-M58 HydrophobicContact CB-CB 4.14Å; A18-M58 HydrophobicContact CB-CG 4.32Å |
| 19 | I | 92.4 | Very high | 88.6 | Confident | 93 Ų | 93 | 45 Ų | 45 | 48% | 0.477 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 176.8 | -67.1 | 166 | 0 | 0 | 0 | 110.7 | M15 P16 C21 V22 L23 | M15-I19 WeakPolarHBondContact O-CG1 3.26Å; M15-I19 PolarHBondContact O-N 3.11Å; M15-I19 VanDerWaalsContact O-N 3.12Å; P16-I19 PolarHBondContact O-N 2.93Å; I19-C21 VanDerWaalsContact C-N 3.31Å; I19-C21 PolarHBondContact O-N 3.41Å; I19-V22 PolarHBondContact O-N 2.99Å; I19-L23 HydrophobicContact CG2-CD1 3.91Å; I19-L23 HydrophobicContact CG2-CG 4.33Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.03Å; I19-L23 PolarHBondContact O-N 3.34Å |
| 20 | V | 92.8 | Very high | 88.7 | Confident | 53 Ų | 53 | 45.4 Ų | 45.4 | 32% | 0.321 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.3 | -42.4 | 177.5 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | P16 L17 V22 L23 C24 V167 M171 | P16-V20 WeakPolarHBondContact O-CG2 3.49Å; P16-V20 PolarHBondContact O-N 2.94Å; L17-V20 PolarHBondContact O-N 3.14Å; V20-V22 PolarHBondContact O-N 3.34Å; V20-L23 PolarHBondContact O-N 3.19Å; V20-C24 WeakPolarHBondContact O-CB 3.48Å; V20-C24 PolarHBondContact O-N 2.97Å; V20-C24 PolarHBondContact O-SG 2.96Å; V20-C24 VanDerWaalsContact O-SG 3.33Å; V20-V167 HydrophobicContact CG1-CG1 4.11Å; V20-M171 HydrophobicContact CB-CE 3.87Å; V20-M171 HydrophobicContact CG1-CE 3.92Å; V20-M171 HydrophobicContact CG2-CE 4.27Å |
| 21 | C | 90.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62 | -42.1 | 177.8 | -65.2 | 0 | 0 | 0 | 0 | 112.7 | L17 A18 I19 N25 S54 L168 M171 | L17-C21 PolarHBondContact O-N 3.4Å; L17-C21 PolarHBondContact O-SG 3.34Å; A18-C21 PolarHBondContact O-N 2.75Å; I19-C21 VanDerWaalsContact C-N 3.31Å; I19-C21 PolarHBondContact O-N 3.41Å; C21-N25 WeakPolarHBondContact O-CB 3.23Å; C21-N25 PolarHBondContact O-N 2.86Å; C21-N25 VanDerWaalsContact O-N 3.11Å; C21-S54 WeakPolarHBondContact CB-OG 3.18Å; C21-L168 HydrophobicContact CB-CD2 3.89Å; C21-L168 WeakPolarHBondContact O-CD2 3.12Å; C21-M171 VanDerWaalsContact SG-CB 3.59Å |
| 22 | V | 91.6 | Very high | 88 | Confident | 42 Ų | 42 | 46.7 Ų | 46.7 | 26% | 0.255 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63 | -46.8 | 175.5 | 170.5 | 0 | 0 | 0 | 0 | 110.5 | A18 I19 V20 N25 I26 I51 | A18-V22 WeakPolarHBondContact O-CG2 3.42Å; A18-V22 PolarHBondContact O-N 2.03Å; I19-V22 PolarHBondContact O-N 2.99Å; V20-V22 PolarHBondContact O-N 3.34Å; V22-N25 PolarHBondContact O-N 3.35Å; V22-I26 HydrophobicContact CG1-CD1 3.81Å; V22-I26 HydrophobicContact CG1-CG1 4.48Å; V22-I26 VanDerWaalsContact O-CG1 3.32Å; V22-I26 WeakPolarHBondContact O-CG1 3.06Å; V22-I26 PolarHBondContact O-N 3.33Å; V22-I51 HydrophobicContact CG1-CG1 4.34Å |
| 23 | L | 91.9 | Very high | 87.3 | Confident | 94 Ų | 94 | 44.7 Ų | 44.7 | 49% | 0.492 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 179.5 | -69.9 | 174.7 | 0 | 0 | 0 | 112.2 | I19 V20 N25 I26 L27 | I19-L23 HydrophobicContact CG2-CD1 3.91Å; I19-L23 HydrophobicContact CG2-CG 4.33Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.03Å; I19-L23 PolarHBondContact O-N 3.34Å; V20-L23 PolarHBondContact O-N 3.19Å; L23-N25 VanDerWaalsContact C-N 3.27Å; L23-N25 PolarHBondContact O-N 3.02Å; L23-I26 PolarHBondContact O-N 3.37Å; L23-L27 WeakPolarHBondContact O-CG 3.44Å; L23-L27 PolarHBondContact O-N 3.2Å |
| 24 | C | 90.1 | Very high | 86.7 | Confident | 13 Ų | 13 | 47.3 Ų | 47.3 | 9% | 0.088 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 177 | -72.7 | 0 | 0 | 0 | 0 | 111.7 | V20 L27 L28 L164 L168 | V20-C24 WeakPolarHBondContact O-CB 3.48Å; V20-C24 PolarHBondContact O-N 2.97Å; V20-C24 PolarHBondContact O-SG 2.96Å; V20-C24 VanDerWaalsContact O-SG 3.33Å; C24-L27 PolarHBondContact O-N 3.29Å; C24-L28 WeakPolarHBondContact O-CG 3.38Å; C24-L28 PolarHBondContact O-N 3.35Å; C24-L164 HydrophobicContact CB-CD2 4.08Å; C24-L168 HydrophobicContact CB-CD2 3.96Å; C24-L168 HydrophobicContact CB-CG 4.03Å |
| 25 | N | 89.7 | Confident | 86 | Confident | 3 Ų | 3 | 53.6 Ų | 53.6 | 2% | 0.016 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -72.7 | -31.5 | 178.9 | -159.5 | 35.8 | 0 | 0 | 0 | 113 | C21 V22 L23 L28 F29 I51 | C21-N25 WeakPolarHBondContact O-CB 3.23Å; C21-N25 PolarHBondContact O-N 2.86Å; C21-N25 VanDerWaalsContact O-N 3.11Å; V22-N25 PolarHBondContact O-N 3.35Å; L23-N25 VanDerWaalsContact C-N 3.27Å; L23-N25 PolarHBondContact O-N 3.02Å; N25-L28 WeakPolarHBondContact O-CB 3.43Å; N25-L28 PolarHBondContact O-N 3.42Å; N25-F29 VanDerWaalsContact O-CD2 3.27Å; N25-F29 WeakPolarHBondContact O-CD2 3.49Å; N25-I51 HydrophobicContact CB-CD1 4.3Å; N25-I51 HydrophobicContact CB-CG1 3.99Å; N25-I51 WeakPolarHBondContact ND2-CD1 3.04Å; N25-I51 WeakPolarHBondContact ND2-CG1 3.33Å; N25-I51 PolarHBondContact ND2-N 3.42Å; N25-I51 VanDerWaalsContact ND2-N 3.12Å |
| 26 | I | 88.2 | Confident | 85 | Confident | 76 Ų | 76 | 50 Ų | 50 | 39% | 0.39 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.5 | -43.4 | 170.2 | -68.3 | 166.5 | 0 | 0 | 0 | 110.3 | V22 L23 L28 F29 I51 | V22-I26 HydrophobicContact CG1-CD1 3.81Å; V22-I26 HydrophobicContact CG1-CG1 4.48Å; V22-I26 VanDerWaalsContact O-CG1 3.32Å; V22-I26 WeakPolarHBondContact O-CG1 3.06Å; V22-I26 PolarHBondContact O-N 3.33Å; L23-I26 PolarHBondContact O-N 3.37Å; I26-L28 PolarHBondContact O-N 3.42Å; I26-F29 WeakPolarHBondContact O-CB 3.38Å; I26-F29 PolarHBondContact O-N 3.32Å; I26-F29 VanDerWaalsContact O-N 3.14Å; I26-I51 HydrophobicContact CG1-CD1 4.23Å |
| 27 | L | 88.1 | Confident | 83.9 | Confident | 74 Ų | 74 | 52.6 Ų | 52.6 | 39% | 0.387 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.1 | -26.8 | 177.6 | -70.3 | 172.2 | 0 | 0 | 0 | 113.1 | L23 C24 F29 F30 W160 L164 | L23-L27 WeakPolarHBondContact O-CG 3.44Å; L23-L27 PolarHBondContact O-N 3.2Å; C24-L27 PolarHBondContact O-N 3.29Å; L27-F29 PolarHBondContact O-N 3.28Å; L27-F30 PolarHBondContact O-N 2.9Å; L27-F30 VanDerWaalsContact O-N 3.09Å; L27-W160 HydrophobicContact CB-CZ2 4.01Å; L27-W160 HydrophobicContact CD2-CZ2 4.15Å; L27-W160 HydrophobicContact CG-CZ2 4.49Å; L27-W160 PolarHBondContact O-NE1 3.46Å; L27-L164 HydrophobicContact CB-CD1 3.79Å; L27-L164 HydrophobicContact CB-CD2 4.22Å; L27-L164 HydrophobicContact CD1-CD2 4.21Å |
| 28 | L | 85.9 | Confident | 82.6 | Confident | 8 Ų | 8 | 59.3 Ų | 59.3 | 4% | 0.042 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -66.1 | -22.6 | 174.1 | -81 | 170.1 | 0 | 0 | 0 | 113.3 | C24 N25 I26 F30 V45 L164 F165 L168 | C24-L28 WeakPolarHBondContact O-CG 3.38Å; C24-L28 PolarHBondContact O-N 3.35Å; N25-L28 WeakPolarHBondContact O-CB 3.43Å; N25-L28 PolarHBondContact O-N 3.42Å; I26-L28 PolarHBondContact O-N 3.42Å; L28-F30 PolarHBondContact O-N 3.42Å; L28-V45 HydrophobicContact CB-CG1 4.06Å; L28-V45 HydrophobicContact CB-CG2 4.07Å; L28-L164 HydrophobicContact CD1-CB 4.35Å; L28-L164 HydrophobicContact CD2-CB 3.76Å; L28-L164 HydrophobicContact CD2-CD1 3.86Å; L28-L164 HydrophobicContact CD2-CG 4.47Å; L28-L164 HydrophobicContact CG-CB 3.86Å; L28-L164 HydrophobicContact CG-CD1 3.86Å; L28-F165 HydrophobicContact CD1-CD1 4.02Å; L28-F165 HydrophobicContact CD1-CD2 4.04Å; L28-F165 HydrophobicContact CD1-CE1 3.69Å; L28-F165 HydrophobicContact CD1-CE2 3.67Å; L28-F165 HydrophobicContact CD1-CG 4.2Å; L28-F165 HydrophobicContact CD1-CZ 3.51Å; L28-F165 HydrophobicContact CD2-CD2 3.75Å; L28-F165 HydrophobicContact CD2-CE2 3.51Å; L28-F165 HydrophobicContact CD2-CZ 4.19Å; L28-F165 HydrophobicContact CG-CE2 4.23Å; L28-F165 HydrophobicContact CG-CZ 4.46Å; L28-L168 HydrophobicContact CD1-CD1 3.65Å |
| 29 | F | 83.4 | Confident | 81.2 | Confident | 45 Ų | 45 | 66.8 Ų | 66.8 | 20% | 0.197 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -14.2 | 171.4 | -75 | -81.4 | 0 | 0 | 0 | 113.4 | N25 I26 L27 P31 V45 F48 I51 | N25-F29 VanDerWaalsContact O-CD2 3.27Å; N25-F29 WeakPolarHBondContact O-CD2 3.49Å; I26-F29 WeakPolarHBondContact O-CB 3.38Å; I26-F29 PolarHBondContact O-N 3.32Å; I26-F29 VanDerWaalsContact O-N 3.14Å; L27-F29 PolarHBondContact O-N 3.28Å; F29-P31 VanDerWaalsContact O-CD 3.24Å; F29-P31 WeakPolarHBondContact O-CD 2.94Å; F29-V45 HydrophobicContact CD1-CG1 3.86Å; F29-V45 HydrophobicContact CD2-CG1 3.93Å; F29-V45 HydrophobicContact CE1-CG1 3.76Å; F29-V45 HydrophobicContact CE2-CG1 3.84Å; F29-V45 HydrophobicContact CG-CG1 3.94Å; F29-V45 HydrophobicContact CZ-CG1 3.74Å; F29-F48 HydrophobicContact CE2-CE1 4.14Å; F29-F48 HydrophobicContact CZ-CD1 4.25Å; F29-F48 AromaticContact CZ-CE1 3.55Å; F29-F48 HydrophobicContact CZ-CE1 3.55Å; F29-F48 HydrophobicContact CZ-CZ 4.09Å; F29-I51 HydrophobicContact CE2-CD1 4.31Å |
| 30 | F | 84.4 | Confident | 79.9 | Confident | 85 Ų | 85 | 63.7 Ų | 63.7 | 37% | 0.373 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -113.8 | 81.1 | 178.8 | -60.2 | -81.6 | 0 | 0 | 0 | 109.5 | L27 L28 G32 G33 V35 W160 | L27-F30 PolarHBondContact O-N 2.9Å; L27-F30 VanDerWaalsContact O-N 3.09Å; L28-F30 PolarHBondContact O-N 3.42Å; F30-G32 PolarHBondContact O-N 3.41Å; F30-G32 VanDerWaalsContact O-N 3.12Å; F30-G33 PolarHBondContact O-N 3Å; F30-V35 HydrophobicContact CD1-CG2 4.32Å; F30-V35 HydrophobicContact CE1-CG2 4.2Å; F30-W160 PolarHBondContact O-NE1 2.9Å; F30-W160 VanDerWaalsContact O-NE1 3.09Å |
| 31 | P | 76.6 | Confident | 78.7 | Confident | 14 Ų | 14 | 61.9 Ų | 61.9 | 9% | 0.091 | 33% | 0.331 | C | S | . | . | G | 310 helix | trans | -60.8 | 118.6 | -178 | 25.5 | -33.9 | 0 | 0 | 0 | 110.4 | F29 G33 K34 V36 P154 V157 | F29-P31 VanDerWaalsContact O-CD 3.24Å; F29-P31 WeakPolarHBondContact O-CD 2.94Å; P31-G33 PolarHBondContact O-N 3.23Å; P31-K34 PolarHBondContact O-N 2.93Å; P31-V36 HydrophobicContact CG-CB 4.26Å; P31-V36 HydrophobicContact CG-CG2 3.77Å; P31-P154 HydrophobicContact CB-CG 3.98Å; P31-P154 HydrophobicContact CG-CG 4.38Å; P31-P154 WeakPolarHBondContact O-CG 3.38Å; P31-V157 HydrophobicContact CB-CG2 3.97Å |
| 32 | G | 76 | Confident | 77.5 | Confident | 24 Ų | 24 | 62.3 Ų | 62.3 | 25% | 0.247 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | 63.6 | 21.6 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | F30 K34 | F30-G32 PolarHBondContact O-N 3.41Å; F30-G32 VanDerWaalsContact O-N 3.12Å; G32-K34 VanDerWaalsContact C-N 3.26Å; G32-K34 PolarHBondContact O-N 3.44Å |
| 33 | G | 72.9 | Confident | 76.5 | Confident | 52 Ų | 52 | 64.1 Ų | 64.1 | 54% | 0.536 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | 72.7 | 13.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | F30 P31 | F30-G33 PolarHBondContact O-N 3Å; P31-G33 PolarHBondContact O-N 3.23Å |
| 34 | K | 74.5 | Confident | 75.4 | Confident | 111 Ų | 111 | 59.8 Ų | 59.8 | 48% | 0.483 | 32% | 0.319 | S | S | . | . | trans | -106.5 | 148.2 | 176.2 | -65.4 | -161 | 177.9 | -175.7 | 0 | 111.3 | P31 G32 V36 | P31-K34 PolarHBondContact O-N 2.93Å; G32-K34 VanDerWaalsContact C-N 3.26Å; G32-K34 PolarHBondContact O-N 3.44Å; K34-V36 PolarHBondContact O-N 2.88Å | ||
| 35 | V | 72.9 | Confident | 74.4 | Confident | 131 Ų | 131 | 59.2 Ų | 59.2 | 79% | 0.794 | 32% | 0.316 | S | S | * | . | trans | -77.3 | 119.1 | 170.3 | -172.4 | 0 | 0 | 0 | 0 | 107.2 | F30 | F30-V35 HydrophobicContact CD1-CG2 4.32Å; F30-V35 HydrophobicContact CE1-CG2 4.2Å | ||
| 36 | V | 69.7 | Low | 73.7 | Confident | 31 Ų | 31 | 64.9 Ų | 64.9 | 19% | 0.188 | 34% | 0.337 | C | S | . | . | trans | -122.8 | 149.1 | 178.1 | -169.8 | 0 | 0 | 0 | 0 | 108.1 | P31 K34 N40 W132 | P31-V36 HydrophobicContact CG-CB 4.26Å; P31-V36 HydrophobicContact CG-CG2 3.77Å; K34-V36 PolarHBondContact O-N 2.88Å; V36-N40 HydrophobicContact CG1-CB 3.62Å; V36-W132 HydrophobicContact CG1-CH2 3.81Å; V36-W132 HydrophobicContact CG1-CZ2 3.99Å | ||
| 37 | D | 68.1 | Low | 73.1 | Confident | 123 Ų | 123 | 67.2 Ų | 67.2 | 66% | 0.658 | 34% | 0.341 | S | S | * | . | trans | -57.6 | 145.7 | 175.9 | -65.2 | -51.8 | 0 | 0 | 0 | 112.1 | E39 N40 | D37-E39 PolarHBondContact O-N 3.35Å; D37-N40 PolarHBondContact O-N 2.89Å | ||
| 38 | K | 62.4 | Low | 72.6 | Confident | 166 Ų | 166 | 67.3 Ų | 67.3 | 72% | 0.722 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -56.1 | -28.7 | -171.9 | -67.4 | -179.4 | -179.5 | 176.4 | 0 | 113.9 | N40 I41 | K38-N40 PolarHBondContact O-N 3.32Å; K38-I41 PolarHBondContact O-N 3.34Å |
| 39 | E | 63.3 | Low | 72.3 | Confident | 164 Ų | 164 | 67 Ų | 67 | 77% | 0.766 | 34% | 0.338 | S | S | * | . | G | 310 helix | trans | -71.4 | -17.5 | -178.2 | -65.8 | 163.6 | -161.1 | 0 | 0 | 113.2 | D37 R118 | D37-E39 PolarHBondContact O-N 3.35Å; E39-R118 PolarHBondContact O-NH1 3.13Å |
| 40 | N | 63.8 | Low | 72 | Confident | 29 Ų | 29 | 65 Ų | 65 | 16% | 0.155 | 33% | 0.329 | C | S | . | . | G | 310 helix | trans | -105.8 | 2.1 | -176.8 | -60.8 | -34.2 | 0 | 0 | 0 | 112.7 | V36 D37 K38 W132 | V36-N40 HydrophobicContact CG1-CB 3.62Å; D37-N40 PolarHBondContact O-N 2.89Å; K38-N40 PolarHBondContact O-N 3.32Å; N40-W132 HydrophobicContact CB-CD2 3.69Å; N40-W132 HydrophobicContact CB-CE3 3.85Å; N40-W132 HydrophobicContact CB-CG 4.2Å; N40-W132 HydrophobicContact CB-CH2 4.15Å; N40-W132 HydrophobicContact CB-CZ2 4Å; N40-W132 HydrophobicContact CB-CZ3 4.08Å; N40-W132 VanDerWaalsContact CG-CE2 3.43Å; N40-W132 PolarHBondContact ND2-NE1 2.9Å; N40-W132 VanDerWaalsContact OD1-CG 3.3Å; N40-W132 PolarHBondContact OD1-NE1 3.48Å |
| 41 | I | 67.9 | Low | 72 | Confident | 14 Ų | 14 | 62.9 Ų | 62.9 | 7% | 0.072 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -80 | 137 | 176.9 | -60 | 179.8 | 0 | 0 | 0 | 109 | K38 D43 V45 | K38-I41 PolarHBondContact O-N 3.34Å; I41-D43 PolarHBondContact O-N 2.9Å; I41-V45 HydrophobicContact CG2-CB 4.32Å; I41-V45 HydrophobicContact CG2-CG2 4.47Å |
| 42 | T | 65.3 | Low | 72.5 | Confident | 10 Ų | 10 | 66.8 Ų | 66.8 | 6% | 0.061 | 34% | 0.342 | C | S | . | . | trans | -53.6 | 127 | 173.9 | -56.6 | 0 | 0 | 0 | 0 | 111 | E44 V45 R118 Y134 | T42-E44 HydrophobicContact CG2-CB 4.17Å; T42-E44 WeakPolarHBondContact CG2-OE2 3.47Å; T42-E44 PolarHBondContact O-N 3.47Å; T42-E44 VanDerWaalsContact O-N 3.12Å; T42-V45 WeakPolarHBondContact O-CB 3.35Å; T42-V45 PolarHBondContact O-N 3.49Å; T42-V45 VanDerWaalsContact O-N 3.16Å; T42-R118 PolarHBondContact OG1-N 3.17Å; T42-Y134 HydrophobicContact CG2-CE1 4.16Å | ||
| 43 | D | 71.7 | Confident | 72.9 | Confident | 79 Ų | 79 | 65.7 Ų | 65.7 | 42% | 0.422 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -60.4 | -28.9 | -174.4 | -61 | -56.4 | 0 | 0 | 0 | 111.8 | I41 V45 W46 Y134 | I41-D43 PolarHBondContact O-N 2.9Å; D43-V45 PolarHBondContact O-N 2.88Å; D43-W46 WeakPolarHBondContact O-CB 3.45Å; D43-W46 PolarHBondContact O-N 3.38Å; D43-Y134 PolarHBondContact N-OH 3.27Å; D43-Y134 PolarHBondContact OD2-OH 3.04Å |
| 44 | E | 68.5 | Low | 73.4 | Confident | 3 Ų | 3 | 63.2 Ų | 63.2 | 1% | 0.014 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -65.6 | -25 | -177.2 | -69.4 | 68.6 | -156.5 | 0 | 0 | 113.6 | T42 W46 Y47 A112 K115 Y134 | T42-E44 HydrophobicContact CG2-CB 4.17Å; T42-E44 WeakPolarHBondContact CG2-OE2 3.47Å; T42-E44 PolarHBondContact O-N 3.47Å; T42-E44 VanDerWaalsContact O-N 3.12Å; E44-W46 PolarHBondContact O-N 3.19Å; E44-Y47 HydrophobicContact CB-CD2 4.25Å; E44-Y47 HydrophobicContact CG-CD2 4.39Å; E44-Y47 HydrophobicContact CG-CE2 4.31Å; E44-Y47 WeakPolarHBondContact O-CB 3.47Å; E44-Y47 PolarHBondContact O-N 3.42Å; E44-A112 HydrophobicContact CB-CB 3.98Å; E44-A112 HydrophobicContact CG-CB 4.16Å; E44-K115 WeakPolarHBondContact OE1-CD 3.32Å; E44-K115 WeakPolarHBondContact OE1-CE 3.47Å; E44-K115 IonicContact OE1-NZ 2.69Å; E44-K115 PolarHBondContact OE1-NZ 2.92Å; E44-Y134 PolarHBondContact OE2-OH 3.44Å |
| 45 | V | 69.8 | Low | 74.1 | Confident | 2 Ų | 2 | 58 Ų | 58 | 1% | 0.012 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -66.5 | -30.2 | 176.2 | -175.5 | 0 | 0 | 0 | 0 | 110.7 | L28 F29 I41 T42 D43 Y47 F48 | L28-V45 HydrophobicContact CB-CG1 4.06Å; L28-V45 HydrophobicContact CB-CG2 4.07Å; F29-V45 HydrophobicContact CD1-CG1 3.86Å; F29-V45 HydrophobicContact CD2-CG1 3.93Å; F29-V45 HydrophobicContact CE1-CG1 3.76Å; F29-V45 HydrophobicContact CE2-CG1 3.84Å; F29-V45 HydrophobicContact CG-CG1 3.94Å; F29-V45 HydrophobicContact CZ-CG1 3.74Å; I41-V45 HydrophobicContact CG2-CB 4.32Å; I41-V45 HydrophobicContact CG2-CG2 4.47Å; T42-V45 WeakPolarHBondContact O-CB 3.35Å; T42-V45 PolarHBondContact O-N 3.49Å; T42-V45 VanDerWaalsContact O-N 3.16Å; D43-V45 PolarHBondContact O-N 2.88Å; V45-Y47 PolarHBondContact O-N 2.85Å; V45-F48 PolarHBondContact O-N 3.08Å |
| 46 | W | 73.9 | Confident | 74.9 | Confident | 121 Ų | 121 | 54.7 Ų | 54.7 | 46% | 0.458 | 26% | 0.262 | S | S | . | . | G | 310 helix | trans | -74.2 | -10.3 | 177.7 | -70.1 | 99.7 | 0 | 0 | 0 | 114.1 | D43 E44 F48 | D43-W46 WeakPolarHBondContact O-CB 3.45Å; D43-W46 PolarHBondContact O-N 3.38Å; E44-W46 PolarHBondContact O-N 3.19Å; W46-F48 HydrophobicContact CE3-CE2 4Å; W46-F48 AromaticContact CE3-CZ 3.96Å; W46-F48 HydrophobicContact CE3-CZ 3.96Å; W46-F48 HydrophobicContact CZ3-CZ 4.2Å; W46-F48 WeakPolarHBondContact O-CD2 3.2Å; W46-F48 WeakPolarHBondContact O-CE2 3.44Å; W46-F48 PolarHBondContact O-N 3.24Å |
| 47 | Y | 75.9 | Confident | 75.9 | Confident | 125 Ų | 125 | 55.8 Ų | 55.8 | 49% | 0.49 | 27% | 0.267 | S | S | . | . | G | 310 helix | trans | -73.6 | -5.6 | 170.9 | -68.8 | -58.4 | 0 | 0 | 0 | 113.2 | E44 V45 G49 Y104 | E44-Y47 HydrophobicContact CB-CD2 4.25Å; E44-Y47 HydrophobicContact CG-CD2 4.39Å; E44-Y47 HydrophobicContact CG-CE2 4.31Å; E44-Y47 WeakPolarHBondContact O-CB 3.47Å; E44-Y47 PolarHBondContact O-N 3.42Å; V45-Y47 PolarHBondContact O-N 2.85Å; Y47-G49 PolarHBondContact O-N 2.92Å; Y47-Y104 WeakPolarHBondContact CB-OH 3.37Å; Y47-Y104 WeakPolarHBondContact O-CE1 3.5Å; Y47-Y104 PolarHBondContact O-OH 3.11Å |
| 48 | F | 77.5 | Confident | 76.9 | Confident | 76 Ų | 76 | 50 Ų | 50 | 33% | 0.333 | 24% | 0.235 | S | C | . | . | trans | 49 | 31.4 | 177.4 | -66.5 | -76.7 | 0 | 0 | 0 | 113.5 | F29 V45 W46 G50 I51 L52 | F29-F48 HydrophobicContact CE2-CE1 4.14Å; F29-F48 HydrophobicContact CZ-CD1 4.25Å; F29-F48 AromaticContact CZ-CE1 3.55Å; F29-F48 HydrophobicContact CZ-CE1 3.55Å; F29-F48 HydrophobicContact CZ-CZ 4.09Å; V45-F48 PolarHBondContact O-N 3.08Å; W46-F48 HydrophobicContact CE3-CE2 4Å; W46-F48 AromaticContact CE3-CZ 3.96Å; W46-F48 HydrophobicContact CE3-CZ 3.96Å; W46-F48 HydrophobicContact CZ3-CZ 4.2Å; W46-F48 WeakPolarHBondContact O-CD2 3.2Å; W46-F48 WeakPolarHBondContact O-CE2 3.44Å; W46-F48 PolarHBondContact O-N 3.24Å; F48-G50 VanDerWaalsContact C-N 3.3Å; F48-G50 PolarHBondContact O-N 3.04Å; F48-I51 HydrophobicContact CD1-CB 4.42Å; F48-I51 HydrophobicContact CD1-CD1 4.02Å; F48-I51 HydrophobicContact CE1-CD1 4.46Å; F48-I51 PolarHBondContact O-N 3.48Å; F48-L52 HydrophobicContact CB-CB 4.17Å; F48-L52 WeakPolarHBondContact O-CB 3.17Å; F48-L52 PolarHBondContact O-N 3.38Å | ||
| 49 | G | 79.1 | Confident | 78.2 | Confident | 3 Ų | 3 | 46.2 Ų | 46.2 | 3% | 0.031 | 22% | 0.222 | C | C | . | . | I | π-helix | trans | -55 | -45.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y47 G53 S54 S105 | Y47-G49 PolarHBondContact O-N 2.92Å; G49-G53 WeakPolarHBondContact O-CA 3.49Å; G49-G53 PolarHBondContact O-N 3.47Å; G49-S54 PolarHBondContact O-N 3.29Å; G49-S54 VanDerWaalsContact O-N 3.14Å; G49-S105 VanDerWaalsContact O-CB 3.3Å; G49-S105 WeakPolarHBondContact O-CB 3.39Å; G49-S105 PolarHBondContact O-OG 3.28Å |
| 50 | G | 77.6 | Confident | 79.4 | Confident | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.01 | 21% | 0.207 | C | C | . | . | I | π-helix | trans | -71.7 | -37.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115 | F48 S54 G55 | F48-G50 VanDerWaalsContact C-N 3.3Å; F48-G50 PolarHBondContact O-N 3.04Å; G50-S54 WeakPolarHBondContact CA-OG 3.22Å; G50-S54 PolarHBondContact O-OG 3.41Å; G50-G55 PolarHBondContact O-N 3.22Å |
| 51 | I | 85.1 | Confident | 80.6 | Confident | 41 Ų | 41 | 41.9 Ų | 41.9 | 21% | 0.21 | 20% | 0.2 | C | C | . | . | I | π-helix | trans | -81.4 | -55.5 | -177.6 | -74.7 | 160 | 0 | 0 | 0 | 111.1 | V22 N25 I26 F29 F48 G55 V56 | V22-I51 HydrophobicContact CG1-CG1 4.34Å; N25-I51 HydrophobicContact CB-CD1 4.3Å; N25-I51 HydrophobicContact CB-CG1 3.99Å; N25-I51 WeakPolarHBondContact ND2-CD1 3.04Å; N25-I51 WeakPolarHBondContact ND2-CG1 3.33Å; N25-I51 PolarHBondContact ND2-N 3.42Å; N25-I51 VanDerWaalsContact ND2-N 3.12Å; I26-I51 HydrophobicContact CG1-CD1 4.23Å; F29-I51 HydrophobicContact CE2-CD1 4.31Å; F48-I51 HydrophobicContact CD1-CB 4.42Å; F48-I51 HydrophobicContact CD1-CD1 4.02Å; F48-I51 HydrophobicContact CE1-CD1 4.46Å; F48-I51 PolarHBondContact O-N 3.48Å; I51-G55 CarbonylContact O-C 3.49Å; I51-G55 VanDerWaalsContact O-CA 3.28Å; I51-G55 WeakPolarHBondContact O-CA 3.36Å; I51-V56 WeakPolarHBondContact O-CG2 3.31Å; I51-V56 PolarHBondContact O-N 3.06Å |
| 52 | L | 86.1 | Confident | 81.6 | Confident | 97 Ų | 97 | 41.5 Ų | 41.5 | 51% | 0.508 | 20% | 0.199 | S | C | . | . | I | π-helix | trans | -78.2 | -48.8 | -175.9 | -168.8 | 71 | 0 | 0 | 0 | 110.6 | F48 L57 | F48-L52 HydrophobicContact CB-CB 4.17Å; F48-L52 WeakPolarHBondContact O-CB 3.17Å; F48-L52 PolarHBondContact O-N 3.38Å; L52-L57 VanDerWaalsContact O-CG 3.27Å; L52-L57 WeakPolarHBondContact O-CG 3.36Å; L52-L57 PolarHBondContact O-N 2.98Å; L52-L57 VanDerWaalsContact O-N 3.12Å |
| 53 | G | 84.4 | Confident | 82.6 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.01 | 22% | 0.221 | C | C | . | . | I | π-helix | trans | -70.1 | -75.4 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | G49 G55 L57 G101 | G49-G53 WeakPolarHBondContact O-CA 3.49Å; G49-G53 PolarHBondContact O-N 3.47Å; G53-G55 VanDerWaalsContact C-N 3.33Å; G53-G55 PolarHBondContact O-N 3.34Å; G53-L57 WeakPolarHBondContact O-CB 3.44Å; G53-G101 CarbonylContact C-O 3.45Å; G53-G101 VanDerWaalsContact C-O 3.3Å; G53-G101 WeakPolarHBondContact CA-O 3.19Å; G53-G101 CarbonylContact O-C 3.3Å |
| 54 | S | 84.8 | Confident | 83.3 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | I | π-helix | trans | -83.2 | -5.8 | -176.3 | 45.4 | 0 | 0 | 0 | 0 | 114.6 | C21 G49 G50 M58 S105 Q175 | C21-S54 WeakPolarHBondContact CB-OG 3.18Å; G49-S54 PolarHBondContact O-N 3.29Å; G49-S54 VanDerWaalsContact O-N 3.14Å; G50-S54 WeakPolarHBondContact CA-OG 3.22Å; G50-S54 PolarHBondContact O-OG 3.41Å; S54-M58 WeakPolarHBondContact O-CB 3.48Å; S54-S105 WeakPolarHBondContact OG-CB 3.27Å; S54-S105 PolarHBondContact OG-OG 3.04Å; S54-Q175 PolarHBondContact O-NE2 3.38Å |
| 55 | G | 89.2 | Confident | 84 | Confident | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.01 | 21% | 0.21 | C | C | . | . | I | π-helix | trans | -98.8 | -87.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | G50 I51 G53 M58 I59 | G50-G55 PolarHBondContact O-N 3.22Å; I51-G55 CarbonylContact O-C 3.49Å; I51-G55 VanDerWaalsContact O-CA 3.28Å; I51-G55 WeakPolarHBondContact O-CA 3.36Å; G53-G55 VanDerWaalsContact C-N 3.33Å; G53-G55 PolarHBondContact O-N 3.34Å; G55-M58 WeakPolarHBondContact O-CB 3.3Å; G55-M58 PolarHBondContact O-N 3.23Å; G55-M58 VanDerWaalsContact O-N 3.13Å; G55-I59 PolarHBondContact O-N 3.39Å |
| 56 | V | 89.2 | Confident | 84.6 | Confident | 62 Ų | 62 | 46 Ų | 46 | 38% | 0.376 | 22% | 0.223 | S | C | . | . | I | π-helix | trans | -60.9 | -48.4 | -173.6 | 174.4 | 0 | 0 | 0 | 0 | 112.1 | I51 M58 I59 F60 | I51-V56 WeakPolarHBondContact O-CG2 3.31Å; I51-V56 PolarHBondContact O-N 3.06Å; V56-M58 PolarHBondContact O-N 3.16Å; V56-M58 VanDerWaalsContact O-N 3.17Å; V56-I59 WeakPolarHBondContact O-CB 3.48Å; V56-I59 PolarHBondContact O-N 3.12Å; V56-I59 VanDerWaalsContact O-N 3.08Å; V56-F60 HydrophobicContact CG1-CE2 4.48Å |
| 57 | L | 89.3 | Confident | 84.7 | Confident | 54 Ų | 54 | 41.5 Ų | 41.5 | 28% | 0.283 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -64.3 | -21.4 | 179.2 | -69.1 | 174 | 0 | 0 | 0 | 112.7 | L52 G53 P61 V97 | L52-L57 VanDerWaalsContact O-CG 3.27Å; L52-L57 WeakPolarHBondContact O-CG 3.36Å; L52-L57 PolarHBondContact O-N 2.98Å; L52-L57 VanDerWaalsContact O-N 3.12Å; G53-L57 WeakPolarHBondContact O-CB 3.44Å; L57-P61 WeakPolarHBondContact O-CD 3.1Å; L57-V97 HydrophobicContact CD2-CG1 4.14Å |
| 58 | M | 90.1 | Very high | 84.4 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -81 | -17.2 | 177.1 | -161.2 | 57.4 | 55.8 | 0 | 0 | 113.4 | L14 A18 S54 G55 V56 P61 A62 G98 A102 Q175 | L14-M58 HydrophobicContact CB-CG 4.49Å; L14-M58 HydrophobicContact CD1-SD 4.31Å; L14-M58 HydrophobicContact CD2-CG 4.24Å; L14-M58 HydrophobicContact CD2-SD 3.77Å; A18-M58 HydrophobicContact CB-CB 4.14Å; A18-M58 HydrophobicContact CB-CG 4.32Å; S54-M58 WeakPolarHBondContact O-CB 3.48Å; G55-M58 WeakPolarHBondContact O-CB 3.3Å; G55-M58 PolarHBondContact O-N 3.23Å; G55-M58 VanDerWaalsContact O-N 3.13Å; V56-M58 PolarHBondContact O-N 3.16Å; V56-M58 VanDerWaalsContact O-N 3.17Å; M58-P61 WeakPolarHBondContact O-CD 3.33Å; M58-P61 WeakPolarHBondContact O-CG 3.42Å; M58-P61 HydrophobicContact SD-CG 3.86Å; M58-A62 VanDerWaalsContact O-CB 3.31Å; M58-A62 WeakPolarHBondContact O-CB 3.49Å; M58-A62 PolarHBondContact O-N 2.91Å; M58-G98 VanDerWaalsContact CE-O 3.24Å; M58-G98 WeakPolarHBondContact CE-O 3.24Å; M58-A102 HydrophobicContact CE-CB 3.82Å; M58-Q175 HydrophobicContact CE-CB 3.71Å; M58-Q175 HydrophobicContact CE-CG 4.01Å; M58-Q175 HydrophobicContact CG-CG 4.39Å; M58-Q175 HydrophobicContact SD-CB 4.33Å; M58-Q175 HydrophobicContact SD-CG 4.31Å |
| 59 | I | 89.8 | Confident | 83.4 | Confident | 87 Ų | 87 | 39.1 Ų | 39.1 | 45% | 0.446 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -66.8 | -39.4 | 176.9 | -63.6 | 173.6 | 0 | 0 | 0 | 110.7 | G55 V56 A62 L63 | G55-I59 PolarHBondContact O-N 3.39Å; V56-I59 WeakPolarHBondContact O-CB 3.48Å; V56-I59 PolarHBondContact O-N 3.12Å; V56-I59 VanDerWaalsContact O-N 3.08Å; I59-A62 PolarHBondContact O-N 3.13Å; I59-L63 HydrophobicContact CG2-CD1 3.77Å; I59-L63 HydrophobicContact CG2-CG 4.09Å; I59-L63 WeakPolarHBondContact O-CG 3.5Å; I59-L63 PolarHBondContact O-N 3Å |
| 60 | F | 88.3 | Confident | 82.1 | Confident | 103 Ų | 103 | 45.8 Ų | 45.8 | 45% | 0.452 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -58.3 | -57.9 | 179.1 | -63.6 | -82.8 | 0 | 0 | 0 | 113.2 | V56 A62 L63 V64 F94 | V56-F60 HydrophobicContact CG1-CE2 4.48Å; F60-A62 VanDerWaalsContact C-N 3.31Å; F60-A62 PolarHBondContact O-N 2.97Å; F60-L63 PolarHBondContact O-N 3.27Å; F60-V64 VanDerWaalsContact O-CG2 3.27Å; F60-V64 WeakPolarHBondContact O-CG2 3.39Å; F60-V64 PolarHBondContact O-N 3.48Å; F60-F94 HydrophobicContact CB-CD1 3.92Å; F60-F94 HydrophobicContact CB-CE1 4.39Å; F60-F94 HydrophobicContact CD1-CE1 4.48Å |
| 61 | P | 88.3 | Confident | 80.6 | Confident | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.7 | -37.9 | 176.1 | 23.3 | -32 | 0 | 0 | 0 | 112.1 | L57 M58 L63 V64 F65 F94 | L57-P61 WeakPolarHBondContact O-CD 3.1Å; M58-P61 WeakPolarHBondContact O-CD 3.33Å; M58-P61 WeakPolarHBondContact O-CG 3.42Å; M58-P61 HydrophobicContact SD-CG 3.86Å; P61-L63 PolarHBondContact O-N 2.93Å; P61-V64 PolarHBondContact O-N 3.18Å; P61-F65 HydrophobicContact CB-CE1 3.84Å; P61-F65 HydrophobicContact CB-CE2 4.07Å; P61-F65 HydrophobicContact CB-CZ 3.53Å; P61-F65 WeakPolarHBondContact O-CB 3.32Å; P61-F65 WeakPolarHBondContact O-CD1 3.4Å; P61-F65 WeakPolarHBondContact O-CG 3.42Å; P61-F65 PolarHBondContact O-N 2.74Å; P61-F94 HydrophobicContact CB-CB 4.48Å |
| 62 | A | 88.9 | Confident | 78.5 | Confident | 6 Ų | 6 | 55.7 Ų | 55.7 | 5% | 0.05 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.1 | -47.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L14 M58 I59 F60 F65 L66 | L14-A62 HydrophobicContact CB-CB 4.1Å; M58-A62 VanDerWaalsContact O-CB 3.31Å; M58-A62 WeakPolarHBondContact O-CB 3.49Å; M58-A62 PolarHBondContact O-N 2.91Å; I59-A62 PolarHBondContact O-N 3.13Å; F60-A62 VanDerWaalsContact C-N 3.31Å; F60-A62 PolarHBondContact O-N 2.97Å; A62-F65 PolarHBondContact O-N 3.47Å; A62-L66 VanDerWaalsContact O-CG 3.26Å; A62-L66 WeakPolarHBondContact O-CG 3.24Å; A62-L66 PolarHBondContact O-N 3.3Å; A62-L66 VanDerWaalsContact O-N 3.08Å |
| 63 | L | 87.1 | Confident | 76.5 | Confident | 102 Ų | 102 | 53.9 Ų | 53.9 | 53% | 0.534 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66.3 | -41.6 | 177.8 | -69.6 | 177.6 | 0 | 0 | 0 | 112.2 | I59 F60 P61 L66 G67 | I59-L63 HydrophobicContact CG2-CD1 3.77Å; I59-L63 HydrophobicContact CG2-CG 4.09Å; I59-L63 WeakPolarHBondContact O-CG 3.5Å; I59-L63 PolarHBondContact O-N 3Å; F60-L63 PolarHBondContact O-N 3.27Å; P61-L63 PolarHBondContact O-N 2.93Å; L63-L66 PolarHBondContact O-N 3.48Å; L63-G67 PolarHBondContact O-N 3.06Å |
| 64 | V | 85.4 | Confident | 74.4 | Confident | 34 Ų | 34 | 59.5 Ų | 59.5 | 21% | 0.206 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.7 | -44.6 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 110.3 | F60 P61 L66 G67 L68 F94 | F60-V64 VanDerWaalsContact O-CG2 3.27Å; F60-V64 WeakPolarHBondContact O-CG2 3.39Å; F60-V64 PolarHBondContact O-N 3.48Å; P61-V64 PolarHBondContact O-N 3.18Å; V64-L66 VanDerWaalsContact C-N 3.32Å; V64-L66 PolarHBondContact O-N 3.28Å; V64-G67 PolarHBondContact O-N 3.35Å; V64-G67 VanDerWaalsContact O-N 3.1Å; V64-L68 WeakPolarHBondContact O-CG 3.33Å; V64-L68 PolarHBondContact O-N 3.48Å; V64-L68 VanDerWaalsContact O-N 3.12Å; V64-F94 HydrophobicContact CB-CD2 4.47Å; V64-F94 HydrophobicContact CG1-CD2 4.31Å; V64-F94 HydrophobicContact CG2-CB 4.31Å; V64-F94 HydrophobicContact CG2-CD2 3.65Å; V64-F94 HydrophobicContact CG2-CE2 4.11Å; V64-F94 HydrophobicContact CG2-CG 3.97Å |
| 65 | F | 84.3 | Confident | 72.2 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -66.8 | -34.6 | -179.2 | -60.1 | -2.1 | 0 | 0 | 0 | 112.2 | A7 L10 L14 P61 A62 A95 Q182 | A7-F65 WeakPolarHBondContact O-CB 3.34Å; L10-F65 HydrophobicContact CB-CD2 4.16Å; L14-F65 HydrophobicContact CD1-CD2 3.76Å; L14-F65 HydrophobicContact CD1-CE2 3.61Å; P61-F65 HydrophobicContact CB-CE1 3.84Å; P61-F65 HydrophobicContact CB-CE2 4.07Å; P61-F65 HydrophobicContact CB-CZ 3.53Å; P61-F65 WeakPolarHBondContact O-CB 3.32Å; P61-F65 WeakPolarHBondContact O-CD1 3.4Å; P61-F65 WeakPolarHBondContact O-CG 3.42Å; P61-F65 PolarHBondContact O-N 2.74Å; A62-F65 PolarHBondContact O-N 3.47Å; F65-A95 HydrophobicContact CE1-CB 4.07Å; F65-A95 HydrophobicContact CZ-CB 3.65Å; F65-Q182 HydrophobicContact CD1-CG 3.9Å; F65-Q182 HydrophobicContact CD2-CB 4.48Å; F65-Q182 HydrophobicContact CD2-CG 4.26Å; F65-Q182 HydrophobicContact CE1-CB 4.32Å; F65-Q182 HydrophobicContact CE1-CG 3.5Å; F65-Q182 VanDerWaalsContact CE1-CG 3.5Å; F65-Q182 HydrophobicContact CE2-CB 3.81Å; F65-Q182 HydrophobicContact CE2-CG 3.82Å; F65-Q182 HydrophobicContact CG-CG 4.32Å; F65-Q182 HydrophobicContact CZ-CB 3.76Å; F65-Q182 HydrophobicContact CZ-CG 3.46Å; F65-Q182 VanDerWaalsContact CZ-CG 3.46Å |
| 66 | L | 82.9 | Confident | 69.6 | Low | 51 Ų | 51 | 66.4 Ų | 66.4 | 27% | 0.267 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 170.9 | -71.4 | 173 | 0 | 0 | 0 | 112.1 | K8 I12 A62 L63 V64 L68 | K8-L66 HydrophobicContact CG-CD2 4.1Å; I12-L66 HydrophobicContact CG1-CD2 3.68Å; A62-L66 VanDerWaalsContact O-CG 3.26Å; A62-L66 WeakPolarHBondContact O-CG 3.24Å; A62-L66 PolarHBondContact O-N 3.3Å; A62-L66 VanDerWaalsContact O-N 3.08Å; L63-L66 PolarHBondContact O-N 3.48Å; V64-L66 VanDerWaalsContact C-N 3.32Å; V64-L66 PolarHBondContact O-N 3.28Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 3.4Å |
| 67 | G | 75.1 | Confident | 67.4 | Low | 28 Ų | 28 | 69.9 Ų | 69.9 | 29% | 0.289 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -69.2 | -24.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | L63 V64 K69 N70 N71 | L63-G67 PolarHBondContact O-N 3.06Å; V64-G67 PolarHBondContact O-N 3.35Å; V64-G67 VanDerWaalsContact O-N 3.1Å; G67-K69 PolarHBondContact O-N 2.98Å; G67-N70 PolarHBondContact O-N 3.41Å; G67-N70 VanDerWaalsContact O-N 3.13Å; G67-N71 PolarHBondContact O-ND2 2.85Å |
| 68 | L | 70.6 | Confident | 65.1 | Low | 29 Ų | 29 | 71.7 Ų | 71.7 | 15% | 0.152 | 44% | 0.443 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -11.8 | -179.4 | -71.8 | 174.4 | 0 | 0 | 0 | 115 | A7 V64 L66 A87 | A7-L68 HydrophobicContact CB-CD1 3.94Å; V64-L68 WeakPolarHBondContact O-CG 3.33Å; V64-L68 PolarHBondContact O-N 3.48Å; V64-L68 VanDerWaalsContact O-N 3.12Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 3.4Å; L68-A87 HydrophobicContact CD2-CB 4.23Å |
| 69 | K | 56.8 | Low | 63 | Low | 122 Ų | 122 | 76.2 Ų | 76.2 | 53% | 0.53 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.8 | -25.7 | 175.8 | 178.1 | 164.1 | 172.8 | 150.6 | 0 | 114.3 | K8 G67 N71 | K8-K69 HydrophobicContact CD-CD 4.1Å; G67-K69 PolarHBondContact O-N 2.98Å; K69-N71 VanDerWaalsContact C-N 3.29Å; K69-N71 PolarHBondContact O-N 3.47Å |
| 70 | N | 50.3 | Low | 61.3 | Low | 142 Ų | 142 | 77.7 Ų | 77.7 | 76% | 0.759 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83 | -7.6 | -176.1 | -88.1 | 3.5 | 0 | 0 | 0 | 113.5 | G67 D72 | G67-N70 PolarHBondContact O-N 3.41Å; G67-N70 VanDerWaalsContact O-N 3.13Å; N70-D72 PolarHBondContact O-N 3.37Å |
| 71 | N | 45.7 | Very low | 59.8 | Low | 104 Ų | 104 | 76.2 Ų | 76.2 | 56% | 0.556 | 48% | 0.475 | S | S | * | . | trans | -89.4 | 86.6 | 174.4 | -49.8 | -34.4 | 0 | 0 | 0 | 107.8 | G67 K69 C73 | G67-N71 PolarHBondContact O-ND2 2.85Å; K69-N71 VanDerWaalsContact C-N 3.29Å; K69-N71 PolarHBondContact O-N 3.47Å; N71-C73 PolarHBondContact O-N 2.88Å | ||
| 72 | D | 42.1 | Very low | 58.2 | Low | 147 Ų | 147 | 80 Ų | 80 | 79% | 0.786 | 50% | 0.5 | S | S | * | . | trans | -52.7 | 137.1 | 150 | -72.3 | -42.5 | 0 | 0 | 0 | 107 | N70 C74 | N70-D72 PolarHBondContact O-N 3.37Å; D72-C74 PolarHBondContact O-N 2.99Å | ||
| 73 | C | 44.7 | Very low | 56.8 | Low | 58 Ų | 58 | 80.8 Ų | 80.8 | 39% | 0.392 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -64.1 | 24.6 | -160.3 | -75.4 | 0 | 0 | 0 | 0 | 117.3 | N71 E80 | N71-C73 PolarHBondContact O-N 2.88Å; C73-E80 HydrophobicContact CB-CB 4.03Å; C73-E80 HydrophobicContact CB-CG 3.98Å; C73-E80 WeakPolarHBondContact CB-OE1 3.45Å; C73-E80 WeakPolarHBondContact O-CG 3.48Å |
| 74 | C | 38.8 | Very low | 55.8 | Low | 119 Ų | 119 | 82.3 Ų | 82.3 | 80% | 0.804 | 51% | 0.507 | S | S | * | . | trans | -110.7 | 88.1 | 179.6 | -88.6 | 0 | 0 | 0 | 0 | 112.1 | D72 | D72-C74 PolarHBondContact O-N 2.99Š| ||
| 75 | G | 40.3 | Very low | 54.9 | Low | 64 Ų | 64 | 86.4 Ų | 86.4 | 66% | 0.66 | 52% | 0.519 | S | S | * | . | trans | -172.4 | 44.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 76 | C | 34.4 | Very low | 54.2 | Low | 82 Ų | 82 | 93.9 Ų | 93.9 | 55% | 0.554 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -174.6 | 115.1 | 146.2 | -101.9 | 0 | 0 | 0 | 0 | 108 | G78 | C76-G78 PolarHBondContact O-N 3.31Š|
| 77 | C | 41.2 | Very low | 53.7 | Low | 136 Ų | 136 | 92.6 Ų | 92.6 | 92% | 0.919 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 39.2 | 173.8 | -57.3 | 0 | 0 | 0 | 0 | 116.6 | N79 | C77-N79 PolarHBondContact O-N 3.03Š|
| 78 | G | 41.7 | Very low | 53.8 | Low | 92 Ų | 92 | 92 Ų | 92 | 95% | 0.948 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.7 | 10.5 | 167.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | C76 | C76-G78 PolarHBondContact O-N 3.31Š|
| 79 | N | 45.6 | Very low | 54.3 | Low | 95 Ų | 95 | 95.5 Ų | 95.5 | 51% | 0.508 | 56% | 0.557 | S | S | . | * | trans | -125.9 | 109.2 | 179.5 | -170.2 | 16.9 | 0 | 0 | 0 | 111 | C77 S81 C82 | C77-N79 PolarHBondContact O-N 3.03Å; N79-S81 PolarHBondContact O-N 3.21Å; N79-S81 VanDerWaalsContact O-N 3.13Å; N79-C82 PolarHBondContact O-N 3.09Å | ||
| 80 | E | 55.8 | Low | 55.5 | Low | 118 Ų | 118 | 91.2 Ų | 91.2 | 55% | 0.551 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -57.7 | -29.5 | -175.7 | -60.2 | -171.3 | 104.1 | 0 | 0 | 112.8 | C73 R84 | C73-E80 HydrophobicContact CB-CB 4.03Å; C73-E80 HydrophobicContact CB-CG 3.98Å; C73-E80 WeakPolarHBondContact CB-OE1 3.45Å; C73-E80 WeakPolarHBondContact O-CG 3.48Å; E80-R84 WeakPolarHBondContact O-CB 3.3Å; E80-R84 PolarHBondContact O-N 3.36Å |
| 81 | S | 56.5 | Low | 57.2 | Low | 72 Ų | 72 | 84.5 Ų | 84.5 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.1 | -36.1 | -177.1 | -43.1 | 0 | 0 | 0 | 0 | 113.2 | N79 R85 | N79-S81 PolarHBondContact O-N 3.21Å; N79-S81 VanDerWaalsContact O-N 3.13Å; S81-R85 PolarHBondContact O-N 3.26Å |
| 82 | C | 53.9 | Low | 59.2 | Low | 79 Ų | 79 | 80.9 Ų | 80.9 | 53% | 0.534 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -76.5 | -45 | -176.4 | -168.1 | 0 | 0 | 0 | 0 | 111.8 | N79 R84 R85 F86 | N79-C82 PolarHBondContact O-N 3.09Å; C82-R84 VanDerWaalsContact C-N 3.31Å; C82-R84 PolarHBondContact O-N 3.36Å; C82-R85 PolarHBondContact O-N 2.92Å; C82-F86 PolarHBondContact O-N 3.12Å; C82-F86 VanDerWaalsContact O-N 3.16Å |
| 83 | G | 60.3 | Low | 61.5 | Low | 22 Ų | 22 | 79.3 Ų | 79.3 | 23% | 0.227 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -62.4 | -37.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | F86 A87 | G83-F86 PolarHBondContact O-N 3.05Å; G83-A87 WeakPolarHBondContact O-CB 3.12Å; G83-A87 PolarHBondContact O-N 2.9Å |
| 84 | R | 64.4 | Low | 63.7 | Low | 135 Ų | 135 | 79.9 Ų | 79.9 | 51% | 0.509 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 177.3 | -175 | 170.4 | 174.9 | 173.5 | -6.3 | 112.7 | E80 C82 A87 M88 | E80-R84 WeakPolarHBondContact O-CB 3.3Å; E80-R84 PolarHBondContact O-N 3.36Å; C82-R84 VanDerWaalsContact C-N 3.31Å; C82-R84 PolarHBondContact O-N 3.36Å; R84-A87 PolarHBondContact O-N 3.31Å; R84-M88 WeakPolarHBondContact O-CG 3.34Å; R84-M88 PolarHBondContact O-N 2.98Å |
| 85 | R | 66.7 | Low | 66.2 | Low | 120 Ų | 120 | 74.2 Ų | 74.2 | 45% | 0.453 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65 | -42.6 | 177.2 | -72.6 | -170 | -172 | 177.4 | 11 | 111.8 | S81 C82 M88 L89 D194 | S81-R85 PolarHBondContact O-N 3.26Å; C82-R85 PolarHBondContact O-N 2.92Å; R85-M88 PolarHBondContact O-N 3.28Å; R85-L89 WeakPolarHBondContact O-CB 3.41Å; R85-L89 WeakPolarHBondContact O-CG 3.02Å; R85-L89 PolarHBondContact O-N 2.98Å; R85-D194 IonicContact CZ-OD1 3.21Å; R85-D194 IonicContact CZ-OD2 3.38Å; R85-D194 IonicContact NE-OD1 3.18Å; R85-D194 PolarHBondContact NE-OD1 3.13Å; R85-D194 IonicContact NE-OD2 3.96Å; R85-D194 IonicContact NH2-OD1 2.59Å; R85-D194 PolarHBondContact NH2-OD1 3Å; R85-D194 IonicContact NH2-OD2 2.66Å; R85-D194 PolarHBondContact NH2-OD2 3.34Å |
| 86 | F | 70.7 | Confident | 68.7 | Low | 157 Ų | 157 | 73.3 Ų | 73.3 | 69% | 0.689 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -63.4 | -42.6 | 178.4 | -174.4 | -100.9 | 0 | 0 | 0 | 112.2 | C82 G83 M88 S90 | C82-F86 PolarHBondContact O-N 3.12Å; C82-F86 VanDerWaalsContact O-N 3.16Å; G83-F86 PolarHBondContact O-N 3.05Å; F86-M88 PolarHBondContact O-N 2.95Å; F86-S90 WeakPolarHBondContact O-CB 3.46Å; F86-S90 PolarHBondContact O-N 3.25Å; F86-S90 PolarHBondContact O-OG 3.29Å |
| 87 | A | 72.9 | Confident | 71.4 | Confident | 24 Ų | 24 | 72 Ų | 72 | 20% | 0.198 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.5 | -37.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L68 G83 R84 S90 S91 | L68-A87 HydrophobicContact CD2-CB 4.23Å; G83-A87 WeakPolarHBondContact O-CB 3.12Å; G83-A87 PolarHBondContact O-N 2.9Å; R84-A87 PolarHBondContact O-N 3.31Å; A87-S90 PolarHBondContact O-OG 2.98Å; A87-S91 PolarHBondContact O-N 3.5Å |
| 88 | M | 77.3 | Confident | 73.9 | Confident | 15 Ų | 15 | 65.6 Ų | 65.6 | 7% | 0.074 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -72.7 | -42.6 | 177.9 | -66.4 | -64.8 | -89.9 | 0 | 0 | 111.7 | S3 R84 R85 F86 S91 I92 | S3-M88 WeakPolarHBondContact OG-CE 3.37Å; R84-M88 WeakPolarHBondContact O-CG 3.34Å; R84-M88 PolarHBondContact O-N 2.98Å; R85-M88 PolarHBondContact O-N 3.28Å; F86-M88 PolarHBondContact O-N 2.95Å; M88-S91 PolarHBondContact O-N 3.3Å; M88-S91 PolarHBondContact O-OG 3.38Å; M88-I92 WeakPolarHBondContact O-CG1 3.33Å; M88-I92 PolarHBondContact O-N 2.84Å |
| 89 | L | 79.4 | Confident | 76.4 | Confident | 103 Ų | 103 | 62.5 Ų | 62.5 | 54% | 0.539 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 176 | -74.6 | 170.7 | 0 | 0 | 0 | 112.4 | R85 S91 I92 L93 | R85-L89 WeakPolarHBondContact O-CB 3.41Å; R85-L89 WeakPolarHBondContact O-CG 3.02Å; R85-L89 PolarHBondContact O-N 2.98Å; L89-S91 VanDerWaalsContact C-N 3.32Å; L89-S91 PolarHBondContact O-N 2.8Å; L89-I92 PolarHBondContact O-N 3.2Å; L89-L93 PolarHBondContact O-N 3.27Å; L89-L93 VanDerWaalsContact O-N 3.07Å |
| 90 | S | 83.2 | Confident | 78.6 | Confident | 32 Ų | 32 | 64.4 Ų | 64.4 | 22% | 0.224 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -63.5 | -39.4 | 175.8 | 66.8 | 0 | 0 | 0 | 0 | 111.4 | F86 A87 I92 L93 F94 | F86-S90 WeakPolarHBondContact O-CB 3.46Å; F86-S90 PolarHBondContact O-N 3.25Å; F86-S90 PolarHBondContact O-OG 3.29Å; A87-S90 PolarHBondContact O-OG 2.98Å; S90-I92 VanDerWaalsContact C-N 3.31Å; S90-I92 PolarHBondContact O-N 2.88Å; S90-L93 WeakPolarHBondContact O-CB 3.44Å; S90-L93 PolarHBondContact O-N 2.91Å; S90-F94 WeakPolarHBondContact O-CD2 3.36Å; S90-F94 PolarHBondContact O-N 3.14Å |
| 91 | S | 85.4 | Confident | 80.4 | Confident | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.1 | -37.4 | 175.5 | 82 | 0 | 0 | 0 | 0 | 113.4 | A87 M88 L89 A95 Q182 | A87-S91 PolarHBondContact O-N 3.5Å; M88-S91 PolarHBondContact O-N 3.3Å; M88-S91 PolarHBondContact O-OG 3.38Å; L89-S91 VanDerWaalsContact C-N 3.32Å; L89-S91 PolarHBondContact O-N 2.8Å; S91-A95 VanDerWaalsContact O-CB 3.23Å; S91-A95 WeakPolarHBondContact O-CB 3.41Å; S91-A95 PolarHBondContact O-N 3.05Å; S91-Q182 PolarHBondContact OG-NE2 3.01Å |
| 92 | I | 88.4 | Confident | 82.1 | Confident | 29 Ų | 29 | 55.4 Ų | 55.4 | 15% | 0.149 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -66 | -44.2 | 175.3 | -64.9 | 165.3 | 0 | 0 | 0 | 110.3 | M88 L89 S90 A95 A96 V183 L187 | M88-I92 WeakPolarHBondContact O-CG1 3.33Å; M88-I92 PolarHBondContact O-N 2.84Å; L89-I92 PolarHBondContact O-N 3.2Å; S90-I92 VanDerWaalsContact C-N 3.31Å; S90-I92 PolarHBondContact O-N 2.88Å; I92-A95 PolarHBondContact O-N 2.82Å; I92-A96 PolarHBondContact O-N 2.87Å; I92-V183 HydrophobicContact CG2-CG1 4.23Å; I92-V183 HydrophobicContact CG2-CG2 4.35Å; I92-L187 HydrophobicContact CD1-CD2 3.92Å; I92-L187 HydrophobicContact CD1-CG 4.04Å |
| 93 | L | 90.6 | Very high | 84 | Confident | 114 Ų | 114 | 52.7 Ų | 52.7 | 60% | 0.597 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -59.1 | -49.9 | 178.2 | -173.1 | 80.3 | 0 | 0 | 0 | 111.2 | L89 S90 A95 A96 V97 | L89-L93 PolarHBondContact O-N 3.27Å; L89-L93 VanDerWaalsContact O-N 3.07Å; S90-L93 WeakPolarHBondContact O-CB 3.44Å; S90-L93 PolarHBondContact O-N 2.91Å; L93-A95 PolarHBondContact O-N 3.19Å; L93-A96 WeakPolarHBondContact O-CB 3.43Å; L93-A96 PolarHBondContact O-N 3.19Å; L93-V97 WeakPolarHBondContact O-CG2 3.41Å; L93-V97 PolarHBondContact O-N 3.37Å |
| 94 | F | 90.9 | Very high | 85.5 | Confident | 69 Ų | 69 | 56.3 Ų | 56.3 | 30% | 0.303 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -68.5 | -33.7 | 179.2 | -73.3 | -70 | 0 | 0 | 0 | 112.6 | F60 P61 V64 S90 A96 V97 G98 | F60-F94 HydrophobicContact CB-CD1 3.92Å; F60-F94 HydrophobicContact CB-CE1 4.39Å; F60-F94 HydrophobicContact CD1-CE1 4.48Å; P61-F94 HydrophobicContact CB-CB 4.48Å; V64-F94 HydrophobicContact CB-CD2 4.47Å; V64-F94 HydrophobicContact CG1-CD2 4.31Å; V64-F94 HydrophobicContact CG2-CB 4.31Å; V64-F94 HydrophobicContact CG2-CD2 3.65Å; V64-F94 HydrophobicContact CG2-CE2 4.11Å; V64-F94 HydrophobicContact CG2-CG 3.97Å; S90-F94 WeakPolarHBondContact O-CD2 3.36Å; S90-F94 PolarHBondContact O-N 3.14Å; F94-A96 VanDerWaalsContact C-N 3.33Å; F94-V97 PolarHBondContact O-N 3.14Å; F94-G98 PolarHBondContact O-N 3.49Å |
| 95 | A | 91.1 | Very high | 86.9 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F65 S91 I92 L93 G98 A99 C179 Q182 V183 | F65-A95 HydrophobicContact CE1-CB 4.07Å; F65-A95 HydrophobicContact CZ-CB 3.65Å; S91-A95 VanDerWaalsContact O-CB 3.23Å; S91-A95 WeakPolarHBondContact O-CB 3.41Å; S91-A95 PolarHBondContact O-N 3.05Å; I92-A95 PolarHBondContact O-N 2.82Å; L93-A95 PolarHBondContact O-N 3.19Å; A95-G98 PolarHBondContact O-N 2.96Å; A95-A99 WeakPolarHBondContact O-CB 3.47Å; A95-A99 PolarHBondContact O-N 3.2Å; A95-C179 HydrophobicContact CB-CB 4.47Å; A95-Q182 HydrophobicContact CB-CB 4.46Å; A95-Q182 HydrophobicContact CB-CG 4.38Å; A95-V183 HydrophobicContact CB-CG2 3.77Å |
| 96 | A | 91.5 | Very high | 88.2 | Confident | 45 Ų | 45 | 45 Ų | 45 | 37% | 0.372 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -65.1 | -43.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | I92 L93 F94 G98 A99 L100 | I92-A96 PolarHBondContact O-N 2.87Å; L93-A96 WeakPolarHBondContact O-CB 3.43Å; L93-A96 PolarHBondContact O-N 3.19Å; F94-A96 VanDerWaalsContact C-N 3.33Å; A96-G98 VanDerWaalsContact C-N 3.33Å; A96-G98 PolarHBondContact O-N 3.12Å; A96-A99 PolarHBondContact O-N 3.38Å; A96-L100 WeakPolarHBondContact O-CG 3.3Å; A96-L100 PolarHBondContact O-N 3.09Å |
| 97 | V | 92.3 | Very high | 89.3 | Confident | 56 Ų | 56 | 41.9 Ų | 41.9 | 34% | 0.339 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -60.2 | -43.6 | 173.8 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | L57 L93 F94 L100 G101 | L57-V97 HydrophobicContact CD2-CG1 4.14Å; L93-V97 WeakPolarHBondContact O-CG2 3.41Å; L93-V97 PolarHBondContact O-N 3.37Å; F94-V97 PolarHBondContact O-N 3.14Å; V97-L100 PolarHBondContact O-N 3.46Å; V97-G101 PolarHBondContact O-N 3.19Å |
| 98 | G | 92.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | M58 F94 A95 A96 L100 G101 A102 | M58-G98 VanDerWaalsContact CE-O 3.24Å; M58-G98 WeakPolarHBondContact CE-O 3.24Å; F94-G98 PolarHBondContact O-N 3.49Å; A95-G98 PolarHBondContact O-N 2.96Å; A96-G98 VanDerWaalsContact C-N 3.33Å; A96-G98 PolarHBondContact O-N 3.12Å; G98-L100 PolarHBondContact O-N 3.45Å; G98-G101 PolarHBondContact O-N 2.88Å; G98-A102 WeakPolarHBondContact O-CB 3.45Å; G98-A102 PolarHBondContact O-N 3.35Å |
| 99 | A | 93.8 | Very high | 90.9 | Very high | 28 Ų | 28 | 40.8 Ų | 40.8 | 23% | 0.231 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.1 | -39 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A95 A96 G103 C179 | A95-A99 WeakPolarHBondContact O-CB 3.47Å; A95-A99 PolarHBondContact O-N 3.2Å; A96-A99 PolarHBondContact O-N 3.38Å; A99-G103 PolarHBondContact O-N 3.49Å; A99-C179 HydrophobicContact CB-CB 4.05Å |
| 100 | L | 93.3 | Very high | 91.5 | Very high | 134 Ų | 134 | 38.7 Ų | 38.7 | 70% | 0.702 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -64.9 | -43.8 | 174 | -70.8 | 172.8 | 0 | 0 | 0 | 111.6 | A96 V97 G98 G103 Y104 | A96-L100 WeakPolarHBondContact O-CG 3.3Å; A96-L100 PolarHBondContact O-N 3.09Å; V97-L100 PolarHBondContact O-N 3.46Å; G98-L100 PolarHBondContact O-N 3.45Å; L100-G103 PolarHBondContact O-N 3.04Å; L100-Y104 PolarHBondContact O-N 3Å |
| 101 | G | 92.1 | Very high | 91.8 | Very high | 2 Ų | 2 | 40.5 Ų | 40.5 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.8 | -45.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | G53 V97 G98 Y104 S105 | G53-G101 CarbonylContact C-O 3.45Å; G53-G101 VanDerWaalsContact C-O 3.3Å; G53-G101 WeakPolarHBondContact CA-O 3.19Å; G53-G101 CarbonylContact O-C 3.3Å; V97-G101 PolarHBondContact O-N 3.19Å; G98-G101 PolarHBondContact O-N 2.88Å; G101-Y104 PolarHBondContact O-N 3.44Å; G101-S105 PolarHBondContact O-N 3.2Å; G101-S105 VanDerWaalsContact O-N 3.13Å |
| 102 | A | 93.5 | Very high | 92 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.9 | -40.2 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | M58 G98 Y104 S105 V106 Q175 I176 | M58-A102 HydrophobicContact CE-CB 3.82Å; G98-A102 WeakPolarHBondContact O-CB 3.45Å; G98-A102 PolarHBondContact O-N 3.35Å; A102-Y104 PolarHBondContact O-N 3.27Å; A102-S105 WeakPolarHBondContact O-CB 3.34Å; A102-S105 PolarHBondContact O-N 2.93Å; A102-V106 WeakPolarHBondContact O-CG2 3.18Å; A102-V106 PolarHBondContact O-N 3.41Å; A102-Q175 HydrophobicContact CB-CB 3.9Å; A102-I176 HydrophobicContact CB-CD1 4.44Å; A102-I176 HydrophobicContact CB-CG1 3.74Å |
| 103 | G | 93.8 | Very high | 92.1 | Very high | 22 Ų | 22 | 40.2 Ų | 40.2 | 23% | 0.227 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.1 | -44 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A99 L100 S105 V106 V107 | A99-G103 PolarHBondContact O-N 3.49Å; L100-G103 PolarHBondContact O-N 3.04Å; G103-S105 PolarHBondContact O-N 3.23Å; G103-V106 PolarHBondContact O-N 3.19Å; G103-V107 WeakPolarHBondContact O-CG2 3.42Å; G103-V107 PolarHBondContact O-N 3.37Å |
| 104 | Y | 92.5 | Very high | 92.1 | Very high | 98 Ų | 98 | 38.2 Ų | 38.2 | 38% | 0.384 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -58.1 | -47.1 | 173.1 | 173.6 | -105.3 | 0 | 0 | 0 | 111.8 | Y47 L100 G101 A102 V106 V107 V108 | Y47-Y104 WeakPolarHBondContact CB-OH 3.37Å; Y47-Y104 WeakPolarHBondContact O-CE1 3.5Å; Y47-Y104 PolarHBondContact O-OH 3.11Å; L100-Y104 PolarHBondContact O-N 3Å; G101-Y104 PolarHBondContact O-N 3.44Å; A102-Y104 PolarHBondContact O-N 3.27Å; Y104-V106 VanDerWaalsContact C-N 3.33Å; Y104-V106 PolarHBondContact O-N 3.48Å; Y104-V107 PolarHBondContact O-N 3.15Å; Y104-V108 HydrophobicContact CD2-CG2 4.24Å; Y104-V108 HydrophobicContact CE1-CG2 4.13Å; Y104-V108 HydrophobicContact CE2-CG2 3.84Å; Y104-V108 WeakPolarHBondContact O-CG2 3.39Å; Y104-V108 PolarHBondContact O-N 3.34Å |
| 105 | S | 92.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.3 | -41.7 | 176.9 | -169.3 | 0 | 0 | 0 | 0 | 112.5 | G49 S54 G101 A102 G103 S109 | G49-S105 VanDerWaalsContact O-CB 3.3Å; G49-S105 WeakPolarHBondContact O-CB 3.39Å; G49-S105 PolarHBondContact O-OG 3.28Å; S54-S105 WeakPolarHBondContact OG-CB 3.27Å; S54-S105 PolarHBondContact OG-OG 3.04Å; G101-S105 PolarHBondContact O-N 3.2Å; G101-S105 VanDerWaalsContact O-N 3.13Å; A102-S105 WeakPolarHBondContact O-CB 3.34Å; A102-S105 PolarHBondContact O-N 2.93Å; G103-S105 PolarHBondContact O-N 3.23Å; S105-S109 WeakPolarHBondContact O-CB 3.43Å; S105-S109 PolarHBondContact O-N 2.94Å; S105-S109 PolarHBondContact O-OG 3.36Å |
| 106 | V | 94.7 | Very high | 91.6 | Very high | 18 Ų | 18 | 39.4 Ų | 39.4 | 11% | 0.109 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.2 | -47 | 176.6 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | A102 G103 Y104 S109 C110 L173 I176 | A102-V106 WeakPolarHBondContact O-CG2 3.18Å; A102-V106 PolarHBondContact O-N 3.41Å; G103-V106 PolarHBondContact O-N 3.19Å; Y104-V106 VanDerWaalsContact C-N 3.33Å; Y104-V106 PolarHBondContact O-N 3.48Å; V106-S109 PolarHBondContact O-N 3.32Å; V106-C110 PolarHBondContact O-N 2.93Å; V106-C110 PolarHBondContact O-SG 3.06Å; V106-C110 VanDerWaalsContact O-SG 3.32Å; V106-L173 HydrophobicContact CG1-CD2 4.17Å; V106-L173 HydrophobicContact CG2-CD2 4.24Å; V106-L173 HydrophobicContact CG2-CG 4.24Å; V106-I176 HydrophobicContact CG2-CD1 4.13Å |
| 107 | V | 93.4 | Very high | 91.3 | Very high | 91 Ų | 91 | 37.3 Ų | 37.3 | 55% | 0.552 | 21% | 0.209 | S | C | * | . | H | α-helix | trans | -61.5 | -47.4 | 179.1 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | G103 Y104 S109 C110 V111 | G103-V107 WeakPolarHBondContact O-CG2 3.42Å; G103-V107 PolarHBondContact O-N 3.37Å; Y104-V107 PolarHBondContact O-N 3.15Å; V107-S109 VanDerWaalsContact C-N 3.3Å; V107-S109 PolarHBondContact O-N 2.86Å; V107-C110 PolarHBondContact O-N 2.92Å; V107-V111 WeakPolarHBondContact O-CG2 3.39Å; V107-V111 PolarHBondContact O-N 2.94Å |
| 108 | V | 91.6 | Very high | 90.8 | Very high | 14 Ų | 14 | 37.6 Ų | 37.6 | 9% | 0.085 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.8 | -42.6 | 176.6 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | Y104 V111 A112 | Y104-V108 HydrophobicContact CD2-CG2 4.24Å; Y104-V108 HydrophobicContact CE1-CG2 4.13Å; Y104-V108 HydrophobicContact CE2-CG2 3.84Å; Y104-V108 WeakPolarHBondContact O-CG2 3.39Å; Y104-V108 PolarHBondContact O-N 3.34Å; V108-V111 PolarHBondContact O-N 3.37Å; V108-A112 WeakPolarHBondContact O-CB 3.45Å; V108-A112 PolarHBondContact O-N 3.26Å |
| 109 | S | 92.2 | Very high | 90.4 | Very high | 1 Ų | 1 | 37.6 Ų | 37.6 | 1% | 0.007 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.9 | -42.1 | 178.4 | -58.3 | 0 | 0 | 0 | 0 | 112.2 | S105 V106 V107 A112 I113 | S105-S109 WeakPolarHBondContact O-CB 3.43Å; S105-S109 PolarHBondContact O-N 2.94Å; S105-S109 PolarHBondContact O-OG 3.36Å; V106-S109 PolarHBondContact O-N 3.32Å; V107-S109 VanDerWaalsContact C-N 3.3Å; V107-S109 PolarHBondContact O-N 2.86Å; S109-A112 PolarHBondContact O-N 3.23Å; S109-I113 WeakPolarHBondContact O-CB 3.4Å; S109-I113 WeakPolarHBondContact O-CD1 3.31Å; S109-I113 WeakPolarHBondContact O-CG1 3.43Å; S109-I113 PolarHBondContact O-N 3.35Å |
| 110 | C | 91.8 | Very high | 89.6 | Confident | 60 Ų | 60 | 36.6 Ų | 36.6 | 41% | 0.405 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61.5 | -45.2 | 174.6 | -70.9 | 0 | 0 | 0 | 0 | 112 | V106 V107 I113 N114 L169 | V106-C110 PolarHBondContact O-N 2.93Å; V106-C110 PolarHBondContact O-SG 3.06Å; V106-C110 VanDerWaalsContact O-SG 3.32Å; V107-C110 PolarHBondContact O-N 2.92Å; C110-I113 PolarHBondContact O-N 3.33Å; C110-N114 WeakPolarHBondContact O-CB 3.34Å; C110-N114 PolarHBondContact O-N 2.93Å; C110-L169 WeakPolarHBondContact SG-CD1 3.47Å |
| 111 | V | 90.4 | Very high | 88.8 | Confident | 69 Ų | 69 | 33 Ų | 33 | 42% | 0.418 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -64.3 | -43.5 | 178.9 | 172.6 | 0 | 0 | 0 | 0 | 110.8 | V107 V108 N114 K115 | V107-V111 WeakPolarHBondContact O-CG2 3.39Å; V107-V111 PolarHBondContact O-N 2.94Å; V108-V111 PolarHBondContact O-N 3.37Å; V111-N114 PolarHBondContact O-N 3.46Å; V111-K115 HydrophobicContact CG1-CD 4.38Å; V111-K115 PolarHBondContact O-N 2.91Å |
| 112 | A | 88.5 | Confident | 87.7 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.8 | -45.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | E44 V108 S109 N114 K115 G116 H161 F165 | E44-A112 HydrophobicContact CB-CB 3.98Å; E44-A112 HydrophobicContact CG-CB 4.16Å; V108-A112 WeakPolarHBondContact O-CB 3.45Å; V108-A112 PolarHBondContact O-N 3.26Å; S109-A112 PolarHBondContact O-N 3.23Å; A112-N114 VanDerWaalsContact C-N 3.29Å; A112-N114 PolarHBondContact O-N 3.32Å; A112-K115 PolarHBondContact O-N 3.35Å; A112-G116 PolarHBondContact O-N 2.92Å; A112-H161 PolarHBondContact O-CE1 3.49Å; A112-F165 HydrophobicContact CB-CD1 3.82Å; A112-F165 HydrophobicContact CB-CD2 3.85Å; A112-F165 HydrophobicContact CB-CE1 3.6Å; A112-F165 HydrophobicContact CB-CE2 3.66Å; A112-F165 HydrophobicContact CB-CG 3.93Å; A112-F165 HydrophobicContact CB-CZ 3.5Å |
| 113 | I | 90.7 | Very high | 86.2 | Confident | 24 Ų | 24 | 39 Ų | 39 | 12% | 0.123 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -62.8 | -36.2 | 176.1 | -68.5 | 165.2 | 0 | 0 | 0 | 111.4 | S109 C110 Y141 L142 L162 F165 L169 | S109-I113 WeakPolarHBondContact O-CB 3.4Å; S109-I113 WeakPolarHBondContact O-CD1 3.31Å; S109-I113 WeakPolarHBondContact O-CG1 3.43Å; S109-I113 PolarHBondContact O-N 3.35Å; C110-I113 PolarHBondContact O-N 3.33Å; I113-Y141 WeakPolarHBondContact O-CE1 3.36Å; I113-Y141 PolarHBondContact O-OH 3.12Å; I113-L142 HydrophobicContact CG2-CD1 3.96Å; I113-L142 HydrophobicContact CG2-CD2 4.19Å; I113-L162 HydrophobicContact CG1-CD1 4.24Å; I113-L162 HydrophobicContact CG2-CD1 3.83Å; I113-F165 HydrophobicContact CD1-CB 4.01Å; I113-F165 HydrophobicContact CG1-CB 3.72Å; I113-L169 HydrophobicContact CD1-CD1 4.04Å |
| 114 | N | 89.9 | Confident | 84.5 | Confident | 71 Ų | 71 | 42 Ų | 42 | 38% | 0.38 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -73 | -35.9 | 179.1 | -169.7 | 54.2 | 0 | 0 | 0 | 112.7 | C110 V111 A112 N138 G139 | C110-N114 WeakPolarHBondContact O-CB 3.34Å; C110-N114 PolarHBondContact O-N 2.93Å; V111-N114 PolarHBondContact O-N 3.46Å; A112-N114 VanDerWaalsContact C-N 3.29Å; A112-N114 PolarHBondContact O-N 3.32Å; N114-N138 VanDerWaalsContact OD1-C 3.29Å; N114-G139 PolarHBondContact O-N 3.5Å |
| 115 | K | 86.9 | Confident | 82.8 | Confident | 94 Ų | 94 | 43.3 Ų | 43.3 | 41% | 0.409 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -76.6 | -34.2 | 177 | -85.9 | 179.8 | 158.6 | -178.9 | 0 | 113.4 | E44 V111 A112 | E44-K115 WeakPolarHBondContact OE1-CD 3.32Å; E44-K115 WeakPolarHBondContact OE1-CE 3.47Å; E44-K115 IonicContact OE1-NZ 2.69Å; E44-K115 PolarHBondContact OE1-NZ 2.92Å; V111-K115 HydrophobicContact CG1-CD 4.38Å; V111-K115 PolarHBondContact O-N 2.91Å; A112-K115 PolarHBondContact O-N 3.35Å |
| 116 | G | 85.2 | Confident | 81 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | trans | 75.5 | 171.6 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | A112 Y134 | A112-G116 PolarHBondContact O-N 2.92Å; G116-Y134 WeakPolarHBondContact O-CD1 3.23Å; G116-Y134 WeakPolarHBondContact O-CE1 3.05Å | ||
| 117 | P | 86.4 | Confident | 79.2 | Confident | 1 Ų | 1 | 52.6 Ų | 52.6 | 1% | 0.006 | 30% | 0.297 | C | S | . | . | trans | -75.2 | 153.6 | -179.5 | 30.3 | -34.3 | 0 | 0 | 0 | 112.2 | F136 V157 V158 H161 | P117-F136 HydrophobicContact CG-CE2 4.15Å; P117-V157 HydrophobicContact CB-CG2 3.94Å; P117-V157 HydrophobicContact CG-CG1 4.32Å; P117-V157 HydrophobicContact CG-CG2 4.32Å; P117-V158 HydrophobicContact CG-CG2 4.22Å; P117-H161 HydrophobicContact CB-CB 3.85Å; P117-H161 HydrophobicContact CG-CB 4.02Å | ||
| 118 | R | 82 | Confident | 77.3 | Confident | 63 Ų | 63 | 55.5 Ų | 55.5 | 24% | 0.238 | 31% | 0.309 | C | S | . | . | trans | -75.5 | 135 | 165.7 | -155.5 | 173.7 | -179.3 | -169.6 | -6.9 | 110.1 | E39 T42 W132 E133 Y134 | E39-R118 PolarHBondContact O-NH1 3.13Å; T42-R118 PolarHBondContact OG1-N 3.17Å; R118-W132 HydrophobicContact CG-CB 4.38Å; R118-W132 PolarHBondContact NE-O 3.42Å; R118-W132 PolarHBondContact NH2-O 3.32Å; R118-E133 WeakPolarHBondContact CG-O 3.43Å; R118-Y134 HydrophobicContact CB-CD1 4.36Å; R118-Y134 HydrophobicContact CB-CE1 3.9Å; R118-Y134 HydrophobicContact CB-CE2 4.42Å; R118-Y134 HydrophobicContact CG-CD2 4.43Å; R118-Y134 HydrophobicContact CG-CE1 4.47Å; R118-Y134 HydrophobicContact CG-CE2 4.18Å | ||
| 119 | C | 82.5 | Confident | 75.6 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -148 | 162.2 | -179.7 | 70.7 | 0 | 0 | 0 | 0 | 111.9 | E133 C151 V157 | C119-E133 PolarHBondContact N-O 2.76Å; C119-E133 VanDerWaalsContact N-O 3.14Å; C119-E133 PolarHBondContact O-N 3.31Å; C119-C151 HydrophobicContact CB-CB 3.61Å; C119-C151 WeakPolarHBondContact CB-SG 3.49Å; C119-C151 WeakPolarHBondContact SG-CA 3.46Å; C119-C151 WeakPolarHBondContact SG-CB 3.27Å; C119-C151 CovalentContact SG-SG 2.03Å; C119-C151 PolarHBondContact SG-SG 3.35Å; C119-V157 HydrophobicContact CB-CG1 4.1Å |
| 120 | S | 78.6 | Confident | 74 | Confident | 7 Ų | 7 | 65.9 Ų | 65.9 | 5% | 0.049 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 126.2 | 171.9 | -177.4 | 0 | 0 | 0 | 0 | 109.9 | V122 K152 Q153 | S120-V122 PolarHBondContact OG-O 3.49Å; S120-K152 PolarHBondContact O-N 3.41Å; S120-Q153 PolarHBondContact N-O 2.78Å |
| 121 | L | 76.1 | Confident | 72.8 | Confident | 59 Ų | 59 | 68.1 Ų | 68.1 | 31% | 0.309 | 37% | 0.369 | S | S | . | . | trans | -80.5 | -21.4 | 176.1 | -70.7 | 174.2 | 0 | 0 | 0 | 112.8 | P135 E150 | L121-P135 HydrophobicContact CD1-CB 4.49Å; L121-P135 HydrophobicContact CD2-CB 3.74Å; L121-P135 HydrophobicContact CD2-CG 4.27Å; L121-P135 HydrophobicContact CG-CB 4.48Å; L121-E150 HydrophobicContact CD2-CB 4.08Å; L121-E150 WeakPolarHBondContact CD2-O 3.49Å | ||
| 122 | V | 68 | Low | 72 | Confident | 36 Ų | 36 | 66.7 Ų | 66.7 | 22% | 0.218 | 36% | 0.356 | C | S | . | . | S | Bend | trans | -96.8 | 143 | -174.2 | -175.1 | 0 | 0 | 0 | 0 | 111.1 | S120 D126 Q129 | S120-V122 PolarHBondContact OG-O 3.49Å; V122-D126 HydrophobicContact CG1-CB 3.98Å; V122-Q129 WeakPolarHBondContact CB-O 3.36Å; V122-Q129 HydrophobicContact CG2-CB 4.47Å; V122-Q129 WeakPolarHBondContact CG2-O 3.25Å |
| 123 | D | 62.6 | Low | 71.5 | Confident | 92 Ų | 92 | 70.8 Ų | 70.8 | 49% | 0.492 | 38% | 0.375 | S | S | . | . | trans | -64.8 | 149.2 | 179.3 | -113 | -48.8 | 0 | 0 | 0 | 112 | T125 D126 | D123-T125 PolarHBondContact O-N 3.03Å; D123-D126 PolarHBondContact O-N 2.9Å | ||
| 124 | P | 57.7 | Low | 71 | Confident | 84 Ų | 84 | 72.9 Ų | 72.9 | 55% | 0.545 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -13.5 | -177.8 | -16.6 | 28.9 | 0 | 0 | 0 | 114.5 | ||
| 125 | T | 56.2 | Low | 70.5 | Confident | 125 Ų | 125 | 71.4 Ų | 71.4 | 77% | 0.767 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -13.3 | -177.2 | 45.8 | 0 | 0 | 0 | 0 | 113.6 | D123 | D123-T125 PolarHBondContact O-N 3.03Š|
| 126 | D | 54.9 | Low | 70.3 | Confident | 89 Ų | 89 | 67.5 Ų | 67.5 | 48% | 0.476 | 36% | 0.359 | S | S | . | . | trans | -108.5 | 86.5 | 179.3 | -143.3 | -31.1 | 0 | 0 | 0 | 110.6 | V122 D123 N128 | V122-D126 HydrophobicContact CG1-CB 3.98Å; D123-D126 PolarHBondContact O-N 2.9Å; D126-N128 PolarHBondContact O-N 2.87Å; D126-N128 VanDerWaalsContact O-N 3.11Å | ||
| 127 | V | 56.8 | Low | 70 | Confident | 125 Ų | 125 | 73.2 Ų | 73.2 | 76% | 0.758 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -13.4 | -169.7 | -172.9 | 0 | 0 | 0 | 0 | 112.9 | ||
| 128 | N | 54.9 | Low | 69.9 | Low | 151 Ų | 151 | 79 Ų | 79 | 81% | 0.807 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | -5.2 | -173.6 | -79.7 | -29.7 | 0 | 0 | 0 | 115 | D126 | D126-N128 PolarHBondContact O-N 2.87Å; D126-N128 VanDerWaalsContact O-N 3.11Å |
| 129 | Q | 55.8 | Low | 69.9 | Low | 128 Ų | 128 | 76.4 Ų | 76.4 | 60% | 0.598 | 41% | 0.413 | S | S | * | . | trans | -141.6 | 67.2 | -175.5 | -65.8 | -171.6 | -12.1 | 0 | 0 | 113 | V122 Q131 | V122-Q129 WeakPolarHBondContact CB-O 3.36Å; V122-Q129 HydrophobicContact CG2-CB 4.47Å; V122-Q129 WeakPolarHBondContact CG2-O 3.25Å; Q129-Q131 PolarHBondContact O-N 3.2Å | ||
| 130 | T | 58.8 | Low | 70 | Confident | 105 Ų | 105 | 78.8 Ų | 78.8 | 64% | 0.644 | 43% | 0.426 | S | S | * | . | trans | -83.7 | 85.1 | 168.1 | 34.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 131 | Q | 66.6 | Low | 70.4 | Confident | 108 Ų | 108 | 78.5 Ų | 78.5 | 51% | 0.505 | 42% | 0.424 | S | S | . | . | trans | -95 | 111.3 | 174.2 | -155.1 | 175 | -19.1 | 0 | 0 | 110.1 | Q129 E133 | Q129-Q131 PolarHBondContact O-N 3.2Å; Q131-E133 HydrophobicContact CG-CG 3.79Å; Q131-E133 PolarHBondContact NE2-OE1 3.47Å | ||
| 132 | W | 73.1 | Confident | 71 | Confident | 39 Ų | 39 | 79.1 Ų | 79.1 | 15% | 0.148 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 106.4 | 175.7 | -73.1 | 83.9 | 0 | 0 | 0 | 110.1 | V36 N40 R118 | V36-W132 HydrophobicContact CG1-CH2 3.81Å; V36-W132 HydrophobicContact CG1-CZ2 3.99Å; N40-W132 HydrophobicContact CB-CD2 3.69Å; N40-W132 HydrophobicContact CB-CE3 3.85Å; N40-W132 HydrophobicContact CB-CG 4.2Å; N40-W132 HydrophobicContact CB-CH2 4.15Å; N40-W132 HydrophobicContact CB-CZ2 4Å; N40-W132 HydrophobicContact CB-CZ3 4.08Å; N40-W132 VanDerWaalsContact CG-CE2 3.43Å; N40-W132 PolarHBondContact ND2-NE1 2.9Å; N40-W132 VanDerWaalsContact OD1-CG 3.3Å; N40-W132 PolarHBondContact OD1-NE1 3.48Å; R118-W132 HydrophobicContact CG-CB 4.38Å; R118-W132 PolarHBondContact NE-O 3.42Å; R118-W132 PolarHBondContact NH2-O 3.32Å |
| 133 | E | 78.9 | Confident | 71.8 | Confident | 86 Ų | 86 | 85.3 Ų | 85.3 | 40% | 0.402 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 172.1 | -177.7 | -55.5 | -157.6 | 136.4 | 0 | 0 | 111.8 | R118 C119 Q131 P135 | R118-E133 WeakPolarHBondContact CG-O 3.43Å; C119-E133 PolarHBondContact N-O 2.76Å; C119-E133 VanDerWaalsContact N-O 3.14Å; C119-E133 PolarHBondContact O-N 3.31Å; Q131-E133 HydrophobicContact CG-CG 3.79Å; Q131-E133 PolarHBondContact NE2-OE1 3.47Å; E133-P135 VanDerWaalsContact O-CD 3.23Å; E133-P135 WeakPolarHBondContact O-CD 3.42Å |
| 134 | Y | 80 | Confident | 73 | Confident | 68 Ų | 68 | 85 Ų | 85 | 27% | 0.267 | 45% | 0.452 | S | S | . | . | trans | -94.8 | 98.9 | 166.2 | -67.9 | -85 | 0 | 0 | 0 | 107.2 | T42 D43 E44 G116 R118 F136 | T42-Y134 HydrophobicContact CG2-CE1 4.16Å; D43-Y134 PolarHBondContact N-OH 3.27Å; D43-Y134 PolarHBondContact OD2-OH 3.04Å; E44-Y134 PolarHBondContact OE2-OH 3.44Å; G116-Y134 WeakPolarHBondContact O-CD1 3.23Å; G116-Y134 WeakPolarHBondContact O-CE1 3.05Å; R118-Y134 HydrophobicContact CB-CD1 4.36Å; R118-Y134 HydrophobicContact CB-CE1 3.9Å; R118-Y134 HydrophobicContact CB-CE2 4.42Å; R118-Y134 HydrophobicContact CG-CD2 4.43Å; R118-Y134 HydrophobicContact CG-CE1 4.47Å; R118-Y134 HydrophobicContact CG-CE2 4.18Å; Y134-F136 PolarHBondContact O-N 2.98Å | ||
| 135 | P | 78.8 | Confident | 74.2 | Confident | 39 Ų | 39 | 86.9 Ų | 86.9 | 25% | 0.253 | 45% | 0.453 | S | S | . | . | trans | -77.7 | -11.9 | -176.4 | 34 | -38.8 | 0 | 0 | 0 | 112.9 | L121 E133 | L121-P135 HydrophobicContact CD1-CB 4.49Å; L121-P135 HydrophobicContact CD2-CB 3.74Å; L121-P135 HydrophobicContact CD2-CG 4.27Å; L121-P135 HydrophobicContact CG-CB 4.48Å; E133-P135 VanDerWaalsContact O-CD 3.23Å; E133-P135 WeakPolarHBondContact O-CD 3.42Å | ||
| 136 | F | 83.6 | Confident | 75.6 | Confident | 13 Ų | 13 | 86.1 Ų | 86.1 | 6% | 0.057 | 45% | 0.449 | C | S | . | . | trans | -94 | 138.3 | -175.4 | -52.8 | -55.3 | 0 | 0 | 0 | 111.2 | P117 Y134 Y141 L147 C151 V158 | P117-F136 HydrophobicContact CG-CE2 4.15Å; Y134-F136 PolarHBondContact O-N 2.98Å; F136-Y141 HydrophobicContact CB-CD1 3.68Å; F136-Y141 HydrophobicContact CB-CE1 4.32Å; F136-Y141 HydrophobicContact CB-CG 4.37Å; F136-Y141 HydrophobicContact CD1-CD1 4.1Å; F136-Y141 AromaticContact CD1-CG 3.92Å; F136-Y141 HydrophobicContact CD1-CG 3.92Å; F136-Y141 HydrophobicContact CD2-CD1 4.09Å; F136-Y141 HydrophobicContact CD2-CE1 4.46Å; F136-Y141 HydrophobicContact CD2-CG 4.27Å; F136-Y141 HydrophobicContact CE1-CG 4.25Å; F136-Y141 AromaticContact CG-CD1 3.66Å; F136-Y141 HydrophobicContact CG-CD1 3.66Å; F136-Y141 HydrophobicContact CG-CE1 4.4Å; F136-Y141 AromaticContact CG-CG 3.9Å; F136-Y141 HydrophobicContact CG-CG 3.9Å; F136-L147 HydrophobicContact CD1-CB 4.43Å; F136-L147 HydrophobicContact CE1-CB 4.07Å; F136-L147 WeakPolarHBondContact CE1-O 3.44Å; F136-C151 VanDerWaalsContact CZ-SG 3.55Å; F136-V158 HydrophobicContact CE2-CG2 3.95Å; F136-V158 HydrophobicContact CZ-CG2 3.69Å | ||
| 137 | N | 78.9 | Confident | 76.9 | Confident | 119 Ų | 119 | 83.7 Ų | 83.7 | 64% | 0.636 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -118.4 | 114.3 | -180 | -168.5 | 22.9 | 0 | 0 | 0 | 110.1 | G139 D140 | N137-G139 VanDerWaalsContact C-N 3.33Å; N137-G139 PolarHBondContact O-N 3.35Å; N137-D140 PolarHBondContact N-OD1 3.44Å; N137-D140 VanDerWaalsContact N-OD1 3.12Å; N137-D140 PolarHBondContact N-OD2 3.41Å; N137-D140 WeakPolarHBondContact O-CB 3.44Å; N137-D140 VanDerWaalsContact O-CG 3.31Å; N137-D140 PolarHBondContact O-N 3.46Å |
| 138 | N | 82.3 | Confident | 78.3 | Confident | 123 Ų | 123 | 81.2 Ų | 81.2 | 66% | 0.658 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.2 | 46.3 | 177.6 | -75.4 | -23.3 | 0 | 0 | 0 | 114.5 | N114 D140 | N114-N138 VanDerWaalsContact OD1-C 3.29Å; N138-D140 VanDerWaalsContact C-N 3.28Å; N138-D140 PolarHBondContact O-N 2.93Å |
| 139 | G | 82 | Confident | 79.5 | Confident | 9 Ų | 9 | 77.5 Ų | 77.5 | 9% | 0.093 | 40% | 0.398 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 70.5 | 16.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | N114 N137 Y141 L142 | N114-G139 PolarHBondContact O-N 3.5Å; N137-G139 VanDerWaalsContact C-N 3.33Å; N137-G139 PolarHBondContact O-N 3.35Å; G139-Y141 PolarHBondContact O-N 3.16Å; G139-Y141 VanDerWaalsContact O-N 3.15Å; G139-L142 VanDerWaalsContact O-CB 3.26Å; G139-L142 WeakPolarHBondContact O-CB 3.4Å; G139-L142 WeakPolarHBondContact O-CG 3.28Å; G139-L142 PolarHBondContact O-N 3.1Å |
| 140 | D | 86.4 | Confident | 80.7 | Confident | 50 Ų | 50 | 76.2 Ų | 76.2 | 27% | 0.267 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -50.4 | -34.9 | 173.7 | 58.8 | -10.2 | 0 | 0 | 0 | 113.7 | N137 N138 L142 Q143 N144 L147 | N137-D140 PolarHBondContact N-OD1 3.44Å; N137-D140 VanDerWaalsContact N-OD1 3.12Å; N137-D140 PolarHBondContact N-OD2 3.41Å; N137-D140 WeakPolarHBondContact O-CB 3.44Å; N137-D140 VanDerWaalsContact O-CG 3.31Å; N137-D140 PolarHBondContact O-N 3.46Å; N138-D140 VanDerWaalsContact C-N 3.28Å; N138-D140 PolarHBondContact O-N 2.93Å; D140-L142 PolarHBondContact O-N 2.94Å; D140-Q143 PolarHBondContact O-N 3.26Å; D140-N144 PolarHBondContact O-N 2.98Å; D140-L147 HydrophobicContact CB-CD1 3.99Å |
| 141 | Y | 86.4 | Confident | 81.8 | Confident | 0 Ų | 0 | 71.9 Ų | 71.9 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.1 | -17.8 | 176.2 | 80.8 | -86.3 | 0 | 0 | 0 | 114.7 | I113 F136 G139 W148 V158 | I113-Y141 WeakPolarHBondContact O-CE1 3.36Å; I113-Y141 PolarHBondContact O-OH 3.12Å; F136-Y141 HydrophobicContact CB-CD1 3.68Å; F136-Y141 HydrophobicContact CB-CE1 4.32Å; F136-Y141 HydrophobicContact CB-CG 4.37Å; F136-Y141 HydrophobicContact CD1-CD1 4.1Å; F136-Y141 AromaticContact CD1-CG 3.92Å; F136-Y141 HydrophobicContact CD1-CG 3.92Å; F136-Y141 HydrophobicContact CD2-CD1 4.09Å; F136-Y141 HydrophobicContact CD2-CE1 4.46Å; F136-Y141 HydrophobicContact CD2-CG 4.27Å; F136-Y141 HydrophobicContact CE1-CG 4.25Å; F136-Y141 AromaticContact CG-CD1 3.66Å; F136-Y141 HydrophobicContact CG-CD1 3.66Å; F136-Y141 HydrophobicContact CG-CE1 4.4Å; F136-Y141 AromaticContact CG-CG 3.9Å; F136-Y141 HydrophobicContact CG-CG 3.9Å; G139-Y141 PolarHBondContact O-N 3.16Å; G139-Y141 VanDerWaalsContact O-N 3.15Å; Y141-W148 AromaticContact CD2-NE1 3.78Å; Y141-W148 PolarHBondContact O-NE1 3.27Å; Y141-V158 HydrophobicContact CD2-CG1 3.6Å; Y141-V158 HydrophobicContact CE2-CG1 3.75Å |
| 142 | L | 87.6 | Confident | 82.4 | Confident | 72 Ų | 72 | 71.3 Ų | 71.3 | 38% | 0.377 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -74.1 | -31.4 | 175.7 | -59.3 | 174.6 | 0 | 0 | 0 | 111.6 | I113 G139 D140 L162 | I113-L142 HydrophobicContact CG2-CD1 3.96Å; I113-L142 HydrophobicContact CG2-CD2 4.19Å; G139-L142 VanDerWaalsContact O-CB 3.26Å; G139-L142 WeakPolarHBondContact O-CB 3.4Å; G139-L142 WeakPolarHBondContact O-CG 3.28Å; G139-L142 PolarHBondContact O-N 3.1Å; D140-L142 PolarHBondContact O-N 2.94Å; L142-L162 HydrophobicContact CD2-CD1 3.54Å; L142-L162 HydrophobicContact CD2-CD2 3.92Å; L142-L162 HydrophobicContact CD2-CG 4.39Å |
| 143 | Q | 86.4 | Confident | 82.4 | Confident | 166 Ų | 166 | 73.2 Ų | 73.2 | 78% | 0.776 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -93 | -39.3 | 178.5 | -170.7 | 174.3 | 4.3 | 0 | 0 | 111.5 | D140 | D140-Q143 PolarHBondContact O-N 3.26Å |
| 144 | N | 86 | Confident | 82.1 | Confident | 87 Ų | 87 | 69.3 Ų | 69.3 | 47% | 0.465 | 35% | 0.354 | S | S | . | . | trans | -107.1 | 92.5 | -177.9 | -75.6 | -31.4 | 0 | 0 | 0 | 111.4 | D140 T146 L147 | D140-N144 PolarHBondContact O-N 2.98Å; N144-T146 PolarHBondContact O-N 3.02Å; N144-T146 VanDerWaalsContact O-N 3.11Å; N144-L147 HydrophobicContact CB-CD1 3.76Å; N144-L147 HydrophobicContact CB-CG 4.18Å; N144-L147 WeakPolarHBondContact O-CB 3.41Å; N144-L147 PolarHBondContact O-N 3.15Å; N144-L147 VanDerWaalsContact O-N 3.13Å | ||
| 145 | H | 84.7 | Confident | 82 | Confident | 123 Ų | 123 | 70.4 Ų | 70.4 | 57% | 0.569 | 37% | 0.368 | S | S | * | . | G | 310 helix | trans | -63 | -16.2 | 177.1 | -65.5 | -67.9 | 0 | 0 | 0 | 114.2 | L147 W148 | H145-L147 VanDerWaalsContact C-N 3.25Å; H145-L147 PolarHBondContact O-N 3.37Å; H145-W148 AromaticContact CE1-CZ2 3.76Å; H145-W148 AromaticContact ND1-CE2 3.44Å; H145-W148 AromaticContact ND1-CH2 3.88Å; H145-W148 AromaticContact ND1-CZ2 3.29Å; H145-W148 VanDerWaalsContact ND1-CZ2 3.29Å; H145-W148 WeakPolarHBondContact ND1-CZ2 3.44Å; H145-W148 AromaticContact ND1-NE1 3.74Å; H145-W148 WeakPolarHBondContact O-CB 3.32Å; H145-W148 PolarHBondContact O-N 2.94Å |
| 146 | T | 84.6 | Confident | 82 | Confident | 108 Ų | 108 | 74.7 Ų | 74.7 | 66% | 0.663 | 39% | 0.389 | S | S | * | . | G | 310 helix | trans | -63.6 | -32.1 | 174.4 | 50.2 | 0 | 0 | 0 | 0 | 112.2 | N144 W148 S149 | N144-T146 PolarHBondContact O-N 3.02Å; N144-T146 VanDerWaalsContact O-N 3.11Å; T146-W148 PolarHBondContact O-N 2.94Å; T146-S149 WeakPolarHBondContact O-CB 3.32Å; T146-S149 PolarHBondContact O-N 3.27Å; T146-S149 VanDerWaalsContact O-N 3.15Å; T146-S149 PolarHBondContact O-OG 3.34Å |
| 147 | L | 83.2 | Confident | 82.2 | Confident | 39 Ų | 39 | 74.2 Ų | 74.2 | 20% | 0.204 | 39% | 0.387 | C | S | . | . | G | 310 helix | trans | -64.3 | -18.8 | 177.5 | -69.4 | 164.7 | 0 | 0 | 0 | 112.6 | F136 D140 N144 H145 S149 E150 | F136-L147 HydrophobicContact CD1-CB 4.43Å; F136-L147 HydrophobicContact CE1-CB 4.07Å; F136-L147 WeakPolarHBondContact CE1-O 3.44Å; D140-L147 HydrophobicContact CB-CD1 3.99Å; N144-L147 HydrophobicContact CB-CD1 3.76Å; N144-L147 HydrophobicContact CB-CG 4.18Å; N144-L147 WeakPolarHBondContact O-CB 3.41Å; N144-L147 PolarHBondContact O-N 3.15Å; N144-L147 VanDerWaalsContact O-N 3.13Å; H145-L147 VanDerWaalsContact C-N 3.25Å; H145-L147 PolarHBondContact O-N 3.37Å; L147-S149 PolarHBondContact O-N 2.94Å; L147-S149 VanDerWaalsContact O-N 3.15Å; L147-E150 HydrophobicContact CD2-CG 4.43Å; L147-E150 VanDerWaalsContact O-CB 3.29Å; L147-E150 WeakPolarHBondContact O-CB 3.47Å; L147-E150 WeakPolarHBondContact O-CG 3.38Å; L147-E150 PolarHBondContact O-N 3.42Å; L147-E150 VanDerWaalsContact O-N 3.12Å |
| 148 | W | 85.4 | Confident | 82.5 | Confident | 73 Ų | 73 | 68.8 Ų | 68.8 | 28% | 0.277 | 36% | 0.358 | S | S | . | . | G | 310 helix | trans | -64.9 | -21 | 177.8 | -63.6 | 20.8 | 0 | 0 | 0 | 111.7 | Y141 H145 T146 E150 V158 L162 | Y141-W148 AromaticContact CD2-NE1 3.78Å; Y141-W148 PolarHBondContact O-NE1 3.27Å; H145-W148 AromaticContact CE1-CZ2 3.76Å; H145-W148 AromaticContact ND1-CE2 3.44Å; H145-W148 AromaticContact ND1-CH2 3.88Å; H145-W148 AromaticContact ND1-CZ2 3.29Å; H145-W148 VanDerWaalsContact ND1-CZ2 3.29Å; H145-W148 WeakPolarHBondContact ND1-CZ2 3.44Å; H145-W148 AromaticContact ND1-NE1 3.74Å; H145-W148 WeakPolarHBondContact O-CB 3.32Å; H145-W148 PolarHBondContact O-N 2.94Å; T146-W148 PolarHBondContact O-N 2.94Å; W148-E150 VanDerWaalsContact C-N 3.32Å; W148-V158 HydrophobicContact CB-CG2 4.49Å; W148-V158 HydrophobicContact CD2-CB 4.16Å; W148-V158 HydrophobicContact CD2-CG1 3.73Å; W148-V158 HydrophobicContact CE3-CB 4.42Å; W148-V158 HydrophobicContact CE3-CG1 4.32Å; W148-V158 HydrophobicContact CG-CB 4.26Å; W148-V158 HydrophobicContact CG-CG1 3.88Å; W148-V158 HydrophobicContact CZ2-CG1 4.18Å; W148-L162 HydrophobicContact CH2-CD2 4.48Å; W148-L162 HydrophobicContact CZ2-CD2 4.16Å |
| 149 | S | 80.9 | Confident | 82.8 | Confident | 72 Ų | 72 | 65.8 Ų | 65.8 | 50% | 0.503 | 35% | 0.347 | S | S | . | . | G | 310 helix | trans | -78.7 | -11.4 | 178.1 | 70.7 | 0 | 0 | 0 | 0 | 114.6 | T146 L147 C151 K152 | T146-S149 WeakPolarHBondContact O-CB 3.32Å; T146-S149 PolarHBondContact O-N 3.27Å; T146-S149 VanDerWaalsContact O-N 3.15Å; T146-S149 PolarHBondContact O-OG 3.34Å; L147-S149 PolarHBondContact O-N 2.94Å; L147-S149 VanDerWaalsContact O-N 3.15Å; S149-C151 VanDerWaalsContact C-N 3.35Å; S149-K152 PolarHBondContact O-NZ 3.4Å |
| 150 | E | 80.3 | Confident | 83.1 | Confident | 102 Ų | 102 | 69.7 Ų | 69.7 | 48% | 0.477 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -36 | 171.9 | -64.4 | -68.2 | 157.2 | 0 | 0 | 110.8 | L121 L147 W148 K152 | L121-E150 HydrophobicContact CD2-CB 4.08Å; L121-E150 WeakPolarHBondContact CD2-O 3.49Å; L147-E150 HydrophobicContact CD2-CG 4.43Å; L147-E150 VanDerWaalsContact O-CB 3.29Å; L147-E150 WeakPolarHBondContact O-CB 3.47Å; L147-E150 WeakPolarHBondContact O-CG 3.38Å; L147-E150 PolarHBondContact O-N 3.42Å; L147-E150 VanDerWaalsContact O-N 3.12Å; W148-E150 VanDerWaalsContact C-N 3.32Å; E150-K152 PolarHBondContact O-N 3.38Å |
| 151 | C | 81.1 | Confident | 83.3 | Confident | 13 Ų | 13 | 67.6 Ų | 67.6 | 9% | 0.088 | 35% | 0.348 | C | S | . | . | trans | -79.4 | 100.6 | 173.6 | -72.4 | 0 | 0 | 0 | 0 | 111.1 | C119 F136 S149 V157 V158 | C119-C151 HydrophobicContact CB-CB 3.61Å; C119-C151 WeakPolarHBondContact CB-SG 3.49Å; C119-C151 WeakPolarHBondContact SG-CA 3.46Å; C119-C151 WeakPolarHBondContact SG-CB 3.27Å; C119-C151 CovalentContact SG-SG 2.03Å; C119-C151 PolarHBondContact SG-SG 3.35Å; F136-C151 VanDerWaalsContact CZ-SG 3.55Å; S149-C151 VanDerWaalsContact C-N 3.35Å; C151-V157 HydrophobicContact CB-CG1 4.09Å; C151-V158 HydrophobicContact CB-CG2 4.25Å | ||
| 152 | K | 78.8 | Confident | 83.5 | Confident | 97 Ų | 97 | 69.5 Ų | 69.5 | 42% | 0.422 | 36% | 0.358 | S | S | . | . | trans | -78.4 | -41.4 | 176.8 | -61.8 | -53.9 | -173.3 | -157.1 | 0 | 112.7 | S120 S149 E150 | S120-K152 PolarHBondContact O-N 3.41Å; S149-K152 PolarHBondContact O-NZ 3.4Å; E150-K152 PolarHBondContact O-N 3.38Å | ||
| 153 | Q | 73.9 | Confident | 83.8 | Confident | 79 Ų | 79 | 67.8 Ų | 67.8 | 37% | 0.369 | 36% | 0.357 | S | S | . | . | B | Isolated β-bridge | trans | -138.9 | 134.8 | -176.4 | -168 | 149.4 | -16.2 | 0 | 0 | 111.5 | S120 | S120-Q153 PolarHBondContact N-O 2.78Å |
| 154 | P | 73.6 | Confident | 84 | Confident | 3 Ų | 3 | 60.8 Ų | 60.8 | 2% | 0.019 | 33% | 0.325 | C | S | . | . | S | Bend | cis | -73.1 | 149 | -5 | 18 | -13.4 | 0 | 0 | 0 | 114.7 | P31 N156 V157 | P31-P154 HydrophobicContact CB-CG 3.98Å; P31-P154 HydrophobicContact CG-CG 4.38Å; P31-P154 WeakPolarHBondContact O-CG 3.38Å; P154-N156 PolarHBondContact O-N 2.96Å; P154-V157 HydrophobicContact CB-CB 4.48Å; P154-V157 HydrophobicContact CG-CB 3.87Å; P154-V157 HydrophobicContact CG-CG2 3.89Å; P154-V157 VanDerWaalsContact O-CB 3.3Å; P154-V157 WeakPolarHBondContact O-CB 3.31Å; P154-V157 WeakPolarHBondContact O-CG1 3.06Å; P154-V157 PolarHBondContact O-N 3.33Å |
| 155 | T | 76.7 | Confident | 84.3 | Confident | 92 Ų | 92 | 56.8 Ų | 56.8 | 56% | 0.564 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | 133 | -179.9 | -40.3 | 0 | 0 | 0 | 0 | 110.6 | V157 | T155-V157 PolarHBondContact O-N 3.12Š|
| 156 | N | 80.1 | Confident | 84.7 | Confident | 128 Ų | 128 | 53.9 Ų | 53.9 | 68% | 0.684 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.2 | 22.6 | -178.5 | -60.9 | -35.7 | 0 | 0 | 0 | 115.4 | P154 V158 S159 W160 | P154-N156 PolarHBondContact O-N 2.96Å; N156-V158 VanDerWaalsContact C-N 3.26Å; N156-V158 PolarHBondContact O-N 2.66Å; N156-S159 PolarHBondContact O-N 2.97Å; N156-W160 PolarHBondContact O-N 3.07Å; N156-W160 VanDerWaalsContact O-N 3.08Å |
| 157 | V | 85.8 | Confident | 85.2 | Confident | 4 Ų | 4 | 51.6 Ų | 51.6 | 2% | 0.024 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.6 | -37.1 | 178.5 | 67.5 | 0 | 0 | 0 | 0 | 112.9 | P31 P117 C119 C151 P154 T155 W160 H161 | P31-V157 HydrophobicContact CB-CG2 3.97Å; P117-V157 HydrophobicContact CB-CG2 3.94Å; P117-V157 HydrophobicContact CG-CG1 4.32Å; P117-V157 HydrophobicContact CG-CG2 4.32Å; C119-V157 HydrophobicContact CB-CG1 4.1Å; C151-V157 HydrophobicContact CB-CG1 4.09Å; P154-V157 HydrophobicContact CB-CB 4.48Å; P154-V157 HydrophobicContact CG-CB 3.87Å; P154-V157 HydrophobicContact CG-CG2 3.89Å; P154-V157 VanDerWaalsContact O-CB 3.3Å; P154-V157 WeakPolarHBondContact O-CB 3.31Å; P154-V157 WeakPolarHBondContact O-CG1 3.06Å; P154-V157 PolarHBondContact O-N 3.33Å; T155-V157 PolarHBondContact O-N 3.12Å; V157-W160 PolarHBondContact O-N 3.12Å; V157-H161 VanDerWaalsContact O-CB 3.22Å; V157-H161 WeakPolarHBondContact O-CB 3.08Å; V157-H161 PolarHBondContact O-N 2.72Å |
| 158 | V | 86.8 | Confident | 85.7 | Confident | 4 Ų | 4 | 49.9 Ų | 49.9 | 2% | 0.024 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62 | -50.2 | -179.7 | -175.8 | 0 | 0 | 0 | 0 | 111.3 | P117 F136 Y141 W148 C151 N156 H161 L162 | P117-V158 HydrophobicContact CG-CG2 4.22Å; F136-V158 HydrophobicContact CE2-CG2 3.95Å; F136-V158 HydrophobicContact CZ-CG2 3.69Å; Y141-V158 HydrophobicContact CD2-CG1 3.6Å; Y141-V158 HydrophobicContact CE2-CG1 3.75Å; W148-V158 HydrophobicContact CB-CG2 4.49Å; W148-V158 HydrophobicContact CD2-CB 4.16Å; W148-V158 HydrophobicContact CD2-CG1 3.73Å; W148-V158 HydrophobicContact CE3-CB 4.42Å; W148-V158 HydrophobicContact CE3-CG1 4.32Å; W148-V158 HydrophobicContact CG-CB 4.26Å; W148-V158 HydrophobicContact CG-CG1 3.88Å; W148-V158 HydrophobicContact CZ2-CG1 4.18Å; C151-V158 HydrophobicContact CB-CG2 4.25Å; N156-V158 VanDerWaalsContact C-N 3.26Å; N156-V158 PolarHBondContact O-N 2.66Å; V158-H161 PolarHBondContact O-N 3.18Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 3.36Å |
| 159 | S | 88.1 | Confident | 86.1 | Confident | 61 Ų | 61 | 48.4 Ų | 48.4 | 43% | 0.427 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64.4 | -41.3 | 178.2 | -175.2 | 0 | 0 | 0 | 0 | 111.8 | N156 G163 | N156-S159 PolarHBondContact O-N 2.97Å; S159-G163 PolarHBondContact O-N 3.19Å |
| 160 | W | 89.1 | Confident | 86.8 | Confident | 90 Ų | 90 | 47 Ų | 47 | 34% | 0.341 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.8 | -51.2 | 177 | -172.4 | -97.4 | 0 | 0 | 0 | 112.2 | L27 F30 N156 V157 L164 | L27-W160 HydrophobicContact CB-CZ2 4.01Å; L27-W160 HydrophobicContact CD2-CZ2 4.15Å; L27-W160 HydrophobicContact CG-CZ2 4.49Å; L27-W160 PolarHBondContact O-NE1 3.46Å; F30-W160 PolarHBondContact O-NE1 2.9Å; F30-W160 VanDerWaalsContact O-NE1 3.09Å; N156-W160 PolarHBondContact O-N 3.07Å; N156-W160 VanDerWaalsContact O-N 3.08Å; V157-W160 PolarHBondContact O-N 3.12Å; W160-L164 HydrophobicContact CD2-CD1 4.17Å; W160-L164 HydrophobicContact CG-CD1 4.2Å; W160-L164 HydrophobicContact CZ2-CD1 4.15Å; W160-L164 VanDerWaalsContact NE1-CD1 3.26Å; W160-L164 WeakPolarHBondContact O-CB 3.29Å; W160-L164 WeakPolarHBondContact O-CG 3.25Å; W160-L164 PolarHBondContact O-N 3.25Å |
| 161 | H | 90.1 | Very high | 87.5 | Confident | 7 Ų | 7 | 43.9 Ų | 43.9 | 3% | 0.032 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.5 | -51.6 | 179.4 | -177.9 | -86.9 | 0 | 0 | 0 | 111.5 | A112 P117 V157 V158 G163 L164 F165 | A112-H161 PolarHBondContact O-CE1 3.49Å; P117-H161 HydrophobicContact CB-CB 3.85Å; P117-H161 HydrophobicContact CG-CB 4.02Å; V157-H161 VanDerWaalsContact O-CB 3.22Å; V157-H161 WeakPolarHBondContact O-CB 3.08Å; V157-H161 PolarHBondContact O-N 2.72Å; V158-H161 PolarHBondContact O-N 3.18Å; H161-G163 VanDerWaalsContact C-N 3.34Å; H161-G163 PolarHBondContact O-N 3.29Å; H161-L164 PolarHBondContact O-N 2.98Å; H161-F165 AromaticContact CD2-CD2 3.78Å; H161-F165 AromaticContact CD2-CE2 3.54Å; H161-F165 AromaticContact CE1-CD2 3.47Å; H161-F165 VanDerWaalsContact CE1-CD2 3.47Å; H161-F165 WeakPolarHBondContact CE1-CD2 3.49Å; H161-F165 AromaticContact CE1-CE2 3.61Å; H161-F165 AromaticContact CG-CD2 3.91Å; H161-F165 AromaticContact ND1-CD2 3.72Å; H161-F165 AromaticContact NE2-CD2 3.52Å; H161-F165 AromaticContact NE2-CE2 3.17Å; H161-F165 WeakPolarHBondContact NE2-CE2 3.5Å; H161-F165 WeakPolarHBondContact O-CB 3.32Å; H161-F165 WeakPolarHBondContact O-CD2 3.08Å; H161-F165 PolarHBondContact O-N 3.18Å |
| 162 | L | 91 | Very high | 88.1 | Confident | 39 Ų | 39 | 43.2 Ų | 43.2 | 20% | 0.204 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.6 | -43.9 | 179.3 | -177.5 | 62 | 0 | 0 | 0 | 111.5 | I113 L142 W148 V158 S166 | I113-L162 HydrophobicContact CG1-CD1 4.24Å; I113-L162 HydrophobicContact CG2-CD1 3.83Å; L142-L162 HydrophobicContact CD2-CD1 3.54Å; L142-L162 HydrophobicContact CD2-CD2 3.92Å; L142-L162 HydrophobicContact CD2-CG 4.39Å; W148-L162 HydrophobicContact CH2-CD2 4.48Å; W148-L162 HydrophobicContact CZ2-CD2 4.16Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 3.36Å; L162-S166 WeakPolarHBondContact O-CB 3.34Å; L162-S166 PolarHBondContact O-N 3.39Å |
| 163 | G | 92.4 | Very high | 88.9 | Confident | 36 Ų | 36 | 42.6 Ų | 42.6 | 37% | 0.371 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.7 | -50 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | S159 H161 S166 V167 | S159-G163 PolarHBondContact O-N 3.19Å; H161-G163 VanDerWaalsContact C-N 3.34Å; H161-G163 PolarHBondContact O-N 3.29Å; G163-S166 PolarHBondContact O-N 3.4Å; G163-V167 WeakPolarHBondContact O-CG2 3.36Å; G163-V167 PolarHBondContact O-N 3.08Å |
| 164 | L | 91.8 | Very high | 89.9 | Confident | 20 Ų | 20 | 42.7 Ų | 42.7 | 11% | 0.105 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -66.4 | -44.4 | -178.4 | -70.1 | 174 | 0 | 0 | 0 | 112.4 | C24 L27 L28 W160 H161 S166 V167 L168 | C24-L164 HydrophobicContact CB-CD2 4.08Å; L27-L164 HydrophobicContact CB-CD1 3.79Å; L27-L164 HydrophobicContact CB-CD2 4.22Å; L27-L164 HydrophobicContact CD1-CD2 4.21Å; L28-L164 HydrophobicContact CD1-CB 4.35Å; L28-L164 HydrophobicContact CD2-CB 3.76Å; L28-L164 HydrophobicContact CD2-CD1 3.86Å; L28-L164 HydrophobicContact CD2-CG 4.47Å; L28-L164 HydrophobicContact CG-CB 3.86Å; L28-L164 HydrophobicContact CG-CD1 3.86Å; W160-L164 HydrophobicContact CD2-CD1 4.17Å; W160-L164 HydrophobicContact CG-CD1 4.2Å; W160-L164 HydrophobicContact CZ2-CD1 4.15Å; W160-L164 VanDerWaalsContact NE1-CD1 3.26Å; W160-L164 WeakPolarHBondContact O-CB 3.29Å; W160-L164 WeakPolarHBondContact O-CG 3.25Å; W160-L164 PolarHBondContact O-N 3.25Å; H161-L164 PolarHBondContact O-N 2.98Å; L164-S166 VanDerWaalsContact C-N 3.34Å; L164-V167 PolarHBondContact O-N 3.04Å; L164-L168 WeakPolarHBondContact O-CG 3.42Å; L164-L168 PolarHBondContact O-N 3.43Å |
| 165 | F | 92.4 | Very high | 90.9 | Very high | 3 Ų | 3 | 42.6 Ų | 42.6 | 1% | 0.013 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -68.2 | -32.8 | 175.7 | -81.7 | -67 | 0 | 0 | 0 | 112.7 | L28 A112 I113 H161 L168 L169 | L28-F165 HydrophobicContact CD1-CD1 4.02Å; L28-F165 HydrophobicContact CD1-CD2 4.04Å; L28-F165 HydrophobicContact CD1-CE1 3.69Å; L28-F165 HydrophobicContact CD1-CE2 3.67Å; L28-F165 HydrophobicContact CD1-CG 4.2Å; L28-F165 HydrophobicContact CD1-CZ 3.51Å; L28-F165 HydrophobicContact CD2-CD2 3.75Å; L28-F165 HydrophobicContact CD2-CE2 3.51Å; L28-F165 HydrophobicContact CD2-CZ 4.19Å; L28-F165 HydrophobicContact CG-CE2 4.23Å; L28-F165 HydrophobicContact CG-CZ 4.46Å; A112-F165 HydrophobicContact CB-CD1 3.82Å; A112-F165 HydrophobicContact CB-CD2 3.85Å; A112-F165 HydrophobicContact CB-CE1 3.6Å; A112-F165 HydrophobicContact CB-CE2 3.66Å; A112-F165 HydrophobicContact CB-CG 3.93Å; A112-F165 HydrophobicContact CB-CZ 3.5Å; I113-F165 HydrophobicContact CD1-CB 4.01Å; I113-F165 HydrophobicContact CG1-CB 3.72Å; H161-F165 AromaticContact CD2-CD2 3.78Å; H161-F165 AromaticContact CD2-CE2 3.54Å; H161-F165 AromaticContact CE1-CD2 3.47Å; H161-F165 VanDerWaalsContact CE1-CD2 3.47Å; H161-F165 WeakPolarHBondContact CE1-CD2 3.49Å; H161-F165 AromaticContact CE1-CE2 3.61Å; H161-F165 AromaticContact CG-CD2 3.91Å; H161-F165 AromaticContact ND1-CD2 3.72Å; H161-F165 AromaticContact NE2-CD2 3.52Å; H161-F165 AromaticContact NE2-CE2 3.17Å; H161-F165 WeakPolarHBondContact NE2-CE2 3.5Å; H161-F165 WeakPolarHBondContact O-CB 3.32Å; H161-F165 WeakPolarHBondContact O-CD2 3.08Å; H161-F165 PolarHBondContact O-N 3.18Å; F165-L168 HydrophobicContact CD1-CD1 4.01Å; F165-L168 HydrophobicContact CE1-CD1 4.32Å; F165-L168 PolarHBondContact O-N 3.34Å; F165-L169 VanDerWaalsContact O-CB 3.31Å; F165-L169 WeakPolarHBondContact O-CB 3.27Å; F165-L169 PolarHBondContact O-N 2.89Å |
| 166 | S | 93.6 | Very high | 91.7 | Very high | 62 Ų | 62 | 40.7 Ų | 40.7 | 43% | 0.434 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -65.3 | -39.4 | 173.1 | -176.3 | 0 | 0 | 0 | 0 | 112 | L162 G163 L164 L169 A170 | L162-S166 WeakPolarHBondContact O-CB 3.34Å; L162-S166 PolarHBondContact O-N 3.39Å; G163-S166 PolarHBondContact O-N 3.4Å; L164-S166 VanDerWaalsContact C-N 3.34Å; S166-L169 PolarHBondContact O-N 3.35Å; S166-A170 WeakPolarHBondContact O-CB 3.37Å; S166-A170 PolarHBondContact O-N 3.32Å |
| 167 | V | 94.3 | Very high | 92.4 | Very high | 60 Ų | 60 | 38.9 Ų | 38.9 | 36% | 0.364 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.2 | -45.4 | 174.4 | 172.1 | 0 | 0 | 0 | 0 | 110.2 | V20 G163 L164 L169 A170 M171 | V20-V167 HydrophobicContact CG1-CG1 4.11Å; G163-V167 WeakPolarHBondContact O-CG2 3.36Å; G163-V167 PolarHBondContact O-N 3.08Å; L164-V167 PolarHBondContact O-N 3.04Å; V167-L169 VanDerWaalsContact C-N 3.31Å; V167-L169 PolarHBondContact O-N 2.89Å; V167-A170 PolarHBondContact O-N 3.44Å; V167-M171 HydrophobicContact CG1-CG 4Å; V167-M171 WeakPolarHBondContact O-CB 3.44Å; V167-M171 WeakPolarHBondContact O-CG 3.36Å; V167-M171 PolarHBondContact O-N 3.34Å |
| 168 | L | 93.2 | Very high | 92.7 | Very high | 2 Ų | 2 | 40.2 Ų | 40.2 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57.9 | -43.6 | 175.6 | -73.1 | 172.3 | 0 | 0 | 0 | 112.2 | C21 C24 L28 L164 F165 G172 | C21-L168 HydrophobicContact CB-CD2 3.89Å; C21-L168 WeakPolarHBondContact O-CD2 3.12Å; C24-L168 HydrophobicContact CB-CD2 3.96Å; C24-L168 HydrophobicContact CB-CG 4.03Å; L28-L168 HydrophobicContact CD1-CD1 3.65Å; L164-L168 WeakPolarHBondContact O-CG 3.42Å; L164-L168 PolarHBondContact O-N 3.43Å; F165-L168 HydrophobicContact CD1-CD1 4.01Å; F165-L168 HydrophobicContact CE1-CD1 4.32Å; F165-L168 PolarHBondContact O-N 3.34Å; L168-G172 PolarHBondContact O-N 2.83Å |
| 169 | L | 94.8 | Very high | 92.9 | Very high | 42 Ų | 42 | 40 Ų | 40 | 22% | 0.22 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -51.3 | 176.7 | -174.8 | 153.5 | 0 | 0 | 0 | 111.3 | C110 I113 F165 S166 V167 M171 G172 L173 | C110-L169 WeakPolarHBondContact SG-CD1 3.47Å; I113-L169 HydrophobicContact CD1-CD1 4.04Å; F165-L169 VanDerWaalsContact O-CB 3.31Å; F165-L169 WeakPolarHBondContact O-CB 3.27Å; F165-L169 PolarHBondContact O-N 2.89Å; S166-L169 PolarHBondContact O-N 3.35Å; V167-L169 VanDerWaalsContact C-N 3.31Å; V167-L169 PolarHBondContact O-N 2.89Å; L169-M171 PolarHBondContact O-N 3.49Å; L169-G172 PolarHBondContact O-N 2.85Å; L169-L173 HydrophobicContact CD2-CD1 3.68Å; L169-L173 HydrophobicContact CD2-CG 4.4Å; L169-L173 WeakPolarHBondContact O-CG 3.41Å; L169-L173 PolarHBondContact O-N 3.08Å |
| 170 | A | 95.6 | Very high | 93.1 | Very high | 44 Ų | 44 | 39.3 Ų | 39.3 | 36% | 0.364 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.8 | -46.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S166 V167 L173 I174 | S166-A170 WeakPolarHBondContact O-CB 3.37Å; S166-A170 PolarHBondContact O-N 3.32Å; V167-A170 PolarHBondContact O-N 3.44Å; A170-L173 PolarHBondContact O-N 3.13Å; A170-I174 VanDerWaalsContact O-CG1 3.3Å; A170-I174 WeakPolarHBondContact O-CG1 3.48Å; A170-I174 PolarHBondContact O-N 3.3Å |
| 171 | M | 93.6 | Very high | 93.2 | Very high | 35 Ų | 35 | 37.3 Ų | 37.3 | 17% | 0.172 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -67.1 | -40 | -179.6 | -63.5 | -65 | -94.5 | 0 | 0 | 111.6 | L17 V20 C21 V167 L169 I174 Q175 | L17-M171 HydrophobicContact CB-CE 4.1Å; L17-M171 HydrophobicContact CD1-CE 4.12Å; L17-M171 HydrophobicContact CG-CE 3.55Å; L17-M171 HydrophobicContact CG-SD 4.14Å; V20-M171 HydrophobicContact CB-CE 3.87Å; V20-M171 HydrophobicContact CG1-CE 3.92Å; V20-M171 HydrophobicContact CG2-CE 4.27Å; C21-M171 VanDerWaalsContact SG-CB 3.59Å; V167-M171 HydrophobicContact CG1-CG 4Å; V167-M171 WeakPolarHBondContact O-CB 3.44Å; V167-M171 WeakPolarHBondContact O-CG 3.36Å; V167-M171 PolarHBondContact O-N 3.34Å; L169-M171 PolarHBondContact O-N 3.49Å; M171-I174 PolarHBondContact O-N 3.23Å; M171-I174 HydrophobicContact SD-CD1 4.35Å; M171-Q175 VanDerWaalsContact O-CG 3.31Å; M171-Q175 WeakPolarHBondContact O-CG 3.05Å; M171-Q175 PolarHBondContact O-N 3.47Å |
| 172 | G | 94 | Very high | 93 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.5 | -42.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L168 L169 I174 Q175 I176 | L168-G172 PolarHBondContact O-N 2.83Å; L169-G172 PolarHBondContact O-N 2.85Å; G172-I174 PolarHBondContact O-N 3.19Å; G172-Q175 WeakPolarHBondContact O-CB 3.16Å; G172-Q175 PolarHBondContact O-N 2.94Å; G172-I176 WeakPolarHBondContact O-CG1 3.02Å; G172-I176 PolarHBondContact O-N 3.38Å |
| 173 | L | 95.6 | Very high | 93 | Very high | 84 Ų | 84 | 37 Ų | 37 | 44% | 0.44 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.6 | -43.6 | 174.3 | -70.9 | 175.7 | 0 | 0 | 0 | 112 | V106 L169 A170 Q175 I176 V177 | V106-L173 HydrophobicContact CG1-CD2 4.17Å; V106-L173 HydrophobicContact CG2-CD2 4.24Å; V106-L173 HydrophobicContact CG2-CG 4.24Å; L169-L173 HydrophobicContact CD2-CD1 3.68Å; L169-L173 HydrophobicContact CD2-CG 4.4Å; L169-L173 WeakPolarHBondContact O-CG 3.41Å; L169-L173 PolarHBondContact O-N 3.08Å; A170-L173 PolarHBondContact O-N 3.13Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3.34Å; L173-I176 PolarHBondContact O-N 3.44Å; L173-V177 WeakPolarHBondContact O-CG2 3.35Å; L173-V177 PolarHBondContact O-N 2.91Å |
| 174 | I | 94.9 | Very high | 92.7 | Very high | 81 Ų | 81 | 40 Ų | 40 | 42% | 0.415 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.3 | -42.6 | 176.5 | -63.5 | 163 | 0 | 0 | 0 | 110.4 | L17 A170 M171 G172 I176 V177 L178 | L17-I174 HydrophobicContact CD2-CB 3.99Å; L17-I174 HydrophobicContact CD2-CG2 3.58Å; A170-I174 VanDerWaalsContact O-CG1 3.3Å; A170-I174 WeakPolarHBondContact O-CG1 3.48Å; A170-I174 PolarHBondContact O-N 3.3Å; M171-I174 PolarHBondContact O-N 3.23Å; M171-I174 HydrophobicContact SD-CD1 4.35Å; G172-I174 PolarHBondContact O-N 3.19Å; I174-I176 VanDerWaalsContact C-N 3.35Å; I174-I176 PolarHBondContact O-N 2.93Å; I174-V177 PolarHBondContact O-N 3.5Å; I174-L178 HydrophobicContact CG2-CD1 3.95Å; I174-L178 HydrophobicContact CG2-CG 4.25Å; I174-L178 WeakPolarHBondContact O-CG 3.38Å; I174-L178 PolarHBondContact O-N 3.27Å |
| 175 | Q | 94.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.7 | -42.5 | 176.2 | -73.6 | 174 | -16.6 | 0 | 0 | 112.4 | L14 L17 S54 M58 A102 M171 G172 L173 V177 L178 C179 | L14-Q175 HydrophobicContact CD2-CB 4.35Å; L14-Q175 HydrophobicContact CD2-CG 4.02Å; L17-Q175 HydrophobicContact CB-CG 4.33Å; L17-Q175 HydrophobicContact CD2-CG 3.94Å; S54-Q175 PolarHBondContact O-NE2 3.38Å; M58-Q175 HydrophobicContact CE-CB 3.71Å; M58-Q175 HydrophobicContact CE-CG 4.01Å; M58-Q175 HydrophobicContact CG-CG 4.39Å; M58-Q175 HydrophobicContact SD-CB 4.33Å; M58-Q175 HydrophobicContact SD-CG 4.31Å; A102-Q175 HydrophobicContact CB-CB 3.9Å; M171-Q175 VanDerWaalsContact O-CG 3.31Å; M171-Q175 WeakPolarHBondContact O-CG 3.05Å; M171-Q175 PolarHBondContact O-N 3.47Å; G172-Q175 WeakPolarHBondContact O-CB 3.16Å; G172-Q175 PolarHBondContact O-N 2.94Å; L173-Q175 VanDerWaalsContact C-N 3.33Å; L173-Q175 PolarHBondContact O-N 3.34Å; Q175-V177 VanDerWaalsContact C-N 3.34Å; Q175-V177 PolarHBondContact O-N 3.26Å; Q175-L178 PolarHBondContact O-N 3.25Å; Q175-C179 WeakPolarHBondContact O-CB 3.45Å; Q175-C179 PolarHBondContact O-N 3.04Å; Q175-C179 PolarHBondContact O-SG 3.49Å |
| 176 | I | 94.9 | Very high | 91.7 | Very high | 52 Ų | 52 | 40.7 Ų | 40.7 | 27% | 0.267 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -59.9 | -46.2 | 175.7 | -67.7 | 165.7 | 0 | 0 | 0 | 110.4 | A102 V106 G172 L173 I174 C179 A180 | A102-I176 HydrophobicContact CB-CD1 4.44Å; A102-I176 HydrophobicContact CB-CG1 3.74Å; V106-I176 HydrophobicContact CG2-CD1 4.13Å; G172-I176 WeakPolarHBondContact O-CG1 3.02Å; G172-I176 PolarHBondContact O-N 3.38Å; L173-I176 PolarHBondContact O-N 3.44Å; I174-I176 VanDerWaalsContact C-N 3.35Å; I174-I176 PolarHBondContact O-N 2.93Å; I176-C179 PolarHBondContact O-N 3.12Å; I176-A180 WeakPolarHBondContact O-CB 3.47Å; I176-A180 PolarHBondContact O-N 3.46Å |
| 177 | V | 94.6 | Very high | 91.2 | Very high | 91 Ų | 91 | 41.7 Ų | 41.7 | 55% | 0.552 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -61 | -48.1 | 178.1 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | L173 I174 Q175 C179 A180 V181 | L173-V177 WeakPolarHBondContact O-CG2 3.35Å; L173-V177 PolarHBondContact O-N 2.91Å; I174-V177 PolarHBondContact O-N 3.5Å; Q175-V177 VanDerWaalsContact C-N 3.34Å; Q175-V177 PolarHBondContact O-N 3.26Å; V177-C179 VanDerWaalsContact C-N 3.33Å; V177-C179 PolarHBondContact O-N 3.28Å; V177-A180 PolarHBondContact O-N 2.96Å; V177-V181 WeakPolarHBondContact O-CG2 3.31Å; V177-V181 PolarHBondContact O-N 3.4Å |
| 178 | L | 91.8 | Very high | 90.5 | Very high | 31 Ų | 31 | 43.2 Ų | 43.2 | 16% | 0.162 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.7 | -40.3 | 179 | -66.5 | 172.6 | 0 | 0 | 0 | 112 | L10 L14 L17 I174 Q175 V181 Q182 | L10-L178 HydrophobicContact CD2-CB 4.44Å; L10-L178 HydrophobicContact CD2-CD2 3.55Å; L14-L178 HydrophobicContact CD2-CB 4.03Å; L14-L178 HydrophobicContact CD2-CD1 3.71Å; L14-L178 HydrophobicContact CG-CD1 4.18Å; L17-L178 HydrophobicContact CD2-CD1 4.22Å; I174-L178 HydrophobicContact CG2-CD1 3.95Å; I174-L178 HydrophobicContact CG2-CG 4.25Å; I174-L178 WeakPolarHBondContact O-CG 3.38Å; I174-L178 PolarHBondContact O-N 3.27Å; Q175-L178 PolarHBondContact O-N 3.25Å; L178-V181 PolarHBondContact O-N 3.49Å; L178-Q182 PolarHBondContact O-N 3.05Å; L178-Q182 VanDerWaalsContact O-N 3.1Å |
| 179 | C | 91.7 | Very high | 89.5 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 174.4 | -67.9 | 0 | 0 | 0 | 0 | 111.7 | A95 A99 Q175 I176 V177 V181 Q182 V183 | A95-C179 HydrophobicContact CB-CB 4.47Å; A99-C179 HydrophobicContact CB-CB 4.05Å; Q175-C179 WeakPolarHBondContact O-CB 3.45Å; Q175-C179 PolarHBondContact O-N 3.04Å; Q175-C179 PolarHBondContact O-SG 3.49Å; I176-C179 PolarHBondContact O-N 3.12Å; V177-C179 VanDerWaalsContact C-N 3.33Å; V177-C179 PolarHBondContact O-N 3.28Å; C179-V181 PolarHBondContact O-N 3.3Å; C179-Q182 WeakPolarHBondContact O-CB 3.35Å; C179-Q182 PolarHBondContact O-N 2.96Å; C179-Q182 VanDerWaalsContact O-N 3.16Å; C179-V183 WeakPolarHBondContact O-CG2 3.29Å; C179-V183 PolarHBondContact O-N 3.49Å |
| 180 | A | 91.8 | Very high | 88.4 | Confident | 47 Ų | 47 | 42.8 Ų | 42.8 | 39% | 0.388 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62 | -42.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | I176 V177 Q182 V183 I184 | I176-A180 WeakPolarHBondContact O-CB 3.47Å; I176-A180 PolarHBondContact O-N 3.46Å; V177-A180 PolarHBondContact O-N 2.96Å; A180-Q182 VanDerWaalsContact C-N 3.32Å; A180-Q182 PolarHBondContact O-N 2.59Å; A180-V183 PolarHBondContact O-N 3.18Å; A180-I184 WeakPolarHBondContact O-CG1 3.48Å; A180-I184 PolarHBondContact O-N 3.34Å |
| 181 | V | 89.9 | Confident | 87.2 | Confident | 48 Ų | 48 | 46.8 Ų | 46.8 | 29% | 0.291 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.9 | -41.2 | 174.8 | 179.7 | 0 | 0 | 0 | 0 | 110.7 | F6 V177 L178 C179 V183 I184 N185 | F6-V181 HydrophobicContact CE1-CG1 3.49Å; F6-V181 VanDerWaalsContact CE1-CG1 3.49Å; F6-V181 HydrophobicContact CZ-CG1 3.76Å; V177-V181 WeakPolarHBondContact O-CG2 3.31Å; V177-V181 PolarHBondContact O-N 3.4Å; L178-V181 PolarHBondContact O-N 3.49Å; C179-V181 PolarHBondContact O-N 3.3Å; V181-V183 PolarHBondContact O-N 3.21Å; V181-I184 PolarHBondContact O-N 3.46Å; V181-N185 VanDerWaalsContact O-CG 3.31Å; V181-N185 PolarHBondContact O-N 3.43Å; V181-N185 PolarHBondContact O-ND2 3.46Å; V181-N185 VanDerWaalsContact O-ND2 3.15Å |
| 182 | Q | 87.8 | Confident | 85.6 | Confident | 1 Ų | 1 | 49 Ų | 49 | 1% | 0.005 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 174.7 | -179 | 67.4 | 14.3 | 0 | 0 | 112.4 | L10 F65 S91 A95 L178 C179 A180 I184 N185 G186 | L10-Q182 HydrophobicContact CD1-CB 3.93Å; F65-Q182 HydrophobicContact CD1-CG 3.9Å; F65-Q182 HydrophobicContact CD2-CB 4.48Å; F65-Q182 HydrophobicContact CD2-CG 4.26Å; F65-Q182 HydrophobicContact CE1-CB 4.32Å; F65-Q182 HydrophobicContact CE1-CG 3.5Å; F65-Q182 VanDerWaalsContact CE1-CG 3.5Å; F65-Q182 HydrophobicContact CE2-CB 3.81Å; F65-Q182 HydrophobicContact CE2-CG 3.82Å; F65-Q182 HydrophobicContact CG-CG 4.32Å; F65-Q182 HydrophobicContact CZ-CB 3.76Å; F65-Q182 HydrophobicContact CZ-CG 3.46Å; F65-Q182 VanDerWaalsContact CZ-CG 3.46Å; S91-Q182 PolarHBondContact OG-NE2 3.01Å; A95-Q182 HydrophobicContact CB-CB 4.46Å; A95-Q182 HydrophobicContact CB-CG 4.38Å; L178-Q182 PolarHBondContact O-N 3.05Å; L178-Q182 VanDerWaalsContact O-N 3.1Å; C179-Q182 WeakPolarHBondContact O-CB 3.35Å; C179-Q182 PolarHBondContact O-N 2.96Å; C179-Q182 VanDerWaalsContact O-N 3.16Å; A180-Q182 VanDerWaalsContact C-N 3.32Å; A180-Q182 PolarHBondContact O-N 2.59Å; Q182-I184 VanDerWaalsContact C-N 3.32Å; Q182-I184 PolarHBondContact O-N 3.16Å; Q182-N185 PolarHBondContact O-N 3.42Å; Q182-G186 PolarHBondContact O-N 3.12Å |
| 183 | V | 89.2 | Confident | 83.6 | Confident | 39 Ų | 39 | 50.3 Ų | 50.3 | 24% | 0.236 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59 | -46.4 | 176.2 | 170.2 | 0 | 0 | 0 | 0 | 110.3 | I92 A95 C179 A180 V181 N185 G186 L187 | I92-V183 HydrophobicContact CG2-CG1 4.23Å; I92-V183 HydrophobicContact CG2-CG2 4.35Å; A95-V183 HydrophobicContact CB-CG2 3.77Å; C179-V183 WeakPolarHBondContact O-CG2 3.29Å; C179-V183 PolarHBondContact O-N 3.49Å; A180-V183 PolarHBondContact O-N 3.18Å; V181-V183 PolarHBondContact O-N 3.21Å; V183-N185 PolarHBondContact O-N 3.38Å; V183-G186 PolarHBondContact O-N 3.1Å; V183-L187 HydrophobicContact CG1-CD1 3.89Å; V183-L187 HydrophobicContact CG1-CG 4.39Å; V183-L187 WeakPolarHBondContact O-CB 3.42Å; V183-L187 VanDerWaalsContact O-CG 3.25Å; V183-L187 WeakPolarHBondContact O-CG 3.2Å; V183-L187 PolarHBondContact O-N 3.45Å |
| 184 | I | 87.5 | Confident | 81.2 | Confident | 97 Ų | 97 | 50.1 Ų | 50.1 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.2 | -47 | 177 | -64.4 | 165.6 | 0 | 0 | 0 | 110.6 | A180 V181 Q182 G186 L187 L188 | A180-I184 WeakPolarHBondContact O-CG1 3.48Å; A180-I184 PolarHBondContact O-N 3.34Å; V181-I184 PolarHBondContact O-N 3.46Å; Q182-I184 VanDerWaalsContact C-N 3.32Å; Q182-I184 PolarHBondContact O-N 3.16Å; I184-G186 PolarHBondContact O-N 2.92Å; I184-L187 PolarHBondContact O-N 3.41Å; I184-L188 HydrophobicContact CG2-CD1 3.97Å; I184-L188 HydrophobicContact CG2-CG 4.41Å; I184-L188 WeakPolarHBondContact O-CB 2.96Å; I184-L188 VanDerWaalsContact O-CG 3.32Å; I184-L188 WeakPolarHBondContact O-CG 3.35Å; I184-L188 PolarHBondContact O-N 3.39Å |
| 185 | N | 82.9 | Confident | 78.7 | Confident | 38 Ų | 38 | 51.1 Ų | 51.1 | 20% | 0.203 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.3 | -38.6 | 178.7 | -70.7 | -34.2 | 0 | 0 | 0 | 112.9 | F6 V181 Q182 V183 G189 | F6-N185 WeakPolarHBondContact CD1-ND2 3.27Å; F6-N185 WeakPolarHBondContact CE1-ND2 3.41Å; V181-N185 VanDerWaalsContact O-CG 3.31Å; V181-N185 PolarHBondContact O-N 3.43Å; V181-N185 PolarHBondContact O-ND2 3.46Å; V181-N185 VanDerWaalsContact O-ND2 3.15Å; Q182-N185 PolarHBondContact O-N 3.42Å; V183-N185 PolarHBondContact O-N 3.38Å; N185-G189 PolarHBondContact O-N 3.3Å |
| 186 | G | 79.9 | Confident | 76.2 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.3 | -46.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q182 V183 I184 G189 A190 | Q182-G186 PolarHBondContact O-N 3.12Å; V183-G186 PolarHBondContact O-N 3.1Å; I184-G186 PolarHBondContact O-N 2.92Å; G186-G189 PolarHBondContact O-N 3.26Å; G186-A190 WeakPolarHBondContact O-CB 3.26Å; G186-A190 PolarHBondContact O-N 3.39Å |
| 187 | L | 83 | Confident | 73.8 | Confident | 83 Ų | 83 | 57.5 Ų | 57.5 | 44% | 0.435 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.4 | -46.7 | 177.8 | -71.4 | 170.7 | 0 | 0 | 0 | 111.8 | I92 V183 I184 G189 A190 L191 | I92-L187 HydrophobicContact CD1-CD2 3.92Å; I92-L187 HydrophobicContact CD1-CG 4.04Å; V183-L187 HydrophobicContact CG1-CD1 3.89Å; V183-L187 HydrophobicContact CG1-CG 4.39Å; V183-L187 WeakPolarHBondContact O-CB 3.42Å; V183-L187 VanDerWaalsContact O-CG 3.25Å; V183-L187 WeakPolarHBondContact O-CG 3.2Å; V183-L187 PolarHBondContact O-N 3.45Å; I184-L187 PolarHBondContact O-N 3.41Å; L187-G189 VanDerWaalsContact C-N 3.3Å; L187-G189 PolarHBondContact O-N 3.38Å; L187-A190 PolarHBondContact O-N 3.08Å; L187-L191 WeakPolarHBondContact O-CB 3.4Å; L187-L191 WeakPolarHBondContact O-CG 3.35Å; L187-L191 PolarHBondContact O-N 3.24Å |
| 188 | L | 79.6 | Confident | 71 | Confident | 93 Ų | 93 | 58.9 Ų | 58.9 | 49% | 0.487 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.4 | -39.3 | 175.6 | -70.9 | 174 | 0 | 0 | 0 | 111.6 | I184 C192 | I184-L188 HydrophobicContact CG2-CD1 3.97Å; I184-L188 HydrophobicContact CG2-CG 4.41Å; I184-L188 WeakPolarHBondContact O-CB 2.96Å; I184-L188 VanDerWaalsContact O-CG 3.32Å; I184-L188 WeakPolarHBondContact O-CG 3.35Å; I184-L188 PolarHBondContact O-N 3.39Å; L188-C192 WeakPolarHBondContact O-CA 3.13Å; L188-C192 WeakPolarHBondContact O-CB 3.41Å; L188-C192 PolarHBondContact O-N 3.13Å |
| 189 | G | 72.1 | Confident | 68.5 | Low | 14 Ų | 14 | 63.4 Ų | 63.4 | 14% | 0.144 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -72.7 | -26.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | N185 G186 L187 G193 | N185-G189 PolarHBondContact O-N 3.3Å; G186-G189 PolarHBondContact O-N 3.26Å; L187-G189 VanDerWaalsContact C-N 3.3Å; L187-G189 PolarHBondContact O-N 3.38Å; G189-G193 PolarHBondContact O-N 2.99Å |
| 190 | A | 72.8 | Confident | 66 | Low | 21 Ų | 21 | 67.3 Ų | 67.3 | 17% | 0.174 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -76.7 | -40.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G186 L187 | G186-A190 WeakPolarHBondContact O-CB 3.26Å; G186-A190 PolarHBondContact O-N 3.39Å; L187-A190 PolarHBondContact O-N 3.08Å |
| 191 | L | 69.2 | Low | 63.6 | Low | 127 Ų | 127 | 69 Ų | 69 | 67% | 0.665 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -82.4 | -45.2 | -178.4 | -67 | 170.7 | 0 | 0 | 0 | 112.9 | L187 G193 | L187-L191 WeakPolarHBondContact O-CB 3.4Å; L187-L191 WeakPolarHBondContact O-CG 3.35Å; L187-L191 PolarHBondContact O-N 3.24Å; L191-G193 VanDerWaalsContact C-N 3.32Å |
| 192 | C | 59.3 | Low | 61.2 | Low | 81 Ų | 81 | 69.8 Ų | 69.8 | 55% | 0.547 | 49% | 0.491 | S | S | . | . | G | 310 helix | trans | -81.9 | -8.7 | 178.4 | -63.5 | 0 | 0 | 0 | 0 | 113.3 | L188 D194 C195 | L188-C192 WeakPolarHBondContact O-CA 3.13Å; L188-C192 WeakPolarHBondContact O-CB 3.41Å; L188-C192 PolarHBondContact O-N 3.13Å; C192-D194 PolarHBondContact O-N 3.5Å; C192-C195 PolarHBondContact O-N 2.71Å |
| 193 | G | 53.1 | Low | 58.9 | Low | 29 Ų | 29 | 77.9 Ų | 77.9 | 30% | 0.299 | 54% | 0.535 | S | S | . | . | G | 310 helix | trans | -66.6 | -21.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G189 L191 | G189-G193 PolarHBondContact O-N 2.99Å; L191-G193 VanDerWaalsContact C-N 3.32Å |
| 194 | D | 44.6 | Very low | 56.3 | Low | 80 Ų | 80 | 79.4 Ų | 79.4 | 43% | 0.428 | 56% | 0.558 | S | S | . | * | G | 310 helix | trans | -80.7 | -21.4 | 178.9 | -77.5 | -2.2 | 0 | 0 | 0 | 113.7 | R85 C192 C196 G197 | R85-D194 IonicContact CZ-OD1 3.21Å; R85-D194 IonicContact CZ-OD2 3.38Å; R85-D194 IonicContact NE-OD1 3.18Å; R85-D194 PolarHBondContact NE-OD1 3.13Å; R85-D194 IonicContact NE-OD2 3.96Å; R85-D194 IonicContact NH2-OD1 2.59Å; R85-D194 PolarHBondContact NH2-OD1 3Å; R85-D194 IonicContact NH2-OD2 2.66Å; R85-D194 PolarHBondContact NH2-OD2 3.34Å; C192-D194 PolarHBondContact O-N 3.5Å; D194-C196 VanDerWaalsContact C-N 3.33Å; D194-C196 PolarHBondContact O-N 3.49Å; D194-G197 PolarHBondContact O-N 3.25Å |
| 195 | C | 42 | Very low | 53.9 | Low | 101 Ų | 101 | 79.5 Ų | 79.5 | 68% | 0.682 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -81.7 | -8 | -175.7 | -64.1 | 0 | 0 | 0 | 0 | 114.3 | C192 | C192-C195 PolarHBondContact O-N 2.71Š|
| 196 | C | 42.8 | Very low | 51.6 | Low | 121 Ų | 121 | 88.5 Ų | 88.5 | 82% | 0.818 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -101.3 | 9 | 172.5 | -77 | 0 | 0 | 0 | 0 | 113.6 | D194 | D194-C196 VanDerWaalsContact C-N 3.33Å; D194-C196 PolarHBondContact O-N 3.49Å |
| 197 | G | 43.3 | Very low | 50.2 | Low | 66 Ų | 66 | 92.9 Ų | 92.9 | 68% | 0.68 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -98.8 | -4.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | D194 | D194-G197 PolarHBondContact O-N 3.25Š|
| 198 | C | 36.8 | Very low | 48.5 | Very low | 120 Ų | 120 | 93.4 Ų | 93.4 | 81% | 0.811 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -104.9 | 7 | -179.8 | -77.5 | 0 | 0 | 0 | 0 | 114.8 | ||
| 199 | C | 39.1 | Very low | 46.8 | Very low | 126 Ų | 126 | 93.4 Ų | 93.4 | 85% | 0.851 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -120.1 | 77.7 | 170.9 | -65.6 | 0 | 0 | 0 | 0 | 109.6 | ||
| 200 | G | 39.2 | Very low | 45.3 | Very low | 82 Ų | 82 | 98.1 Ų | 98.1 | 85% | 0.845 | 71% | 0.714 | S | S | * | * | trans | -179.7 | 27.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 201 | G | 40.8 | Very low | 43.6 | Very low | 82 Ų | 82 | 102.9 Ų | 102.9 | 85% | 0.845 | 75% | 0.748 | S | S | * | * | trans | -117.2 | 113.3 | 163.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 202 | G | 40.5 | Very low | 41.9 | Very low | 64 Ų | 64 | 101.3 Ų | 101.3 | 66% | 0.66 | 75% | 0.754 | S | S | * | * | trans | 117.6 | 92.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 203 | D | 39.4 | Very low | 40.6 | Very low | 172 Ų | 172 | 102.8 Ų | 102.8 | 92% | 0.92 | 77% | 0.768 | S | S | * | * | 162.7 | 130.3 | 105.9 | -83.5 | -17.3 | 0 | 0 | 0 | 114.2 | |||||
| 204 | G | 34.2 | Very low | 39.7 | Very low | 70 Ų | 70 | 108.5 Ų | 108.5 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | trans | 81.3 | 112.6 | 160.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 205 | A | 36.7 | Very low | 39.2 | Very low | 100 Ų | 100 | 110.8 Ų | 110.8 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | cis | 43.8 | 79 | 40.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 206 | V | 36.3 | Very low | 39 | Very low | 226 Ų | 226 | 111.7 Ų | 111.7 | 100% | 1.37 | 85% | 0.85 | S | S | * | * | -168.7 | 0 | 119.3 | -88.3 | 0 | 0 | 0 | 0 | 110 |
Retrieved 206 of 206 residues in 36.3 ms
(Link to these results)