| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 49.2 | Very low | 83 | Confident | 223 Ų | 223 | 79.6 Ų | 79.6 | 100% | 1.099 | 40% | 0.4 | S | S | * | . | 0 | 130.4 | 0 | -75 | 169.8 | 72 | 0 | 0 | 107.8 | T3 | M1-T3 PolarHBondContact O-N 3.32Š| |||
| 2 | V | 61.1 | Low | 84.1 | Confident | 87 Ų | 87 | 73 Ų | 73 | 53% | 0.527 | 37% | 0.366 | S | S | . | . | trans | -74.6 | 116.6 | 171.9 | -177 | 0 | 0 | 0 | 0 | 107.3 | F6 Y7 | V2-F6 HydrophobicContact CG1-CB 3.76Å; V2-F6 HydrophobicContact CG1-CD1 3.25Å; V2-F6 HydrophobicContact CG1-CE1 4.01Å; V2-F6 HydrophobicContact CG1-CG 3.71Å; V2-Y7 HydrophobicContact CB-CE2 4.15Å; V2-Y7 HydrophobicContact CG1-CD2 4Å; V2-Y7 HydrophobicContact CG1-CE1 4.28Å; V2-Y7 HydrophobicContact CG1-CE2 3.4Å | ||
| 3 | T | 75.4 | Confident | 85 | Confident | 32 Ų | 32 | 67.5 Ų | 67.5 | 20% | 0.196 | 34% | 0.339 | C | S | . | . | trans | -78.5 | 158.7 | -178 | 63.1 | 0 | 0 | 0 | 0 | 110.7 | M1 R5 F6 Y7 L205 | M1-T3 PolarHBondContact O-N 3.32Å; T3-R5 PolarHBondContact O-N 2.97Å; T3-F6 VanDerWaalsContact O-CB 3.28Å; T3-F6 WeakPolarHBondContact O-CB 3.46Å; T3-F6 PolarHBondContact O-N 3.04Å; T3-F6 VanDerWaalsContact O-N 3.08Å; T3-F6 PolarHBondContact OG1-N 2.78Å; T3-Y7 WeakPolarHBondContact O-CD2 3.22Å; T3-L205 WeakPolarHBondContact CG2-O 3.42Å; T3-L205 PolarHBondContact OG1-O 2.82Å | ||
| 4 | S | 85.3 | Confident | 85.9 | Confident | 100 Ų | 100 | 65.6 Ų | 65.6 | 70% | 0.699 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -57.2 | -31.3 | 171 | 56.3 | 0 | 0 | 0 | 0 | 112.4 | F6 Y7 F8 | S4-F6 VanDerWaalsContact C-N 3.34Å; S4-F6 PolarHBondContact O-N 3.36Å; S4-Y7 PolarHBondContact O-N 2.89Å; S4-F8 PolarHBondContact O-N 3.35Å |
| 5 | R | 89.6 | Confident | 86.7 | Confident | 106 Ų | 106 | 63.9 Ų | 63.9 | 40% | 0.4 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.5 | -33.1 | 176.4 | -69.2 | 176.6 | 177.6 | 170.4 | 0.3 | 113 | T3 F8 V9 W204 | T3-R5 PolarHBondContact O-N 2.97Å; R5-F8 WeakPolarHBondContact O-CB 3.33Å; R5-F8 PolarHBondContact O-N 3.32Å; R5-V9 WeakPolarHBondContact O-CG2 3.02Å; R5-V9 PolarHBondContact O-N 3.35Å; R5-W204 HydrophobicContact CB-CE3 4.22Å; R5-W204 HydrophobicContact CB-CH2 3.87Å; R5-W204 HydrophobicContact CB-CZ2 4.32Å; R5-W204 HydrophobicContact CB-CZ3 3.8Å; R5-W204 WeakPolarHBondContact CD-O 3.36Å; R5-W204 HydrophobicContact CG-CH2 4.13Å; R5-W204 HydrophobicContact CG-CZ2 4.08Å; R5-W204 HydrophobicContact CG-CZ3 4.39Å; R5-W204 PolarHBondContact NH1-O 3.34Å |
| 6 | F | 87.1 | Confident | 87.4 | Confident | 17 Ų | 17 | 60 Ų | 60 | 8% | 0.075 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.7 | -50.7 | 172.2 | -177.9 | -98.5 | 0 | 0 | 0 | 111.5 | V2 T3 S4 F8 V9 L10 I129 P130 L205 | V2-F6 HydrophobicContact CG1-CB 3.76Å; V2-F6 HydrophobicContact CG1-CD1 3.25Å; V2-F6 HydrophobicContact CG1-CE1 4.01Å; V2-F6 HydrophobicContact CG1-CG 3.71Å; T3-F6 VanDerWaalsContact O-CB 3.28Å; T3-F6 WeakPolarHBondContact O-CB 3.46Å; T3-F6 PolarHBondContact O-N 3.04Å; T3-F6 VanDerWaalsContact O-N 3.08Å; T3-F6 PolarHBondContact OG1-N 2.78Å; S4-F6 VanDerWaalsContact C-N 3.34Å; S4-F6 PolarHBondContact O-N 3.36Å; F6-F8 VanDerWaalsContact C-N 3.25Å; F6-F8 PolarHBondContact O-N 3.46Å; F6-V9 WeakPolarHBondContact O-CB 3.18Å; F6-V9 PolarHBondContact O-N 3.47Å; F6-L10 HydrophobicContact CD1-CD1 3.95Å; F6-L10 HydrophobicContact CD1-CG 4.2Å; F6-L10 HydrophobicContact CE1-CD1 3.51Å; F6-L10 HydrophobicContact CE1-CD2 4.26Å; F6-L10 HydrophobicContact CE1-CG 3.95Å; F6-L10 HydrophobicContact CZ-CD1 4.21Å; F6-L10 HydrophobicContact CZ-CD2 4.18Å; F6-L10 HydrophobicContact CZ-CG 4.35Å; F6-L10 WeakPolarHBondContact O-CG 3Å; F6-L10 PolarHBondContact O-N 3.23Å; F6-I129 HydrophobicContact CE2-CD1 4.39Å; F6-I129 HydrophobicContact CE2-CG1 3.7Å; F6-I129 HydrophobicContact CZ-CD1 4.05Å; F6-I129 HydrophobicContact CZ-CG1 3.77Å; F6-P130 HydrophobicContact CE2-CG 4.27Å; F6-P130 HydrophobicContact CZ-CG 4.5Å; F6-L205 HydrophobicContact CD2-CD1 4.47Å |
| 7 | Y | 90.4 | Very high | 88 | Confident | 143 Ų | 143 | 56.5 Ų | 56.5 | 56% | 0.561 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -62.8 | -33.9 | 177.1 | -65.9 | -70.7 | 0 | 0 | 0 | 112.4 | V2 T3 S4 L10 L11 | V2-Y7 HydrophobicContact CB-CE2 4.15Å; V2-Y7 HydrophobicContact CG1-CD2 4Å; V2-Y7 HydrophobicContact CG1-CE1 4.28Å; V2-Y7 HydrophobicContact CG1-CE2 3.4Å; T3-Y7 WeakPolarHBondContact O-CD2 3.22Å; S4-Y7 PolarHBondContact O-N 2.89Å; Y7-L10 HydrophobicContact CD1-CD1 4.4Å; Y7-L10 PolarHBondContact O-N 3.48Å; Y7-L11 WeakPolarHBondContact O-CB 3.42Å; Y7-L11 PolarHBondContact O-N 3.01Å |
| 8 | F | 93.9 | Very high | 88.6 | Confident | 53 Ų | 53 | 55.4 Ų | 55.4 | 23% | 0.232 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 173.3 | -179.6 | -106.7 | 0 | 0 | 0 | 112.2 | S4 R5 F6 L10 L11 V12 L178 M181 L182 W204 | S4-F8 PolarHBondContact O-N 3.35Å; R5-F8 WeakPolarHBondContact O-CB 3.33Å; R5-F8 PolarHBondContact O-N 3.32Å; F6-F8 VanDerWaalsContact C-N 3.25Å; F6-F8 PolarHBondContact O-N 3.46Å; F8-L10 VanDerWaalsContact C-N 3.29Å; F8-L10 PolarHBondContact O-N 2.73Å; F8-L11 PolarHBondContact O-N 3.34Å; F8-V12 HydrophobicContact CD1-CG2 4.4Å; F8-V12 HydrophobicContact CD2-CG2 4.32Å; F8-V12 HydrophobicContact CE1-CG2 4Å; F8-V12 HydrophobicContact CE2-CG2 3.9Å; F8-V12 HydrophobicContact CZ-CG2 3.73Å; F8-V12 WeakPolarHBondContact O-CG2 3.39Å; F8-V12 PolarHBondContact O-N 3.43Å; F8-L178 HydrophobicContact CE2-CD2 4.34Å; F8-M181 HydrophobicContact CE1-CB 3.85Å; F8-M181 HydrophobicContact CZ-CB 3.92Å; F8-M181 HydrophobicContact CZ-SD 4.16Å; F8-L182 HydrophobicContact CD1-CD2 3.88Å; F8-L182 HydrophobicContact CE1-CD2 3.74Å; F8-W204 HydrophobicContact CD1-CH2 4.2Å |
| 9 | V | 92.7 | Very high | 89.1 | Confident | 4 Ų | 4 | 52.6 Ų | 52.6 | 2% | 0.024 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -56.6 | -45.2 | 173.4 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | R5 F6 L11 V12 S13 I128 L182 W204 L205 | R5-V9 WeakPolarHBondContact O-CG2 3.02Å; R5-V9 PolarHBondContact O-N 3.35Å; F6-V9 WeakPolarHBondContact O-CB 3.18Å; F6-V9 PolarHBondContact O-N 3.47Å; V9-L11 PolarHBondContact O-N 3.49Å; V9-V12 PolarHBondContact O-N 2.68Å; V9-S13 WeakPolarHBondContact O-CB 3.09Å; V9-S13 PolarHBondContact O-N 2.79Å; V9-S13 PolarHBondContact O-OG 2.97Å; V9-I128 HydrophobicContact CG1-CD1 3.35Å; V9-I128 HydrophobicContact CG1-CG1 4.23Å; V9-L182 HydrophobicContact CB-CD2 4.43Å; V9-L182 HydrophobicContact CG2-CD2 3.86Å; V9-W204 HydrophobicContact CG2-CH2 4.17Å; V9-W204 HydrophobicContact CG2-CZ3 3.8Å; V9-L205 HydrophobicContact CG2-CD1 3.87Å |
| 10 | L | 92.4 | Very high | 89.6 | Confident | 19 Ų | 19 | 50 Ų | 50 | 10% | 0.099 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.8 | -48.3 | 177.7 | -64.1 | -173.3 | 0 | 0 | 0 | 111.7 | F6 Y7 F8 S13 I14 I129 M137 | F6-L10 HydrophobicContact CD1-CD1 3.95Å; F6-L10 HydrophobicContact CD1-CG 4.2Å; F6-L10 HydrophobicContact CE1-CD1 3.51Å; F6-L10 HydrophobicContact CE1-CD2 4.26Å; F6-L10 HydrophobicContact CE1-CG 3.95Å; F6-L10 HydrophobicContact CZ-CD1 4.21Å; F6-L10 HydrophobicContact CZ-CD2 4.18Å; F6-L10 HydrophobicContact CZ-CG 4.35Å; F6-L10 WeakPolarHBondContact O-CG 3Å; F6-L10 PolarHBondContact O-N 3.23Å; Y7-L10 HydrophobicContact CD1-CD1 4.4Å; Y7-L10 PolarHBondContact O-N 3.48Å; F8-L10 VanDerWaalsContact C-N 3.29Å; F8-L10 PolarHBondContact O-N 2.73Å; L10-S13 PolarHBondContact O-N 3.37Å; L10-I14 VanDerWaalsContact O-CG1 3.28Å; L10-I14 WeakPolarHBondContact O-CG1 3.23Å; L10-I14 PolarHBondContact O-N 3.03Å; L10-I129 HydrophobicContact CD2-CD1 3.76Å; L10-M137 HydrophobicContact CD2-CE 3.31Å; L10-M137 HydrophobicContact CD2-CG 4.49Å; L10-M137 HydrophobicContact CD2-SD 3.6Å; L10-M137 HydrophobicContact CG-CE 4.48Å |
| 11 | L | 95.4 | Very high | 90 | Very high | 92 Ų | 92 | 47.6 Ų | 47.6 | 48% | 0.482 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.9 | -49.7 | 179.2 | -179.3 | 67.7 | 0 | 0 | 0 | 111.8 | Y7 F8 V9 S13 I14 L15 | Y7-L11 WeakPolarHBondContact O-CB 3.42Å; Y7-L11 PolarHBondContact O-N 3.01Å; F8-L11 PolarHBondContact O-N 3.34Å; V9-L11 PolarHBondContact O-N 3.49Å; L11-S13 VanDerWaalsContact C-N 3.26Å; L11-S13 PolarHBondContact O-N 3.28Å; L11-I14 PolarHBondContact O-N 2.68Å; L11-L15 HydrophobicContact CD1-CD1 4.43Å; L11-L15 HydrophobicContact CG-CD1 4.11Å; L11-L15 WeakPolarHBondContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.34Å; L11-L15 PolarHBondContact O-N 3.04Å |
| 12 | V | 96.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.1 | -34.5 | -179.5 | 179.9 | 0 | 0 | 0 | 0 | 111.7 | F8 V9 L15 S16 L178 T179 L182 | F8-V12 HydrophobicContact CD1-CG2 4.4Å; F8-V12 HydrophobicContact CD2-CG2 4.32Å; F8-V12 HydrophobicContact CE1-CG2 4Å; F8-V12 HydrophobicContact CE2-CG2 3.9Å; F8-V12 HydrophobicContact CZ-CG2 3.73Å; F8-V12 WeakPolarHBondContact O-CG2 3.39Å; F8-V12 PolarHBondContact O-N 3.43Å; V9-V12 PolarHBondContact O-N 2.68Å; V12-L15 PolarHBondContact O-N 2.9Å; V12-S16 WeakPolarHBondContact O-CB 3.32Å; V12-S16 PolarHBondContact O-N 3.24Å; V12-S16 PolarHBondContact O-OG 2.77Å; V12-L178 HydrophobicContact CG1-CB 4.31Å; V12-L178 HydrophobicContact CG2-CB 3.83Å; V12-T179 VanDerWaalsContact CG1-OG1 3.31Å; V12-T179 WeakPolarHBondContact CG1-OG1 3.26Å; V12-L182 HydrophobicContact CB-CD1 4.03Å; V12-L182 HydrophobicContact CB-CD2 4.3Å; V12-L182 HydrophobicContact CB-CG 4.46Å; V12-L182 HydrophobicContact CG1-CD1 3.58Å; V12-L182 HydrophobicContact CG1-CG 4.2Å; V12-L182 HydrophobicContact CG2-CD2 4.29Å |
| 13 | S | 95.6 | Very high | 94.1 | Very high | 1 Ų | 1 | 33.1 Ų | 33.1 | 1% | 0.007 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.8 | -40.4 | 176.9 | -53.9 | 0 | 0 | 0 | 0 | 112.2 | V9 L10 L11 S16 A17 N121 V125 M137 | V9-S13 WeakPolarHBondContact O-CB 3.09Å; V9-S13 PolarHBondContact O-N 2.79Å; V9-S13 PolarHBondContact O-OG 2.97Å; L10-S13 PolarHBondContact O-N 3.37Å; L11-S13 VanDerWaalsContact C-N 3.26Å; L11-S13 PolarHBondContact O-N 3.28Å; S13-S16 PolarHBondContact O-N 3.2Å; S13-A17 PolarHBondContact O-N 3.13Å; S13-N121 PolarHBondContact O-ND2 3.03Å; S13-V125 WeakPolarHBondContact OG-CG2 3.42Å; S13-M137 WeakPolarHBondContact OG-CE 3.21Å |
| 14 | I | 97.5 | Very high | 95.1 | Very high | 41 Ų | 41 | 32.6 Ų | 32.6 | 21% | 0.21 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.8 | -43.2 | 173.4 | -66.4 | 164.9 | 0 | 0 | 0 | 110 | L10 L11 S16 A17 F18 L140 | L10-I14 VanDerWaalsContact O-CG1 3.28Å; L10-I14 WeakPolarHBondContact O-CG1 3.23Å; L10-I14 PolarHBondContact O-N 3.03Å; L11-I14 PolarHBondContact O-N 2.68Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 3.33Å; I14-A17 CarbonylContact O-C 3.57Å; I14-A17 WeakPolarHBondContact O-CB 3.45Å; I14-A17 PolarHBondContact O-N 3.07Å; I14-A17 VanDerWaalsContact O-N 3.14Å; I14-F18 PolarHBondContact O-N 3.49Å; I14-L140 HydrophobicContact CD1-CB 4.18Å; I14-L140 HydrophobicContact CD1-CD1 4.28Å; I14-L140 HydrophobicContact CD1-CD2 4.15Å; I14-L140 HydrophobicContact CD1-CG 4.44Å; I14-L140 HydrophobicContact CG1-CB 4.06Å |
| 15 | L | 98 | Very high | 95.6 | Very high | 41 Ų | 41 | 27.8 Ų | 27.8 | 22% | 0.215 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.8 | -33.2 | 176.7 | -72.3 | 174.6 | 0 | 0 | 0 | 112.7 | L11 V12 A17 F18 T19 V175 L178 | L11-L15 HydrophobicContact CD1-CD1 4.43Å; L11-L15 HydrophobicContact CG-CD1 4.11Å; L11-L15 WeakPolarHBondContact O-CB 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.34Å; L11-L15 PolarHBondContact O-N 3.04Å; V12-L15 PolarHBondContact O-N 2.9Å; L15-A17 VanDerWaalsContact C-N 3.35Å; L15-F18 VanDerWaalsContact O-CB 3.31Å; L15-F18 WeakPolarHBondContact O-CB 2.97Å; L15-F18 PolarHBondContact O-N 3.3Å; L15-T19 PolarHBondContact O-N 3.18Å; L15-T19 VanDerWaalsContact O-N 3.11Å; L15-V175 HydrophobicContact CB-CG1 4.34Å; L15-V175 HydrophobicContact CB-CG2 3.86Å; L15-L178 HydrophobicContact CD1-CD1 3.56Å |
| 16 | S | 98 | Very high | 96 | Very high | 1 Ų | 1 | 22.8 Ų | 22.8 | 1% | 0.007 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -69.3 | -32.9 | 172.6 | -61.4 | 0 | 0 | 0 | 0 | 112.6 | V12 S13 I14 T19 S20 Y76 T117 N121 | V12-S16 WeakPolarHBondContact O-CB 3.32Å; V12-S16 PolarHBondContact O-N 3.24Å; V12-S16 PolarHBondContact O-OG 2.77Å; S13-S16 PolarHBondContact O-N 3.2Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 3.33Å; S16-T19 PolarHBondContact O-OG1 3.22Å; S16-S20 PolarHBondContact O-OG 3.28Å; S16-Y76 PolarHBondContact OG-OH 3.36Å; S16-T117 WeakPolarHBondContact O-CG2 3.38Å; S16-N121 WeakPolarHBondContact CB-ND2 3.25Å |
| 17 | A | 98.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -71.3 | -35.4 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | S13 I14 L15 T19 S20 G21 F141 I145 | S13-A17 PolarHBondContact O-N 3.13Å; I14-A17 CarbonylContact O-C 3.57Å; I14-A17 WeakPolarHBondContact O-CB 3.45Å; I14-A17 PolarHBondContact O-N 3.07Å; I14-A17 VanDerWaalsContact O-N 3.14Å; L15-A17 VanDerWaalsContact C-N 3.35Å; A17-T19 PolarHBondContact O-N 3.22Å; A17-S20 VanDerWaalsContact O-CB 3.31Å; A17-S20 WeakPolarHBondContact O-CB 3.04Å; A17-S20 PolarHBondContact O-N 3.34Å; A17-S20 VanDerWaalsContact O-N 3.11Å; A17-G21 PolarHBondContact O-N 3.09Å; A17-F141 HydrophobicContact CB-CD1 4.12Å; A17-F141 WeakPolarHBondContact CB-O 3.41Å; A17-I145 HydrophobicContact CB-CG1 4.16Å |
| 18 | F | 98.5 | Very high | 96.5 | Very high | 37 Ų | 37 | 15.2 Ų | 15.2 | 16% | 0.162 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -58.6 | -41.5 | 173.8 | 167.2 | -88.6 | 0 | 0 | 0 | 113.4 | I14 L15 S20 G21 L22 G144 C147 G148 A151 A171 | I14-F18 PolarHBondContact O-N 3.49Å; L15-F18 VanDerWaalsContact O-CB 3.31Å; L15-F18 WeakPolarHBondContact O-CB 2.97Å; L15-F18 PolarHBondContact O-N 3.3Å; F18-S20 PolarHBondContact O-N 2.91Å; F18-G21 WeakPolarHBondContact O-CA 3.19Å; F18-G21 PolarHBondContact O-N 3.32Å; F18-G21 VanDerWaalsContact O-N 3.07Å; F18-L22 HydrophobicContact CD1-CD1 4.08Å; F18-L22 HydrophobicContact CD1-CG 4.38Å; F18-L22 HydrophobicContact CE1-CD1 3.46Å; F18-L22 VanDerWaalsContact CE1-CD1 3.46Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CE1-CG 3.91Å; F18-L22 HydrophobicContact CE2-CD2 4.48Å; F18-L22 HydrophobicContact CZ-CD1 3.91Å; F18-L22 HydrophobicContact CZ-CD2 3.96Å; F18-L22 HydrophobicContact CZ-CG 3.96Å; F18-L22 PolarHBondContact O-N 2.92Å; F18-G144 WeakPolarHBondContact CA-O 3.33Å; F18-C147 HydrophobicContact CD2-CB 3.96Å; F18-G148 VanDerWaalsContact CD2-CA 3.4Å; F18-G148 VanDerWaalsContact CD2-N 3.29Å; F18-A151 HydrophobicContact CE2-CB 3.79Å; F18-A151 HydrophobicContact CZ-CB 4.1Å; F18-A171 HydrophobicContact CE1-CB 4.37Å |
| 19 | T | 98.4 | Very high | 96.3 | Very high | 3 Ų | 3 | 12.7 Ų | 12.7 | 2% | 0.018 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -61.8 | -33.2 | 175.2 | 57.8 | 0 | 0 | 0 | 0 | 112.6 | L15 S16 A17 T23 V172 V175 | L15-T19 PolarHBondContact O-N 3.18Å; L15-T19 VanDerWaalsContact O-N 3.11Å; S16-T19 PolarHBondContact O-OG1 3.22Å; A17-T19 PolarHBondContact O-N 3.22Å; T19-T23 PolarHBondContact O-N 2.98Å; T19-T23 PolarHBondContact O-OG1 3.48Å; T19-V172 HydrophobicContact CG2-CB 4.33Å; T19-V172 HydrophobicContact CG2-CG2 3.75Å; T19-V175 HydrophobicContact CG2-CB 4.06Å; T19-V175 HydrophobicContact CG2-CG1 4.35Å; T19-V175 HydrophobicContact CG2-CG2 3.79Å |
| 20 | S | 98.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -71 | -40 | 175 | -50.8 | 0 | 0 | 0 | 0 | 110.7 | S16 A17 F18 T23 F24 L118 | S16-S20 PolarHBondContact O-OG 3.28Å; A17-S20 VanDerWaalsContact O-CB 3.31Å; A17-S20 WeakPolarHBondContact O-CB 3.04Å; A17-S20 PolarHBondContact O-N 3.34Å; A17-S20 VanDerWaalsContact O-N 3.11Å; F18-S20 PolarHBondContact O-N 2.91Å; S20-T23 WeakPolarHBondContact O-CB 3.32Å; S20-T23 PolarHBondContact O-N 3.29Å; S20-T23 VanDerWaalsContact O-N 3.14Å; S20-F24 WeakPolarHBondContact O-CD2 3.31Å; S20-F24 PolarHBondContact O-N 3Å; S20-F24 VanDerWaalsContact O-N 3.09Å; S20-L118 WeakPolarHBondContact OG-CG 3.15Å |
| 21 | G | 98.2 | Very high | 96 | Very high | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -56.5 | -47.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | A17 F18 T23 F24 G25 I145 G148 I149 | A17-G21 PolarHBondContact O-N 3.09Å; F18-G21 WeakPolarHBondContact O-CA 3.19Å; F18-G21 PolarHBondContact O-N 3.32Å; F18-G21 VanDerWaalsContact O-N 3.07Å; G21-T23 PolarHBondContact O-N 2.7Å; G21-F24 PolarHBondContact O-N 2.84Å; G21-F24 VanDerWaalsContact O-N 3.11Å; G21-G25 PolarHBondContact O-N 2.95Å; G21-G25 VanDerWaalsContact O-N 3.07Å; G21-I145 WeakPolarHBondContact CA-O 3.4Å; G21-G148 VanDerWaalsContact C-C 3.47Å; G21-I149 WeakPolarHBondContact O-CG1 3.15Å |
| 22 | L | 98.3 | Very high | 95.6 | Very high | 4 Ų | 4 | 8.8 Ų | 8.8 | 2% | 0.021 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -54.3 | -43.5 | 173.5 | -72.2 | 173.7 | 0 | 0 | 0 | 110.8 | F18 F24 G25 F26 G148 A151 D152 A171 | F18-L22 HydrophobicContact CD1-CD1 4.08Å; F18-L22 HydrophobicContact CD1-CG 4.38Å; F18-L22 HydrophobicContact CE1-CD1 3.46Å; F18-L22 VanDerWaalsContact CE1-CD1 3.46Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CE1-CG 3.91Å; F18-L22 HydrophobicContact CE2-CD2 4.48Å; F18-L22 HydrophobicContact CZ-CD1 3.91Å; F18-L22 HydrophobicContact CZ-CD2 3.96Å; F18-L22 HydrophobicContact CZ-CG 3.96Å; F18-L22 PolarHBondContact O-N 2.92Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 3.34Å; L22-G25 PolarHBondContact O-N 2.96Å; L22-F26 WeakPolarHBondContact O-CB 3.46Å; L22-F26 PolarHBondContact O-N 3.24Å; L22-F26 VanDerWaalsContact O-N 3.11Å; L22-G148 WeakPolarHBondContact CD2-O 3.4Å; L22-A151 HydrophobicContact CD2-CB 4.09Å; L22-D152 HydrophobicContact CD2-CB 4.28Å; L22-A171 HydrophobicContact CD1-CB 3.95Å |
| 23 | T | 98 | Very high | 95.3 | Very high | 2 Ų | 2 | 10.2 Ų | 10.2 | 1% | 0.012 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -65.6 | -33.4 | -178.8 | -48.2 | 0 | 0 | 0 | 0 | 112.5 | T19 S20 G21 L48 W83 R107 C114 | T19-T23 PolarHBondContact O-N 2.98Å; T19-T23 PolarHBondContact O-OG1 3.48Å; S20-T23 WeakPolarHBondContact O-CB 3.32Å; S20-T23 PolarHBondContact O-N 3.29Å; S20-T23 VanDerWaalsContact O-N 3.14Å; G21-T23 PolarHBondContact O-N 2.7Å; T23-L48 HydrophobicContact CG2-CD1 3.43Å; T23-L48 VanDerWaalsContact CG2-CD1 3.43Å; T23-L48 HydrophobicContact CG2-CD2 4Å; T23-L48 HydrophobicContact CG2-CG 4.37Å; T23-L48 WeakPolarHBondContact O-CD2 3.39Å; T23-W83 HydrophobicContact CG2-CZ2 4.23Å; T23-R107 PolarHBondContact O-NH1 3.24Å; T23-R107 VanDerWaalsContact O-NH1 3.13Å; T23-R107 PolarHBondContact O-NH2 3.48Å; T23-C114 HydrophobicContact CG2-CB 4.29Å |
| 24 | F | 97.4 | Very high | 94.8 | Very high | 20 Ų | 20 | 10.4 Ų | 10.4 | 9% | 0.088 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -70.8 | -50.7 | 175.7 | -66.5 | -42 | 0 | 0 | 0 | 112.8 | S20 G21 L22 F26 L48 L118 I145 I149 I270 Y271 W387 | S20-F24 WeakPolarHBondContact O-CD2 3.31Å; S20-F24 PolarHBondContact O-N 3Å; S20-F24 VanDerWaalsContact O-N 3.09Å; G21-F24 PolarHBondContact O-N 2.84Å; G21-F24 VanDerWaalsContact O-N 3.11Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 3.34Å; F24-F26 VanDerWaalsContact C-N 3.26Å; F24-F26 PolarHBondContact O-N 3.2Å; F24-L48 HydrophobicContact CD1-CD2 3.66Å; F24-L48 HydrophobicContact CE1-CD2 4.15Å; F24-L118 HydrophobicContact CE2-CD1 4.26Å; F24-L118 HydrophobicContact CZ-CD1 3.88Å; F24-I145 HydrophobicContact CD2-CG2 3.72Å; F24-I145 HydrophobicContact CE2-CG2 3.87Å; F24-I149 HydrophobicContact CB-CD1 4.37Å; F24-I149 HydrophobicContact CB-CG1 4.1Å; F24-I270 HydrophobicContact CB-CG2 4.09Å; F24-Y271 HydrophobicContact CB-CE2 4.31Å; F24-Y271 AromaticContact CD1-CE2 3.78Å; F24-Y271 HydrophobicContact CD1-CE2 3.78Å; F24-Y271 AromaticContact CD1-CZ 3.81Å; F24-Y271 VanDerWaalsContact CD1-OH 3.27Å; F24-Y271 WeakPolarHBondContact CD1-OH 3.21Å; F24-Y271 WeakPolarHBondContact CE1-OH 3.42Å; F24-Y271 HydrophobicContact CG-CE2 4.37Å; F24-W387 AromaticContact CE1-CH2 3.36Å; F24-W387 HydrophobicContact CE1-CH2 3.36Å; F24-W387 HydrophobicContact CE1-CZ2 4.47Å; F24-W387 AromaticContact CE1-CZ3 3.64Å; F24-W387 HydrophobicContact CE1-CZ3 3.64Å; F24-W387 AromaticContact CZ-CH2 3.59Å; F24-W387 HydrophobicContact CZ-CH2 3.59Å; F24-W387 HydrophobicContact CZ-CZ2 4.34Å; F24-W387 HydrophobicContact CZ-CZ3 4.22Å |
| 25 | G | 96.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -61.7 | -36.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G21 L22 S27 S28 D152 | G21-G25 PolarHBondContact O-N 2.95Å; G21-G25 VanDerWaalsContact O-N 3.07Å; L22-G25 PolarHBondContact O-N 2.96Å; G25-S27 PolarHBondContact O-N 2.85Å; G25-S28 VanDerWaalsContact O-CB 3.24Å; G25-S28 WeakPolarHBondContact O-CB 3.19Å; G25-S28 PolarHBondContact O-N 3.15Å; G25-D152 VanDerWaalsContact O-OD2 3.12Å |
| 26 | F | 97 | Very high | 93.2 | Very high | 1 Ų | 1 | 16.4 Ų | 16.4 | 0% | 0.004 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -52.6 | -32.2 | -170.9 | -175.7 | -107.1 | 0 | 0 | 0 | 115.4 | L22 F24 S28 T30 F44 W83 L86 D152 W161 I164 S165 | L22-F26 WeakPolarHBondContact O-CB 3.46Å; L22-F26 PolarHBondContact O-N 3.24Å; L22-F26 VanDerWaalsContact O-N 3.11Å; F24-F26 VanDerWaalsContact C-N 3.26Å; F24-F26 PolarHBondContact O-N 3.2Å; F26-S28 PolarHBondContact O-N 3.36Å; F26-T30 HydrophobicContact CE1-CG2 4.34Å; F26-T30 HydrophobicContact CZ-CG2 4.44Å; F26-T30 WeakPolarHBondContact CZ-OG1 3.44Å; F26-T30 VanDerWaalsContact O-CB 3.24Å; F26-T30 WeakPolarHBondContact O-CB 3.44Å; F26-T30 PolarHBondContact O-N 3.3Å; F26-T30 PolarHBondContact O-OG1 2.83Å; F26-F44 AromaticContact CD1-CZ 3.96Å; F26-F44 HydrophobicContact CD1-CZ 3.96Å; F26-F44 HydrophobicContact CE1-CE2 4.45Å; F26-F44 AromaticContact CE1-CZ 3.75Å; F26-F44 HydrophobicContact CE1-CZ 3.75Å; F26-W83 HydrophobicContact CB-CH2 3.8Å; F26-W83 HydrophobicContact CB-CZ3 4.28Å; F26-W83 AromaticContact CD1-CH2 3.94Å; F26-W83 HydrophobicContact CD1-CH2 3.94Å; F26-W83 AromaticContact CD1-CZ3 3.67Å; F26-W83 HydrophobicContact CD1-CZ3 3.67Å; F26-W83 AromaticContact CD2-CH2 3.96Å; F26-W83 HydrophobicContact CD2-CH2 3.96Å; F26-W83 AromaticContact CD2-CZ3 3.64Å; F26-W83 HydrophobicContact CD2-CZ3 3.64Å; F26-W83 AromaticContact CE1-CZ3 3.8Å; F26-W83 HydrophobicContact CE1-CZ3 3.8Å; F26-W83 AromaticContact CE2-CZ3 3.79Å; F26-W83 HydrophobicContact CE2-CZ3 3.79Å; F26-W83 AromaticContact CG-CH2 3.62Å; F26-W83 HydrophobicContact CG-CH2 3.62Å; F26-W83 AromaticContact CG-CZ3 3.57Å; F26-W83 HydrophobicContact CG-CZ3 3.57Å; F26-W83 AromaticContact CZ-CZ3 3.87Å; F26-W83 HydrophobicContact CZ-CZ3 3.87Å; F26-L86 HydrophobicContact CE1-CD1 3.85Å; F26-L86 HydrophobicContact CZ-CD1 4.32Å; F26-D152 WeakPolarHBondContact CA-OD1 3.31Å; F26-D152 WeakPolarHBondContact CA-OD2 3.38Å; F26-D152 PolarHBondContact N-OD2 3.15Å; F26-W161 HydrophobicContact CE2-CB 4.24Å; F26-W161 WeakPolarHBondContact CE2-O 3.37Å; F26-W161 HydrophobicContact CZ-CB 4.24Å; F26-W161 HydrophobicContact CZ-CE3 4.13Å; F26-I164 HydrophobicContact CD2-CG2 3.87Å; F26-I164 HydrophobicContact CE2-CB 4.28Å; F26-I164 HydrophobicContact CE2-CG2 3.98Å; F26-S165 WeakPolarHBondContact CE2-OG 3.13Å; F26-S165 WeakPolarHBondContact CZ-OG 3.41Å |
| 27 | S | 94.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -58.7 | -36.7 | 178.2 | -67.1 | 0 | 0 | 0 | 0 | 112.2 | G25 T31 R107 Y271 | G25-S27 PolarHBondContact O-N 2.85Å; S27-T31 VanDerWaalsContact O-CG2 3.27Å; S27-T31 WeakPolarHBondContact O-CG2 3.33Å; S27-T31 PolarHBondContact O-N 3.3Å; S27-T31 PolarHBondContact O-OG1 2.89Å; S27-R107 PolarHBondContact OG-NH2 2.71Å; S27-Y271 CarbonylContact C-O 3.39Å; S27-Y271 VanDerWaalsContact CB-O 3.24Å; S27-Y271 WeakPolarHBondContact CB-O 2.84Å |
| 28 | S | 93.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -66 | -60 | -164.2 | -162.7 | 0 | 0 | 0 | 0 | 111.6 | G25 F26 T30 T31 Y271 A273 E274 | G25-S28 VanDerWaalsContact O-CB 3.24Å; G25-S28 WeakPolarHBondContact O-CB 3.19Å; G25-S28 PolarHBondContact O-N 3.15Å; F26-S28 PolarHBondContact O-N 3.36Å; S28-T30 PolarHBondContact O-N 2.97Å; S28-T31 PolarHBondContact O-OG1 3.09Å; S28-Y271 WeakPolarHBondContact CA-O 3.42Å; S28-Y271 PolarHBondContact N-O 2.82Å; S28-Y271 VanDerWaalsContact N-O 3.14Å; S28-A273 PolarHBondContact OG-N 2.67Å; S28-E274 WeakPolarHBondContact CB-OE2 3.3Å; S28-E274 VanDerWaalsContact OG-CG 3.3Å; S28-E274 WeakPolarHBondContact OG-CG 3.41Å; S28-E274 PolarHBondContact OG-N 2.8Å; S28-E274 PolarHBondContact OG-OE2 3.39Å |
| 29 | A | 90.4 | Very high | 91.8 | Very high | 1 Ų | 1 | 26.3 Ų | 26.3 | 1% | 0.008 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.6 | -39 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | T31 L32 Q33 A156 E274 Y285 | A29-T31 VanDerWaalsContact C-N 3.34Å; A29-T31 PolarHBondContact O-N 3.4Å; A29-L32 PolarHBondContact O-N 3.25Å; A29-Q33 WeakPolarHBondContact O-CG 3.49Å; A29-Q33 PolarHBondContact O-N 2.9Å; A29-A156 HydrophobicContact CB-CB 3.28Å; A29-E274 HydrophobicContact CB-CG 4.34Å; A29-Y285 HydrophobicContact CB-CE1 4.25Å |
| 30 | T | 92.5 | Very high | 91.5 | Very high | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.006 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61 | -41.1 | -176.6 | -57.8 | 0 | 0 | 0 | 0 | 112.3 | F26 S28 L32 Q33 I34 F44 F103 W161 | F26-T30 HydrophobicContact CE1-CG2 4.34Å; F26-T30 HydrophobicContact CZ-CG2 4.44Å; F26-T30 WeakPolarHBondContact CZ-OG1 3.44Å; F26-T30 VanDerWaalsContact O-CB 3.24Å; F26-T30 WeakPolarHBondContact O-CB 3.44Å; F26-T30 PolarHBondContact O-N 3.3Å; F26-T30 PolarHBondContact O-OG1 2.83Å; S28-T30 PolarHBondContact O-N 2.97Å; T30-L32 VanDerWaalsContact C-N 3.31Å; T30-L32 PolarHBondContact O-N 2.84Å; T30-Q33 PolarHBondContact O-N 3.28Å; T30-I34 HydrophobicContact CG2-CD1 3.46Å; T30-I34 VanDerWaalsContact CG2-CD1 3.46Å; T30-I34 HydrophobicContact CG2-CG1 4.31Å; T30-I34 WeakPolarHBondContact O-CG1 3.42Å; T30-I34 PolarHBondContact O-N 3.5Å; T30-I34 VanDerWaalsContact O-N 3.12Å; T30-F44 HydrophobicContact CG2-CE1 3.62Å; T30-F44 HydrophobicContact CG2-CZ 3.57Å; T30-F103 HydrophobicContact CG2-CE2 4.45Å; T30-F103 HydrophobicContact CG2-CZ 4.21Å; T30-W161 HydrophobicContact CG2-CB 3.93Å; T30-W161 HydrophobicContact CG2-CD2 4.2Å; T30-W161 HydrophobicContact CG2-CE3 4.44Å; T30-W161 HydrophobicContact CG2-CG 3.99Å; T30-W161 WeakPolarHBondContact OG1-CB 2.97Å |
| 31 | T | 87.2 | Confident | 91.1 | Very high | 9 Ų | 9 | 30.6 Ų | 30.6 | 6% | 0.055 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.7 | -36.2 | 178.4 | 54.2 | 0 | 0 | 0 | 0 | 112.8 | S27 S28 A29 Y35 A41 F44 F272 | S27-T31 VanDerWaalsContact O-CG2 3.27Å; S27-T31 WeakPolarHBondContact O-CG2 3.33Å; S27-T31 PolarHBondContact O-N 3.3Å; S27-T31 PolarHBondContact O-OG1 2.89Å; S28-T31 PolarHBondContact O-OG1 3.09Å; A29-T31 VanDerWaalsContact C-N 3.34Å; A29-T31 PolarHBondContact O-N 3.4Å; T31-Y35 PolarHBondContact O-N 3.26Å; T31-A41 HydrophobicContact CG2-CB 4.2Å; T31-F44 HydrophobicContact CG2-CD1 3.92Å; T31-F44 HydrophobicContact CG2-CE1 4.4Å; T31-F272 HydrophobicContact CG2-CD1 4.47Å; T31-F272 HydrophobicContact CG2-CE1 4.2Å |
| 32 | L | 86.4 | Confident | 90.8 | Very high | 23 Ų | 23 | 30.6 Ų | 30.6 | 12% | 0.12 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -76.2 | -38.8 | 175.2 | -71.8 | -170.6 | 0 | 0 | 0 | 113.6 | A29 T30 Y35 E274 S275 L278 S284 | A29-L32 PolarHBondContact O-N 3.25Å; T30-L32 VanDerWaalsContact C-N 3.31Å; T30-L32 PolarHBondContact O-N 2.84Å; L32-Y35 VanDerWaalsContact O-CD2 3.31Å; L32-Y35 WeakPolarHBondContact O-CD2 3.44Å; L32-Y35 VanDerWaalsContact O-CE2 3.25Å; L32-Y35 WeakPolarHBondContact O-CE2 3.45Å; L32-E274 HydrophobicContact CD1-CB 3.65Å; L32-E274 HydrophobicContact CD1-CG 4.26Å; L32-S275 WeakPolarHBondContact CD2-OG 3.32Å; L32-L278 HydrophobicContact CD1-CD1 3.86Å; L32-L278 HydrophobicContact CD2-CD1 3.68Å; L32-L278 HydrophobicContact CG-CD1 4.48Å; L32-S284 WeakPolarHBondContact CD1-OG 3.13Å |
| 33 | Q | 89 | Confident | 90.6 | Very high | 29 Ų | 29 | 32 Ų | 32 | 14% | 0.136 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -69.6 | -34.9 | -176.8 | -72 | 177.5 | -0.5 | 0 | 0 | 112.6 | A29 T30 L159 W161 Y285 | A29-Q33 WeakPolarHBondContact O-CG 3.49Å; A29-Q33 PolarHBondContact O-N 2.9Å; T30-Q33 PolarHBondContact O-N 3.28Å; Q33-L159 PolarHBondContact NE2-O 3Å; Q33-W161 VanDerWaalsContact OE1-CB 3.29Å; Q33-Y285 HydrophobicContact CG-CE1 4.49Å; Q33-Y285 WeakPolarHBondContact CG-OH 3.29Å |
| 34 | I | 86.5 | Confident | 90.4 | Very high | 6 Ų | 6 | 32.1 Ų | 32.1 | 3% | 0.031 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -87.4 | -20.2 | -179.4 | -56.1 | 168.1 | 0 | 0 | 0 | 112.1 | T30 F36 V93 F103 W161 | T30-I34 HydrophobicContact CG2-CD1 3.46Å; T30-I34 VanDerWaalsContact CG2-CD1 3.46Å; T30-I34 HydrophobicContact CG2-CG1 4.31Å; T30-I34 WeakPolarHBondContact O-CG1 3.42Å; T30-I34 PolarHBondContact O-N 3.5Å; T30-I34 VanDerWaalsContact O-N 3.12Å; I34-F36 VanDerWaalsContact C-N 3.34Å; I34-F36 HydrophobicContact CB-CD2 4.17Å; I34-F36 HydrophobicContact CB-CE1 4.4Å; I34-F36 HydrophobicContact CB-CE2 4.01Å; I34-F36 HydrophobicContact CB-CG 4.44Å; I34-F36 HydrophobicContact CB-CZ 4.14Å; I34-F36 HydrophobicContact CD1-CD2 4.41Å; I34-F36 HydrophobicContact CD1-CE2 3.56Å; I34-F36 HydrophobicContact CD1-CZ 3.78Å; I34-F36 HydrophobicContact CG1-CE2 4.4Å; I34-F36 HydrophobicContact CG2-CD1 3.68Å; I34-F36 HydrophobicContact CG2-CD2 4.08Å; I34-F36 HydrophobicContact CG2-CE1 3.33Å; I34-F36 HydrophobicContact CG2-CE2 3.78Å; I34-F36 HydrophobicContact CG2-CG 4.04Å; I34-F36 HydrophobicContact CG2-CZ 3.41Å; I34-F36 VanDerWaalsContact CG2-CZ 3.41Å; I34-F36 PolarHBondContact O-N 2.91Å; I34-V93 HydrophobicContact CD1-CG1 4.03Å; I34-V93 HydrophobicContact CG1-CG1 4.28Å; I34-V93 HydrophobicContact CG2-CG1 3.63Å; I34-F103 HydrophobicContact CD1-CE2 3.77Å; I34-F103 HydrophobicContact CD1-CZ 3.74Å; I34-W161 HydrophobicContact CD1-CD2 4.05Å; I34-W161 HydrophobicContact CD1-CG 4.36Å; I34-W161 HydrophobicContact CD1-CZ2 3.98Å; I34-W161 HydrophobicContact CG1-CD2 4.47Å; I34-W161 HydrophobicContact CG1-CG 4.44Å; I34-W161 HydrophobicContact CG1-CZ2 4.38Å |
| 35 | Y | 78.8 | Confident | 90.1 | Very high | 186 Ų | 186 | 31.1 Ų | 31.1 | 73% | 0.729 | 15% | 0.148 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 54.2 | 46.1 | -174.5 | -62.9 | -86.7 | 0 | 0 | 0 | 113.1 | T31 L32 | T31-Y35 PolarHBondContact O-N 3.26Å; L32-Y35 VanDerWaalsContact O-CD2 3.31Å; L32-Y35 WeakPolarHBondContact O-CD2 3.44Å; L32-Y35 VanDerWaalsContact O-CE2 3.25Å; L32-Y35 WeakPolarHBondContact O-CE2 3.45Å |
| 36 | F | 81.7 | Confident | 90.1 | Very high | 21 Ų | 21 | 31.2 Ų | 31.2 | 9% | 0.092 | 15% | 0.149 | C | C | . | . | trans | -60.4 | 150.1 | 173.7 | -74.9 | -45.7 | 0 | 0 | 0 | 111.6 | I34 W40 A41 V93 P99 F103 | I34-F36 VanDerWaalsContact C-N 3.34Å; I34-F36 HydrophobicContact CB-CD2 4.17Å; I34-F36 HydrophobicContact CB-CE1 4.4Å; I34-F36 HydrophobicContact CB-CE2 4.01Å; I34-F36 HydrophobicContact CB-CG 4.44Å; I34-F36 HydrophobicContact CB-CZ 4.14Å; I34-F36 HydrophobicContact CD1-CD2 4.41Å; I34-F36 HydrophobicContact CD1-CE2 3.56Å; I34-F36 HydrophobicContact CD1-CZ 3.78Å; I34-F36 HydrophobicContact CG1-CE2 4.4Å; I34-F36 HydrophobicContact CG2-CD1 3.68Å; I34-F36 HydrophobicContact CG2-CD2 4.08Å; I34-F36 HydrophobicContact CG2-CE1 3.33Å; I34-F36 HydrophobicContact CG2-CE2 3.78Å; I34-F36 HydrophobicContact CG2-CG 4.04Å; I34-F36 HydrophobicContact CG2-CZ 3.41Å; I34-F36 VanDerWaalsContact CG2-CZ 3.41Å; I34-F36 PolarHBondContact O-N 2.91Å; F36-W40 HydrophobicContact CB-CB 3.93Å; F36-W40 HydrophobicContact CD1-CB 4.2Å; F36-W40 HydrophobicContact CG-CB 4.05Å; F36-A41 HydrophobicContact CB-CB 4.37Å; F36-V93 HydrophobicContact CE1-CG1 4.38Å; F36-V93 HydrophobicContact CZ-CG1 4.11Å; F36-P99 HydrophobicContact CE1-CB 4.15Å; F36-P99 HydrophobicContact CE1-CG 4.26Å; F36-P99 HydrophobicContact CZ-CB 4.02Å; F36-F103 HydrophobicContact CE2-CD1 4.46Å; F36-F103 AromaticContact CE2-CE1 3.48Å; F36-F103 HydrophobicContact CE2-CE1 3.48Å; F36-F103 VanDerWaalsContact CE2-CE1 3.48Å; F36-F103 AromaticContact CE2-CZ 3.55Å; F36-F103 HydrophobicContact CE2-CZ 3.55Å; F36-F103 HydrophobicContact CZ-CD1 4.2Å; F36-F103 AromaticContact CZ-CE1 3.63Å; F36-F103 HydrophobicContact CZ-CE1 3.63Å; F36-F103 AromaticContact CZ-CZ 3.86Å; F36-F103 HydrophobicContact CZ-CZ 3.86Å | ||
| 37 | N | 87.6 | Confident | 90.1 | Very high | 89 Ų | 89 | 32.4 Ų | 32.4 | 48% | 0.476 | 16% | 0.155 | S | C | . | . | trans | -63.5 | 163.8 | 167.2 | 74.9 | 12.1 | 0 | 0 | 0 | 110.8 | I39 W40 A41 | N37-I39 VanDerWaalsContact C-N 3.26Å; N37-I39 PolarHBondContact O-N 3.38Å; N37-I39 VanDerWaalsContact O-N 3.14Å; N37-I39 PolarHBondContact OD1-N 3.28Å; N37-W40 PolarHBondContact O-N 3.01Å; N37-W40 VanDerWaalsContact O-N 3.1Å; N37-W40 WeakPolarHBondContact OD1-CB 3.48Å; N37-W40 PolarHBondContact OD1-N 3.3Å; N37-A41 PolarHBondContact O-N 3.4Å | ||
| 38 | T | 88 | Confident | 90.3 | Very high | 50 Ų | 50 | 32.4 Ų | 32.4 | 31% | 0.307 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -49.5 | -43.5 | -176.3 | -49.6 | 0 | 0 | 0 | 0 | 113.4 | A42 E398 P399 | T38-A42 WeakPolarHBondContact O-CB 3.39Å; T38-A42 PolarHBondContact O-N 2.83Å; T38-A42 VanDerWaalsContact O-N 3.15Å; T38-E398 HydrophobicContact CG2-CB 3.71Å; T38-E398 WeakPolarHBondContact CG2-O 3.46Å; T38-E398 WeakPolarHBondContact O-CB 3.39Å; T38-P399 HydrophobicContact CG2-CG 4.46Å |
| 39 | I | 91.2 | Very high | 90.5 | Very high | 108 Ų | 108 | 32.5 Ų | 32.5 | 55% | 0.554 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -68.4 | -46.5 | -178.2 | -61.5 | 171.2 | 0 | 0 | 0 | 110.7 | N37 A42 V43 | N37-I39 VanDerWaalsContact C-N 3.26Å; N37-I39 PolarHBondContact O-N 3.38Å; N37-I39 VanDerWaalsContact O-N 3.14Å; N37-I39 PolarHBondContact OD1-N 3.28Å; I39-A42 PolarHBondContact O-N 3.24Å; I39-V43 HydrophobicContact CG2-CG2 4.35Å; I39-V43 VanDerWaalsContact O-CG2 3.28Å; I39-V43 WeakPolarHBondContact O-CG2 3.33Å; I39-V43 PolarHBondContact O-N 3.17Å |
| 40 | W | 90.8 | Very high | 90.9 | Very high | 89 Ų | 89 | 34.8 Ų | 34.8 | 34% | 0.337 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -70.5 | -34.4 | -178.2 | -75 | 125.2 | 0 | 0 | 0 | 112.9 | F36 N37 A42 V43 F44 P99 I104 | F36-W40 HydrophobicContact CB-CB 3.93Å; F36-W40 HydrophobicContact CD1-CB 4.2Å; F36-W40 HydrophobicContact CG-CB 4.05Å; N37-W40 PolarHBondContact O-N 3.01Å; N37-W40 VanDerWaalsContact O-N 3.1Å; N37-W40 WeakPolarHBondContact OD1-CB 3.48Å; N37-W40 PolarHBondContact OD1-N 3.3Å; W40-A42 VanDerWaalsContact C-N 3.35Å; W40-V43 HydrophobicContact CE3-CB 4.19Å; W40-V43 HydrophobicContact CE3-CG1 4.15Å; W40-V43 HydrophobicContact CZ3-CG1 4.19Å; W40-V43 PolarHBondContact O-N 2.72Å; W40-F44 VanDerWaalsContact O-CB 3.23Å; W40-F44 WeakPolarHBondContact O-CB 3Å; W40-F44 PolarHBondContact O-N 3.16Å; W40-P99 HydrophobicContact CB-CG 4.3Å; W40-P99 HydrophobicContact CD2-CG 3.25Å; W40-P99 HydrophobicContact CE3-CB 4.43Å; W40-P99 HydrophobicContact CE3-CG 3.29Å; W40-P99 HydrophobicContact CG-CG 3.73Å; W40-P99 HydrophobicContact CH2-CG 4Å; W40-P99 HydrophobicContact CZ2-CG 3.99Å; W40-P99 HydrophobicContact CZ3-CG 3.67Å; W40-I104 HydrophobicContact CH2-CD1 4.17Å; W40-I104 HydrophobicContact CZ3-CD1 3.8Å |
| 41 | A | 90 | Very high | 91.2 | Very high | 4 Ų | 4 | 34.7 Ų | 34.7 | 3% | 0.033 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.8 | -44.8 | 171 | 0 | 0 | 0 | 0 | 0 | 111.3 | T31 F36 N37 F44 G45 E398 | T31-A41 HydrophobicContact CG2-CB 4.2Å; F36-A41 HydrophobicContact CB-CB 4.37Å; N37-A41 PolarHBondContact O-N 3.4Å; A41-F44 PolarHBondContact O-N 3.44Å; A41-G45 PolarHBondContact O-N 3.5Å; A41-E398 HydrophobicContact CB-CG 3.98Å |
| 42 | A | 92.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.5 | -44.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | T38 I39 W40 S46 F395 E398 P399 | T38-A42 WeakPolarHBondContact O-CB 3.39Å; T38-A42 PolarHBondContact O-N 2.83Å; T38-A42 VanDerWaalsContact O-N 3.15Å; I39-A42 PolarHBondContact O-N 3.24Å; W40-A42 VanDerWaalsContact C-N 3.35Å; A42-S46 WeakPolarHBondContact O-CB 3.39Å; A42-S46 PolarHBondContact O-N 3Å; A42-S46 PolarHBondContact O-OG 3.22Å; A42-F395 HydrophobicContact CB-CD2 4.38Å; A42-F395 WeakPolarHBondContact CB-O 3.42Å; A42-E398 HydrophobicContact CB-CB 4.04Å; A42-P399 HydrophobicContact CB-CG 4.2Å |
| 43 | V | 94.1 | Very high | 92.3 | Very high | 33 Ų | 33 | 34.5 Ų | 34.5 | 20% | 0.2 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -61 | -48.8 | 175.8 | 169.7 | 0 | 0 | 0 | 0 | 110.2 | I39 W40 G45 S46 L47 F395 | I39-V43 HydrophobicContact CG2-CG2 4.35Å; I39-V43 VanDerWaalsContact O-CG2 3.28Å; I39-V43 WeakPolarHBondContact O-CG2 3.33Å; I39-V43 PolarHBondContact O-N 3.17Å; W40-V43 HydrophobicContact CE3-CB 4.19Å; W40-V43 HydrophobicContact CE3-CG1 4.15Å; W40-V43 HydrophobicContact CZ3-CG1 4.19Å; W40-V43 PolarHBondContact O-N 2.72Å; V43-G45 PolarHBondContact O-N 3.36Å; V43-S46 PolarHBondContact O-N 3.16Å; V43-S46 PolarHBondContact O-OG 3.21Å; V43-S46 VanDerWaalsContact O-OG 3.13Å; V43-L47 HydrophobicContact CG1-CD1 3.73Å; V43-L47 HydrophobicContact CG1-CG 4.08Å; V43-L47 WeakPolarHBondContact O-CB 3.48Å; V43-L47 WeakPolarHBondContact O-CG 3.48Å; V43-L47 PolarHBondContact O-N 2.97Å; V43-F395 HydrophobicContact CG2-CE2 3.9Å |
| 44 | F | 93 | Very high | 92.8 | Very high | 4 Ų | 4 | 36.6 Ų | 36.6 | 2% | 0.018 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.6 | -47.3 | -179.1 | 173.3 | -108.9 | 0 | 0 | 0 | 112.7 | F26 T30 T31 W40 A41 S46 L86 F103 R107 | F26-F44 AromaticContact CD1-CZ 3.96Å; F26-F44 HydrophobicContact CD1-CZ 3.96Å; F26-F44 HydrophobicContact CE1-CE2 4.45Å; F26-F44 AromaticContact CE1-CZ 3.75Å; F26-F44 HydrophobicContact CE1-CZ 3.75Å; T30-F44 HydrophobicContact CG2-CE1 3.62Å; T30-F44 HydrophobicContact CG2-CZ 3.57Å; T31-F44 HydrophobicContact CG2-CD1 3.92Å; T31-F44 HydrophobicContact CG2-CE1 4.4Å; W40-F44 VanDerWaalsContact O-CB 3.23Å; W40-F44 WeakPolarHBondContact O-CB 3Å; W40-F44 PolarHBondContact O-N 3.16Å; A41-F44 PolarHBondContact O-N 3.44Å; F44-S46 VanDerWaalsContact C-N 3.34Å; F44-S46 PolarHBondContact O-N 2.94Å; F44-L86 HydrophobicContact CE2-CD2 4.45Å; F44-F103 HydrophobicContact CB-CE1 4.36Å; F44-F103 HydrophobicContact CD2-CD1 4.15Å; F44-F103 AromaticContact CD2-CE1 3.15Å; F44-F103 HydrophobicContact CD2-CE1 3.15Å; F44-F103 HydrophobicContact CD2-CE2 4.49Å; F44-F103 AromaticContact CD2-CZ 3.37Å; F44-F103 HydrophobicContact CD2-CZ 3.37Å; F44-F103 HydrophobicContact CE1-CZ 4.45Å; F44-F103 HydrophobicContact CE2-CD1 4.48Å; F44-F103 AromaticContact CE2-CE1 3.5Å; F44-F103 HydrophobicContact CE2-CE1 3.5Å; F44-F103 HydrophobicContact CE2-CE2 4.01Å; F44-F103 AromaticContact CE2-CZ 3.19Å; F44-F103 HydrophobicContact CE2-CZ 3.19Å; F44-F103 AromaticContact CG-CE1 3.87Å; F44-F103 HydrophobicContact CG-CE1 3.87Å; F44-F103 HydrophobicContact CG-CZ 4.07Å; F44-F103 HydrophobicContact CZ-CE1 4.44Å; F44-F103 AromaticContact CZ-CZ 3.8Å; F44-F103 HydrophobicContact CZ-CZ 3.8Å; F44-R107 HydrophobicContact CD2-CB 4.07Å; F44-R107 HydrophobicContact CD2-CG 3.75Å; F44-R107 HydrophobicContact CE2-CB 3.99Å; F44-R107 HydrophobicContact CE2-CG 3.71Å; F44-R107 WeakPolarHBondContact O-CG 3.45Å |
| 45 | G | 92.4 | Very high | 93.4 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.8 | -42.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A41 V43 Y271 I394 | A41-G45 PolarHBondContact O-N 3.5Å; V43-G45 PolarHBondContact O-N 3.36Å; G45-Y271 WeakPolarHBondContact O-CE1 3.11Å; G45-I394 VanDerWaalsContact C-CG2 3.43Å |
| 46 | S | 96.1 | Very high | 94.3 | Very high | 2 Ų | 2 | 27.4 Ų | 27.4 | 1% | 0.014 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -80.2 | -23.3 | -175.2 | 65 | 0 | 0 | 0 | 0 | 114.4 | A42 V43 F44 L48 N49 V50 F395 | A42-S46 WeakPolarHBondContact O-CB 3.39Å; A42-S46 PolarHBondContact O-N 3Å; A42-S46 PolarHBondContact O-OG 3.22Å; V43-S46 PolarHBondContact O-N 3.16Å; V43-S46 PolarHBondContact O-OG 3.21Å; V43-S46 VanDerWaalsContact O-OG 3.13Å; F44-S46 VanDerWaalsContact C-N 3.34Å; F44-S46 PolarHBondContact O-N 2.94Å; S46-L48 PolarHBondContact O-N 3.2Å; S46-N49 WeakPolarHBondContact O-CA 3.44Å; S46-N49 VanDerWaalsContact O-CB 3.31Å; S46-N49 WeakPolarHBondContact O-CB 3.12Å; S46-N49 PolarHBondContact O-N 3.02Å; S46-V50 PolarHBondContact O-N 3Å; S46-V50 VanDerWaalsContact O-N 3.15Å; S46-F395 WeakPolarHBondContact OG-CD2 3.1Å |
| 47 | L | 96.9 | Very high | 95 | Very high | 25 Ų | 25 | 30.7 Ų | 30.7 | 13% | 0.131 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -59.4 | -31 | 177.7 | -85.8 | 168.4 | 0 | 0 | 0 | 113.4 | V43 N49 V50 G51 I104 R107 L108 | V43-L47 HydrophobicContact CG1-CD1 3.73Å; V43-L47 HydrophobicContact CG1-CG 4.08Å; V43-L47 WeakPolarHBondContact O-CB 3.48Å; V43-L47 WeakPolarHBondContact O-CG 3.48Å; V43-L47 PolarHBondContact O-N 2.97Å; L47-N49 VanDerWaalsContact C-N 3.28Å; L47-N49 PolarHBondContact O-N 3.48Å; L47-V50 PolarHBondContact O-N 3.41Å; L47-G51 PolarHBondContact O-N 3.47Å; L47-I104 HydrophobicContact CD1-CB 4.4Å; L47-I104 HydrophobicContact CD1-CG1 4.46Å; L47-I104 HydrophobicContact CD1-CG2 3.81Å; L47-R107 HydrophobicContact CB-CB 4.38Å; L47-R107 HydrophobicContact CB-CG 3.91Å; L47-L108 HydrophobicContact CD2-CD1 4.44Å |
| 48 | L | 97.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -55 | -47.1 | 169.3 | 170.1 | 53.1 | 0 | 0 | 0 | 111 | T23 F24 S46 G51 G52 R107 G111 C114 Y271 W387 | T23-L48 HydrophobicContact CG2-CD1 3.43Å; T23-L48 VanDerWaalsContact CG2-CD1 3.43Å; T23-L48 HydrophobicContact CG2-CD2 4Å; T23-L48 HydrophobicContact CG2-CG 4.37Å; T23-L48 WeakPolarHBondContact O-CD2 3.39Å; F24-L48 HydrophobicContact CD1-CD2 3.66Å; F24-L48 HydrophobicContact CE1-CD2 4.15Å; S46-L48 PolarHBondContact O-N 3.2Å; L48-G51 PolarHBondContact O-N 2.89Å; L48-G52 PolarHBondContact O-N 3.41Å; L48-R107 VanDerWaalsContact CD2-NH2 3.34Å; L48-G111 WeakPolarHBondContact O-CA 3.49Å; L48-C114 HydrophobicContact CD1-CB 4.04Å; L48-Y271 HydrophobicContact CB-CE1 4.4Å; L48-Y271 HydrophobicContact CD2-CE1 3.82Å; L48-Y271 VanDerWaalsContact CD2-OH 3.31Å; L48-Y271 WeakPolarHBondContact CD2-OH 3.44Å; L48-Y271 HydrophobicContact CG-CE1 4.4Å; L48-W387 HydrophobicContact CG-CZ3 4.39Å |
| 49 | N | 98.4 | Very high | 95.8 | Very high | 3 Ų | 3 | 29.2 Ų | 29.2 | 2% | 0.016 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -68 | -38.7 | -179 | -65.5 | -83.8 | 0 | 0 | 0 | 111.8 | S46 L47 G51 G52 V53 Y271 W387 F391 | S46-N49 WeakPolarHBondContact O-CA 3.44Å; S46-N49 VanDerWaalsContact O-CB 3.31Å; S46-N49 WeakPolarHBondContact O-CB 3.12Å; S46-N49 PolarHBondContact O-N 3.02Å; L47-N49 VanDerWaalsContact C-N 3.28Å; L47-N49 PolarHBondContact O-N 3.48Å; N49-G51 VanDerWaalsContact C-N 3.33Å; N49-G51 PolarHBondContact O-N 3.37Å; N49-G52 CarbonylContact O-C 3.59Å; N49-G52 WeakPolarHBondContact O-CA 3.43Å; N49-G52 PolarHBondContact O-N 3.08Å; N49-G52 VanDerWaalsContact O-N 3.08Å; N49-V53 WeakPolarHBondContact O-CG2 3.33Å; N49-V53 PolarHBondContact O-N 3.02Å; N49-Y271 WeakPolarHBondContact ND2-CE1 3.45Å; N49-W387 HydrophobicContact CB-CE3 4.19Å; N49-W387 VanDerWaalsContact OD1-CE3 3.31Å; N49-F391 HydrophobicContact CB-CB 3.7Å |
| 50 | V | 98.5 | Very high | 95.8 | Very high | 48 Ų | 48 | 24.2 Ų | 24.2 | 29% | 0.291 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -58.1 | -48 | 172.9 | -179.9 | 0 | 0 | 0 | 0 | 110.5 | S46 L47 G52 V53 I54 L108 F391 | S46-V50 PolarHBondContact O-N 3Å; S46-V50 VanDerWaalsContact O-N 3.15Å; L47-V50 PolarHBondContact O-N 3.41Å; V50-G52 VanDerWaalsContact C-N 3.29Å; V50-G52 PolarHBondContact O-N 3.25Å; V50-V53 PolarHBondContact O-N 3.16Å; V50-I54 HydrophobicContact CG1-CD1 4.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.45Å; V50-I54 PolarHBondContact O-N 3.38Å; V50-L108 HydrophobicContact CB-CD1 4.18Å; V50-L108 HydrophobicContact CG1-CD1 3.93Å; V50-F391 HydrophobicContact CG2-CD2 3.42Å; V50-F391 VanDerWaalsContact CG2-CD2 3.42Å; V50-F391 HydrophobicContact CG2-CE2 3.56Å; V50-F391 HydrophobicContact CG2-CG 4.34Å |
| 51 | G | 98.6 | Very high | 96 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.4 | -42.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | L47 L48 N49 V53 I54 G55 G111 I112 | L47-G51 PolarHBondContact O-N 3.47Å; L48-G51 PolarHBondContact O-N 2.89Å; N49-G51 VanDerWaalsContact C-N 3.33Å; N49-G51 PolarHBondContact O-N 3.37Å; G51-V53 VanDerWaalsContact C-N 3.34Å; G51-V53 PolarHBondContact O-N 3.16Å; G51-I54 PolarHBondContact O-N 2.91Å; G51-I54 VanDerWaalsContact O-N 3.16Å; G51-G55 PolarHBondContact O-N 3.32Å; G51-G111 CarbonylContact C-O 3.58Å; G51-G111 VanDerWaalsContact C-O 3.26Å; G51-I112 VanDerWaalsContact O-CA 3.27Å; G51-I112 WeakPolarHBondContact O-CA 3.42Å |
| 52 | G | 98.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -57.1 | -42.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L48 N49 V50 S56 G111 | L48-G52 PolarHBondContact O-N 3.41Å; N49-G52 CarbonylContact O-C 3.59Å; N49-G52 WeakPolarHBondContact O-CA 3.43Å; N49-G52 PolarHBondContact O-N 3.08Å; N49-G52 VanDerWaalsContact O-N 3.08Å; V50-G52 VanDerWaalsContact C-N 3.29Å; V50-G52 PolarHBondContact O-N 3.25Å; G52-S56 VanDerWaalsContact O-CB 3.25Å; G52-S56 WeakPolarHBondContact O-CB 3.38Å; G52-S56 PolarHBondContact O-N 3.4Å; G52-S56 PolarHBondContact O-OG 3.41Å; G52-G111 WeakPolarHBondContact CA-O 3.43Å; G52-G111 PolarHBondContact N-O 3.35Å |
| 53 | V | 98.7 | Very high | 96.4 | Very high | 27 Ų | 27 | 25.3 Ų | 25.3 | 16% | 0.164 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.6 | -52 | 173 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | N49 V50 G51 G55 S56 L57 T384 W387 I388 | N49-V53 WeakPolarHBondContact O-CG2 3.33Å; N49-V53 PolarHBondContact O-N 3.02Å; V50-V53 PolarHBondContact O-N 3.16Å; G51-V53 VanDerWaalsContact C-N 3.34Å; G51-V53 PolarHBondContact O-N 3.16Å; V53-G55 PolarHBondContact O-N 2.72Å; V53-S56 PolarHBondContact O-N 2.97Å; V53-S56 PolarHBondContact O-OG 3.45Å; V53-L57 HydrophobicContact CG1-CD1 3.89Å; V53-L57 WeakPolarHBondContact O-CB 3.23Å; V53-L57 VanDerWaalsContact O-CG 3.31Å; V53-L57 WeakPolarHBondContact O-CG 3.24Å; V53-L57 PolarHBondContact O-N 2.84Å; V53-T384 HydrophobicContact CG1-CG2 4.12Å; V53-W387 HydrophobicContact CB-CB 4.43Å; V53-W387 HydrophobicContact CG2-CB 3.51Å; V53-I388 HydrophobicContact CG1-CG1 4.27Å; V53-I388 HydrophobicContact CG2-CB 4.49Å; V53-I388 HydrophobicContact CG2-CG1 3.61Å |
| 54 | I | 98.4 | Very high | 96.3 | Very high | 73 Ų | 73 | 24.6 Ų | 24.6 | 37% | 0.374 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -61 | -48.2 | -178.9 | -63.9 | 166.8 | 0 | 0 | 0 | 110.2 | V50 G51 L57 W58 L108 I112 | V50-I54 HydrophobicContact CG1-CD1 4.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.45Å; V50-I54 PolarHBondContact O-N 3.38Å; G51-I54 PolarHBondContact O-N 2.91Å; G51-I54 VanDerWaalsContact O-N 3.16Å; I54-L57 PolarHBondContact O-N 3.46Å; I54-W58 WeakPolarHBondContact O-CB 3.41Å; I54-W58 PolarHBondContact O-N 2.85Å; I54-L108 HydrophobicContact CD1-CD1 4.44Å; I54-I112 HydrophobicContact CB-CG1 4.19Å; I54-I112 HydrophobicContact CD1-CD1 4.48Å; I54-I112 HydrophobicContact CG2-CD1 4.24Å; I54-I112 HydrophobicContact CG2-CG1 4.18Å |
| 55 | G | 98.4 | Very high | 96.3 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.3 | -44.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | G51 V53 W58 S59 L116 | G51-G55 PolarHBondContact O-N 3.32Å; V53-G55 PolarHBondContact O-N 2.72Å; G55-W58 PolarHBondContact O-N 3.16Å; G55-S59 WeakPolarHBondContact O-CB 3.37Å; G55-S59 PolarHBondContact O-N 2.71Å; G55-L116 WeakPolarHBondContact O-CD2 3.34Å |
| 56 | S | 97.6 | Very high | 96.4 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.1 | -45.7 | 177 | 55.1 | 0 | 0 | 0 | 0 | 111.8 | G52 V53 W58 S59 T119 K380 T384 | G52-S56 VanDerWaalsContact O-CB 3.25Å; G52-S56 WeakPolarHBondContact O-CB 3.38Å; G52-S56 PolarHBondContact O-N 3.4Å; G52-S56 PolarHBondContact O-OG 3.41Å; V53-S56 PolarHBondContact O-N 2.97Å; V53-S56 PolarHBondContact O-OG 3.45Å; S56-W58 VanDerWaalsContact C-N 3.3Å; S56-W58 PolarHBondContact O-N 3.35Å; S56-S59 PolarHBondContact O-N 3.4Å; S56-S59 PolarHBondContact O-OG 3.24Å; S56-T119 WeakPolarHBondContact CB-OG1 3.37Å; S56-K380 WeakPolarHBondContact O-CG 3.39Å; S56-T384 PolarHBondContact OG-OG1 2.85Å |
| 57 | L | 96.8 | Very high | 96.4 | Very high | 90 Ų | 90 | 34.7 Ų | 34.7 | 47% | 0.471 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -58.9 | -40.8 | 176.4 | -75.7 | 174.3 | 0 | 0 | 0 | 112.7 | V53 I54 T384 | V53-L57 HydrophobicContact CG1-CD1 3.89Å; V53-L57 WeakPolarHBondContact O-CB 3.23Å; V53-L57 VanDerWaalsContact O-CG 3.31Å; V53-L57 WeakPolarHBondContact O-CG 3.24Å; V53-L57 PolarHBondContact O-N 2.84Å; I54-L57 PolarHBondContact O-N 3.46Å; L57-T384 HydrophobicContact CD1-CG2 4.25Å; L57-T384 HydrophobicContact CD2-CG2 3.76Å; L57-T384 HydrophobicContact CG-CG2 3.75Å |
| 58 | W | 96.1 | Very high | 96.3 | Very high | 107 Ų | 107 | 33.5 Ų | 33.5 | 41% | 0.405 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -79 | -28.2 | -176.3 | -159.6 | 14.9 | 0 | 0 | 0 | 113.4 | I54 G55 S56 T60 W61 L62 L116 | I54-W58 WeakPolarHBondContact O-CB 3.41Å; I54-W58 PolarHBondContact O-N 2.85Å; G55-W58 PolarHBondContact O-N 3.16Å; S56-W58 VanDerWaalsContact C-N 3.3Å; S56-W58 PolarHBondContact O-N 3.35Å; W58-T60 VanDerWaalsContact C-N 3.35Å; W58-T60 PolarHBondContact O-N 3.41Å; W58-W61 AromaticContact CD1-CE3 3.5Å; W58-W61 VanDerWaalsContact CD1-CE3 3.5Å; W58-W61 HydrophobicContact CZ2-CZ3 4.45Å; W58-W61 AromaticContact NE1-CE3 3.09Å; W58-W61 AromaticContact NE1-CZ3 3.28Å; W58-W61 VanDerWaalsContact NE1-CZ3 3.28Å; W58-W61 PolarHBondContact O-N 2.97Å; W58-L62 HydrophobicContact CB-CD1 4.37Å; W58-L62 HydrophobicContact CD2-CD1 3.76Å; W58-L62 HydrophobicContact CD2-CG 4.22Å; W58-L62 HydrophobicContact CE3-CD1 4.19Å; W58-L62 HydrophobicContact CG-CD1 3.81Å; W58-L62 HydrophobicContact CG-CG 4.09Å; W58-L62 HydrophobicContact CZ2-CD2 4.28Å; W58-L62 PolarHBondContact O-N 3.34Å; W58-L116 HydrophobicContact CB-CD2 4.46Å |
| 59 | S | 96.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -49.4 | -49.2 | -174.7 | 66 | 0 | 0 | 0 | 0 | 113.9 | G55 S56 W61 L62 I63 T119 | G55-S59 WeakPolarHBondContact O-CB 3.37Å; G55-S59 PolarHBondContact O-N 2.71Å; S56-S59 PolarHBondContact O-N 3.4Å; S56-S59 PolarHBondContact O-OG 3.24Å; S59-W61 PolarHBondContact O-N 2.99Å; S59-L62 PolarHBondContact O-N 2.56Å; S59-I63 VanDerWaalsContact O-CG1 3.22Å; S59-I63 WeakPolarHBondContact O-CG1 3.45Å; S59-I63 PolarHBondContact O-N 3.34Å; S59-T119 WeakPolarHBondContact OG-CB 3.26Å; S59-T119 WeakPolarHBondContact OG-CG2 3.3Å |
| 60 | T | 92.1 | Very high | 96.1 | Very high | 3 Ų | 3 | 44.9 Ų | 44.9 | 2% | 0.018 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -69.8 | -38.4 | -173.4 | -60.6 | 0 | 0 | 0 | 0 | 111.5 | W58 I63 C64 Y237 N376 K380 | W58-T60 VanDerWaalsContact C-N 3.35Å; W58-T60 PolarHBondContact O-N 3.41Å; T60-I63 PolarHBondContact O-N 3.03Å; T60-C64 PolarHBondContact O-N 3.44Å; T60-C64 PolarHBondContact O-SG 3.24Å; T60-Y237 HydrophobicContact CG2-CD1 3.56Å; T60-Y237 HydrophobicContact CG2-CE1 4.49Å; T60-Y237 HydrophobicContact CG2-CG 4.33Å; T60-N376 HydrophobicContact CG2-CB 4.32Å; T60-K380 HydrophobicContact CG2-CD 4.27Å; T60-K380 VanDerWaalsContact OG1-CB 3.28Å; T60-K380 WeakPolarHBondContact OG1-CB 2.99Å; T60-K380 VanDerWaalsContact OG1-CD 3.32Å; T60-K380 WeakPolarHBondContact OG1-CD 3.45Å; T60-K380 WeakPolarHBondContact OG1-CG 3.35Å |
| 61 | W | 94.2 | Very high | 96.1 | Very high | 112 Ų | 112 | 42.6 Ų | 42.6 | 42% | 0.424 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -64.2 | -42.9 | 173.7 | 178 | 86.1 | 0 | 0 | 0 | 111 | W58 S59 I63 C64 H65 Y66 | W58-W61 AromaticContact CD1-CE3 3.5Å; W58-W61 VanDerWaalsContact CD1-CE3 3.5Å; W58-W61 HydrophobicContact CZ2-CZ3 4.45Å; W58-W61 AromaticContact NE1-CE3 3.09Å; W58-W61 AromaticContact NE1-CZ3 3.28Å; W58-W61 VanDerWaalsContact NE1-CZ3 3.28Å; W58-W61 PolarHBondContact O-N 2.97Å; S59-W61 PolarHBondContact O-N 2.99Å; W61-I63 PolarHBondContact O-N 2.78Å; W61-C64 WeakPolarHBondContact O-CB 3.37Å; W61-C64 PolarHBondContact O-N 3.36Å; W61-H65 AromaticContact CD1-CD2 3.7Å; W61-H65 AromaticContact CD1-NE2 3.76Å; W61-H65 AromaticContact CD2-CD2 3.85Å; W61-H65 AromaticContact CE2-CD2 3.39Å; W61-H65 AromaticContact CE2-NE2 3.79Å; W61-H65 AromaticContact CZ2-CD2 3.81Å; W61-H65 AromaticContact NE1-CD2 3.28Å; W61-H65 PolarHBondContact NE1-CD2 3.37Å; W61-H65 VanDerWaalsContact NE1-CD2 3.28Å; W61-H65 AromaticContact NE1-NE2 3.22Å; W61-H65 PolarHBondContact NE1-NE2 3.04Å; W61-H65 PolarHBondContact O-CD2 2.96Å; W61-H65 VanDerWaalsContact O-CD2 3.3Å; W61-H65 PolarHBondContact O-N 3.03Å; W61-Y66 HydrophobicContact CH2-CE2 4.18Å; W61-Y66 HydrophobicContact CZ3-CE2 4.05Å |
| 62 | L | 96.2 | Very high | 96.1 | Very high | 5 Ų | 5 | 42.8 Ų | 42.8 | 3% | 0.026 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.9 | -42.6 | 175.9 | -71.6 | 165.9 | 0 | 0 | 0 | 112 | W58 S59 C64 H65 Y66 T71 L74 L116 | W58-L62 HydrophobicContact CB-CD1 4.37Å; W58-L62 HydrophobicContact CD2-CD1 3.76Å; W58-L62 HydrophobicContact CD2-CG 4.22Å; W58-L62 HydrophobicContact CE3-CD1 4.19Å; W58-L62 HydrophobicContact CG-CD1 3.81Å; W58-L62 HydrophobicContact CG-CG 4.09Å; W58-L62 HydrophobicContact CZ2-CD2 4.28Å; W58-L62 PolarHBondContact O-N 3.34Å; S59-L62 PolarHBondContact O-N 2.56Å; L62-C64 VanDerWaalsContact C-N 3.31Å; L62-C64 PolarHBondContact O-N 3.04Å; L62-H65 PolarHBondContact O-N 3.22Å; L62-Y66 HydrophobicContact CD2-CD2 3.85Å; L62-Y66 HydrophobicContact CD2-CE2 3.99Å; L62-Y66 WeakPolarHBondContact O-CB 3.14Å; L62-Y66 PolarHBondContact O-N 2.56Å; L62-T71 VanDerWaalsContact C-OG1 3.24Å; L62-T71 HydrophobicContact CB-CG2 3.66Å; L62-T71 WeakPolarHBondContact CB-OG1 3.22Å; L62-T71 HydrophobicContact CD1-CG2 4.14Å; L62-T71 PolarHBondContact O-OG1 3.03Å; L62-L74 HydrophobicContact CD1-CD2 3.82Å; L62-L74 HydrophobicContact CD2-CD2 3.98Å; L62-L116 HydrophobicContact CD1-CD2 3.54Å |
| 63 | I | 95.3 | Very high | 96.1 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.1 | -43.7 | 174.7 | -68.2 | 162.6 | 0 | 0 | 0 | 110.1 | S59 T60 W61 H65 G67 H68 T71 T120 I123 W188 Y237 | S59-I63 VanDerWaalsContact O-CG1 3.22Å; S59-I63 WeakPolarHBondContact O-CG1 3.45Å; S59-I63 PolarHBondContact O-N 3.34Å; T60-I63 PolarHBondContact O-N 3.03Å; W61-I63 PolarHBondContact O-N 2.78Å; I63-H65 VanDerWaalsContact C-N 3.34Å; I63-H65 PolarHBondContact O-N 2.85Å; I63-G67 WeakPolarHBondContact O-CA 3.4Å; I63-G67 PolarHBondContact O-N 2.89Å; I63-H68 WeakPolarHBondContact CG2-NE2 3.4Å; I63-T71 HydrophobicContact CG1-CG2 4.2Å; I63-T71 PolarHBondContact N-OG1 2.84Å; I63-T120 HydrophobicContact CD1-CG2 3.88Å; I63-T120 HydrophobicContact CG1-CG2 3.94Å; I63-I123 HydrophobicContact CD1-CB 4.46Å; I63-I123 HydrophobicContact CD1-CD1 3.79Å; I63-W188 PolarHBondContact O-NE1 3.16Å; I63-Y237 HydrophobicContact CG2-CE1 4.07Å |
| 64 | C | 92 | Very high | 96 | Very high | 17 Ų | 17 | 47.1 Ų | 47.1 | 12% | 0.115 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -56.2 | -47.4 | 176.8 | -61.1 | 0 | 0 | 0 | 0 | 112.4 | T60 W61 L62 M192 Y237 | T60-C64 PolarHBondContact O-N 3.44Å; T60-C64 PolarHBondContact O-SG 3.24Å; W61-C64 WeakPolarHBondContact O-CB 3.37Å; W61-C64 PolarHBondContact O-N 3.36Å; L62-C64 VanDerWaalsContact C-N 3.31Å; L62-C64 PolarHBondContact O-N 3.04Å; C64-M192 WeakPolarHBondContact O-CE 3.47Å; C64-Y237 WeakPolarHBondContact SG-CB 3.26Å; C64-Y237 WeakPolarHBondContact SG-CD1 3.24Å |
| 65 | H | 93.7 | Very high | 96 | Very high | 107 Ų | 107 | 43.6 Ų | 43.6 | 50% | 0.495 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -90.6 | -28.4 | -168.6 | -72.5 | -69.7 | 0 | 0 | 0 | 113.4 | W61 L62 I63 | W61-H65 AromaticContact CD1-CD2 3.7Å; W61-H65 AromaticContact CD1-NE2 3.76Å; W61-H65 AromaticContact CD2-CD2 3.85Å; W61-H65 AromaticContact CE2-CD2 3.39Å; W61-H65 AromaticContact CE2-NE2 3.79Å; W61-H65 AromaticContact CZ2-CD2 3.81Å; W61-H65 AromaticContact NE1-CD2 3.28Å; W61-H65 PolarHBondContact NE1-CD2 3.37Å; W61-H65 VanDerWaalsContact NE1-CD2 3.28Å; W61-H65 AromaticContact NE1-NE2 3.22Å; W61-H65 PolarHBondContact NE1-NE2 3.04Å; W61-H65 PolarHBondContact O-CD2 2.96Å; W61-H65 VanDerWaalsContact O-CD2 3.3Å; W61-H65 PolarHBondContact O-N 3.03Å; L62-H65 PolarHBondContact O-N 3.22Å; I63-H65 VanDerWaalsContact C-N 3.34Å; I63-H65 PolarHBondContact O-N 2.85Å |
| 66 | Y | 94.8 | Very high | 96 | Very high | 111 Ų | 111 | 43.7 Ų | 43.7 | 44% | 0.435 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -125.2 | -10.6 | -169.5 | -57 | -72 | 0 | 0 | 0 | 114.4 | W61 L62 R70 | W61-Y66 HydrophobicContact CH2-CE2 4.18Å; W61-Y66 HydrophobicContact CZ3-CE2 4.05Å; L62-Y66 HydrophobicContact CD2-CD2 3.85Å; L62-Y66 HydrophobicContact CD2-CE2 3.99Å; L62-Y66 WeakPolarHBondContact O-CB 3.14Å; L62-Y66 PolarHBondContact O-N 2.56Å; Y66-R70 WeakPolarHBondContact O-CB 3.31Å; Y66-R70 WeakPolarHBondContact O-CD 3.39Å |
| 67 | G | 95.1 | Very high | 96.1 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | 82.8 | 170.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | I63 T71 W188 | I63-G67 WeakPolarHBondContact O-CA 3.4Å; I63-G67 PolarHBondContact O-N 2.89Å; G67-T71 WeakPolarHBondContact O-CB 3.32Å; G67-T71 PolarHBondContact O-N 3.35Å; G67-T71 PolarHBondContact O-OG1 3Å; G67-W188 VanDerWaalsContact CA-CE2 3.44Å; G67-W188 VanDerWaalsContact N-CZ2 3.3Å |
| 68 | H | 95.7 | Very high | 96.2 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -67.5 | -42.1 | -174.9 | -58.9 | 84.3 | 0 | 0 | 0 | 111.5 | I63 T71 L72 T120 I123 Y124 E127 E184 W188 | I63-H68 WeakPolarHBondContact CG2-NE2 3.4Å; H68-T71 PolarHBondContact O-N 2.98Å; H68-L72 WeakPolarHBondContact O-CB 3.07Å; H68-L72 WeakPolarHBondContact O-CG 3.45Å; H68-L72 PolarHBondContact O-N 2.9Å; H68-T120 HydrophobicContact CB-CG2 4.14Å; H68-I123 WeakPolarHBondContact NE2-CG2 3.34Å; H68-Y124 HydrophobicContact CB-CD2 3.55Å; H68-Y124 HydrophobicContact CB-CE2 4.44Å; H68-Y124 HydrophobicContact CB-CG 4.04Å; H68-Y124 AromaticContact CG-CD2 3.71Å; H68-E127 IonicContact CE1-OE2 2.78Å; H68-E127 PolarHBondContact CE1-OE2 2.99Å; H68-E127 IonicContact NE2-OE2 3.99Å; H68-E184 VanDerWaalsContact CB-OE1 3.26Å; H68-E184 WeakPolarHBondContact CB-OE1 3.45Å; H68-E184 IonicContact CE1-OE1 3.38Å; H68-E184 IonicContact CG-OE1 3.04Å; H68-E184 VanDerWaalsContact N-CD 3.31Å; H68-E184 PolarHBondContact N-OE1 3.03Å; H68-E184 PolarHBondContact N-OE2 3.27Å; H68-E184 IonicContact ND1-OE1 3.6Å; H68-E184 PolarHBondContact ND1-OE1 3.39Å; H68-W188 AromaticContact CE1-CD1 3.93Å |
| 69 | R | 95.7 | Very high | 96.3 | Very high | 70 Ų | 70 | 39.3 Ų | 39.3 | 26% | 0.264 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62.5 | -50.7 | -175.6 | -70.5 | 178.8 | 66.3 | -156.3 | 4 | 111.8 | T71 L72 F73 Y180 L182 E184 | R69-T71 VanDerWaalsContact C-N 3.27Å; R69-T71 PolarHBondContact O-N 2.64Å; R69-L72 PolarHBondContact O-N 2.66Å; R69-F73 WeakPolarHBondContact O-CD2 3.28Å; R69-F73 PolarHBondContact O-N 3.25Å; R69-Y180 PolarHBondContact NH2-O 2.94Å; R69-L182 WeakPolarHBondContact CD-O 3.28Å; R69-L182 PolarHBondContact NE-O 3.44Å; R69-E184 PolarHBondContact N-OE2 3.37Å |
| 70 | R | 96.2 | Very high | 96.4 | Very high | 172 Ų | 172 | 41.3 Ų | 41.3 | 65% | 0.649 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -63.9 | -36.1 | 179.2 | -67.5 | -174.5 | 177.8 | 170.7 | -1.5 | 111.5 | Y66 F73 L74 | Y66-R70 WeakPolarHBondContact O-CB 3.31Å; Y66-R70 WeakPolarHBondContact O-CD 3.39Å; R70-F73 PolarHBondContact O-N 3.07Å; R70-L74 PolarHBondContact O-N 3.39Å |
| 71 | T | 98 | Very high | 96.7 | Very high | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.006 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.4 | -44.5 | 174.7 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | L62 I63 G67 H68 R69 L74 S75 L116 T120 | L62-T71 VanDerWaalsContact C-OG1 3.24Å; L62-T71 HydrophobicContact CB-CG2 3.66Å; L62-T71 WeakPolarHBondContact CB-OG1 3.22Å; L62-T71 HydrophobicContact CD1-CG2 4.14Å; L62-T71 PolarHBondContact O-OG1 3.03Å; I63-T71 HydrophobicContact CG1-CG2 4.2Å; I63-T71 PolarHBondContact N-OG1 2.84Å; G67-T71 WeakPolarHBondContact O-CB 3.32Å; G67-T71 PolarHBondContact O-N 3.35Å; G67-T71 PolarHBondContact O-OG1 3Å; H68-T71 PolarHBondContact O-N 2.98Å; R69-T71 VanDerWaalsContact C-N 3.27Å; R69-T71 PolarHBondContact O-N 2.64Å; T71-L74 PolarHBondContact O-N 2.99Å; T71-S75 WeakPolarHBondContact O-CB 3.34Å; T71-S75 PolarHBondContact O-N 3.41Å; T71-L116 HydrophobicContact CG2-CD2 4.32Å; T71-T120 HydrophobicContact CG2-CG2 3.96Å; T71-T120 WeakPolarHBondContact CG2-OG1 3.39Å |
| 72 | L | 98.2 | Very high | 97 | Very high | 3 Ų | 3 | 40 Ų | 40 | 2% | 0.016 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.6 | -40.2 | 174 | -72.9 | 172.2 | 0 | 0 | 0 | 111.8 | H68 R69 S75 Y76 T117 T120 N121 T179 | H68-L72 WeakPolarHBondContact O-CB 3.07Å; H68-L72 WeakPolarHBondContact O-CG 3.45Å; H68-L72 PolarHBondContact O-N 2.9Å; R69-L72 PolarHBondContact O-N 2.66Å; L72-S75 WeakPolarHBondContact O-CA 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.47Å; L72-S75 PolarHBondContact O-N 3.45Å; L72-Y76 HydrophobicContact CB-CE2 3.87Å; L72-Y76 WeakPolarHBondContact O-CD2 3.39Å; L72-Y76 VanDerWaalsContact O-CG 3.3Å; L72-Y76 PolarHBondContact O-N 3.43Å; L72-T117 HydrophobicContact CD2-CG2 4.46Å; L72-T120 HydrophobicContact CD1-CG2 4.47Å; L72-T120 HydrophobicContact CD2-CG2 3.92Å; L72-T120 HydrophobicContact CG-CG2 3.73Å; L72-N121 HydrophobicContact CD2-CB 4.46Å; L72-T179 HydrophobicContact CB-CG2 4.06Å; L72-T179 HydrophobicContact CD1-CG2 3.89Å |
| 73 | F | 98 | Very high | 97.1 | Very high | 59 Ų | 59 | 39.8 Ų | 39.8 | 26% | 0.259 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -61.6 | -44.8 | 175.1 | -86.3 | -63.6 | 0 | 0 | 0 | 113.3 | R69 R70 S75 Y76 S77 A176 Y180 | R69-F73 WeakPolarHBondContact O-CD2 3.28Å; R69-F73 PolarHBondContact O-N 3.25Å; R70-F73 PolarHBondContact O-N 3.07Å; F73-S75 VanDerWaalsContact C-N 3.27Å; F73-S75 PolarHBondContact O-N 2.69Å; F73-Y76 PolarHBondContact O-N 2.9Å; F73-S77 WeakPolarHBondContact O-CB 3.39Å; F73-S77 PolarHBondContact O-N 2.9Å; F73-S77 PolarHBondContact O-OG 2.97Å; F73-A176 HydrophobicContact CE1-CB 4.48Å; F73-A176 VanDerWaalsContact CE1-O 3.31Å; F73-A176 WeakPolarHBondContact CE1-O 3.15Å; F73-Y180 HydrophobicContact CE2-CD2 4.11Å; F73-Y180 VanDerWaalsContact CZ-CA 3.43Å; F73-Y180 AromaticContact CZ-CD2 3.71Å; F73-Y180 HydrophobicContact CZ-CD2 3.71Å; F73-Y180 HydrophobicContact CZ-CG 4.15Å |
| 74 | L | 98.3 | Very high | 97.2 | Very high | 59 Ų | 59 | 42.1 Ų | 42.1 | 31% | 0.309 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -59.6 | -44.6 | 173.4 | 177 | 61.4 | 0 | 0 | 0 | 110.4 | L62 R70 T71 S77 L78 | L62-L74 HydrophobicContact CD1-CD2 3.82Å; L62-L74 HydrophobicContact CD2-CD2 3.98Å; R70-L74 PolarHBondContact O-N 3.39Å; T71-L74 PolarHBondContact O-N 2.99Å; L74-S77 PolarHBondContact O-N 3.03Å; L74-L78 HydrophobicContact CD1-CD1 4.21Å; L74-L78 HydrophobicContact CD1-CG 4.24Å; L74-L78 HydrophobicContact CG-CD1 4.12Å; L74-L78 WeakPolarHBondContact O-CG 3.35Å; L74-L78 PolarHBondContact O-N 3.37Å |
| 75 | S | 98.4 | Very high | 97.5 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -55.6 | -53.5 | 177.6 | -168.3 | 0 | 0 | 0 | 0 | 112.9 | T71 L72 F73 S77 L78 S79 G113 L116 T117 | T71-S75 WeakPolarHBondContact O-CB 3.34Å; T71-S75 PolarHBondContact O-N 3.41Å; L72-S75 WeakPolarHBondContact O-CA 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.47Å; L72-S75 PolarHBondContact O-N 3.45Å; F73-S75 VanDerWaalsContact C-N 3.27Å; F73-S75 PolarHBondContact O-N 2.69Å; S75-S77 VanDerWaalsContact C-N 3.32Å; S75-S77 PolarHBondContact O-N 3.12Å; S75-L78 PolarHBondContact O-N 2.87Å; S75-S79 PolarHBondContact O-N 2.7Å; S75-S79 PolarHBondContact O-OG 2.94Å; S75-G113 WeakPolarHBondContact O-CA 3.5Å; S75-G113 PolarHBondContact OG-O 3.05Å; S75-L116 WeakPolarHBondContact OG-CB 3.31Å; S75-T117 PolarHBondContact OG-N 3.32Å; S75-T117 PolarHBondContact OG-OG1 3.44Å |
| 76 | Y | 98.6 | Very high | 97.7 | Very high | 1 Ų | 1 | 38.2 Ų | 38.2 | 0% | 0.004 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.1 | -36.8 | 177.8 | -56.9 | -47.6 | 0 | 0 | 0 | 112.1 | S16 L72 F73 L78 S79 I80 T117 V172 V175 A176 T179 | S16-Y76 PolarHBondContact OG-OH 3.36Å; L72-Y76 HydrophobicContact CB-CE2 3.87Å; L72-Y76 WeakPolarHBondContact O-CD2 3.39Å; L72-Y76 VanDerWaalsContact O-CG 3.3Å; L72-Y76 PolarHBondContact O-N 3.43Å; F73-Y76 PolarHBondContact O-N 2.9Å; Y76-L78 VanDerWaalsContact C-N 3.33Å; Y76-L78 PolarHBondContact O-N 3.23Å; Y76-S79 PolarHBondContact O-N 3.29Å; Y76-I80 WeakPolarHBondContact O-CB 3.37Å; Y76-I80 WeakPolarHBondContact O-CD1 3.16Å; Y76-I80 WeakPolarHBondContact O-CG1 3.19Å; Y76-I80 PolarHBondContact O-N 3Å; Y76-T117 HydrophobicContact CE1-CG2 3.96Å; Y76-V172 HydrophobicContact CD1-CG1 3.93Å; Y76-V172 HydrophobicContact CG-CG1 4.24Å; Y76-V175 HydrophobicContact CE1-CG1 4.04Å; Y76-A176 HydrophobicContact CD2-CB 3.58Å; Y76-A176 HydrophobicContact CE2-CB 4.39Å; Y76-A176 HydrophobicContact CG-CB 3.91Å; Y76-T179 HydrophobicContact CE2-CG2 3.86Å; Y76-T179 PolarHBondContact OH-OG1 3.2Å; Y76-T179 VanDerWaalsContact OH-OG1 3.04Å |
| 77 | S | 98.5 | Very high | 97.9 | Very high | 70 Ų | 70 | 35.7 Ų | 35.7 | 49% | 0.49 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -61.6 | -42.8 | 177.1 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | F73 L74 S75 L81 | F73-S77 WeakPolarHBondContact O-CB 3.39Å; F73-S77 PolarHBondContact O-N 2.9Å; F73-S77 PolarHBondContact O-OG 2.97Å; L74-S77 PolarHBondContact O-N 3.03Å; S75-S77 VanDerWaalsContact C-N 3.32Å; S75-S77 PolarHBondContact O-N 3.12Å; S77-L81 WeakPolarHBondContact O-CB 3.45Å; S77-L81 PolarHBondContact O-N 3.4Å |
| 78 | L | 98.6 | Very high | 98 | Very high | 33 Ų | 33 | 42.1 Ų | 42.1 | 17% | 0.173 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -66.1 | -42.2 | 175.1 | -67.4 | 171.3 | 0 | 0 | 0 | 111.7 | L74 S75 Y76 L81 G82 L109 I112 L116 | L74-L78 HydrophobicContact CD1-CD1 4.21Å; L74-L78 HydrophobicContact CD1-CG 4.24Å; L74-L78 HydrophobicContact CG-CD1 4.12Å; L74-L78 WeakPolarHBondContact O-CG 3.35Å; L74-L78 PolarHBondContact O-N 3.37Å; S75-L78 PolarHBondContact O-N 2.87Å; Y76-L78 VanDerWaalsContact C-N 3.33Å; Y76-L78 PolarHBondContact O-N 3.23Å; L78-L81 PolarHBondContact O-N 3.27Å; L78-G82 PolarHBondContact O-N 3.4Å; L78-L109 HydrophobicContact CD2-CD2 3.96Å; L78-I112 HydrophobicContact CD1-CG2 3.82Å; L78-L116 HydrophobicContact CD1-CD1 3.81Å |
| 79 | S | 98.6 | Very high | 98 | Very high | 3 Ų | 3 | 42.1 Ų | 42.1 | 2% | 0.021 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.5 | -47.8 | 174.5 | -72.2 | 0 | 0 | 0 | 0 | 112.3 | S75 Y76 L81 G82 W83 G113 | S75-S79 PolarHBondContact O-N 2.7Å; S75-S79 PolarHBondContact O-OG 2.94Å; Y76-S79 PolarHBondContact O-N 3.29Å; S79-L81 PolarHBondContact O-N 3.37Å; S79-G82 PolarHBondContact O-N 2.93Å; S79-W83 PolarHBondContact O-N 2.84Å; S79-G113 WeakPolarHBondContact OG-CA 3.43Å |
| 80 | I | 98.8 | Very high | 98 | Very high | 41 Ų | 41 | 39.3 Ų | 39.3 | 21% | 0.21 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60 | -47.7 | 178.2 | -68.5 | 160.2 | 0 | 0 | 0 | 110 | Y76 G82 W83 V84 V172 S173 | Y76-I80 WeakPolarHBondContact O-CB 3.37Å; Y76-I80 WeakPolarHBondContact O-CD1 3.16Å; Y76-I80 WeakPolarHBondContact O-CG1 3.19Å; Y76-I80 PolarHBondContact O-N 3Å; I80-G82 VanDerWaalsContact C-N 3.28Å; I80-G82 PolarHBondContact O-N 2.89Å; I80-W83 PolarHBondContact O-N 2.85Å; I80-V84 HydrophobicContact CG2-CG2 4.27Å; I80-V84 WeakPolarHBondContact O-CB 3.36Å; I80-V84 VanDerWaalsContact O-CG2 3.27Å; I80-V84 WeakPolarHBondContact O-CG2 3.35Å; I80-V84 PolarHBondContact O-N 3.42Å; I80-V172 HydrophobicContact CD1-CG1 4.12Å; I80-V172 HydrophobicContact CG1-CB 3.96Å; I80-V172 HydrophobicContact CG1-CG1 3.66Å; I80-S173 WeakPolarHBondContact CD1-OG 3.27Å |
| 81 | L | 98.6 | Very high | 97.9 | Very high | 88 Ų | 88 | 35.1 Ų | 35.1 | 46% | 0.461 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -58.4 | -42.9 | 176.1 | -179.2 | 62.1 | 0 | 0 | 0 | 111.4 | S77 L78 S79 V84 L85 L109 | S77-L81 WeakPolarHBondContact O-CB 3.45Å; S77-L81 PolarHBondContact O-N 3.4Å; L78-L81 PolarHBondContact O-N 3.27Å; S79-L81 PolarHBondContact O-N 3.37Å; L81-V84 PolarHBondContact O-N 2.88Å; L81-L85 HydrophobicContact CD1-CG 4.46Å; L81-L85 HydrophobicContact CG-CD1 4.34Å; L81-L85 WeakPolarHBondContact O-CB 3.13Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.49Å; L81-L85 PolarHBondContact O-N 2.93Å; L81-L109 HydrophobicContact CD2-CD1 3.92Å; L81-L109 HydrophobicContact CG-CD1 3.97Å |
| 82 | G | 98.7 | Very high | 97.6 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.1 | -47.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | L78 S79 I80 L85 L86 G106 | L78-G82 PolarHBondContact O-N 3.4Å; S79-G82 PolarHBondContact O-N 2.93Å; I80-G82 VanDerWaalsContact C-N 3.28Å; I80-G82 PolarHBondContact O-N 2.89Å; G82-L85 PolarHBondContact O-N 2.65Å; G82-L86 WeakPolarHBondContact O-CG 3.45Å; G82-L86 PolarHBondContact O-N 3.18Å; G82-G106 WeakPolarHBondContact CA-O 3.25Å; G82-G106 WeakPolarHBondContact O-CA 3.17Å |
| 83 | W | 98.7 | Very high | 97.4 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.2 | -40.8 | 177.1 | -70.8 | 125.5 | 0 | 0 | 0 | 113.1 | T23 F26 S79 I80 L86 F87 T110 C168 A169 | T23-W83 HydrophobicContact CG2-CZ2 4.23Å; F26-W83 HydrophobicContact CB-CH2 3.8Å; F26-W83 HydrophobicContact CB-CZ3 4.28Å; F26-W83 AromaticContact CD1-CH2 3.94Å; F26-W83 HydrophobicContact CD1-CH2 3.94Å; F26-W83 AromaticContact CD1-CZ3 3.67Å; F26-W83 HydrophobicContact CD1-CZ3 3.67Å; F26-W83 AromaticContact CD2-CH2 3.96Å; F26-W83 HydrophobicContact CD2-CH2 3.96Å; F26-W83 AromaticContact CD2-CZ3 3.64Å; F26-W83 HydrophobicContact CD2-CZ3 3.64Å; F26-W83 AromaticContact CE1-CZ3 3.8Å; F26-W83 HydrophobicContact CE1-CZ3 3.8Å; F26-W83 AromaticContact CE2-CZ3 3.79Å; F26-W83 HydrophobicContact CE2-CZ3 3.79Å; F26-W83 AromaticContact CG-CH2 3.62Å; F26-W83 HydrophobicContact CG-CH2 3.62Å; F26-W83 AromaticContact CG-CZ3 3.57Å; F26-W83 HydrophobicContact CG-CZ3 3.57Å; F26-W83 AromaticContact CZ-CZ3 3.87Å; F26-W83 HydrophobicContact CZ-CZ3 3.87Å; S79-W83 PolarHBondContact O-N 2.84Å; I80-W83 PolarHBondContact O-N 2.85Å; W83-L86 HydrophobicContact CE3-CD1 3.68Å; W83-L86 HydrophobicContact CZ3-CD1 3.89Å; W83-L86 PolarHBondContact O-N 3.28Å; W83-F87 PolarHBondContact O-N 2.8Å; W83-T110 HydrophobicContact CD2-CG2 3.68Å; W83-T110 HydrophobicContact CE3-CG2 4.1Å; W83-T110 HydrophobicContact CG-CG2 3.98Å; W83-T110 HydrophobicContact CZ2-CG2 4.22Å; W83-C168 HydrophobicContact CD2-CB 3.52Å; W83-C168 HydrophobicContact CE3-CB 3.82Å; W83-C168 HydrophobicContact CG-CB 3.97Å; W83-C168 HydrophobicContact CH2-CB 4.09Å; W83-C168 HydrophobicContact CZ2-CB 3.81Å; W83-C168 HydrophobicContact CZ3-CB 4.09Å; W83-A169 HydrophobicContact CB-CB 3.7Å |
| 84 | V | 98.5 | Very high | 97.1 | Very high | 49 Ų | 49 | 37.9 Ų | 37.9 | 30% | 0.297 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.9 | -41.2 | 176.4 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | I80 L81 F87 F88 A169 | I80-V84 HydrophobicContact CG2-CG2 4.27Å; I80-V84 WeakPolarHBondContact O-CB 3.36Å; I80-V84 VanDerWaalsContact O-CG2 3.27Å; I80-V84 WeakPolarHBondContact O-CG2 3.35Å; I80-V84 PolarHBondContact O-N 3.42Å; L81-V84 PolarHBondContact O-N 2.88Å; V84-F87 PolarHBondContact O-N 3.47Å; V84-F88 HydrophobicContact CG1-CD2 3.59Å; V84-F88 HydrophobicContact CG1-CE2 3.63Å; V84-F88 VanDerWaalsContact O-CD2 3.28Å; V84-F88 WeakPolarHBondContact O-CD2 3.33Å; V84-F88 PolarHBondContact O-N 3.03Å; V84-A169 HydrophobicContact CG2-CB 4.25Å |
| 85 | L | 98.1 | Very high | 96.7 | Very high | 43 Ų | 43 | 43 Ų | 43 | 23% | 0.225 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.9 | -39.9 | 174.2 | -74.6 | 174.3 | 0 | 0 | 0 | 112.2 | L81 G82 S89 L105 L109 | L81-L85 HydrophobicContact CD1-CG 4.46Å; L81-L85 HydrophobicContact CG-CD1 4.34Å; L81-L85 WeakPolarHBondContact O-CB 3.13Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.49Å; L81-L85 PolarHBondContact O-N 2.93Å; G82-L85 PolarHBondContact O-N 2.65Å; L85-S89 VanDerWaalsContact O-CB 3.24Å; L85-S89 WeakPolarHBondContact O-CB 3.16Å; L85-S89 PolarHBondContact O-N 2.98Å; L85-S89 PolarHBondContact O-OG 3.31Å; L85-L105 HydrophobicContact CD1-CB 4.49Å; L85-L109 HydrophobicContact CD1-CD1 3.73Å |
| 86 | L | 97.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.1 | -50.2 | 174.1 | -73.5 | 167.1 | 0 | 0 | 0 | 110.7 | F26 F44 G82 W83 F88 S89 F103 T110 W161 | F26-L86 HydrophobicContact CE1-CD1 3.85Å; F26-L86 HydrophobicContact CZ-CD1 4.32Å; F44-L86 HydrophobicContact CE2-CD2 4.45Å; G82-L86 WeakPolarHBondContact O-CG 3.45Å; G82-L86 PolarHBondContact O-N 3.18Å; W83-L86 HydrophobicContact CE3-CD1 3.68Å; W83-L86 HydrophobicContact CZ3-CD1 3.89Å; W83-L86 PolarHBondContact O-N 3.28Å; L86-F88 PolarHBondContact O-N 3.47Å; L86-S89 PolarHBondContact O-N 3.39Å; L86-S89 VanDerWaalsContact O-N 3.16Å; L86-S89 PolarHBondContact O-OG 2.7Å; L86-F103 HydrophobicContact CD2-CD2 3.68Å; L86-F103 HydrophobicContact CD2-CE2 3.84Å; L86-F103 HydrophobicContact CD2-CG 4.25Å; L86-T110 HydrophobicContact CD1-CG2 4.07Å; L86-W161 HydrophobicContact CB-CZ3 4.36Å; L86-W161 VanDerWaalsContact O-CZ3 3.24Å; L86-W161 WeakPolarHBondContact O-CZ3 2.88Å |
| 87 | F | 97.8 | Very high | 95.2 | Very high | 57 Ų | 57 | 60 Ų | 60 | 25% | 0.25 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -55.5 | -52.3 | 177 | 175.5 | -108.4 | 0 | 0 | 0 | 112.5 | W83 V84 S89 S90 D162 L166 | W83-F87 PolarHBondContact O-N 2.8Å; V84-F87 PolarHBondContact O-N 3.47Å; F87-S89 PolarHBondContact O-N 2.84Å; F87-S90 WeakPolarHBondContact O-CB 3.39Å; F87-S90 PolarHBondContact O-N 2.94Å; F87-S90 PolarHBondContact O-OG 3.45Å; F87-D162 HydrophobicContact CD2-CB 4.31Å; F87-D162 VanDerWaalsContact CD2-O 3.29Å; F87-D162 WeakPolarHBondContact CD2-O 3.23Å; F87-L166 HydrophobicContact CD2-CB 3.91Å; F87-L166 HydrophobicContact CE2-CB 4.2Å; F87-L166 HydrophobicContact CE2-CD2 4.16Å; F87-L166 HydrophobicContact CG-CB 4.26Å; F87-L166 HydrophobicContact CZ-CD2 4.19Å |
| 88 | F | 97.3 | Very high | 94.6 | Very high | 135 Ų | 135 | 57.9 Ų | 57.9 | 59% | 0.592 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -71.3 | -16.7 | -179.1 | -76.3 | -62.3 | 0 | 0 | 0 | 114.2 | V84 L86 S90 P91 | V84-F88 HydrophobicContact CG1-CD2 3.59Å; V84-F88 HydrophobicContact CG1-CE2 3.63Å; V84-F88 VanDerWaalsContact O-CD2 3.28Å; V84-F88 WeakPolarHBondContact O-CD2 3.33Å; V84-F88 PolarHBondContact O-N 3.03Å; L86-F88 PolarHBondContact O-N 3.47Å; F88-S90 VanDerWaalsContact C-N 3.26Å; F88-S90 PolarHBondContact O-N 3.47Å; F88-P91 WeakPolarHBondContact O-CD 3.33Å |
| 89 | S | 96.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -75.7 | -14.2 | 174.4 | 74.5 | 0 | 0 | 0 | 0 | 113.4 | L85 L86 F87 A92 V93 | L85-S89 VanDerWaalsContact O-CB 3.24Å; L85-S89 WeakPolarHBondContact O-CB 3.16Å; L85-S89 PolarHBondContact O-N 2.98Å; L85-S89 PolarHBondContact O-OG 3.31Å; L86-S89 PolarHBondContact O-N 3.39Å; L86-S89 VanDerWaalsContact O-N 3.16Å; L86-S89 PolarHBondContact O-OG 2.7Å; F87-S89 PolarHBondContact O-N 2.84Å; S89-A92 PolarHBondContact O-N 3.06Å; S89-V93 WeakPolarHBondContact O-CG2 3.18Å; S89-V93 PolarHBondContact O-N 3.19Å |
| 90 | S | 95.2 | Very high | 93.6 | Very high | 11 Ų | 11 | 57.6 Ų | 57.6 | 8% | 0.077 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -59.4 | -44 | -169.9 | 86.3 | 0 | 0 | 0 | 0 | 115.1 | F87 F88 A92 V93 Y94 D162 | F87-S90 WeakPolarHBondContact O-CB 3.39Å; F87-S90 PolarHBondContact O-N 2.94Å; F87-S90 PolarHBondContact O-OG 3.45Å; F88-S90 VanDerWaalsContact C-N 3.26Å; F88-S90 PolarHBondContact O-N 3.47Å; S90-A92 VanDerWaalsContact C-N 3.33Å; S90-A92 PolarHBondContact O-N 3.4Å; S90-V93 PolarHBondContact O-N 3.33Å; S90-Y94 WeakPolarHBondContact O-CD2 3.33Å; S90-Y94 PolarHBondContact O-N 3.29Å; S90-D162 VanDerWaalsContact CB-CB 3.4Å; S90-D162 WeakPolarHBondContact CB-OD2 3.49Å; S90-D162 PolarHBondContact OG-OD2 3.49Å; S90-D162 VanDerWaalsContact OG-OD2 3.05Å |
| 91 | P | 94.1 | Very high | 93.3 | Very high | 85 Ų | 85 | 60.8 Ų | 60.8 | 55% | 0.552 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -60.7 | -43.8 | -178.1 | -23.4 | 35.5 | 0 | 0 | 0 | 112.1 | F88 Y94 E95 | F88-P91 WeakPolarHBondContact O-CD 3.33Å; P91-Y94 PolarHBondContact O-N 2.86Å; P91-E95 WeakPolarHBondContact O-CB 3.42Å; P91-E95 PolarHBondContact O-N 3.49Å |
| 92 | A | 93.6 | Very high | 93.1 | Very high | 40 Ų | 40 | 61.3 Ų | 61.3 | 33% | 0.331 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -73 | -32.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | S89 S90 R96 T100 | S89-A92 PolarHBondContact O-N 3.06Å; S90-A92 VanDerWaalsContact C-N 3.33Å; S90-A92 PolarHBondContact O-N 3.4Å; A92-R96 VanDerWaalsContact O-CB 3.25Å; A92-R96 WeakPolarHBondContact O-CB 3.39Å; A92-R96 PolarHBondContact O-N 2.69Å; A92-R96 VanDerWaalsContact O-N 3.08Å; A92-T100 HydrophobicContact CB-CG2 3.68Å |
| 93 | V | 92.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -68.5 | -43.4 | 174.1 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | I34 F36 S89 S90 Y97 T100 F103 W161 | I34-V93 HydrophobicContact CD1-CG1 4.03Å; I34-V93 HydrophobicContact CG1-CG1 4.28Å; I34-V93 HydrophobicContact CG2-CG1 3.63Å; F36-V93 HydrophobicContact CE1-CG1 4.38Å; F36-V93 HydrophobicContact CZ-CG1 4.11Å; S89-V93 WeakPolarHBondContact O-CG2 3.18Å; S89-V93 PolarHBondContact O-N 3.19Å; S90-V93 PolarHBondContact O-N 3.33Å; V93-Y97 WeakPolarHBondContact O-CA 3.43Å; V93-Y97 PolarHBondContact O-N 3.28Å; V93-T100 HydrophobicContact CG2-CG2 4.08Å; V93-F103 HydrophobicContact CG2-CB 4.02Å; V93-F103 HydrophobicContact CG2-CD2 4Å; V93-F103 HydrophobicContact CG2-CG 4.12Å; V93-W161 HydrophobicContact CB-CH2 4.45Å; V93-W161 HydrophobicContact CB-CZ2 4.17Å; V93-W161 HydrophobicContact CG1-CZ2 4.07Å; V93-W161 HydrophobicContact CG2-CH2 4.5Å |
| 94 | Y | 91.5 | Very high | 92.7 | Very high | 81 Ų | 81 | 63.7 Ų | 63.7 | 32% | 0.318 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.6 | -40.2 | 176.3 | -68.3 | -48.6 | 0 | 0 | 0 | 112.6 | S90 P91 W161 D162 | S90-Y94 WeakPolarHBondContact O-CD2 3.33Å; S90-Y94 PolarHBondContact O-N 3.29Å; P91-Y94 PolarHBondContact O-N 2.86Å; Y94-W161 AromaticContact CE1-NE1 3.44Å; Y94-W161 AromaticContact CZ-NE1 3.41Å; Y94-W161 PolarHBondContact OH-NE1 3.04Å; Y94-W161 VanDerWaalsContact OH-NE1 3.08Å; Y94-D162 WeakPolarHBondContact CE2-OD2 3.44Å; Y94-D162 PolarHBondContact OH-OD1 3.47Å; Y94-D162 PolarHBondContact OH-OD2 3.47Å |
| 95 | E | 90.1 | Very high | 92.7 | Very high | 167 Ų | 167 | 65.2 Ų | 65.2 | 78% | 0.78 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -68.6 | -41 | 178.8 | -173.4 | -178.2 | 176.7 | 0 | 0 | 112.4 | P91 | P91-E95 WeakPolarHBondContact O-CB 3.42Å; P91-E95 PolarHBondContact O-N 3.49Å |
| 96 | R | 86.4 | Confident | 92.7 | Very high | 176 Ų | 176 | 63.2 Ų | 63.2 | 66% | 0.664 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -91.7 | -17.3 | -172.6 | -161.2 | -179.3 | 172.3 | 173.1 | -0.4 | 114.1 | A92 S98 | A92-R96 VanDerWaalsContact O-CB 3.25Å; A92-R96 WeakPolarHBondContact O-CB 3.39Å; A92-R96 PolarHBondContact O-N 2.69Å; A92-R96 VanDerWaalsContact O-N 3.08Å; R96-S98 PolarHBondContact O-N 3.44Å; R96-S98 VanDerWaalsContact O-N 3.13Å |
| 97 | Y | 80.6 | Confident | 92.6 | Very high | 181 Ų | 181 | 63.2 Ų | 63.2 | 71% | 0.71 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 32.7 | -167 | -61.9 | -85.8 | 0 | 0 | 0 | 112.7 | V93 | V93-Y97 WeakPolarHBondContact O-CA 3.43Å; V93-Y97 PolarHBondContact O-N 3.28Å |
| 98 | S | 84 | Confident | 92.7 | Very high | 26 Ų | 26 | 62.4 Ų | 62.4 | 18% | 0.182 | 31% | 0.305 | C | S | . | . | S | Bend | trans | -149.3 | 142.3 | -172.7 | -170.7 | 0 | 0 | 0 | 0 | 109.7 | R96 T100 | R96-S98 PolarHBondContact O-N 3.44Å; R96-S98 VanDerWaalsContact O-N 3.13Å; S98-T100 PolarHBondContact O-N 3.19Å |
| 99 | P | 85.7 | Confident | 92.7 | Very high | 11 Ų | 11 | 57.5 Ų | 57.5 | 7% | 0.071 | 28% | 0.284 | C | S | . | . | trans | -67.8 | 133.9 | -176.6 | 25.2 | -30.3 | 0 | 0 | 0 | 110.9 | F36 W40 F103 I104 | F36-P99 HydrophobicContact CE1-CB 4.15Å; F36-P99 HydrophobicContact CE1-CG 4.26Å; F36-P99 HydrophobicContact CZ-CB 4.02Å; W40-P99 HydrophobicContact CB-CG 4.3Å; W40-P99 HydrophobicContact CD2-CG 3.25Å; W40-P99 HydrophobicContact CE3-CB 4.43Å; W40-P99 HydrophobicContact CE3-CG 3.29Å; W40-P99 HydrophobicContact CG-CG 3.73Å; W40-P99 HydrophobicContact CH2-CG 4Å; W40-P99 HydrophobicContact CZ2-CG 3.99Å; W40-P99 HydrophobicContact CZ3-CG 3.67Å; P99-F103 HydrophobicContact CB-CD1 3.68Å; P99-F103 HydrophobicContact CB-CE1 4.29Å; P99-F103 HydrophobicContact CB-CG 4.47Å; P99-I104 HydrophobicContact CB-CD1 4.36Å; P99-I104 HydrophobicContact CB-CG1 4.18Å | ||
| 100 | T | 90.7 | Very high | 92.8 | Very high | 18 Ų | 18 | 57.5 Ų | 57.5 | 11% | 0.11 | 28% | 0.284 | C | S | . | . | trans | -82.8 | 162.4 | 172.1 | 64.5 | 0 | 0 | 0 | 0 | 110.6 | A92 V93 S98 Q102 F103 I104 | A92-T100 HydrophobicContact CB-CG2 3.68Å; V93-T100 HydrophobicContact CG2-CG2 4.08Å; S98-T100 PolarHBondContact O-N 3.19Å; T100-Q102 PolarHBondContact O-N 3.16Å; T100-F103 WeakPolarHBondContact O-CB 3.43Å; T100-F103 PolarHBondContact O-N 3.31Å; T100-F103 VanDerWaalsContact O-N 3.12Å; T100-F103 WeakPolarHBondContact OG1-CB 3.43Å; T100-F103 PolarHBondContact OG1-N 2.72Å; T100-F103 VanDerWaalsContact OG1-N 3.08Å; T100-I104 PolarHBondContact O-N 3.02Å | ||
| 101 | V | 92.9 | Very high | 93 | Very high | 109 Ų | 109 | 57 Ų | 57 | 66% | 0.661 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -57.4 | -37.8 | 171.9 | 178 | 0 | 0 | 0 | 0 | 110.6 | I104 L105 | V101-I104 PolarHBondContact O-N 3.16Å; V101-L105 HydrophobicContact CG1-CD1 3.82Å; V101-L105 HydrophobicContact CG1-CG 4.17Å; V101-L105 WeakPolarHBondContact O-CB 3.15Å; V101-L105 VanDerWaalsContact O-CG 3.26Å; V101-L105 WeakPolarHBondContact O-CG 3.19Å; V101-L105 PolarHBondContact O-N 2.86Å |
| 102 | Q | 94.3 | Very high | 93.2 | Very high | 99 Ų | 99 | 53.9 Ų | 53.9 | 46% | 0.463 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 175.7 | -68.6 | 173.6 | -12.1 | 0 | 0 | 112.2 | T100 L105 G106 | T100-Q102 PolarHBondContact O-N 3.16Å; Q102-L105 PolarHBondContact O-N 2.76Å; Q102-G106 PolarHBondContact O-N 3.08Å |
| 103 | F | 94.3 | Very high | 93.5 | Very high | 2 Ų | 2 | 52 Ų | 52 | 1% | 0.009 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.8 | -46.3 | 176.7 | -176.9 | -96.5 | 0 | 0 | 0 | 111.8 | T30 I34 F36 F44 L86 V93 P99 T100 G106 R107 W161 | T30-F103 HydrophobicContact CG2-CE2 4.45Å; T30-F103 HydrophobicContact CG2-CZ 4.21Å; I34-F103 HydrophobicContact CD1-CE2 3.77Å; I34-F103 HydrophobicContact CD1-CZ 3.74Å; F36-F103 HydrophobicContact CE2-CD1 4.46Å; F36-F103 AromaticContact CE2-CE1 3.48Å; F36-F103 HydrophobicContact CE2-CE1 3.48Å; F36-F103 VanDerWaalsContact CE2-CE1 3.48Å; F36-F103 AromaticContact CE2-CZ 3.55Å; F36-F103 HydrophobicContact CE2-CZ 3.55Å; F36-F103 HydrophobicContact CZ-CD1 4.2Å; F36-F103 AromaticContact CZ-CE1 3.63Å; F36-F103 HydrophobicContact CZ-CE1 3.63Å; F36-F103 AromaticContact CZ-CZ 3.86Å; F36-F103 HydrophobicContact CZ-CZ 3.86Å; F44-F103 HydrophobicContact CB-CE1 4.36Å; F44-F103 HydrophobicContact CD2-CD1 4.15Å; F44-F103 AromaticContact CD2-CE1 3.15Å; F44-F103 HydrophobicContact CD2-CE1 3.15Å; F44-F103 HydrophobicContact CD2-CE2 4.49Å; F44-F103 AromaticContact CD2-CZ 3.37Å; F44-F103 HydrophobicContact CD2-CZ 3.37Å; F44-F103 HydrophobicContact CE1-CZ 4.45Å; F44-F103 HydrophobicContact CE2-CD1 4.48Å; F44-F103 AromaticContact CE2-CE1 3.5Å; F44-F103 HydrophobicContact CE2-CE1 3.5Å; F44-F103 HydrophobicContact CE2-CE2 4.01Å; F44-F103 AromaticContact CE2-CZ 3.19Å; F44-F103 HydrophobicContact CE2-CZ 3.19Å; F44-F103 AromaticContact CG-CE1 3.87Å; F44-F103 HydrophobicContact CG-CE1 3.87Å; F44-F103 HydrophobicContact CG-CZ 4.07Å; F44-F103 HydrophobicContact CZ-CE1 4.44Å; F44-F103 AromaticContact CZ-CZ 3.8Å; F44-F103 HydrophobicContact CZ-CZ 3.8Å; L86-F103 HydrophobicContact CD2-CD2 3.68Å; L86-F103 HydrophobicContact CD2-CE2 3.84Å; L86-F103 HydrophobicContact CD2-CG 4.25Å; V93-F103 HydrophobicContact CG2-CB 4.02Å; V93-F103 HydrophobicContact CG2-CD2 4Å; V93-F103 HydrophobicContact CG2-CG 4.12Å; P99-F103 HydrophobicContact CB-CD1 3.68Å; P99-F103 HydrophobicContact CB-CE1 4.29Å; P99-F103 HydrophobicContact CB-CG 4.47Å; T100-F103 WeakPolarHBondContact O-CB 3.43Å; T100-F103 PolarHBondContact O-N 3.31Å; T100-F103 VanDerWaalsContact O-N 3.12Å; T100-F103 WeakPolarHBondContact OG1-CB 3.43Å; T100-F103 PolarHBondContact OG1-N 2.72Å; T100-F103 VanDerWaalsContact OG1-N 3.08Å; F103-G106 PolarHBondContact O-N 3.13Å; F103-R107 PolarHBondContact O-N 3.48Å; F103-W161 AromaticContact CD2-CH2 3.86Å; F103-W161 HydrophobicContact CD2-CH2 3.86Å; F103-W161 AromaticContact CD2-CZ3 3.94Å; F103-W161 HydrophobicContact CD2-CZ3 3.94Å; F103-W161 HydrophobicContact CE2-CE3 4.22Å; F103-W161 AromaticContact CE2-CH2 3.84Å; F103-W161 HydrophobicContact CE2-CH2 3.84Å; F103-W161 HydrophobicContact CE2-CZ2 4.47Å; F103-W161 AromaticContact CE2-CZ3 3.71Å; F103-W161 HydrophobicContact CE2-CZ3 3.71Å |
| 104 | I | 95.6 | Very high | 93.7 | Very high | 47 Ų | 47 | 52 Ų | 52 | 24% | 0.241 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.2 | -47.9 | 177.7 | -69 | 170.4 | 0 | 0 | 0 | 111.3 | W40 L47 P99 T100 V101 G106 R107 L108 | W40-I104 HydrophobicContact CH2-CD1 4.17Å; W40-I104 HydrophobicContact CZ3-CD1 3.8Å; L47-I104 HydrophobicContact CD1-CB 4.4Å; L47-I104 HydrophobicContact CD1-CG1 4.46Å; L47-I104 HydrophobicContact CD1-CG2 3.81Å; P99-I104 HydrophobicContact CB-CD1 4.36Å; P99-I104 HydrophobicContact CB-CG1 4.18Å; T100-I104 PolarHBondContact O-N 3.02Å; V101-I104 PolarHBondContact O-N 3.16Å; I104-G106 VanDerWaalsContact C-N 3.35Å; I104-R107 PolarHBondContact O-N 3.39Å; I104-L108 PolarHBondContact O-N 2.86Å |
| 105 | L | 97.2 | Very high | 94.1 | Very high | 82 Ų | 82 | 48.1 Ų | 48.1 | 43% | 0.429 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64 | -40.6 | 178 | -73.3 | 176.9 | 0 | 0 | 0 | 111.8 | L85 V101 Q102 R107 L108 L109 | L85-L105 HydrophobicContact CD1-CB 4.49Å; V101-L105 HydrophobicContact CG1-CD1 3.82Å; V101-L105 HydrophobicContact CG1-CG 4.17Å; V101-L105 WeakPolarHBondContact O-CB 3.15Å; V101-L105 VanDerWaalsContact O-CG 3.26Å; V101-L105 WeakPolarHBondContact O-CG 3.19Å; V101-L105 PolarHBondContact O-N 2.86Å; Q102-L105 PolarHBondContact O-N 2.76Å; L105-R107 VanDerWaalsContact C-N 3.34Å; L105-R107 PolarHBondContact O-N 3.28Å; L105-L108 PolarHBondContact O-N 3.16Å; L105-L109 WeakPolarHBondContact O-CB 3.34Å; L105-L109 VanDerWaalsContact O-CG 3.31Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.05Å |
| 106 | G | 98.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.6 | -49 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G82 Q102 F103 I104 L109 T110 | G82-G106 WeakPolarHBondContact CA-O 3.25Å; G82-G106 WeakPolarHBondContact O-CA 3.17Å; Q102-G106 PolarHBondContact O-N 3.08Å; F103-G106 PolarHBondContact O-N 3.13Å; I104-G106 VanDerWaalsContact C-N 3.35Å; G106-L109 PolarHBondContact O-N 3.42Å; G106-T110 WeakPolarHBondContact O-CG2 3.4Å; G106-T110 PolarHBondContact O-N 2.96Å |
| 107 | R | 97.3 | Very high | 95 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -63.1 | -45.8 | 178.1 | -168.3 | 56.5 | 174.4 | 150.7 | -10.6 | 112.6 | T23 S27 F44 L47 L48 F103 I104 L105 L109 T110 G111 | T23-R107 PolarHBondContact O-NH1 3.24Å; T23-R107 VanDerWaalsContact O-NH1 3.13Å; T23-R107 PolarHBondContact O-NH2 3.48Å; S27-R107 PolarHBondContact OG-NH2 2.71Å; F44-R107 HydrophobicContact CD2-CB 4.07Å; F44-R107 HydrophobicContact CD2-CG 3.75Å; F44-R107 HydrophobicContact CE2-CB 3.99Å; F44-R107 HydrophobicContact CE2-CG 3.71Å; F44-R107 WeakPolarHBondContact O-CG 3.45Å; L47-R107 HydrophobicContact CB-CB 4.38Å; L47-R107 HydrophobicContact CB-CG 3.91Å; L48-R107 VanDerWaalsContact CD2-NH2 3.34Å; F103-R107 PolarHBondContact O-N 3.48Å; I104-R107 PolarHBondContact O-N 3.39Å; L105-R107 VanDerWaalsContact C-N 3.34Å; L105-R107 PolarHBondContact O-N 3.28Å; R107-L109 VanDerWaalsContact C-N 3.34Å; R107-L109 PolarHBondContact O-N 2.86Å; R107-T110 PolarHBondContact NH1-OG1 3.48Å; R107-T110 PolarHBondContact O-N 2.93Å; R107-T110 PolarHBondContact O-OG1 3.12Å; R107-G111 PolarHBondContact O-N 2.92Å; R107-G111 VanDerWaalsContact O-N 3.08Å |
| 108 | L | 98.4 | Very high | 95.8 | Very high | 40 Ų | 40 | 24 Ų | 24 | 21% | 0.209 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -58.4 | -45.1 | 177 | -177.6 | 65.6 | 0 | 0 | 0 | 111.7 | L47 V50 I54 I104 L105 G111 I112 | L47-L108 HydrophobicContact CD2-CD1 4.44Å; V50-L108 HydrophobicContact CB-CD1 4.18Å; V50-L108 HydrophobicContact CG1-CD1 3.93Å; I54-L108 HydrophobicContact CD1-CD1 4.44Å; I104-L108 PolarHBondContact O-N 2.86Å; L105-L108 PolarHBondContact O-N 3.16Å; L108-G111 CarbonylContact O-C 3.58Å; L108-G111 WeakPolarHBondContact O-CA 3.25Å; L108-G111 PolarHBondContact O-N 3.41Å; L108-G111 VanDerWaalsContact O-N 3.11Å; L108-I112 HydrophobicContact CG-CD1 4.24Å; L108-I112 WeakPolarHBondContact O-CG1 3.41Å; L108-I112 PolarHBondContact O-N 3.13Å |
| 109 | L | 98.6 | Very high | 96.5 | Very high | 32 Ų | 32 | 22.7 Ų | 22.7 | 17% | 0.168 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -65.5 | -41.9 | 179.3 | -74.7 | 173.5 | 0 | 0 | 0 | 112.8 | L78 L81 L85 L105 G106 R107 G111 I112 G113 | L78-L109 HydrophobicContact CD2-CD2 3.96Å; L81-L109 HydrophobicContact CD2-CD1 3.92Å; L81-L109 HydrophobicContact CG-CD1 3.97Å; L85-L109 HydrophobicContact CD1-CD1 3.73Å; L105-L109 WeakPolarHBondContact O-CB 3.34Å; L105-L109 VanDerWaalsContact O-CG 3.31Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.05Å; G106-L109 PolarHBondContact O-N 3.42Å; R107-L109 VanDerWaalsContact C-N 3.34Å; R107-L109 PolarHBondContact O-N 2.86Å; L109-G111 PolarHBondContact O-N 3.41Å; L109-I112 HydrophobicContact CD2-CD1 4.47Å; L109-I112 PolarHBondContact O-N 2.99Å; L109-G113 PolarHBondContact O-N 3.11Å |
| 110 | T | 98.6 | Very high | 97 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -58.4 | -35.3 | 171.9 | 62.1 | 0 | 0 | 0 | 0 | 111.2 | W83 L86 G106 R107 C114 | W83-T110 HydrophobicContact CD2-CG2 3.68Å; W83-T110 HydrophobicContact CE3-CG2 4.1Å; W83-T110 HydrophobicContact CG-CG2 3.98Å; W83-T110 HydrophobicContact CZ2-CG2 4.22Å; L86-T110 HydrophobicContact CD1-CG2 4.07Å; G106-T110 WeakPolarHBondContact O-CG2 3.4Å; G106-T110 PolarHBondContact O-N 2.96Å; R107-T110 PolarHBondContact NH1-OG1 3.48Å; R107-T110 PolarHBondContact O-N 2.93Å; R107-T110 PolarHBondContact O-OG1 3.12Å; T110-C114 VanDerWaalsContact O-CB 3.27Å; T110-C114 WeakPolarHBondContact O-CB 3.25Å; T110-C114 PolarHBondContact O-N 3.14Å |
| 111 | G | 98.5 | Very high | 97.3 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -71.6 | -41 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | L48 G51 G52 R107 L108 L109 G113 C114 G115 | L48-G111 WeakPolarHBondContact O-CA 3.49Å; G51-G111 CarbonylContact C-O 3.58Å; G51-G111 VanDerWaalsContact C-O 3.26Å; G52-G111 WeakPolarHBondContact CA-O 3.43Å; G52-G111 PolarHBondContact N-O 3.35Å; R107-G111 PolarHBondContact O-N 2.92Å; R107-G111 VanDerWaalsContact O-N 3.08Å; L108-G111 CarbonylContact O-C 3.58Å; L108-G111 WeakPolarHBondContact O-CA 3.25Å; L108-G111 PolarHBondContact O-N 3.41Å; L108-G111 VanDerWaalsContact O-N 3.11Å; L109-G111 PolarHBondContact O-N 3.41Å; G111-G113 VanDerWaalsContact C-N 3.33Å; G111-G113 PolarHBondContact O-N 2.87Å; G111-C114 PolarHBondContact O-N 3.16Å; G111-G115 PolarHBondContact O-N 2.99Å |
| 112 | I | 98.7 | Very high | 97.4 | Very high | 20 Ų | 20 | 16.5 Ų | 16.5 | 10% | 0.103 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60 | -47.1 | 174.2 | -63.2 | 171.2 | 0 | 0 | 0 | 109.9 | G51 I54 L78 L108 L109 C114 G115 L116 | G51-I112 VanDerWaalsContact O-CA 3.27Å; G51-I112 WeakPolarHBondContact O-CA 3.42Å; I54-I112 HydrophobicContact CB-CG1 4.19Å; I54-I112 HydrophobicContact CD1-CD1 4.48Å; I54-I112 HydrophobicContact CG2-CD1 4.24Å; I54-I112 HydrophobicContact CG2-CG1 4.18Å; L78-I112 HydrophobicContact CD1-CG2 3.82Å; L108-I112 HydrophobicContact CG-CD1 4.24Å; L108-I112 WeakPolarHBondContact O-CG1 3.41Å; L108-I112 PolarHBondContact O-N 3.13Å; L109-I112 HydrophobicContact CD2-CD1 4.47Å; L109-I112 PolarHBondContact O-N 2.99Å; I112-C114 PolarHBondContact O-N 3.35Å; I112-G115 PolarHBondContact O-N 2.98Å; I112-L116 HydrophobicContact CG2-CD1 4.02Å; I112-L116 WeakPolarHBondContact O-CB 3.12Å; I112-L116 WeakPolarHBondContact O-CG 3.18Å; I112-L116 PolarHBondContact O-N 3.37Å |
| 113 | G | 98.7 | Very high | 97.4 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -63.6 | -37.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S75 S79 L109 G111 T117 | S75-G113 WeakPolarHBondContact O-CA 3.5Å; S75-G113 PolarHBondContact OG-O 3.05Å; S79-G113 WeakPolarHBondContact OG-CA 3.43Å; L109-G113 PolarHBondContact O-N 3.11Å; G111-G113 VanDerWaalsContact C-N 3.33Å; G111-G113 PolarHBondContact O-N 2.87Å; G113-T117 VanDerWaalsContact O-CB 3.24Å; G113-T117 WeakPolarHBondContact O-CB 3.46Å; G113-T117 PolarHBondContact O-N 3.14Å; G113-T117 PolarHBondContact O-OG1 3.4Å |
| 114 | C | 98.5 | Very high | 97.4 | Very high | 1 Ų | 1 | 11.7 Ų | 11.7 | 1% | 0.007 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -62.7 | -48 | 174.8 | -174.4 | 0 | 0 | 0 | 0 | 111.9 | T23 L48 T110 G111 I112 L116 T117 L118 | T23-C114 HydrophobicContact CG2-CB 4.29Å; L48-C114 HydrophobicContact CD1-CB 4.04Å; T110-C114 VanDerWaalsContact O-CB 3.27Å; T110-C114 WeakPolarHBondContact O-CB 3.25Å; T110-C114 PolarHBondContact O-N 3.14Å; G111-C114 PolarHBondContact O-N 3.16Å; I112-C114 PolarHBondContact O-N 3.35Å; C114-L116 PolarHBondContact O-N 3.06Å; C114-T117 PolarHBondContact O-N 2.65Å; C114-L118 PolarHBondContact O-N 2.99Å |
| 115 | G | 98.4 | Very high | 97.2 | Very high | 0 Ų | 0 | 9.6 Ų | 9.6 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -62.4 | -41.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | G111 I112 T119 | G111-G115 PolarHBondContact O-N 2.99Å; I112-G115 PolarHBondContact O-N 2.98Å; G115-T119 WeakPolarHBondContact O-CB 3.33Å; G115-T119 PolarHBondContact O-N 3.48Å; G115-T119 PolarHBondContact O-OG1 2.89Å |
| 116 | L | 98.4 | Very high | 96.9 | Very high | 0 Ų | 0 | 6.6 Ų | 6.6 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -64.1 | -47.4 | 173.5 | -77.8 | 169.9 | 0 | 0 | 0 | 111.4 | G55 W58 L62 T71 S75 L78 I112 C114 T120 | G55-L116 WeakPolarHBondContact O-CD2 3.34Å; W58-L116 HydrophobicContact CB-CD2 4.46Å; L62-L116 HydrophobicContact CD1-CD2 3.54Å; T71-L116 HydrophobicContact CG2-CD2 4.32Å; S75-L116 WeakPolarHBondContact OG-CB 3.31Å; L78-L116 HydrophobicContact CD1-CD1 3.81Å; I112-L116 HydrophobicContact CG2-CD1 4.02Å; I112-L116 WeakPolarHBondContact O-CB 3.12Å; I112-L116 WeakPolarHBondContact O-CG 3.18Å; I112-L116 PolarHBondContact O-N 3.37Å; C114-L116 PolarHBondContact O-N 3.06Å; L116-T120 WeakPolarHBondContact O-CB 3.38Å; L116-T120 PolarHBondContact O-N 3.39Å; L116-T120 PolarHBondContact O-OG1 2.86Å |
| 117 | T | 98.4 | Very high | 96.5 | Very high | 0 Ų | 0 | 6.9 Ų | 6.9 | 0% | 0 | 4% | 0.035 | C | C | . | . | H | α-helix | trans | -61.8 | -54.1 | -177.6 | -56.7 | 0 | 0 | 0 | 0 | 110.5 | S16 L72 S75 Y76 G113 C114 T119 T120 N121 | S16-T117 WeakPolarHBondContact O-CG2 3.38Å; L72-T117 HydrophobicContact CD2-CG2 4.46Å; S75-T117 PolarHBondContact OG-N 3.32Å; S75-T117 PolarHBondContact OG-OG1 3.44Å; Y76-T117 HydrophobicContact CE1-CG2 3.96Å; G113-T117 VanDerWaalsContact O-CB 3.24Å; G113-T117 WeakPolarHBondContact O-CB 3.46Å; G113-T117 PolarHBondContact O-N 3.14Å; G113-T117 PolarHBondContact O-OG1 3.4Å; C114-T117 PolarHBondContact O-N 2.65Å; T117-T119 PolarHBondContact O-N 2.98Å; T117-T120 PolarHBondContact O-N 3.45Å; T117-N121 WeakPolarHBondContact O-CB 3.48Å; T117-N121 PolarHBondContact O-N 2.93Å |
| 118 | L | 97.6 | Very high | 96.1 | Very high | 16 Ų | 16 | 7.1 Ų | 7.1 | 8% | 0.084 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -59.3 | -48.7 | -177.5 | -77.1 | 174.7 | 0 | 0 | 0 | 111.6 | S20 F24 C114 V122 I145 W387 | S20-L118 WeakPolarHBondContact OG-CG 3.15Å; F24-L118 HydrophobicContact CE2-CD1 4.26Å; F24-L118 HydrophobicContact CZ-CD1 3.88Å; C114-L118 PolarHBondContact O-N 2.99Å; L118-V122 WeakPolarHBondContact O-CB 3.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.37Å; L118-V122 PolarHBondContact O-N 2.78Å; L118-V122 VanDerWaalsContact O-N 3.13Å; L118-I145 HydrophobicContact CD2-CD1 3.92Å; L118-I145 HydrophobicContact CD2-CG1 4.28Å; L118-W387 HydrophobicContact CD1-CH2 4.37Å; L118-W387 HydrophobicContact CD1-CZ2 3.84Å |
| 119 | T | 97.2 | Very high | 95.5 | Very high | 0 Ų | 0 | 5.8 Ų | 5.8 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -65 | -48.3 | -177.7 | -47.2 | 0 | 0 | 0 | 0 | 111.4 | S56 S59 G115 T117 I123 I379 K380 L383 | S56-T119 WeakPolarHBondContact CB-OG1 3.37Å; S59-T119 WeakPolarHBondContact OG-CB 3.26Å; S59-T119 WeakPolarHBondContact OG-CG2 3.3Å; G115-T119 WeakPolarHBondContact O-CB 3.33Å; G115-T119 PolarHBondContact O-N 3.48Å; G115-T119 PolarHBondContact O-OG1 2.89Å; T117-T119 PolarHBondContact O-N 2.98Å; T119-I123 HydrophobicContact CG2-CD1 3.99Å; T119-I123 VanDerWaalsContact O-CG1 3.31Å; T119-I123 WeakPolarHBondContact O-CG1 3.43Å; T119-I123 PolarHBondContact O-N 3.18Å; T119-I123 VanDerWaalsContact O-N 3.16Å; T119-I379 HydrophobicContact CG2-CG2 4.11Å; T119-K380 HydrophobicContact CG2-CB 4.47Å; T119-L383 HydrophobicContact CG2-CD1 4.19Å; T119-L383 WeakPolarHBondContact OG1-CD1 3.29Å |
| 120 | T | 97.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 6.1 Ų | 6.1 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -68.7 | -41.1 | -176.6 | -52.1 | 0 | 0 | 0 | 0 | 111.9 | I63 H68 T71 L72 L116 T117 I123 Y124 | I63-T120 HydrophobicContact CD1-CG2 3.88Å; I63-T120 HydrophobicContact CG1-CG2 3.94Å; H68-T120 HydrophobicContact CB-CG2 4.14Å; T71-T120 HydrophobicContact CG2-CG2 3.96Å; T71-T120 WeakPolarHBondContact CG2-OG1 3.39Å; L72-T120 HydrophobicContact CD1-CG2 4.47Å; L72-T120 HydrophobicContact CD2-CG2 3.92Å; L72-T120 HydrophobicContact CG-CG2 3.73Å; L116-T120 WeakPolarHBondContact O-CB 3.38Å; L116-T120 PolarHBondContact O-N 3.39Å; L116-T120 PolarHBondContact O-OG1 2.86Å; T117-T120 PolarHBondContact O-N 3.45Å; T120-I123 PolarHBondContact O-N 3.01Å; T120-Y124 WeakPolarHBondContact O-CB 3.38Å; T120-Y124 PolarHBondContact O-N 3.3Å |
| 121 | N | 96.5 | Very high | 93.8 | Very high | 3 Ų | 3 | 10.8 Ų | 10.8 | 2% | 0.016 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -63.3 | -45 | 179.4 | -173 | 29.8 | 0 | 0 | 0 | 111 | S13 S16 L72 T117 I123 Y124 V125 F141 | S13-N121 PolarHBondContact O-ND2 3.03Å; S16-N121 WeakPolarHBondContact CB-ND2 3.25Å; L72-N121 HydrophobicContact CD2-CB 4.46Å; T117-N121 WeakPolarHBondContact O-CB 3.48Å; T117-N121 PolarHBondContact O-N 2.93Å; N121-I123 PolarHBondContact O-N 2.84Å; N121-Y124 PolarHBondContact O-N 2.95Å; N121-V125 VanDerWaalsContact O-CB 3.25Å; N121-V125 WeakPolarHBondContact O-CB 3.38Å; N121-V125 WeakPolarHBondContact O-CG2 3.26Å; N121-V125 PolarHBondContact O-N 3.1Å; N121-F141 VanDerWaalsContact ND2-CE1 3.32Å; N121-F141 WeakPolarHBondContact ND2-CE1 3.46Å |
| 122 | V | 94.9 | Very high | 93 | Very high | 4 Ų | 4 | 14.6 Ų | 14.6 | 2% | 0.024 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60.6 | -47.2 | 176.8 | 175.2 | 0 | 0 | 0 | 0 | 111.3 | L118 Y126 F141 L363 L367 I379 | L118-V122 WeakPolarHBondContact O-CB 3.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.37Å; L118-V122 PolarHBondContact O-N 2.78Å; L118-V122 VanDerWaalsContact O-N 3.13Å; V122-Y126 WeakPolarHBondContact O-CB 3.35Å; V122-Y126 PolarHBondContact O-N 2.95Å; V122-Y126 VanDerWaalsContact O-N 3.13Å; V122-F141 HydrophobicContact CB-CE2 4.08Å; V122-F141 HydrophobicContact CB-CZ 4.38Å; V122-F141 HydrophobicContact CG1-CE2 4.21Å; V122-F141 HydrophobicContact CG2-CD2 3.86Å; V122-F141 HydrophobicContact CG2-CE2 3.67Å; V122-F141 HydrophobicContact CG2-CG 4.45Å; V122-F141 HydrophobicContact CG2-CZ 4.07Å; V122-L363 HydrophobicContact CG1-CD1 4.21Å; V122-L363 HydrophobicContact CG2-CD2 4.09Å; V122-L367 HydrophobicContact CG1-CD1 4.24Å; V122-L367 HydrophobicContact CG1-CD2 3.67Å; V122-L367 HydrophobicContact CG1-CG 4.44Å; V122-I379 HydrophobicContact CB-CG2 4.34Å; V122-I379 HydrophobicContact CG1-CD1 3.78Å; V122-I379 HydrophobicContact CG1-CG1 4.37Å; V122-I379 HydrophobicContact CG1-CG2 4.09Å |
| 123 | I | 94.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62.7 | -53 | 179.1 | -66.7 | 165.8 | 0 | 0 | 0 | 110.7 | I63 H68 T119 T120 N121 V125 Y126 E127 N376 I379 | I63-I123 HydrophobicContact CD1-CB 4.46Å; I63-I123 HydrophobicContact CD1-CD1 3.79Å; H68-I123 WeakPolarHBondContact NE2-CG2 3.34Å; T119-I123 HydrophobicContact CG2-CD1 3.99Å; T119-I123 VanDerWaalsContact O-CG1 3.31Å; T119-I123 WeakPolarHBondContact O-CG1 3.43Å; T119-I123 PolarHBondContact O-N 3.18Å; T119-I123 VanDerWaalsContact O-N 3.16Å; T120-I123 PolarHBondContact O-N 3.01Å; N121-I123 PolarHBondContact O-N 2.84Å; I123-V125 VanDerWaalsContact C-N 3.29Å; I123-V125 PolarHBondContact O-N 2.7Å; I123-Y126 PolarHBondContact O-N 2.95Å; I123-Y126 VanDerWaalsContact O-N 3.08Å; I123-E127 HydrophobicContact CG2-CG 4.37Å; I123-E127 WeakPolarHBondContact O-CG 3.33Å; I123-E127 PolarHBondContact O-N 3.15Å; I123-N376 HydrophobicContact CD1-CB 4.24Å; I123-N376 WeakPolarHBondContact CG2-OD1 3.45Å; I123-I379 HydrophobicContact CG1-CB 4.28Å; I123-I379 HydrophobicContact CG1-CD1 3.63Å; I123-I379 HydrophobicContact CG1-CG2 4.27Å |
| 124 | Y | 94.4 | Very high | 91.7 | Very high | 1 Ų | 1 | 16.1 Ų | 16.1 | 0% | 0.004 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -52.7 | -49.6 | -177.4 | 171.5 | -110.4 | 0 | 0 | 0 | 111.7 | H68 T120 N121 Y126 E127 I128 L182 P183 | H68-Y124 HydrophobicContact CB-CD2 3.55Å; H68-Y124 HydrophobicContact CB-CE2 4.44Å; H68-Y124 HydrophobicContact CB-CG 4.04Å; H68-Y124 AromaticContact CG-CD2 3.71Å; T120-Y124 WeakPolarHBondContact O-CB 3.38Å; T120-Y124 PolarHBondContact O-N 3.3Å; N121-Y124 PolarHBondContact O-N 2.95Å; Y124-Y126 PolarHBondContact O-N 3.46Å; Y124-E127 PolarHBondContact O-N 2.96Å; Y124-I128 HydrophobicContact CD1-CD1 3.71Å; Y124-I128 HydrophobicContact CD2-CD1 4.41Å; Y124-I128 HydrophobicContact CD2-CG2 4.39Å; Y124-I128 HydrophobicContact CE1-CD1 3.2Å; Y124-I128 HydrophobicContact CE2-CD1 3.99Å; Y124-I128 HydrophobicContact CE2-CG2 3.99Å; Y124-I128 HydrophobicContact CG-CD1 4.28Å; Y124-I128 WeakPolarHBondContact O-CG1 3.26Å; Y124-I128 PolarHBondContact O-N 3.26Å; Y124-L182 HydrophobicContact CE1-CD1 3.89Å; Y124-P183 WeakPolarHBondContact CE2-O 3.26Å; Y124-P183 PolarHBondContact OH-O 3.38Å |
| 125 | V | 92.4 | Very high | 91.2 | Very high | 3 Ų | 3 | 16.5 Ų | 16.5 | 2% | 0.018 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -63.2 | -42 | 180 | 162.8 | 0 | 0 | 0 | 0 | 112.3 | S13 N121 I123 E127 I128 I129 M137 F141 | S13-V125 WeakPolarHBondContact OG-CG2 3.42Å; N121-V125 VanDerWaalsContact O-CB 3.25Å; N121-V125 WeakPolarHBondContact O-CB 3.38Å; N121-V125 WeakPolarHBondContact O-CG2 3.26Å; N121-V125 PolarHBondContact O-N 3.1Å; I123-V125 VanDerWaalsContact C-N 3.29Å; I123-V125 PolarHBondContact O-N 2.7Å; V125-E127 VanDerWaalsContact C-N 3.27Å; V125-E127 PolarHBondContact O-N 2.79Å; V125-I128 WeakPolarHBondContact O-CG1 3.14Å; V125-I128 PolarHBondContact O-N 3.48Å; V125-I129 WeakPolarHBondContact O-CB 3.47Å; V125-I129 WeakPolarHBondContact O-CG2 3.25Å; V125-I129 PolarHBondContact O-N 2.94Å; V125-M137 HydrophobicContact CB-CE 4.11Å; V125-M137 HydrophobicContact CB-CG 4.47Å; V125-M137 HydrophobicContact CG1-CB 4.24Å; V125-M137 HydrophobicContact CG1-CE 3.28Å; V125-M137 HydrophobicContact CG1-CG 3.08Å; V125-M137 HydrophobicContact CG1-SD 4.02Å; V125-M137 HydrophobicContact CG2-CE 3.63Å; V125-F141 HydrophobicContact CB-CZ 3.73Å; V125-F141 HydrophobicContact CG1-CE2 4.3Å; V125-F141 HydrophobicContact CG1-CZ 3.78Å; V125-F141 HydrophobicContact CG2-CE1 4.15Å; V125-F141 HydrophobicContact CG2-CZ 3.77Å |
| 126 | Y | 89.7 | Confident | 90.7 | Very high | 18 Ų | 18 | 18.8 Ų | 18.8 | 7% | 0.071 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.9 | -31.1 | -179.8 | -169.4 | -82.3 | 0 | 0 | 0 | 112.3 | V122 I123 Y124 K134 L367 F370 T372 L375 | V122-Y126 WeakPolarHBondContact O-CB 3.35Å; V122-Y126 PolarHBondContact O-N 2.95Å; V122-Y126 VanDerWaalsContact O-N 3.13Å; I123-Y126 PolarHBondContact O-N 2.95Å; I123-Y126 VanDerWaalsContact O-N 3.08Å; Y124-Y126 PolarHBondContact O-N 3.46Å; Y126-K134 HydrophobicContact CD1-CD 4.45Å; Y126-K134 HydrophobicContact CD2-CB 4.43Å; Y126-K134 HydrophobicContact CD2-CD 3.83Å; Y126-K134 HydrophobicContact CD2-CG 4.06Å; Y126-K134 HydrophobicContact CE1-CD 4.13Å; Y126-K134 HydrophobicContact CE2-CB 4.32Å; Y126-K134 HydrophobicContact CE2-CD 3.44Å; Y126-K134 VanDerWaalsContact CE2-CD 3.44Å; Y126-K134 HydrophobicContact CE2-CG 4.07Å; Y126-K134 HydrophobicContact CG-CD 4.35Å; Y126-K134 WeakPolarHBondContact O-CE 3.3Å; Y126-L367 HydrophobicContact CD2-CB 4.17Å; Y126-L367 HydrophobicContact CD2-CD1 4.49Å; Y126-L367 HydrophobicContact CD2-CD2 3.85Å; Y126-L367 HydrophobicContact CD2-CG 4.39Å; Y126-L367 HydrophobicContact CE2-CB 3.86Å; Y126-L367 HydrophobicContact CE2-CD2 4.24Å; Y126-L367 VanDerWaalsContact CE2-O 3.29Å; Y126-L367 WeakPolarHBondContact CE2-O 3.46Å; Y126-L367 PolarHBondContact OH-O 3.43Å; Y126-F370 PolarHBondContact OH-O 3.25Å; Y126-T372 HydrophobicContact CE1-CG2 4.25Å; Y126-L375 HydrophobicContact CD1-CD1 4.37Å; Y126-L375 HydrophobicContact CD1-CD2 3.05Å; Y126-L375 HydrophobicContact CD1-CG 4.27Å; Y126-L375 HydrophobicContact CD2-CD2 4.26Å; Y126-L375 HydrophobicContact CE1-CD1 4.06Å; Y126-L375 HydrophobicContact CE1-CD2 3.41Å; Y126-L375 VanDerWaalsContact CE1-CD2 3.41Å; Y126-L375 HydrophobicContact CE1-CG 4.27Å; Y126-L375 HydrophobicContact CE2-CD1 4.26Å; Y126-L375 HydrophobicContact CG-CD2 3.5Å |
| 127 | E | 90 | Very high | 90.2 | Very high | 7 Ų | 7 | 19 Ų | 19 | 3% | 0.033 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -76.8 | -25.2 | 177 | -67.6 | -166.8 | 162.9 | 0 | 0 | 113.3 | H68 I123 Y124 V125 S185 E187 K191 N376 | H68-E127 IonicContact CE1-OE2 2.78Å; H68-E127 PolarHBondContact CE1-OE2 2.99Å; H68-E127 IonicContact NE2-OE2 3.99Å; I123-E127 HydrophobicContact CG2-CG 4.37Å; I123-E127 WeakPolarHBondContact O-CG 3.33Å; I123-E127 PolarHBondContact O-N 3.15Å; Y124-E127 PolarHBondContact O-N 2.96Å; V125-E127 VanDerWaalsContact C-N 3.27Å; V125-E127 PolarHBondContact O-N 2.79Å; E127-S185 VanDerWaalsContact CB-OG 3.26Å; E127-S185 WeakPolarHBondContact CB-OG 3.08Å; E127-S185 VanDerWaalsContact OE2-CB 3.24Å; E127-S185 WeakPolarHBondContact OE2-CB 3.32Å; E127-S185 PolarHBondContact OE2-OG 3.49Å; E127-E187 HydrophobicContact CB-CB 4.18Å; E127-E187 HydrophobicContact CB-CG 4.35Å; E127-E187 HydrophobicContact CG-CB 4.39Å; E127-K191 IonicContact OE1-NZ 2.89Å; E127-K191 PolarHBondContact OE1-NZ 2.81Å; E127-N376 PolarHBondContact OE1-ND2 3.04Å |
| 128 | I | 88.9 | Confident | 89.7 | Confident | 4 Ų | 4 | 19 Ų | 19 | 2% | 0.021 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -101 | -28.1 | -177.6 | 67.8 | -165.8 | 0 | 0 | 0 | 114.2 | V9 Y124 V125 L205 Y206 | V9-I128 HydrophobicContact CG1-CD1 3.35Å; V9-I128 HydrophobicContact CG1-CG1 4.23Å; Y124-I128 HydrophobicContact CD1-CD1 3.71Å; Y124-I128 HydrophobicContact CD2-CD1 4.41Å; Y124-I128 HydrophobicContact CD2-CG2 4.39Å; Y124-I128 HydrophobicContact CE1-CD1 3.2Å; Y124-I128 HydrophobicContact CE2-CD1 3.99Å; Y124-I128 HydrophobicContact CE2-CG2 3.99Å; Y124-I128 HydrophobicContact CG-CD1 4.28Å; Y124-I128 WeakPolarHBondContact O-CG1 3.26Å; Y124-I128 PolarHBondContact O-N 3.26Å; V125-I128 WeakPolarHBondContact O-CG1 3.14Å; V125-I128 PolarHBondContact O-N 3.48Å; I128-L205 HydrophobicContact CB-CD2 3.96Å; I128-L205 VanDerWaalsContact O-CD2 3.25Å; I128-L205 WeakPolarHBondContact O-CD2 3.4Å; I128-Y206 PolarHBondContact O-OH 3.46Å |
| 129 | I | 85.3 | Confident | 89.4 | Confident | 12 Ų | 12 | 18.3 Ų | 18.3 | 6% | 0.062 | 11% | 0.113 | C | C | . | . | S | Bend | trans | -80.4 | 143.2 | -173.9 | -154.8 | 170.6 | 0 | 0 | 0 | 110.9 | F6 L10 V125 K134 M137 | F6-I129 HydrophobicContact CE2-CD1 4.39Å; F6-I129 HydrophobicContact CE2-CG1 3.7Å; F6-I129 HydrophobicContact CZ-CD1 4.05Å; F6-I129 HydrophobicContact CZ-CG1 3.77Å; L10-I129 HydrophobicContact CD2-CD1 3.76Å; V125-I129 WeakPolarHBondContact O-CB 3.47Å; V125-I129 WeakPolarHBondContact O-CG2 3.25Å; V125-I129 PolarHBondContact O-N 2.94Å; I129-K134 HydrophobicContact CG2-CG 3.65Å; I129-M137 HydrophobicContact CD1-CB 3.48Å; I129-M137 VanDerWaalsContact CD1-CB 3.48Å; I129-M137 HydrophobicContact CD1-CG 3.75Å |
| 130 | P | 83.2 | Confident | 89.3 | Confident | 40 Ų | 40 | 19.7 Ų | 19.7 | 26% | 0.26 | 12% | 0.121 | S | C | . | . | trans | -62.4 | 149.2 | 174.5 | 27.4 | -34.9 | 0 | 0 | 0 | 110.4 | F6 S132 S133 Y206 | F6-P130 HydrophobicContact CE2-CG 4.27Å; F6-P130 HydrophobicContact CZ-CG 4.5Å; P130-S132 PolarHBondContact O-N 3.47Å; P130-S132 VanDerWaalsContact O-N 3.12Å; P130-S133 PolarHBondContact O-N 3.24Å; P130-Y206 WeakPolarHBondContact CD-OH 3.38Å | ||
| 131 | S | 78.9 | Confident | 89.3 | Confident | 98 Ų | 98 | 20 Ų | 20 | 69% | 0.685 | 12% | 0.122 | S | C | * | . | G | 310 helix | trans | -53.3 | -37.2 | -177.2 | 51.9 | 0 | 0 | 0 | 0 | 113.4 | S133 K134 | S131-S133 PolarHBondContact O-N 3.13Å; S131-S133 VanDerWaalsContact O-N 3.16Å; S131-K134 PolarHBondContact O-N 3.21Å |
| 132 | S | 81 | Confident | 89.3 | Confident | 79 Ų | 79 | 20.8 Ų | 20.8 | 55% | 0.552 | 13% | 0.126 | S | C | * | . | G | 310 helix | trans | -62.5 | -19.3 | 178.2 | 60.4 | 0 | 0 | 0 | 0 | 114.7 | P130 | P130-S132 PolarHBondContact O-N 3.47Å; P130-S132 VanDerWaalsContact O-N 3.12Å |
| 133 | S | 86.1 | Confident | 89.4 | Confident | 23 Ų | 23 | 21.3 Ų | 21.3 | 16% | 0.161 | 13% | 0.129 | C | C | . | . | G | 310 helix | trans | -109.9 | 1 | -175.6 | -61.9 | 0 | 0 | 0 | 0 | 113.8 | P130 S131 V135 L136 M137 | P130-S133 PolarHBondContact O-N 3.24Å; S131-S133 PolarHBondContact O-N 3.13Å; S131-S133 VanDerWaalsContact O-N 3.16Å; S133-V135 PolarHBondContact O-N 3.21Å; S133-L136 WeakPolarHBondContact O-CB 3.34Å; S133-L136 PolarHBondContact O-N 2.89Å; S133-M137 WeakPolarHBondContact O-CB 3.34Å; S133-M137 PolarHBondContact O-N 3.01Å |
| 134 | K | 85.6 | Confident | 89.6 | Confident | 29 Ų | 29 | 21.3 Ų | 21.3 | 13% | 0.126 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.2 | -46.7 | -177.4 | -74.4 | 176.4 | 167.8 | -176.1 | 0 | 112.9 | Y126 I129 S131 M137 G138 | Y126-K134 HydrophobicContact CD1-CD 4.45Å; Y126-K134 HydrophobicContact CD2-CB 4.43Å; Y126-K134 HydrophobicContact CD2-CD 3.83Å; Y126-K134 HydrophobicContact CD2-CG 4.06Å; Y126-K134 HydrophobicContact CE1-CD 4.13Å; Y126-K134 HydrophobicContact CE2-CB 4.32Å; Y126-K134 HydrophobicContact CE2-CD 3.44Å; Y126-K134 VanDerWaalsContact CE2-CD 3.44Å; Y126-K134 HydrophobicContact CE2-CG 4.07Å; Y126-K134 HydrophobicContact CG-CD 4.35Å; Y126-K134 WeakPolarHBondContact O-CE 3.3Å; I129-K134 HydrophobicContact CG2-CG 3.65Å; S131-K134 PolarHBondContact O-N 3.21Å; K134-M137 PolarHBondContact O-N 3.28Å; K134-G138 PolarHBondContact O-N 2.9Å |
| 135 | V | 86 | Confident | 89.8 | Confident | 10 Ų | 10 | 22.4 Ų | 22.4 | 6% | 0.061 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.9 | -44.9 | 177.3 | 176.7 | 0 | 0 | 0 | 0 | 111.9 | S133 M137 G138 S139 V306 R307 W311 L364 E368 L433 | S133-V135 PolarHBondContact O-N 3.21Å; V135-M137 PolarHBondContact O-N 2.97Å; V135-G138 PolarHBondContact O-N 2.87Å; V135-S139 PolarHBondContact O-N 3.24Å; V135-S139 VanDerWaalsContact O-N 3.14Å; V135-S139 PolarHBondContact O-OG 3.39Å; V135-V306 HydrophobicContact CG1-CG1 4.47Å; V135-R307 HydrophobicContact CG1-CG 4.29Å; V135-W311 HydrophobicContact CG1-CZ2 3.98Å; V135-W311 HydrophobicContact CG2-CH2 4.16Å; V135-W311 HydrophobicContact CG2-CZ2 4.08Å; V135-L364 HydrophobicContact CG1-CD2 4.23Å; V135-E368 HydrophobicContact CG2-CG 4.41Å; V135-E368 WeakPolarHBondContact CG2-OE1 3.29Å; V135-L433 HydrophobicContact CB-CD2 4.3Å; V135-L433 HydrophobicContact CG1-CD1 4.19Å; V135-L433 HydrophobicContact CG2-CD1 4.49Å; V135-L433 HydrophobicContact CG2-CD2 3.93Å; V135-L433 HydrophobicContact CG2-CG 4.32Å |
| 136 | L | 89.5 | Confident | 90.1 | Very high | 48 Ų | 48 | 22.2 Ų | 22.2 | 25% | 0.251 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -53.1 | -46.1 | 176.7 | 169.9 | 62.2 | 0 | 0 | 0 | 110.1 | S133 S139 L140 V303 | S133-L136 WeakPolarHBondContact O-CB 3.34Å; S133-L136 PolarHBondContact O-N 2.89Å; L136-S139 PolarHBondContact O-N 2.65Å; L136-L140 HydrophobicContact CD1-CD1 4.13Å; L136-L140 HydrophobicContact CD1-CG 4.37Å; L136-L140 HydrophobicContact CG-CD1 4Å; L136-L140 WeakPolarHBondContact O-CG 3.18Å; L136-L140 PolarHBondContact O-N 2.7Å; L136-L140 VanDerWaalsContact O-N 3.07Å; L136-V303 HydrophobicContact CD1-CG1 3.43Å; L136-V303 VanDerWaalsContact CD1-CG1 3.43Å |
| 137 | M | 88 | Confident | 90.5 | Very high | 3 Ų | 3 | 23.2 Ų | 23.2 | 2% | 0.015 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -72.4 | -38.5 | -176.3 | -173.3 | 55.2 | 143.4 | 0 | 0 | 114 | L10 S13 V125 I129 S133 K134 V135 S139 L140 F141 | L10-M137 HydrophobicContact CD2-CE 3.31Å; L10-M137 HydrophobicContact CD2-CG 4.49Å; L10-M137 HydrophobicContact CD2-SD 3.6Å; L10-M137 HydrophobicContact CG-CE 4.48Å; S13-M137 WeakPolarHBondContact OG-CE 3.21Å; V125-M137 HydrophobicContact CB-CE 4.11Å; V125-M137 HydrophobicContact CB-CG 4.47Å; V125-M137 HydrophobicContact CG1-CB 4.24Å; V125-M137 HydrophobicContact CG1-CE 3.28Å; V125-M137 HydrophobicContact CG1-CG 3.08Å; V125-M137 HydrophobicContact CG1-SD 4.02Å; V125-M137 HydrophobicContact CG2-CE 3.63Å; I129-M137 HydrophobicContact CD1-CB 3.48Å; I129-M137 VanDerWaalsContact CD1-CB 3.48Å; I129-M137 HydrophobicContact CD1-CG 3.75Å; S133-M137 WeakPolarHBondContact O-CB 3.34Å; S133-M137 PolarHBondContact O-N 3.01Å; K134-M137 PolarHBondContact O-N 3.28Å; V135-M137 PolarHBondContact O-N 2.97Å; M137-S139 VanDerWaalsContact C-N 3.25Å; M137-S139 PolarHBondContact O-N 3.23Å; M137-L140 PolarHBondContact O-N 2.97Å; M137-L140 HydrophobicContact SD-CB 4.25Å; M137-L140 HydrophobicContact SD-CD1 4.32Å; M137-F141 HydrophobicContact CG-CE2 4.47Å; M137-F141 HydrophobicContact CG-CZ 4.45Å; M137-F141 PolarHBondContact O-N 2.95Å; M137-F141 VanDerWaalsContact O-N 3.1Å |
| 138 | G | 87.4 | Confident | 90.9 | Very high | 2 Ų | 2 | 22.9 Ų | 22.9 | 2% | 0.021 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.3 | -38.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K134 V135 F141 | K134-G138 PolarHBondContact O-N 2.9Å; V135-G138 PolarHBondContact O-N 2.87Å; G138-F141 PolarHBondContact O-N 3.19Å |
| 139 | S | 92 | Very high | 91.4 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -69.4 | -34.9 | 173.1 | -58 | 0 | 0 | 0 | 0 | 113 | V135 L136 M137 F141 Q142 V143 | V135-S139 PolarHBondContact O-N 3.24Å; V135-S139 VanDerWaalsContact O-N 3.14Å; V135-S139 PolarHBondContact O-OG 3.39Å; L136-S139 PolarHBondContact O-N 2.65Å; M137-S139 VanDerWaalsContact C-N 3.25Å; M137-S139 PolarHBondContact O-N 3.23Å; S139-F141 VanDerWaalsContact C-N 3.29Å; S139-F141 PolarHBondContact O-N 3.29Å; S139-Q142 WeakPolarHBondContact O-CB 3.31Å; S139-Q142 PolarHBondContact O-N 3.21Å; S139-V143 PolarHBondContact O-N 3.03Å |
| 140 | L | 94.8 | Very high | 92 | Very high | 30 Ų | 30 | 22.8 Ų | 22.8 | 16% | 0.157 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -67.6 | -25.6 | 177.8 | -72.8 | 170.4 | 0 | 0 | 0 | 113.1 | I14 L136 M137 Q142 V143 G144 V303 | I14-L140 HydrophobicContact CD1-CB 4.18Å; I14-L140 HydrophobicContact CD1-CD1 4.28Å; I14-L140 HydrophobicContact CD1-CD2 4.15Å; I14-L140 HydrophobicContact CD1-CG 4.44Å; I14-L140 HydrophobicContact CG1-CB 4.06Å; L136-L140 HydrophobicContact CD1-CD1 4.13Å; L136-L140 HydrophobicContact CD1-CG 4.37Å; L136-L140 HydrophobicContact CG-CD1 4Å; L136-L140 WeakPolarHBondContact O-CG 3.18Å; L136-L140 PolarHBondContact O-N 2.7Å; L136-L140 VanDerWaalsContact O-N 3.07Å; M137-L140 PolarHBondContact O-N 2.97Å; M137-L140 HydrophobicContact SD-CB 4.25Å; M137-L140 HydrophobicContact SD-CD1 4.32Å; L140-Q142 VanDerWaalsContact C-N 3.32Å; L140-Q142 PolarHBondContact O-N 3.42Å; L140-V143 HydrophobicContact CD2-CG2 4.42Å; L140-V143 WeakPolarHBondContact O-CB 3.4Å; L140-V143 PolarHBondContact O-N 2.7Å; L140-G144 PolarHBondContact O-N 3.04Å; L140-V303 HydrophobicContact CD2-CG2 4.23Å |
| 141 | F | 96.1 | Very high | 92.7 | Very high | 5 Ų | 5 | 22.2 Ų | 22.2 | 2% | 0.022 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.6 | -42.4 | 169.7 | -70 | -48.5 | 0 | 0 | 0 | 112 | A17 N121 V122 V125 M137 G138 S139 V143 G144 I145 L363 | A17-F141 HydrophobicContact CB-CD1 4.12Å; A17-F141 WeakPolarHBondContact CB-O 3.41Å; N121-F141 VanDerWaalsContact ND2-CE1 3.32Å; N121-F141 WeakPolarHBondContact ND2-CE1 3.46Å; V122-F141 HydrophobicContact CB-CE2 4.08Å; V122-F141 HydrophobicContact CB-CZ 4.38Å; V122-F141 HydrophobicContact CG1-CE2 4.21Å; V122-F141 HydrophobicContact CG2-CD2 3.86Å; V122-F141 HydrophobicContact CG2-CE2 3.67Å; V122-F141 HydrophobicContact CG2-CG 4.45Å; V122-F141 HydrophobicContact CG2-CZ 4.07Å; V125-F141 HydrophobicContact CB-CZ 3.73Å; V125-F141 HydrophobicContact CG1-CE2 4.3Å; V125-F141 HydrophobicContact CG1-CZ 3.78Å; V125-F141 HydrophobicContact CG2-CE1 4.15Å; V125-F141 HydrophobicContact CG2-CZ 3.77Å; M137-F141 HydrophobicContact CG-CE2 4.47Å; M137-F141 HydrophobicContact CG-CZ 4.45Å; M137-F141 PolarHBondContact O-N 2.95Å; M137-F141 VanDerWaalsContact O-N 3.1Å; G138-F141 PolarHBondContact O-N 3.19Å; S139-F141 VanDerWaalsContact C-N 3.29Å; S139-F141 PolarHBondContact O-N 3.29Å; F141-V143 VanDerWaalsContact C-N 3.28Å; F141-V143 PolarHBondContact O-N 3.17Å; F141-G144 PolarHBondContact O-N 3.5Å; F141-I145 WeakPolarHBondContact O-CG1 3.34Å; F141-I145 PolarHBondContact O-N 3.08Å; F141-L363 HydrophobicContact CD2-CD2 4.34Å |
| 142 | Q | 96.5 | Very high | 93.6 | Very high | 21 Ų | 21 | 17.6 Ų | 17.6 | 10% | 0.098 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -61.5 | -40.6 | 175.5 | -173.3 | 65.8 | 48.3 | 0 | 0 | 110.7 | S139 L140 G144 I145 T146 G359 P360 | S139-Q142 WeakPolarHBondContact O-CB 3.31Å; S139-Q142 PolarHBondContact O-N 3.21Å; L140-Q142 VanDerWaalsContact C-N 3.32Å; L140-Q142 PolarHBondContact O-N 3.42Å; Q142-G144 VanDerWaalsContact C-N 3.34Å; Q142-G144 PolarHBondContact O-N 2.9Å; Q142-I145 PolarHBondContact O-N 3.5Å; Q142-T146 HydrophobicContact CG-CG2 4.25Å; Q142-T146 VanDerWaalsContact NE2-CG2 3.32Å; Q142-T146 WeakPolarHBondContact O-CG2 3.31Å; Q142-T146 PolarHBondContact O-N 2.66Å; Q142-T146 PolarHBondContact O-OG1 2.87Å; Q142-G359 PolarHBondContact OE1-O 3.38Å; Q142-P360 HydrophobicContact CB-CB 4.16Å |
| 143 | V | 98 | Very high | 94.4 | Very high | 15 Ų | 15 | 14 Ų | 14 | 9% | 0.091 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -59.8 | -43.4 | 175.8 | 179 | 0 | 0 | 0 | 0 | 111.8 | S139 L140 F141 T146 C147 F296 S299 I300 V303 | S139-V143 PolarHBondContact O-N 3.03Å; L140-V143 HydrophobicContact CD2-CG2 4.42Å; L140-V143 WeakPolarHBondContact O-CB 3.4Å; L140-V143 PolarHBondContact O-N 2.7Å; F141-V143 VanDerWaalsContact C-N 3.28Å; F141-V143 PolarHBondContact O-N 3.17Å; V143-T146 PolarHBondContact O-OG1 3.42Å; V143-T146 VanDerWaalsContact O-OG1 3.08Å; V143-C147 WeakPolarHBondContact O-CB 3.48Å; V143-C147 PolarHBondContact O-N 3.11Å; V143-F296 HydrophobicContact CG1-CE2 3.9Å; V143-S299 WeakPolarHBondContact CA-OG 3.49Å; V143-S299 WeakPolarHBondContact CG2-O 3.09Å; V143-I300 HydrophobicContact CG1-CG1 3.88Å; V143-I300 HydrophobicContact CG2-CG1 4.35Å; V143-V303 HydrophobicContact CG2-CG2 3.81Å |
| 144 | G | 98.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -60.3 | -50.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | F18 L140 F141 Q142 T146 C147 G148 | F18-G144 WeakPolarHBondContact CA-O 3.33Å; L140-G144 PolarHBondContact O-N 3.04Å; F141-G144 PolarHBondContact O-N 3.5Å; Q142-G144 VanDerWaalsContact C-N 3.34Å; Q142-G144 PolarHBondContact O-N 2.9Å; G144-T146 PolarHBondContact O-N 3.28Å; G144-C147 WeakPolarHBondContact O-CB 3.26Å; G144-C147 PolarHBondContact O-N 3.48Å; G144-G148 PolarHBondContact O-N 3.4Å |
| 145 | I | 98.5 | Very high | 95.5 | Very high | 23 Ų | 23 | 16.4 Ų | 16.4 | 12% | 0.118 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57.1 | -49.4 | 179.6 | -69.1 | 167 | 0 | 0 | 0 | 111.4 | A17 G21 F24 L118 F141 Q142 C147 G148 I149 | A17-I145 HydrophobicContact CB-CG1 4.16Å; G21-I145 WeakPolarHBondContact CA-O 3.4Å; F24-I145 HydrophobicContact CD2-CG2 3.72Å; F24-I145 HydrophobicContact CE2-CG2 3.87Å; L118-I145 HydrophobicContact CD2-CD1 3.92Å; L118-I145 HydrophobicContact CD2-CG1 4.28Å; F141-I145 WeakPolarHBondContact O-CG1 3.34Å; F141-I145 PolarHBondContact O-N 3.08Å; Q142-I145 PolarHBondContact O-N 3.5Å; I145-C147 VanDerWaalsContact C-N 3.32Å; I145-C147 PolarHBondContact O-N 3.22Å; I145-G148 PolarHBondContact O-N 2.87Å; I145-I149 HydrophobicContact CG2-CD1 3.94Å; I145-I149 WeakPolarHBondContact O-CG1 3.49Å; I145-I149 PolarHBondContact O-N 3.19Å |
| 146 | T | 98.4 | Very high | 96 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -69.6 | -31.5 | -178.5 | 56.4 | 0 | 0 | 0 | 0 | 112.4 | Q142 V143 G144 G148 I149 V150 L295 S299 | Q142-T146 HydrophobicContact CG-CG2 4.25Å; Q142-T146 VanDerWaalsContact NE2-CG2 3.32Å; Q142-T146 WeakPolarHBondContact O-CG2 3.31Å; Q142-T146 PolarHBondContact O-N 2.66Å; Q142-T146 PolarHBondContact O-OG1 2.87Å; V143-T146 PolarHBondContact O-OG1 3.42Å; V143-T146 VanDerWaalsContact O-OG1 3.08Å; G144-T146 PolarHBondContact O-N 3.28Å; T146-G148 VanDerWaalsContact C-N 3.31Å; T146-I149 PolarHBondContact O-N 3.42Å; T146-V150 WeakPolarHBondContact O-CG1 3.19Å; T146-V150 PolarHBondContact O-N 3Å; T146-L295 HydrophobicContact CG2-CD1 4.35Å; T146-L295 HydrophobicContact CG2-CD2 3.93Å; T146-L295 HydrophobicContact CG2-CG 3.65Å; T146-S299 WeakPolarHBondContact OG1-CB 3.36Å; T146-S299 PolarHBondContact OG1-OG 2.93Å |
| 147 | C | 98.5 | Very high | 96.2 | Very high | 38 Ų | 38 | 16.3 Ų | 16.3 | 26% | 0.257 | 10% | 0.095 | S | C | . | . | H | α-helix | trans | -60.5 | -42 | 170.9 | -172.3 | 0 | 0 | 0 | 0 | 111.3 | F18 V143 G144 I145 V150 A151 F296 | F18-C147 HydrophobicContact CD2-CB 3.96Å; V143-C147 WeakPolarHBondContact O-CB 3.48Å; V143-C147 PolarHBondContact O-N 3.11Å; G144-C147 WeakPolarHBondContact O-CB 3.26Å; G144-C147 PolarHBondContact O-N 3.48Å; I145-C147 VanDerWaalsContact C-N 3.32Å; I145-C147 PolarHBondContact O-N 3.22Å; C147-V150 VanDerWaalsContact O-CG1 3.24Å; C147-V150 WeakPolarHBondContact O-CG1 3.49Å; C147-A151 VanDerWaalsContact O-CB 3.29Å; C147-A151 WeakPolarHBondContact O-CB 3.02Å; C147-A151 PolarHBondContact O-N 3.48Å; C147-F296 HydrophobicContact CB-CD2 3.73Å; C147-F296 HydrophobicContact CB-CE2 3.52Å; C147-F296 HydrophobicContact CB-CZ 4.31Å |
| 148 | G | 98.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65.8 | -42.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | F18 G21 L22 G144 I145 T146 A151 D152 | F18-G148 VanDerWaalsContact CD2-CA 3.4Å; F18-G148 VanDerWaalsContact CD2-N 3.29Å; G21-G148 VanDerWaalsContact C-C 3.47Å; L22-G148 WeakPolarHBondContact CD2-O 3.4Å; G144-G148 PolarHBondContact O-N 3.4Å; I145-G148 PolarHBondContact O-N 2.87Å; T146-G148 VanDerWaalsContact C-N 3.31Å; G148-A151 PolarHBondContact O-N 2.85Å; G148-D152 PolarHBondContact O-N 2.99Å |
| 149 | I | 98.4 | Very high | 97 | Very high | 1 Ų | 1 | 26.2 Ų | 26.2 | 1% | 0.005 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61 | -50.1 | 177.7 | -66.7 | 164.6 | 0 | 0 | 0 | 110.8 | G21 F24 I145 T146 A151 D152 Y153 I270 L295 | G21-I149 WeakPolarHBondContact O-CG1 3.15Å; F24-I149 HydrophobicContact CB-CD1 4.37Å; F24-I149 HydrophobicContact CB-CG1 4.1Å; I145-I149 HydrophobicContact CG2-CD1 3.94Å; I145-I149 WeakPolarHBondContact O-CG1 3.49Å; I145-I149 PolarHBondContact O-N 3.19Å; T146-I149 PolarHBondContact O-N 3.42Å; I149-A151 VanDerWaalsContact C-N 3.32Å; I149-A151 PolarHBondContact O-N 2.89Å; I149-D152 PolarHBondContact O-N 3.47Å; I149-Y153 HydrophobicContact CG2-CD2 4.14Å; I149-Y153 HydrophobicContact CG2-CE1 4.17Å; I149-Y153 HydrophobicContact CG2-CE2 3.74Å; I149-Y153 PolarHBondContact O-N 2.67Å; I149-Y153 VanDerWaalsContact O-N 3.07Å; I149-I270 HydrophobicContact CD1-CD1 4.22Å; I149-I270 HydrophobicContact CD1-CG1 4.49Å; I149-I270 HydrophobicContact CD1-CG2 3.72Å; I149-I270 HydrophobicContact CG1-CG2 4.15Å; I149-I270 HydrophobicContact CG2-CG2 4.3Å; I149-L295 HydrophobicContact CD1-CD2 4.11Å; I149-L295 HydrophobicContact CG2-CD2 4.39Å |
| 150 | V | 98 | Very high | 97.2 | Very high | 14 Ų | 14 | 30.6 Ų | 30.6 | 9% | 0.085 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.8 | -37.7 | 179.2 | 66.3 | 0 | 0 | 0 | 0 | 111.8 | T146 C147 D152 Y153 T154 L293 F296 | T146-V150 WeakPolarHBondContact O-CG1 3.19Å; T146-V150 PolarHBondContact O-N 3Å; C147-V150 VanDerWaalsContact O-CG1 3.24Å; C147-V150 WeakPolarHBondContact O-CG1 3.49Å; V150-D152 PolarHBondContact O-N 3.3Å; V150-Y153 PolarHBondContact O-N 3.44Å; V150-T154 WeakPolarHBondContact O-CB 3.45Å; V150-T154 PolarHBondContact O-N 3.08Å; V150-T154 PolarHBondContact O-OG1 2.8Å; V150-L293 HydrophobicContact CG2-CB 4.09Å; V150-F296 HydrophobicContact CB-CB 4.33Å; V150-F296 HydrophobicContact CG1-CB 3.86Å; V150-F296 HydrophobicContact CG1-CD1 4.28Å; V150-F296 HydrophobicContact CG1-CG 4.04Å |
| 151 | A | 98.2 | Very high | 97.3 | Very high | 28 Ų | 28 | 29.1 Ų | 29.1 | 23% | 0.231 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.5 | -45.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | F18 L22 C147 G148 I149 T154 L155 | F18-A151 HydrophobicContact CE2-CB 3.79Å; F18-A151 HydrophobicContact CZ-CB 4.1Å; L22-A151 HydrophobicContact CD2-CB 4.09Å; C147-A151 VanDerWaalsContact O-CB 3.29Å; C147-A151 WeakPolarHBondContact O-CB 3.02Å; C147-A151 PolarHBondContact O-N 3.48Å; G148-A151 PolarHBondContact O-N 2.85Å; I149-A151 VanDerWaalsContact C-N 3.32Å; I149-A151 PolarHBondContact O-N 2.89Å; A151-T154 PolarHBondContact O-N 3.01Å; A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 WeakPolarHBondContact O-CG 3.27Å; A151-L155 PolarHBondContact O-N 3.4Å |
| 152 | D | 98.1 | Very high | 97.3 | Very high | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.005 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.5 | -48.8 | 176.9 | -178 | 84.5 | 0 | 0 | 0 | 112.2 | L22 G25 F26 G148 I149 V150 T154 L155 A156 I164 | L22-D152 HydrophobicContact CD2-CB 4.28Å; G25-D152 VanDerWaalsContact O-OD2 3.12Å; F26-D152 WeakPolarHBondContact CA-OD1 3.31Å; F26-D152 WeakPolarHBondContact CA-OD2 3.38Å; F26-D152 PolarHBondContact N-OD2 3.15Å; G148-D152 PolarHBondContact O-N 2.99Å; I149-D152 PolarHBondContact O-N 3.47Å; V150-D152 PolarHBondContact O-N 3.3Å; D152-T154 VanDerWaalsContact C-N 3.32Å; D152-T154 PolarHBondContact O-N 3.34Å; D152-L155 WeakPolarHBondContact O-CB 3.45Å; D152-L155 PolarHBondContact O-N 3.34Å; D152-L155 VanDerWaalsContact O-N 3.13Å; D152-A156 PolarHBondContact O-N 3.47Å; D152-I164 WeakPolarHBondContact OD1-CG2 3.42Å |
| 153 | Y | 97.2 | Very high | 97.4 | Very high | 3 Ų | 3 | 31.7 Ų | 31.7 | 1% | 0.012 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.7 | -39.6 | 177.5 | -68.4 | -5.8 | 0 | 0 | 0 | 113.1 | I149 V150 A156 I270 A273 G288 | I149-Y153 HydrophobicContact CG2-CD2 4.14Å; I149-Y153 HydrophobicContact CG2-CE1 4.17Å; I149-Y153 HydrophobicContact CG2-CE2 3.74Å; I149-Y153 PolarHBondContact O-N 2.67Å; I149-Y153 VanDerWaalsContact O-N 3.07Å; V150-Y153 PolarHBondContact O-N 3.44Å; Y153-A156 WeakPolarHBondContact O-CB 3.47Å; Y153-A156 PolarHBondContact O-N 3.4Å; Y153-I270 WeakPolarHBondContact OH-CA 3.39Å; Y153-I270 PolarHBondContact OH-O 3.22Å; Y153-A273 HydrophobicContact CE1-CB 4.41Å; Y153-A273 HydrophobicContact CE2-CB 3.85Å; Y153-A273 WeakPolarHBondContact OH-CB 3.45Å; Y153-G288 VanDerWaalsContact CD2-C 3.48Å; Y153-G288 WeakPolarHBondContact CD2-O 3.46Å |
| 154 | T | 97.2 | Very high | 97.4 | Very high | 54 Ų | 54 | 31 Ų | 31 | 33% | 0.331 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -69.2 | -37.9 | 176.8 | -60.7 | 0 | 0 | 0 | 0 | 111.2 | V150 A151 D152 A156 I157 F158 S289 | V150-T154 WeakPolarHBondContact O-CB 3.45Å; V150-T154 PolarHBondContact O-N 3.08Å; V150-T154 PolarHBondContact O-OG1 2.8Å; A151-T154 PolarHBondContact O-N 3.01Å; D152-T154 VanDerWaalsContact C-N 3.32Å; D152-T154 PolarHBondContact O-N 3.34Å; T154-A156 VanDerWaalsContact C-N 3.29Å; T154-A156 PolarHBondContact O-N 3.3Å; T154-I157 WeakPolarHBondContact O-CB 3.46Å; T154-I157 PolarHBondContact O-N 2.92Å; T154-F158 HydrophobicContact CG2-CE2 4.45Å; T154-F158 WeakPolarHBondContact O-CD2 3.24Å; T154-S289 PolarHBondContact OG1-OG 3.13Å |
| 155 | L | 97.5 | Very high | 97.4 | Very high | 48 Ų | 48 | 31 Ų | 31 | 25% | 0.251 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -62.9 | -38.1 | 173.8 | -70.8 | 168.1 | 0 | 0 | 0 | 111.3 | A151 D152 I157 F158 L159 I164 V167 | A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 WeakPolarHBondContact O-CG 3.27Å; A151-L155 PolarHBondContact O-N 3.4Å; D152-L155 WeakPolarHBondContact O-CB 3.45Å; D152-L155 PolarHBondContact O-N 3.34Å; D152-L155 VanDerWaalsContact O-N 3.13Å; L155-I157 PolarHBondContact O-N 2.85Å; L155-I157 VanDerWaalsContact O-N 3.17Å; L155-F158 PolarHBondContact O-N 3.26Å; L155-L159 HydrophobicContact CB-CD1 4.48Å; L155-L159 HydrophobicContact CD2-CD1 3.84Å; L155-L159 WeakPolarHBondContact O-CB 3.36Å; L155-L159 PolarHBondContact O-N 3.27Å; L155-I164 HydrophobicContact CB-CD1 4.23Å; L155-I164 HydrophobicContact CB-CG1 4.05Å; L155-V167 HydrophobicContact CD1-CG1 3.92Å |
| 156 | A | 96 | Very high | 97.4 | Very high | 3 Ų | 3 | 33.2 Ų | 33.2 | 3% | 0.025 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.2 | -18 | 178.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | A29 D152 Y153 T154 F158 I164 Y285 | A29-A156 HydrophobicContact CB-CB 3.28Å; D152-A156 PolarHBondContact O-N 3.47Å; Y153-A156 WeakPolarHBondContact O-CB 3.47Å; Y153-A156 PolarHBondContact O-N 3.4Å; T154-A156 VanDerWaalsContact C-N 3.29Å; T154-A156 PolarHBondContact O-N 3.3Å; A156-F158 VanDerWaalsContact C-N 3.3Å; A156-I164 HydrophobicContact CB-CD1 4.1Å; A156-Y285 HydrophobicContact CB-CD1 4.26Å |
| 157 | I | 95.6 | Very high | 97.4 | Very high | 53 Ų | 53 | 35.6 Ų | 35.6 | 27% | 0.272 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -67.4 | -35.2 | 171.7 | -62.3 | 173.7 | 0 | 0 | 0 | 110.9 | T154 L155 | T154-I157 WeakPolarHBondContact O-CB 3.46Å; T154-I157 PolarHBondContact O-N 2.92Å; L155-I157 PolarHBondContact O-N 2.85Å; L155-I157 VanDerWaalsContact O-N 3.17Å |
| 158 | F | 95.3 | Very high | 97.4 | Very high | 159 Ų | 159 | 33.8 Ų | 33.8 | 70% | 0.697 | 18% | 0.182 | S | C | * | . | H | α-helix | trans | -113.5 | -22 | -167.9 | -54.2 | -70.3 | 0 | 0 | 0 | 113.6 | T154 L155 A156 | T154-F158 HydrophobicContact CG2-CE2 4.45Å; T154-F158 WeakPolarHBondContact O-CD2 3.24Å; L155-F158 PolarHBondContact O-N 3.26Å; A156-F158 VanDerWaalsContact C-N 3.3Å |
| 159 | L | 96.6 | Very high | 97.4 | Very high | 55 Ų | 55 | 34 Ų | 34 | 29% | 0.288 | 18% | 0.184 | S | C | . | . | S | Bend | trans | -126.9 | 150.2 | -169.7 | -56.8 | 179.1 | 0 | 0 | 0 | 111.4 | Q33 L155 V163 I164 V167 | Q33-L159 PolarHBondContact NE2-O 3Å; L155-L159 HydrophobicContact CB-CD1 4.48Å; L155-L159 HydrophobicContact CD2-CD1 3.84Å; L155-L159 WeakPolarHBondContact O-CB 3.36Å; L155-L159 PolarHBondContact O-N 3.27Å; L159-V163 HydrophobicContact CB-CB 4.44Å; L159-V163 HydrophobicContact CD1-CG1 4.11Å; L159-V163 HydrophobicContact CD2-CG1 4.18Å; L159-I164 HydrophobicContact CB-CD1 4.29Å; L159-I164 HydrophobicContact CB-CG1 3.8Å; L159-V167 HydrophobicContact CD1-CG2 4.48Å |
| 160 | N | 95.9 | Very high | 97.4 | Very high | 91 Ų | 91 | 39.4 Ų | 39.4 | 49% | 0.487 | 21% | 0.212 | S | C | . | . | trans | -80 | 157.2 | 169 | -65.3 | -31.8 | 0 | 0 | 0 | 110.8 | D162 V163 I164 | N160-D162 WeakPolarHBondContact CB-OD1 3.37Å; N160-D162 PolarHBondContact O-N 3.14Å; N160-D162 VanDerWaalsContact O-N 3.1Å; N160-V163 PolarHBondContact O-N 3.2Å; N160-V163 VanDerWaalsContact O-N 3.1Å; N160-I164 WeakPolarHBondContact O-CG1 3.41Å; N160-I164 PolarHBondContact O-N 3.34Å | ||
| 161 | W | 95.6 | Very high | 97.4 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -56.6 | -29 | -174.3 | 67 | -89.1 | 0 | 0 | 0 | 113.2 | F26 T30 Q33 I34 L86 V93 Y94 F103 S165 | F26-W161 HydrophobicContact CE2-CB 4.24Å; F26-W161 WeakPolarHBondContact CE2-O 3.37Å; F26-W161 HydrophobicContact CZ-CB 4.24Å; F26-W161 HydrophobicContact CZ-CE3 4.13Å; T30-W161 HydrophobicContact CG2-CB 3.93Å; T30-W161 HydrophobicContact CG2-CD2 4.2Å; T30-W161 HydrophobicContact CG2-CE3 4.44Å; T30-W161 HydrophobicContact CG2-CG 3.99Å; T30-W161 WeakPolarHBondContact OG1-CB 2.97Å; Q33-W161 VanDerWaalsContact OE1-CB 3.29Å; I34-W161 HydrophobicContact CD1-CD2 4.05Å; I34-W161 HydrophobicContact CD1-CG 4.36Å; I34-W161 HydrophobicContact CD1-CZ2 3.98Å; I34-W161 HydrophobicContact CG1-CD2 4.47Å; I34-W161 HydrophobicContact CG1-CG 4.44Å; I34-W161 HydrophobicContact CG1-CZ2 4.38Å; L86-W161 HydrophobicContact CB-CZ3 4.36Å; L86-W161 VanDerWaalsContact O-CZ3 3.24Å; L86-W161 WeakPolarHBondContact O-CZ3 2.88Å; V93-W161 HydrophobicContact CB-CH2 4.45Å; V93-W161 HydrophobicContact CB-CZ2 4.17Å; V93-W161 HydrophobicContact CG1-CZ2 4.07Å; V93-W161 HydrophobicContact CG2-CH2 4.5Å; Y94-W161 AromaticContact CE1-NE1 3.44Å; Y94-W161 AromaticContact CZ-NE1 3.41Å; Y94-W161 PolarHBondContact OH-NE1 3.04Å; Y94-W161 VanDerWaalsContact OH-NE1 3.08Å; F103-W161 AromaticContact CD2-CH2 3.86Å; F103-W161 HydrophobicContact CD2-CH2 3.86Å; F103-W161 AromaticContact CD2-CZ3 3.94Å; F103-W161 HydrophobicContact CD2-CZ3 3.94Å; F103-W161 HydrophobicContact CE2-CE3 4.22Å; F103-W161 AromaticContact CE2-CH2 3.84Å; F103-W161 HydrophobicContact CE2-CH2 3.84Å; F103-W161 HydrophobicContact CE2-CZ2 4.47Å; F103-W161 AromaticContact CE2-CZ3 3.71Å; F103-W161 HydrophobicContact CE2-CZ3 3.71Å; W161-S165 WeakPolarHBondContact O-CB 3.32Å; W161-S165 PolarHBondContact O-N 3.26Å; W161-S165 PolarHBondContact O-OG 3.42Å |
| 162 | D | 97 | Very high | 97.4 | Very high | 21 Ų | 21 | 38.6 Ų | 38.6 | 11% | 0.112 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -70.5 | -51.3 | 176.9 | 56.2 | -9.9 | 0 | 0 | 0 | 111.1 | F87 S90 Y94 N160 I164 S165 L166 | F87-D162 HydrophobicContact CD2-CB 4.31Å; F87-D162 VanDerWaalsContact CD2-O 3.29Å; F87-D162 WeakPolarHBondContact CD2-O 3.23Å; S90-D162 VanDerWaalsContact CB-CB 3.4Å; S90-D162 WeakPolarHBondContact CB-OD2 3.49Å; S90-D162 PolarHBondContact OG-OD2 3.49Å; S90-D162 VanDerWaalsContact OG-OD2 3.05Å; Y94-D162 WeakPolarHBondContact CE2-OD2 3.44Å; Y94-D162 PolarHBondContact OH-OD1 3.47Å; Y94-D162 PolarHBondContact OH-OD2 3.47Å; N160-D162 WeakPolarHBondContact CB-OD1 3.37Å; N160-D162 PolarHBondContact O-N 3.14Å; N160-D162 VanDerWaalsContact O-N 3.1Å; D162-I164 VanDerWaalsContact C-N 3.27Å; D162-I164 PolarHBondContact O-N 3.37Å; D162-S165 WeakPolarHBondContact O-CA 3.11Å; D162-S165 VanDerWaalsContact O-CB 3.25Å; D162-S165 WeakPolarHBondContact O-CB 3.48Å; D162-S165 PolarHBondContact O-N 3.32Å; D162-L166 PolarHBondContact O-N 2.83Å |
| 163 | V | 98 | Very high | 97.4 | Very high | 59 Ų | 59 | 40.8 Ų | 40.8 | 36% | 0.358 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.1 | -38.9 | 174.1 | -175.3 | 0 | 0 | 0 | 0 | 110.8 | L159 N160 S165 L166 V167 | L159-V163 HydrophobicContact CB-CB 4.44Å; L159-V163 HydrophobicContact CD1-CG1 4.11Å; L159-V163 HydrophobicContact CD2-CG1 4.18Å; N160-V163 PolarHBondContact O-N 3.2Å; N160-V163 VanDerWaalsContact O-N 3.1Å; V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 2.84Å; V163-L166 WeakPolarHBondContact O-CB 3.4Å; V163-L166 PolarHBondContact O-N 3.18Å; V163-V167 WeakPolarHBondContact O-CG2 3.43Å; V163-V167 PolarHBondContact O-N 3.19Å |
| 164 | I | 98.2 | Very high | 97.5 | Very high | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.6 | -43.5 | 173.1 | -64.2 | 170.9 | 0 | 0 | 0 | 110.6 | F26 D152 L155 A156 L159 N160 D162 L166 V167 C168 | F26-I164 HydrophobicContact CD2-CG2 3.87Å; F26-I164 HydrophobicContact CE2-CB 4.28Å; F26-I164 HydrophobicContact CE2-CG2 3.98Å; D152-I164 WeakPolarHBondContact OD1-CG2 3.42Å; L155-I164 HydrophobicContact CB-CD1 4.23Å; L155-I164 HydrophobicContact CB-CG1 4.05Å; A156-I164 HydrophobicContact CB-CD1 4.1Å; L159-I164 HydrophobicContact CB-CD1 4.29Å; L159-I164 HydrophobicContact CB-CG1 3.8Å; N160-I164 WeakPolarHBondContact O-CG1 3.41Å; N160-I164 PolarHBondContact O-N 3.34Å; D162-I164 VanDerWaalsContact C-N 3.27Å; D162-I164 PolarHBondContact O-N 3.37Å; I164-L166 VanDerWaalsContact C-N 3.28Å; I164-L166 PolarHBondContact O-N 3.08Å; I164-V167 WeakPolarHBondContact O-CB 3.44Å; I164-V167 PolarHBondContact O-N 3.08Å; I164-V167 VanDerWaalsContact O-N 3.1Å; I164-C168 PolarHBondContact O-N 3.44Å; I164-C168 PolarHBondContact O-SG 2.95Å |
| 165 | S | 98.4 | Very high | 97.5 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.3 | -42.2 | 175.8 | -59.2 | 0 | 0 | 0 | 0 | 111.7 | F26 W161 D162 V163 C168 A169 | F26-S165 WeakPolarHBondContact CE2-OG 3.13Å; F26-S165 WeakPolarHBondContact CZ-OG 3.41Å; W161-S165 WeakPolarHBondContact O-CB 3.32Å; W161-S165 PolarHBondContact O-N 3.26Å; W161-S165 PolarHBondContact O-OG 3.42Å; D162-S165 WeakPolarHBondContact O-CA 3.11Å; D162-S165 VanDerWaalsContact O-CB 3.25Å; D162-S165 WeakPolarHBondContact O-CB 3.48Å; D162-S165 PolarHBondContact O-N 3.32Å; V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 2.84Å; S165-C168 PolarHBondContact O-N 3.33Å; S165-A169 PolarHBondContact O-N 3.19Å |
| 166 | L | 98.3 | Very high | 97.6 | Very high | 68 Ų | 68 | 42.2 Ų | 42.2 | 36% | 0.356 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.6 | -43.5 | 175.3 | -177.7 | 63.7 | 0 | 0 | 0 | 111.9 | F87 D162 V163 I164 C168 A169 L170 | F87-L166 HydrophobicContact CD2-CB 3.91Å; F87-L166 HydrophobicContact CE2-CB 4.2Å; F87-L166 HydrophobicContact CE2-CD2 4.16Å; F87-L166 HydrophobicContact CG-CB 4.26Å; F87-L166 HydrophobicContact CZ-CD2 4.19Å; D162-L166 PolarHBondContact O-N 2.83Å; V163-L166 WeakPolarHBondContact O-CB 3.4Å; V163-L166 PolarHBondContact O-N 3.18Å; I164-L166 VanDerWaalsContact C-N 3.28Å; I164-L166 PolarHBondContact O-N 3.08Å; L166-C168 VanDerWaalsContact C-N 3.33Å; L166-C168 PolarHBondContact O-N 2.82Å; L166-A169 WeakPolarHBondContact O-CB 3.47Å; L166-A169 PolarHBondContact O-N 3.4Å; L166-L170 WeakPolarHBondContact O-CG 3.2Å; L166-L170 PolarHBondContact O-N 2.88Å |
| 167 | V | 98.5 | Very high | 97.7 | Very high | 51 Ų | 51 | 48.2 Ų | 48.2 | 31% | 0.309 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.5 | -42.9 | 175.4 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | L155 L159 V163 I164 A169 L170 A171 | L155-V167 HydrophobicContact CD1-CG1 3.92Å; L159-V167 HydrophobicContact CD1-CG2 4.48Å; V163-V167 WeakPolarHBondContact O-CG2 3.43Å; V163-V167 PolarHBondContact O-N 3.19Å; I164-V167 WeakPolarHBondContact O-CB 3.44Å; I164-V167 PolarHBondContact O-N 3.08Å; I164-V167 VanDerWaalsContact O-N 3.1Å; V167-A169 PolarHBondContact O-N 3.47Å; V167-L170 PolarHBondContact O-N 3.34Å; V167-A171 WeakPolarHBondContact O-CB 3.36Å; V167-A171 PolarHBondContact O-N 3.21Å |
| 168 | C | 98.5 | Very high | 97.7 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.7 | -40.8 | 175.3 | -66.3 | 0 | 0 | 0 | 0 | 112 | W83 I164 S165 L166 L170 A171 V172 | W83-C168 HydrophobicContact CD2-CB 3.52Å; W83-C168 HydrophobicContact CE3-CB 3.82Å; W83-C168 HydrophobicContact CG-CB 3.97Å; W83-C168 HydrophobicContact CH2-CB 4.09Å; W83-C168 HydrophobicContact CZ2-CB 3.81Å; W83-C168 HydrophobicContact CZ3-CB 4.09Å; I164-C168 PolarHBondContact O-N 3.44Å; I164-C168 PolarHBondContact O-SG 2.95Å; S165-C168 PolarHBondContact O-N 3.33Å; L166-C168 VanDerWaalsContact C-N 3.33Å; L166-C168 PolarHBondContact O-N 2.82Å; C168-L170 VanDerWaalsContact C-N 3.33Å; C168-L170 PolarHBondContact O-N 2.83Å; C168-A171 PolarHBondContact O-N 3.33Å; C168-V172 VanDerWaalsContact O-CG2 3.24Å; C168-V172 WeakPolarHBondContact O-CG2 3.4Å; C168-V172 PolarHBondContact O-N 3.44Å |
| 169 | A | 98.6 | Very high | 97.8 | Very high | 5 Ų | 5 | 39.2 Ų | 39.2 | 4% | 0.041 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59 | -44 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | W83 V84 S165 L166 V167 S173 | W83-A169 HydrophobicContact CB-CB 3.7Å; V84-A169 HydrophobicContact CG2-CB 4.25Å; S165-A169 PolarHBondContact O-N 3.19Å; L166-A169 WeakPolarHBondContact O-CB 3.47Å; L166-A169 PolarHBondContact O-N 3.4Å; V167-A169 PolarHBondContact O-N 3.47Å; A169-S173 WeakPolarHBondContact O-CB 3.43Å; A169-S173 PolarHBondContact O-N 2.89Å; A169-S173 PolarHBondContact O-OG 3.26Å |
| 170 | L | 98.5 | Very high | 97.7 | Very high | 113 Ų | 113 | 43.8 Ų | 43.8 | 59% | 0.592 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -66.5 | -43.4 | 177.3 | -66.9 | 174.9 | 0 | 0 | 0 | 111.9 | L166 V167 C168 S173 F174 | L166-L170 WeakPolarHBondContact O-CG 3.2Å; L166-L170 PolarHBondContact O-N 2.88Å; V167-L170 PolarHBondContact O-N 3.34Å; C168-L170 VanDerWaalsContact C-N 3.33Å; C168-L170 PolarHBondContact O-N 2.83Å; L170-S173 WeakPolarHBondContact O-CB 3.05Å; L170-S173 PolarHBondContact O-N 3.3Å; L170-F174 PolarHBondContact O-N 3.45Å |
| 171 | A | 98.5 | Very high | 97.5 | Very high | 24 Ų | 24 | 44.4 Ų | 44.4 | 20% | 0.198 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.5 | -46.9 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | F18 L22 V167 C168 S173 F174 V175 | F18-A171 HydrophobicContact CE1-CB 4.37Å; L22-A171 HydrophobicContact CD1-CB 3.95Å; V167-A171 WeakPolarHBondContact O-CB 3.36Å; V167-A171 PolarHBondContact O-N 3.21Å; C168-A171 PolarHBondContact O-N 3.33Å; A171-S173 VanDerWaalsContact C-N 3.32Å; A171-S173 PolarHBondContact O-N 3.45Å; A171-F174 PolarHBondContact O-N 2.91Å; A171-V175 WeakPolarHBondContact O-CG2 3.45Å; A171-V175 PolarHBondContact O-N 3.26Å |
| 172 | V | 98.6 | Very high | 97.5 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.006 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.1 | -39.6 | 176.2 | 178.5 | 0 | 0 | 0 | 0 | 111.2 | T19 Y76 I80 C168 F174 V175 A176 | T19-V172 HydrophobicContact CG2-CB 4.33Å; T19-V172 HydrophobicContact CG2-CG2 3.75Å; Y76-V172 HydrophobicContact CD1-CG1 3.93Å; Y76-V172 HydrophobicContact CG-CG1 4.24Å; I80-V172 HydrophobicContact CD1-CG1 4.12Å; I80-V172 HydrophobicContact CG1-CB 3.96Å; I80-V172 HydrophobicContact CG1-CG1 3.66Å; C168-V172 VanDerWaalsContact O-CG2 3.24Å; C168-V172 WeakPolarHBondContact O-CG2 3.4Å; C168-V172 PolarHBondContact O-N 3.44Å; V172-F174 VanDerWaalsContact C-N 3.33Å; V172-F174 PolarHBondContact O-N 2.83Å; V172-V175 PolarHBondContact O-N 3.35Å; V172-A176 WeakPolarHBondContact O-CB 3.43Å; V172-A176 PolarHBondContact O-N 2.73Å |
| 173 | S | 98.5 | Very high | 97.3 | Very high | 48 Ų | 48 | 44.4 Ų | 44.4 | 34% | 0.336 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.6 | -40.8 | 176.4 | -59.1 | 0 | 0 | 0 | 0 | 112.1 | I80 A169 L170 A171 A176 F177 | I80-S173 WeakPolarHBondContact CD1-OG 3.27Å; A169-S173 WeakPolarHBondContact O-CB 3.43Å; A169-S173 PolarHBondContact O-N 2.89Å; A169-S173 PolarHBondContact O-OG 3.26Å; L170-S173 WeakPolarHBondContact O-CB 3.05Å; L170-S173 PolarHBondContact O-N 3.3Å; A171-S173 VanDerWaalsContact C-N 3.32Å; A171-S173 PolarHBondContact O-N 3.45Å; S173-A176 PolarHBondContact O-N 2.86Å; S173-F177 PolarHBondContact O-N 3.14Å |
| 174 | F | 98.3 | Very high | 97.2 | Very high | 120 Ų | 120 | 43 Ų | 43 | 53% | 0.526 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.4 | -43.2 | 175.1 | -179 | -109.7 | 0 | 0 | 0 | 112 | L170 A171 V172 A176 F177 L178 | L170-F174 PolarHBondContact O-N 3.45Å; A171-F174 PolarHBondContact O-N 2.91Å; V172-F174 VanDerWaalsContact C-N 3.33Å; V172-F174 PolarHBondContact O-N 2.83Å; F174-A176 PolarHBondContact O-N 3.36Å; F174-F177 WeakPolarHBondContact O-CB 3.38Å; F174-F177 PolarHBondContact O-N 3.03Å; F174-L178 HydrophobicContact CD1-CD1 4.16Å; F174-L178 HydrophobicContact CE1-CD1 3.64Å; F174-L178 HydrophobicContact CE1-CG 4.33Å; F174-L178 HydrophobicContact CZ-CD1 3.95Å; F174-L178 HydrophobicContact CZ-CD2 4.38Å; F174-L178 HydrophobicContact CZ-CG 4.3Å; F174-L178 PolarHBondContact O-N 3.46Å; F174-L178 VanDerWaalsContact O-N 3.09Å |
| 175 | V | 98.3 | Very high | 96.9 | Very high | 3 Ų | 3 | 42.9 Ų | 42.9 | 2% | 0.018 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64 | -40.4 | 175.2 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | L15 T19 Y76 A171 V172 F177 L178 T179 | L15-V175 HydrophobicContact CB-CG1 4.34Å; L15-V175 HydrophobicContact CB-CG2 3.86Å; T19-V175 HydrophobicContact CG2-CB 4.06Å; T19-V175 HydrophobicContact CG2-CG1 4.35Å; T19-V175 HydrophobicContact CG2-CG2 3.79Å; Y76-V175 HydrophobicContact CE1-CG1 4.04Å; A171-V175 WeakPolarHBondContact O-CG2 3.45Å; A171-V175 PolarHBondContact O-N 3.26Å; V172-V175 PolarHBondContact O-N 3.35Å; V175-F177 VanDerWaalsContact C-N 3.3Å; V175-F177 PolarHBondContact O-N 3.4Å; V175-L178 PolarHBondContact O-N 2.95Å; V175-L178 VanDerWaalsContact O-N 3.16Å; V175-T179 PolarHBondContact O-N 2.84Å; V175-T179 PolarHBondContact O-OG1 3.37Å |
| 176 | A | 98.1 | Very high | 96.4 | Very high | 12 Ų | 12 | 43.5 Ų | 43.5 | 10% | 0.099 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.3 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F73 Y76 V172 S173 F174 T179 Y180 | F73-A176 HydrophobicContact CE1-CB 4.48Å; F73-A176 VanDerWaalsContact CE1-O 3.31Å; F73-A176 WeakPolarHBondContact CE1-O 3.15Å; Y76-A176 HydrophobicContact CD2-CB 3.58Å; Y76-A176 HydrophobicContact CE2-CB 4.39Å; Y76-A176 HydrophobicContact CG-CB 3.91Å; V172-A176 WeakPolarHBondContact O-CB 3.43Å; V172-A176 PolarHBondContact O-N 2.73Å; S173-A176 PolarHBondContact O-N 2.86Å; F174-A176 PolarHBondContact O-N 3.36Å; A176-T179 PolarHBondContact O-N 2.94Å; A176-Y180 PolarHBondContact O-N 3.5Å; A176-Y180 VanDerWaalsContact O-N 3.13Å |
| 177 | F | 97.7 | Very high | 96 | Very high | 129 Ų | 129 | 43 Ų | 43 | 57% | 0.566 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -61 | -44.9 | 174 | 173 | -99.5 | 0 | 0 | 0 | 112 | S173 F174 V175 Y180 | S173-F177 PolarHBondContact O-N 3.14Å; F174-F177 WeakPolarHBondContact O-CB 3.38Å; F174-F177 PolarHBondContact O-N 3.03Å; V175-F177 VanDerWaalsContact C-N 3.3Å; V175-F177 PolarHBondContact O-N 3.4Å; F177-Y180 WeakPolarHBondContact O-CB 3.45Å; F177-Y180 PolarHBondContact O-N 3.48Å |
| 178 | L | 97.2 | Very high | 95.6 | Very high | 21 Ų | 21 | 42.2 Ų | 42.2 | 11% | 0.11 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.1 | -39.5 | 177.5 | -64.1 | 178.1 | 0 | 0 | 0 | 112.4 | F8 V12 L15 F174 V175 Y180 M181 | F8-L178 HydrophobicContact CE2-CD2 4.34Å; V12-L178 HydrophobicContact CG1-CB 4.31Å; V12-L178 HydrophobicContact CG2-CB 3.83Å; L15-L178 HydrophobicContact CD1-CD1 3.56Å; F174-L178 HydrophobicContact CD1-CD1 4.16Å; F174-L178 HydrophobicContact CE1-CD1 3.64Å; F174-L178 HydrophobicContact CE1-CG 4.33Å; F174-L178 HydrophobicContact CZ-CD1 3.95Å; F174-L178 HydrophobicContact CZ-CD2 4.38Å; F174-L178 HydrophobicContact CZ-CG 4.3Å; F174-L178 PolarHBondContact O-N 3.46Å; F174-L178 VanDerWaalsContact O-N 3.09Å; V175-L178 PolarHBondContact O-N 2.95Å; V175-L178 VanDerWaalsContact O-N 3.16Å; L178-Y180 PolarHBondContact O-N 2.88Å; L178-M181 WeakPolarHBondContact O-CB 3.4Å; L178-M181 PolarHBondContact O-N 3.33Å |
| 179 | T | 96.5 | Very high | 95.3 | Very high | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.006 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.3 | -24.9 | 175.6 | -63.6 | 0 | 0 | 0 | 0 | 112.3 | V12 L72 Y76 V175 A176 M181 L182 | V12-T179 VanDerWaalsContact CG1-OG1 3.31Å; V12-T179 WeakPolarHBondContact CG1-OG1 3.26Å; L72-T179 HydrophobicContact CB-CG2 4.06Å; L72-T179 HydrophobicContact CD1-CG2 3.89Å; Y76-T179 HydrophobicContact CE2-CG2 3.86Å; Y76-T179 PolarHBondContact OH-OG1 3.2Å; Y76-T179 VanDerWaalsContact OH-OG1 3.04Å; V175-T179 PolarHBondContact O-N 2.84Å; V175-T179 PolarHBondContact O-OG1 3.37Å; A176-T179 PolarHBondContact O-N 2.94Å; T179-M181 PolarHBondContact O-N 3.37Å; T179-L182 HydrophobicContact CG2-CD1 4.34Å; T179-L182 WeakPolarHBondContact O-CB 3.47Å; T179-L182 PolarHBondContact O-N 3.43Å |
| 180 | Y | 94.2 | Very high | 94.8 | Very high | 151 Ų | 151 | 44.4 Ų | 44.4 | 59% | 0.592 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -57.8 | -32.7 | 171.3 | -171.9 | -108.6 | 0 | 0 | 0 | 113.2 | R69 F73 A176 F177 L178 L182 | R69-Y180 PolarHBondContact NH2-O 2.94Å; F73-Y180 HydrophobicContact CE2-CD2 4.11Å; F73-Y180 VanDerWaalsContact CZ-CA 3.43Å; F73-Y180 AromaticContact CZ-CD2 3.71Å; F73-Y180 HydrophobicContact CZ-CD2 3.71Å; F73-Y180 HydrophobicContact CZ-CG 4.15Å; A176-Y180 PolarHBondContact O-N 3.5Å; A176-Y180 VanDerWaalsContact O-N 3.13Å; F177-Y180 WeakPolarHBondContact O-CB 3.45Å; F177-Y180 PolarHBondContact O-N 3.48Å; L178-Y180 PolarHBondContact O-N 2.88Å; Y180-L182 VanDerWaalsContact C-N 3.3Å; Y180-L182 PolarHBondContact O-N 3.25Å |
| 181 | M | 93.2 | Very high | 94.2 | Very high | 104 Ų | 104 | 41.2 Ų | 41.2 | 51% | 0.512 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -7.5 | -175.5 | -52.4 | -176.4 | 85.1 | 0 | 0 | 113.1 | F8 L178 T179 | F8-M181 HydrophobicContact CE1-CB 3.85Å; F8-M181 HydrophobicContact CZ-CB 3.92Å; F8-M181 HydrophobicContact CZ-SD 4.16Å; L178-M181 WeakPolarHBondContact O-CB 3.4Å; L178-M181 PolarHBondContact O-N 3.33Å; T179-M181 PolarHBondContact O-N 3.37Å |
| 182 | L | 94 | Very high | 93.7 | Very high | 6 Ų | 6 | 43.6 Ų | 43.6 | 3% | 0.031 | 21% | 0.21 | C | C | . | . | S | Bend | trans | -76.9 | 146.9 | 179.1 | -63.7 | -177 | 0 | 0 | 0 | 111.8 | F8 V9 V12 R69 Y124 T179 Y180 | F8-L182 HydrophobicContact CD1-CD2 3.88Å; F8-L182 HydrophobicContact CE1-CD2 3.74Å; V9-L182 HydrophobicContact CB-CD2 4.43Å; V9-L182 HydrophobicContact CG2-CD2 3.86Å; V12-L182 HydrophobicContact CB-CD1 4.03Å; V12-L182 HydrophobicContact CB-CD2 4.3Å; V12-L182 HydrophobicContact CB-CG 4.46Å; V12-L182 HydrophobicContact CG1-CD1 3.58Å; V12-L182 HydrophobicContact CG1-CG 4.2Å; V12-L182 HydrophobicContact CG2-CD2 4.29Å; R69-L182 WeakPolarHBondContact CD-O 3.28Å; R69-L182 PolarHBondContact NE-O 3.44Å; Y124-L182 HydrophobicContact CE1-CD1 3.89Å; T179-L182 HydrophobicContact CG2-CD1 4.34Å; T179-L182 WeakPolarHBondContact O-CB 3.47Å; T179-L182 PolarHBondContact O-N 3.43Å; Y180-L182 VanDerWaalsContact C-N 3.3Å; Y180-L182 PolarHBondContact O-N 3.25Å |
| 183 | P | 93.7 | Very high | 93.2 | Very high | 16 Ų | 16 | 46 Ų | 46 | 10% | 0.104 | 24% | 0.235 | C | C | . | . | P | Polyproline II helix | trans | -73 | 166.6 | 169 | 35.7 | -39.3 | 0 | 0 | 0 | 110.6 | Y124 W204 | Y124-P183 WeakPolarHBondContact CE2-O 3.26Å; Y124-P183 PolarHBondContact OH-O 3.38Å; P183-W204 HydrophobicContact CB-CD2 4.31Å; P183-W204 HydrophobicContact CB-CE3 4.22Å; P183-W204 HydrophobicContact CG-CD2 3.98Å; P183-W204 HydrophobicContact CG-CE3 3.43Å; P183-W204 VanDerWaalsContact CG-CE3 3.43Å; P183-W204 HydrophobicContact CG-CH2 4.43Å; P183-W204 HydrophobicContact CG-CZ3 3.69Å |
| 184 | E | 94.6 | Very high | 92.8 | Very high | 28 Ų | 28 | 47.1 Ų | 47.1 | 13% | 0.131 | 24% | 0.237 | C | C | . | . | P | Polyproline II helix | trans | -77.7 | 157.6 | 167.1 | -172.1 | 51.1 | -105.6 | 0 | 0 | 109.9 | H68 R69 S186 W188 S201 | H68-E184 VanDerWaalsContact CB-OE1 3.26Å; H68-E184 WeakPolarHBondContact CB-OE1 3.45Å; H68-E184 IonicContact CE1-OE1 3.38Å; H68-E184 IonicContact CG-OE1 3.04Å; H68-E184 VanDerWaalsContact N-CD 3.31Å; H68-E184 PolarHBondContact N-OE1 3.03Å; H68-E184 PolarHBondContact N-OE2 3.27Å; H68-E184 IonicContact ND1-OE1 3.6Å; H68-E184 PolarHBondContact ND1-OE1 3.39Å; R69-E184 PolarHBondContact N-OE2 3.37Å; E184-S186 PolarHBondContact O-N 3.26Å; E184-W188 HydrophobicContact CG-CD2 4.22Å; E184-W188 HydrophobicContact CG-CE3 3.45Å; E184-W188 VanDerWaalsContact CG-CE3 3.45Å; E184-W188 HydrophobicContact CG-CZ3 3.79Å; E184-S201 VanDerWaalsContact O-CB 3.3Å; E184-S201 WeakPolarHBondContact O-CB 3.5Å; E184-S201 PolarHBondContact O-OG 2.72Å |
| 185 | S | 92.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.22 | C | C | . | . | P | Polyproline II helix | trans | -59.2 | 130.1 | 177.1 | 162.3 | 0 | 0 | 0 | 0 | 111.5 | E127 E187 W188 C189 | E127-S185 VanDerWaalsContact CB-OG 3.26Å; E127-S185 WeakPolarHBondContact CB-OG 3.08Å; E127-S185 VanDerWaalsContact OE2-CB 3.24Å; E127-S185 WeakPolarHBondContact OE2-CB 3.32Å; E127-S185 PolarHBondContact OE2-OG 3.49Å; S185-E187 PolarHBondContact OG-N 3.24Å; S185-W188 PolarHBondContact O-N 2.86Å; S185-W188 PolarHBondContact OG-N 3.44Å; S185-W188 VanDerWaalsContact OG-N 3.16Å; S185-C189 PolarHBondContact O-N 3.45Å; S185-C189 PolarHBondContact O-SG 3.09Å |
| 186 | S | 89.3 | Confident | 91.9 | Very high | 13 Ų | 13 | 49.5 Ų | 49.5 | 9% | 0.091 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.6 | -41.5 | 176.7 | 56 | 0 | 0 | 0 | 0 | 111.3 | E184 W188 C189 V190 | E184-S186 PolarHBondContact O-N 3.26Å; S186-W188 VanDerWaalsContact C-N 3.32Å; S186-W188 PolarHBondContact O-N 3.04Å; S186-C189 PolarHBondContact O-N 3.16Å; S186-V190 WeakPolarHBondContact O-CG2 3.35Å; S186-V190 PolarHBondContact O-N 3.16Å |
| 187 | E | 88.1 | Confident | 91.6 | Very high | 58 Ų | 58 | 51.1 Ų | 51.1 | 27% | 0.271 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 175.2 | -66.8 | -168.1 | 177.8 | 0 | 0 | 111.3 | E127 S185 V190 K191 T372 | E127-E187 HydrophobicContact CB-CB 4.18Å; E127-E187 HydrophobicContact CB-CG 4.35Å; E127-E187 HydrophobicContact CG-CB 4.39Å; S185-E187 PolarHBondContact OG-N 3.24Å; E187-V190 PolarHBondContact O-N 3.29Å; E187-K191 VanDerWaalsContact O-CG 3.3Å; E187-K191 WeakPolarHBondContact O-CG 3.45Å; E187-K191 PolarHBondContact O-N 3.05Å; E187-T372 WeakPolarHBondContact OE2-CG2 3.19Å |
| 188 | W | 91.2 | Very high | 91.2 | Very high | 34 Ų | 34 | 45 Ų | 45 | 13% | 0.129 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.8 | -43.2 | 175.4 | -177.7 | 89.9 | 0 | 0 | 0 | 112.3 | I63 G67 H68 E184 S185 S186 V190 K191 M192 | I63-W188 PolarHBondContact O-NE1 3.16Å; G67-W188 VanDerWaalsContact CA-CE2 3.44Å; G67-W188 VanDerWaalsContact N-CZ2 3.3Å; H68-W188 AromaticContact CE1-CD1 3.93Å; E184-W188 HydrophobicContact CG-CD2 4.22Å; E184-W188 HydrophobicContact CG-CE3 3.45Å; E184-W188 VanDerWaalsContact CG-CE3 3.45Å; E184-W188 HydrophobicContact CG-CZ3 3.79Å; S185-W188 PolarHBondContact O-N 2.86Å; S185-W188 PolarHBondContact OG-N 3.44Å; S185-W188 VanDerWaalsContact OG-N 3.16Å; S186-W188 VanDerWaalsContact C-N 3.32Å; S186-W188 PolarHBondContact O-N 3.04Å; W188-V190 VanDerWaalsContact C-N 3.31Å; W188-V190 PolarHBondContact O-N 3.12Å; W188-K191 WeakPolarHBondContact O-CB 3.48Å; W188-K191 PolarHBondContact O-N 2.97Å; W188-K191 VanDerWaalsContact O-N 3.16Å; W188-M192 HydrophobicContact CD2-CG 3.95Å; W188-M192 HydrophobicContact CE3-CG 4.16Å; W188-M192 HydrophobicContact CH2-CG 3.81Å; W188-M192 HydrophobicContact CZ2-CE 4.01Å; W188-M192 HydrophobicContact CZ2-CG 3.56Å; W188-M192 HydrophobicContact CZ2-SD 4.25Å; W188-M192 HydrophobicContact CZ3-CG 4.1Å; W188-M192 WeakPolarHBondContact O-CG 3.31Å; W188-M192 PolarHBondContact O-N 3.41Å |
| 189 | C | 91.3 | Very high | 90.9 | Very high | 4 Ų | 4 | 46.1 Ų | 46.1 | 3% | 0.027 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.1 | -40.4 | 177.8 | -67.9 | 0 | 0 | 0 | 0 | 111.7 | S185 S186 M192 G193 N194 A198 | S185-C189 PolarHBondContact O-N 3.45Å; S185-C189 PolarHBondContact O-SG 3.09Å; S186-C189 PolarHBondContact O-N 3.16Å; C189-M192 PolarHBondContact O-N 3.48Å; C189-G193 PolarHBondContact O-N 3.34Å; C189-N194 PolarHBondContact O-N 3.34Å; C189-A198 HydrophobicContact CB-CB 3.67Å |
| 190 | V | 89.4 | Confident | 90.6 | Very high | 46 Ų | 46 | 49 Ų | 49 | 28% | 0.279 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 173.4 | 175.1 | 0 | 0 | 0 | 0 | 111 | S186 E187 W188 M192 G193 L195 A198 F212 | S186-V190 WeakPolarHBondContact O-CG2 3.35Å; S186-V190 PolarHBondContact O-N 3.16Å; E187-V190 PolarHBondContact O-N 3.29Å; W188-V190 VanDerWaalsContact C-N 3.31Å; W188-V190 PolarHBondContact O-N 3.12Å; V190-M192 PolarHBondContact O-N 2.9Å; V190-G193 PolarHBondContact O-N 2.99Å; V190-L195 HydrophobicContact CG1-CD2 4.39Å; V190-L195 HydrophobicContact CG2-CD2 4.34Å; V190-A198 HydrophobicContact CG2-CB 3.54Å; V190-F212 HydrophobicContact CG2-CD1 3.94Å; V190-F212 HydrophobicContact CG2-CE1 4.04Å; V190-F212 HydrophobicContact CG2-CG 4.42Å |
| 191 | K | 85.6 | Confident | 90.4 | Very high | 47 Ų | 47 | 42.1 Ų | 42.1 | 20% | 0.204 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.9 | -31.8 | 177.2 | -71.7 | 169.7 | -172.1 | 171.8 | 0 | 112.4 | E127 E187 W188 G193 Y237 | E127-K191 IonicContact OE1-NZ 2.89Å; E127-K191 PolarHBondContact OE1-NZ 2.81Å; E187-K191 VanDerWaalsContact O-CG 3.3Å; E187-K191 WeakPolarHBondContact O-CG 3.45Å; E187-K191 PolarHBondContact O-N 3.05Å; W188-K191 WeakPolarHBondContact O-CB 3.48Å; W188-K191 PolarHBondContact O-N 2.97Å; W188-K191 VanDerWaalsContact O-N 3.16Å; K191-G193 VanDerWaalsContact C-N 3.32Å; K191-Y237 HydrophobicContact CD-CE2 4.18Å |
| 192 | M | 88.7 | Confident | 90.2 | Very high | 74 Ų | 74 | 38.2 Ų | 38.2 | 37% | 0.365 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | 1.5 | 175.5 | -65.5 | -58.9 | 155.1 | 0 | 0 | 114.2 | C64 W188 C189 V190 N194 | C64-M192 WeakPolarHBondContact O-CE 3.47Å; W188-M192 HydrophobicContact CD2-CG 3.95Å; W188-M192 HydrophobicContact CE3-CG 4.16Å; W188-M192 HydrophobicContact CH2-CG 3.81Å; W188-M192 HydrophobicContact CZ2-CE 4.01Å; W188-M192 HydrophobicContact CZ2-CG 3.56Å; W188-M192 HydrophobicContact CZ2-SD 4.25Å; W188-M192 HydrophobicContact CZ3-CG 4.1Å; W188-M192 WeakPolarHBondContact O-CG 3.31Å; W188-M192 PolarHBondContact O-N 3.41Å; C189-M192 PolarHBondContact O-N 3.48Å; V190-M192 PolarHBondContact O-N 2.9Å; M192-N194 PolarHBondContact O-N 3.42Å |
| 193 | G | 88 | Confident | 90 | Very high | 52 Ų | 52 | 43.4 Ų | 43.4 | 54% | 0.536 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 74.3 | 6.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | C189 V190 K191 L195 | C189-G193 PolarHBondContact O-N 3.34Å; V190-G193 PolarHBondContact O-N 2.99Å; K191-G193 VanDerWaalsContact C-N 3.32Å; G193-L195 PolarHBondContact O-N 3.18Å |
| 194 | N | 89.2 | Confident | 89.8 | Confident | 71 Ų | 71 | 45.4 Ų | 45.4 | 38% | 0.38 | 24% | 0.243 | S | C | . | . | trans | -92.4 | 74.7 | 178.9 | -172.2 | -11.5 | 0 | 0 | 0 | 110.9 | C189 M192 Q196 S197 A198 | C189-N194 PolarHBondContact O-N 3.34Å; M192-N194 PolarHBondContact O-N 3.42Å; N194-Q196 VanDerWaalsContact C-N 3.27Å; N194-Q196 PolarHBondContact O-N 3.4Å; N194-S197 VanDerWaalsContact CG-OG 3.23Å; N194-S197 WeakPolarHBondContact ND2-CB 3.45Å; N194-S197 PolarHBondContact ND2-OG 3.38Å; N194-S197 PolarHBondContact O-N 3.46Å; N194-S197 WeakPolarHBondContact OD1-CB 3.27Å; N194-S197 PolarHBondContact OD1-N 3Å; N194-S197 VanDerWaalsContact OD1-N 3.09Å; N194-S197 PolarHBondContact OD1-OG 2.9Å; N194-S197 VanDerWaalsContact OD1-OG 3.07Å; N194-A198 PolarHBondContact O-N 2.91Å; N194-A198 VanDerWaalsContact O-N 3.09Å | ||
| 195 | L | 89.1 | Confident | 89.5 | Confident | 32 Ų | 32 | 44.3 Ų | 44.3 | 17% | 0.168 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.8 | -33 | -177.2 | -58.7 | -177.6 | 0 | 0 | 0 | 112.9 | V190 G193 A198 E199 F212 I220 | V190-L195 HydrophobicContact CG1-CD2 4.39Å; V190-L195 HydrophobicContact CG2-CD2 4.34Å; G193-L195 PolarHBondContact O-N 3.18Å; L195-A198 WeakPolarHBondContact O-CB 3.42Å; L195-A198 PolarHBondContact O-N 2.82Å; L195-E199 WeakPolarHBondContact O-CG 3.37Å; L195-E199 PolarHBondContact O-N 2.87Å; L195-F212 HydrophobicContact CD2-CB 4.39Å; L195-I220 HydrophobicContact CD1-CD1 4.23Å |
| 196 | Q | 89.7 | Confident | 89.1 | Confident | 140 Ų | 140 | 47.4 Ų | 47.4 | 65% | 0.654 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -64.4 | -42.4 | 178.1 | -65.8 | -179.8 | -0.9 | 0 | 0 | 111.8 | N194 A198 E199 A200 | N194-Q196 VanDerWaalsContact C-N 3.27Å; N194-Q196 PolarHBondContact O-N 3.4Å; Q196-A198 VanDerWaalsContact C-N 3.34Å; Q196-E199 PolarHBondContact O-N 2.97Å; Q196-A200 WeakPolarHBondContact O-CB 3.38Å; Q196-A200 PolarHBondContact O-N 3.43Å |
| 197 | S | 90.5 | Very high | 88.9 | Confident | 47 Ų | 47 | 49 Ų | 49 | 33% | 0.329 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -71.7 | -30.9 | 176.3 | -62 | 0 | 0 | 0 | 0 | 112.1 | N194 S201 | N194-S197 VanDerWaalsContact CG-OG 3.23Å; N194-S197 WeakPolarHBondContact ND2-CB 3.45Å; N194-S197 PolarHBondContact ND2-OG 3.38Å; N194-S197 PolarHBondContact O-N 3.46Å; N194-S197 WeakPolarHBondContact OD1-CB 3.27Å; N194-S197 PolarHBondContact OD1-N 3Å; N194-S197 VanDerWaalsContact OD1-N 3.09Å; N194-S197 PolarHBondContact OD1-OG 2.9Å; N194-S197 VanDerWaalsContact OD1-OG 3.07Å; S197-S201 VanDerWaalsContact O-CB 3.29Å; S197-S201 WeakPolarHBondContact O-CB 3.45Å; S197-S201 PolarHBondContact O-N 3.22Å |
| 198 | A | 90.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.3 | -46.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | C189 V190 N194 L195 Q196 S201 H202 F212 | C189-A198 HydrophobicContact CB-CB 3.67Å; V190-A198 HydrophobicContact CG2-CB 3.54Å; N194-A198 PolarHBondContact O-N 2.91Å; N194-A198 VanDerWaalsContact O-N 3.09Å; L195-A198 WeakPolarHBondContact O-CB 3.42Å; L195-A198 PolarHBondContact O-N 2.82Å; Q196-A198 VanDerWaalsContact C-N 3.34Å; A198-S201 PolarHBondContact O-N 3.34Å; A198-H202 WeakPolarHBondContact O-CB 3.44Å; A198-H202 PolarHBondContact O-N 3.34Å; A198-F212 HydrophobicContact CB-CD2 4.24Å; A198-F212 HydrophobicContact CB-CE2 4.44Å |
| 199 | E | 89.8 | Confident | 87.8 | Confident | 45 Ų | 45 | 56.1 Ų | 56.1 | 21% | 0.21 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.3 | -48 | 174.6 | -73.4 | 175.3 | 173.1 | 0 | 0 | 110.8 | L195 Q196 S201 H202 Y203 F212 K213 | L195-E199 WeakPolarHBondContact O-CG 3.37Å; L195-E199 PolarHBondContact O-N 2.87Å; Q196-E199 PolarHBondContact O-N 2.97Å; E199-S201 PolarHBondContact O-N 3.04Å; E199-H202 PolarHBondContact O-N 3.07Å; E199-Y203 VanDerWaalsContact O-CB 3.24Å; E199-Y203 WeakPolarHBondContact O-CB 3.36Å; E199-Y203 PolarHBondContact O-N 3.34Å; E199-F212 HydrophobicContact CG-CB 4Å; E199-F212 HydrophobicContact CG-CD2 3.75Å; E199-F212 HydrophobicContact CG-CG 4.38Å; E199-F212 PolarHBondContact OE1-N 3.11Å; E199-K213 WeakPolarHBondContact OE1-CG 3.27Å; E199-K213 PolarHBondContact OE1-N 2.9Å |
| 200 | A | 90.8 | Very high | 86.7 | Confident | 60 Ų | 60 | 58.9 Ų | 58.9 | 50% | 0.496 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63 | -40.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | Q196 W204 | Q196-A200 WeakPolarHBondContact O-CB 3.38Å; Q196-A200 PolarHBondContact O-N 3.43Å; A200-W204 VanDerWaalsContact O-CB 3.23Å; A200-W204 WeakPolarHBondContact O-CB 3.37Å; A200-W204 PolarHBondContact O-N 3Å |
| 201 | S | 90.3 | Very high | 85.1 | Confident | 8 Ų | 8 | 59.6 Ų | 59.6 | 6% | 0.056 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.5 | -46 | 176.1 | 174.8 | 0 | 0 | 0 | 0 | 111.8 | E184 S197 A198 E199 W204 L205 | E184-S201 VanDerWaalsContact O-CB 3.3Å; E184-S201 WeakPolarHBondContact O-CB 3.5Å; E184-S201 PolarHBondContact O-OG 2.72Å; S197-S201 VanDerWaalsContact O-CB 3.29Å; S197-S201 WeakPolarHBondContact O-CB 3.45Å; S197-S201 PolarHBondContact O-N 3.22Å; A198-S201 PolarHBondContact O-N 3.34Å; E199-S201 PolarHBondContact O-N 3.04Å; S201-W204 WeakPolarHBondContact O-CB 3.24Å; S201-W204 PolarHBondContact O-N 3.28Å; S201-L205 PolarHBondContact O-N 3.08Å |
| 202 | H | 87.7 | Confident | 84 | Confident | 22 Ų | 22 | 59.4 Ų | 59.4 | 10% | 0.102 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.8 | -47.6 | 177.9 | -171.7 | 89.4 | 0 | 0 | 0 | 111.3 | A198 E199 W204 L205 Y206 N208 I210 F212 | A198-H202 WeakPolarHBondContact O-CB 3.44Å; A198-H202 PolarHBondContact O-N 3.34Å; E199-H202 PolarHBondContact O-N 3.07Å; H202-W204 VanDerWaalsContact C-N 3.3Å; H202-W204 PolarHBondContact O-N 3.11Å; H202-L205 PolarHBondContact O-N 2.75Å; H202-L205 VanDerWaalsContact O-N 3.16Å; H202-Y206 AromaticContact CE1-CD2 3.28Å; H202-Y206 WeakPolarHBondContact CE1-CD2 3.42Å; H202-Y206 AromaticContact CE1-CE2 3.69Å; H202-Y206 AromaticContact ND1-CD2 3.55Å; H202-Y206 AromaticContact ND1-CE2 3.84Å; H202-Y206 AromaticContact NE2-CD2 3.59Å; H202-Y206 PolarHBondContact O-N 3.35Å; H202-N208 PolarHBondContact NE2-OD1 3.06Å; H202-I210 WeakPolarHBondContact CE1-CD1 3.28Å; H202-I210 WeakPolarHBondContact NE2-CD1 3.43Å; H202-I210 WeakPolarHBondContact NE2-CG1 3.47Å; H202-F212 HydrophobicContact CB-CE2 3.99Å |
| 203 | Y | 89.9 | Confident | 82.4 | Confident | 115 Ų | 115 | 60.8 Ų | 60.8 | 45% | 0.451 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.3 | -41.2 | 175.6 | -177.8 | -97.8 | 0 | 0 | 0 | 111.7 | E199 L205 G207 E209 | E199-Y203 VanDerWaalsContact O-CB 3.24Å; E199-Y203 WeakPolarHBondContact O-CB 3.36Å; E199-Y203 PolarHBondContact O-N 3.34Å; Y203-L205 VanDerWaalsContact C-N 3.29Å; Y203-L205 PolarHBondContact O-N 3.34Å; Y203-G207 VanDerWaalsContact O-CA 3.23Å; Y203-G207 WeakPolarHBondContact O-CA 3.4Å; Y203-G207 PolarHBondContact O-N 2.86Å; Y203-E209 HydrophobicContact CD2-CG 3.66Å; Y203-E209 HydrophobicContact CE2-CG 4Å |
| 204 | W | 90.5 | Very high | 80.6 | Confident | 58 Ų | 58 | 64.6 Ų | 64.6 | 22% | 0.22 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -58.2 | -44.4 | 176.2 | -176.6 | 99.3 | 0 | 0 | 0 | 110.9 | R5 F8 V9 P183 A200 S201 H202 | R5-W204 HydrophobicContact CB-CE3 4.22Å; R5-W204 HydrophobicContact CB-CH2 3.87Å; R5-W204 HydrophobicContact CB-CZ2 4.32Å; R5-W204 HydrophobicContact CB-CZ3 3.8Å; R5-W204 WeakPolarHBondContact CD-O 3.36Å; R5-W204 HydrophobicContact CG-CH2 4.13Å; R5-W204 HydrophobicContact CG-CZ2 4.08Å; R5-W204 HydrophobicContact CG-CZ3 4.39Å; R5-W204 PolarHBondContact NH1-O 3.34Å; F8-W204 HydrophobicContact CD1-CH2 4.2Å; V9-W204 HydrophobicContact CG2-CH2 4.17Å; V9-W204 HydrophobicContact CG2-CZ3 3.8Å; P183-W204 HydrophobicContact CB-CD2 4.31Å; P183-W204 HydrophobicContact CB-CE3 4.22Å; P183-W204 HydrophobicContact CG-CD2 3.98Å; P183-W204 HydrophobicContact CG-CE3 3.43Å; P183-W204 VanDerWaalsContact CG-CE3 3.43Å; P183-W204 HydrophobicContact CG-CH2 4.43Å; P183-W204 HydrophobicContact CG-CZ3 3.69Å; A200-W204 VanDerWaalsContact O-CB 3.23Å; A200-W204 WeakPolarHBondContact O-CB 3.37Å; A200-W204 PolarHBondContact O-N 3Å; S201-W204 WeakPolarHBondContact O-CB 3.24Å; S201-W204 PolarHBondContact O-N 3.28Å; H202-W204 VanDerWaalsContact C-N 3.3Å; H202-W204 PolarHBondContact O-N 3.11Å |
| 205 | L | 87.2 | Confident | 78.8 | Confident | 4 Ų | 4 | 66 Ų | 66 | 2% | 0.021 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -77.8 | -46.5 | -174.4 | -173 | 58.6 | 0 | 0 | 0 | 113.1 | T3 F6 V9 I128 S201 H202 Y203 | T3-L205 WeakPolarHBondContact CG2-O 3.42Å; T3-L205 PolarHBondContact OG1-O 2.82Å; F6-L205 HydrophobicContact CD2-CD1 4.47Å; V9-L205 HydrophobicContact CG2-CD1 3.87Å; I128-L205 HydrophobicContact CB-CD2 3.96Å; I128-L205 VanDerWaalsContact O-CD2 3.25Å; I128-L205 WeakPolarHBondContact O-CD2 3.4Å; S201-L205 PolarHBondContact O-N 3.08Å; H202-L205 PolarHBondContact O-N 2.75Å; H202-L205 VanDerWaalsContact O-N 3.16Å; Y203-L205 VanDerWaalsContact C-N 3.29Å; Y203-L205 PolarHBondContact O-N 3.34Å |
| 206 | Y | 85.8 | Confident | 76.7 | Confident | 66 Ų | 66 | 64.8 Ų | 64.8 | 26% | 0.259 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -104.9 | -15 | -169.4 | -64.7 | -73.5 | 0 | 0 | 0 | 114 | I128 P130 H202 N208 | I128-Y206 PolarHBondContact O-OH 3.46Å; P130-Y206 WeakPolarHBondContact CD-OH 3.38Å; H202-Y206 AromaticContact CE1-CD2 3.28Å; H202-Y206 WeakPolarHBondContact CE1-CD2 3.42Å; H202-Y206 AromaticContact CE1-CE2 3.69Å; H202-Y206 AromaticContact ND1-CD2 3.55Å; H202-Y206 AromaticContact ND1-CE2 3.84Å; H202-Y206 AromaticContact NE2-CD2 3.59Å; H202-Y206 PolarHBondContact O-N 3.35Å; Y206-N208 WeakPolarHBondContact CB-OD1 3.46Å; Y206-N208 PolarHBondContact O-N 3.14Å |
| 207 | G | 84.2 | Confident | 74.5 | Confident | 46 Ų | 46 | 62.1 Ų | 62.1 | 47% | 0.474 | 32% | 0.324 | S | S | . | . | S | Bend | trans | 73.6 | 5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y203 | Y203-G207 VanDerWaalsContact O-CA 3.23Å; Y203-G207 WeakPolarHBondContact O-CA 3.4Å; Y203-G207 PolarHBondContact O-N 2.86Å |
| 208 | N | 81.8 | Confident | 72.1 | Confident | 79 Ų | 79 | 64.8 Ų | 64.8 | 42% | 0.422 | 34% | 0.335 | S | S | . | . | S | Bend | trans | -116.2 | 149.6 | 174.2 | 62 | -24.9 | 0 | 0 | 0 | 110.3 | H202 Y206 | H202-N208 PolarHBondContact NE2-OD1 3.06Å; Y206-N208 WeakPolarHBondContact CB-OD1 3.46Å; Y206-N208 PolarHBondContact O-N 3.14Å |
| 209 | E | 73.5 | Confident | 69.9 | Low | 162 Ų | 162 | 70.8 Ų | 70.8 | 76% | 0.757 | 37% | 0.366 | S | S | * | . | trans | -84.9 | 131.9 | 172.8 | -64.7 | 179.3 | -179.7 | 0 | 0 | 108.9 | Y203 | Y203-E209 HydrophobicContact CD2-CG 3.66Å; Y203-E209 HydrophobicContact CE2-CG 4Å | ||
| 210 | I | 68 | Low | 67.4 | Low | 63 Ų | 63 | 74 Ų | 74 | 32% | 0.323 | 38% | 0.384 | S | S | . | . | trans | -113.1 | 118.8 | 158.8 | -61.4 | -177.7 | 0 | 0 | 0 | 105 | H202 F212 | H202-I210 WeakPolarHBondContact CE1-CD1 3.28Å; H202-I210 WeakPolarHBondContact NE2-CD1 3.43Å; H202-I210 WeakPolarHBondContact NE2-CG1 3.47Å; I210-F212 VanDerWaalsContact C-N 3.29Å; I210-F212 HydrophobicContact CB-CE2 4.44Å; I210-F212 PolarHBondContact O-N 3.26Å | ||
| 211 | P | 56.2 | Low | 64.8 | Low | 60 Ų | 60 | 77 Ų | 77 | 39% | 0.39 | 39% | 0.39 | S | S | . | . | trans | -70 | 91.4 | 173.7 | 27.7 | -31.1 | 0 | 0 | 0 | 108.4 | K213 E214 | P211-K213 PolarHBondContact O-N 2.85Å; P211-E214 HydrophobicContact CB-CB 4.32Å; P211-E214 HydrophobicContact CB-CG 4.14Å; P211-E214 HydrophobicContact CG-CB 4.4Å; P211-E214 HydrophobicContact CG-CG 4.34Å; P211-E214 PolarHBondContact O-N 3.25Å | ||
| 212 | F | 62.9 | Low | 62 | Low | 43 Ų | 43 | 82.8 Ų | 82.8 | 19% | 0.189 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63 | -22.4 | 166.6 | -74.2 | -79.3 | 0 | 0 | 0 | 110.1 | V190 L195 A198 E199 H202 I210 E214 G216 | V190-F212 HydrophobicContact CG2-CD1 3.94Å; V190-F212 HydrophobicContact CG2-CE1 4.04Å; V190-F212 HydrophobicContact CG2-CG 4.42Å; L195-F212 HydrophobicContact CD2-CB 4.39Å; A198-F212 HydrophobicContact CB-CD2 4.24Å; A198-F212 HydrophobicContact CB-CE2 4.44Å; E199-F212 HydrophobicContact CG-CB 4Å; E199-F212 HydrophobicContact CG-CD2 3.75Å; E199-F212 HydrophobicContact CG-CG 4.38Å; E199-F212 PolarHBondContact OE1-N 3.11Å; H202-F212 HydrophobicContact CB-CE2 3.99Å; I210-F212 VanDerWaalsContact C-N 3.29Å; I210-F212 HydrophobicContact CB-CE2 4.44Å; I210-F212 PolarHBondContact O-N 3.26Å; F212-E214 PolarHBondContact O-N 3.42Å; F212-G216 VanDerWaalsContact O-CA 3.23Å; F212-G216 WeakPolarHBondContact O-CA 3.36Å; F212-G216 PolarHBondContact O-N 3.37Å |
| 213 | K | 54.7 | Low | 59.4 | Low | 104 Ų | 104 | 83.8 Ų | 83.8 | 45% | 0.452 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.2 | -34.2 | 170.5 | -75.9 | 176.8 | -173.7 | 171.6 | 0 | 114.7 | E199 P211 N217 | E199-K213 WeakPolarHBondContact OE1-CG 3.27Å; E199-K213 PolarHBondContact OE1-N 2.9Å; P211-K213 PolarHBondContact O-N 2.85Å; K213-N217 WeakPolarHBondContact O-CB 3.31Å; K213-N217 PolarHBondContact O-N 2.93Å; K213-N217 PolarHBondContact O-ND2 3.5Å; K213-N217 PolarHBondContact O-OD1 3.32Å |
| 214 | E | 51.1 | Low | 56.8 | Low | 132 Ų | 132 | 85.2 Ų | 85.2 | 62% | 0.617 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -77.1 | -43.3 | 179.8 | -74.7 | -176.6 | 165.4 | 0 | 0 | 111.7 | P211 F212 G216 N217 N218 | P211-E214 HydrophobicContact CB-CB 4.32Å; P211-E214 HydrophobicContact CB-CG 4.14Å; P211-E214 HydrophobicContact CG-CB 4.4Å; P211-E214 HydrophobicContact CG-CG 4.34Å; P211-E214 PolarHBondContact O-N 3.25Å; F212-E214 PolarHBondContact O-N 3.42Å; E214-G216 VanDerWaalsContact C-N 3.35Å; E214-N217 PolarHBondContact O-N 3.33Å; E214-N218 PolarHBondContact O-N 2.89Å |
| 215 | N | 50.6 | Low | 54.4 | Low | 101 Ų | 101 | 85 Ų | 85 | 54% | 0.54 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -68.5 | -35.8 | 171.6 | -82.3 | -12.5 | 0 | 0 | 0 | 112.2 | N218 L219 | N215-N218 PolarHBondContact O-N 2.88Å; N215-L219 WeakPolarHBondContact O-CG 3.28Å; N215-L219 PolarHBondContact O-N 2.98Å |
| 216 | G | 46.2 | Very low | 52.3 | Low | 6 Ų | 6 | 89.7 Ų | 89.7 | 6% | 0.062 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -66.8 | -41.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | F212 E214 N218 L219 I220 | F212-G216 VanDerWaalsContact O-CA 3.23Å; F212-G216 WeakPolarHBondContact O-CA 3.36Å; F212-G216 PolarHBondContact O-N 3.37Å; E214-G216 VanDerWaalsContact C-N 3.35Å; G216-N218 VanDerWaalsContact C-N 3.31Å; G216-N218 PolarHBondContact O-N 2.98Å; G216-L219 CarbonylContact O-C 3.42Å; G216-L219 WeakPolarHBondContact O-CA 3.41Å; G216-L219 PolarHBondContact O-N 3.35Å; G216-I220 WeakPolarHBondContact O-CB 3.28Å; G216-I220 WeakPolarHBondContact O-CD1 3.38Å; G216-I220 WeakPolarHBondContact O-CG1 3.17Å; G216-I220 PolarHBondContact O-N 3.28Å |
| 217 | N | 42.4 | Very low | 49.7 | Very low | 83 Ų | 83 | 93.3 Ų | 93.3 | 44% | 0.444 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.8 | -38.9 | 171.7 | -79.1 | -8.2 | 0 | 0 | 0 | 110.8 | K213 E214 L219 I220 I221 | K213-N217 WeakPolarHBondContact O-CB 3.31Å; K213-N217 PolarHBondContact O-N 2.93Å; K213-N217 PolarHBondContact O-ND2 3.5Å; K213-N217 PolarHBondContact O-OD1 3.32Å; E214-N217 PolarHBondContact O-N 3.33Å; N217-L219 VanDerWaalsContact C-N 3.27Å; N217-L219 PolarHBondContact O-N 3.13Å; N217-I220 PolarHBondContact O-N 3.22Å; N217-I221 HydrophobicContact CB-CD1 3.9Å; N217-I221 HydrophobicContact CB-CG1 4.49Å; N217-I221 WeakPolarHBondContact O-CA 3.31Å; N217-I221 WeakPolarHBondContact O-CB 3.34Å; N217-I221 WeakPolarHBondContact O-CD1 3.31Å; N217-I221 WeakPolarHBondContact O-CG1 3.35Å; N217-I221 PolarHBondContact O-N 3.42Å |
| 218 | N | 40.5 | Very low | 47.3 | Very low | 104 Ų | 104 | 95.6 Ų | 95.6 | 56% | 0.556 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66 | -27 | 171.7 | -74.7 | -21.7 | 0 | 0 | 0 | 113.8 | E214 N215 G216 N222 | E214-N218 PolarHBondContact O-N 2.89Å; N215-N218 PolarHBondContact O-N 2.88Å; G216-N218 VanDerWaalsContact C-N 3.31Å; G216-N218 PolarHBondContact O-N 2.98Å; N218-N222 WeakPolarHBondContact O-CB 3.43Å; N218-N222 PolarHBondContact O-N 2.97Å; N218-N222 PolarHBondContact O-ND2 3.23Å |
| 219 | L | 43.5 | Very low | 45.2 | Very low | 125 Ų | 125 | 95.2 Ų | 95.2 | 65% | 0.654 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -86.3 | -24.7 | 175.3 | -69.1 | 166.3 | 0 | 0 | 0 | 113.7 | N215 G216 N217 | N215-L219 WeakPolarHBondContact O-CG 3.28Å; N215-L219 PolarHBondContact O-N 2.98Å; G216-L219 CarbonylContact O-C 3.42Å; G216-L219 WeakPolarHBondContact O-CA 3.41Å; G216-L219 PolarHBondContact O-N 3.35Å; N217-L219 VanDerWaalsContact C-N 3.27Å; N217-L219 PolarHBondContact O-N 3.13Å |
| 220 | I | 38.1 | Very low | 43.5 | Very low | 113 Ų | 113 | 90 Ų | 90 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -93.1 | -35.7 | -179.4 | -65.4 | 163.1 | 0 | 0 | 0 | 110.3 | L195 G216 N217 | L195-I220 HydrophobicContact CD1-CD1 4.23Å; G216-I220 WeakPolarHBondContact O-CB 3.28Å; G216-I220 WeakPolarHBondContact O-CD1 3.38Å; G216-I220 WeakPolarHBondContact O-CG1 3.17Å; G216-I220 PolarHBondContact O-N 3.28Å; N217-I220 PolarHBondContact O-N 3.22Å |
| 221 | I | 36.3 | Very low | 41.7 | Very low | 123 Ų | 123 | 90.8 Ų | 90.8 | 63% | 0.631 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -72.2 | -35.4 | 174.7 | -64 | 166.5 | 0 | 0 | 0 | 110 | N217 G223 | N217-I221 HydrophobicContact CB-CD1 3.9Å; N217-I221 HydrophobicContact CB-CG1 4.49Å; N217-I221 WeakPolarHBondContact O-CA 3.31Å; N217-I221 WeakPolarHBondContact O-CB 3.34Å; N217-I221 WeakPolarHBondContact O-CD1 3.31Å; N217-I221 WeakPolarHBondContact O-CG1 3.35Å; N217-I221 PolarHBondContact O-N 3.42Å; I221-G223 PolarHBondContact O-N 3.41Å |
| 222 | N | 31.7 | Very low | 40.8 | Very low | 130 Ų | 130 | 93 Ų | 93 | 70% | 0.695 | 50% | 0.503 | S | S | * | . | S | Bend | trans | -81.8 | 62.7 | 169.2 | -71.5 | -22.3 | 0 | 0 | 0 | 111.6 | N218 | N218-N222 WeakPolarHBondContact O-CB 3.43Å; N218-N222 PolarHBondContact O-N 2.97Å; N218-N222 PolarHBondContact O-ND2 3.23Å |
| 223 | G | 31.8 | Very low | 39.7 | Very low | 43 Ų | 43 | 92.3 Ų | 92.3 | 44% | 0.443 | 50% | 0.504 | S | S | . | . | S | Bend | trans | 74.2 | 111.9 | 148 | 0 | 0 | 0 | 0 | 0 | 118.8 | I221 V225 | I221-G223 PolarHBondContact O-N 3.41Å; G223-V225 VanDerWaalsContact C-N 3.28Å; G223-V225 WeakPolarHBondContact O-CG2 3.44Å; G223-V225 PolarHBondContact O-N 3.49Å |
| 224 | N | 35.8 | Very low | 38.8 | Very low | 144 Ų | 144 | 90.5 Ų | 90.5 | 77% | 0.77 | 50% | 0.501 | S | S | * | . | trans | 52.9 | 22.1 | 147.5 | -70.7 | -7.5 | 0 | 0 | 0 | 119.8 | S226 | N224-S226 VanDerWaalsContact C-N 3.29Å; N224-S226 PolarHBondContact O-N 3.1Å | ||
| 225 | V | 41.1 | Very low | 37.9 | Very low | 54 Ų | 54 | 88.7 Ų | 88.7 | 33% | 0.327 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -79.3 | -0.5 | 178.6 | 171 | 0 | 0 | 0 | 0 | 113.7 | G223 H227 D228 L229 | G223-V225 VanDerWaalsContact C-N 3.28Å; G223-V225 WeakPolarHBondContact O-CG2 3.44Å; G223-V225 PolarHBondContact O-N 3.49Å; V225-H227 PolarHBondContact O-N 2.99Å; V225-D228 PolarHBondContact O-N 3.21Å; V225-L229 HydrophobicContact CG1-CB 3.64Å; V225-L229 HydrophobicContact CG1-CD1 3.41Å; V225-L229 VanDerWaalsContact CG1-CD1 3.41Å; V225-L229 HydrophobicContact CG1-CG 4.1Å; V225-L229 WeakPolarHBondContact O-CB 3.38Å; V225-L229 PolarHBondContact O-N 3.49Å |
| 226 | S | 41.1 | Very low | 37.4 | Very low | 103 Ų | 103 | 85.1 Ų | 85.1 | 72% | 0.72 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.9 | -26.2 | 170.5 | 56.4 | 0 | 0 | 0 | 0 | 113.3 | N224 | N224-S226 VanDerWaalsContact C-N 3.29Å; N224-S226 PolarHBondContact O-N 3.1Å |
| 227 | H | 32.9 | Very low | 37.2 | Very low | 142 Ų | 142 | 85.1 Ų | 85.1 | 66% | 0.657 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -96 | -27.5 | 174.1 | -94.2 | -76 | 0 | 0 | 0 | 114 | V225 S230 N231 | V225-H227 PolarHBondContact O-N 2.99Å; H227-S230 PolarHBondContact O-OG 2.99Å; H227-S230 VanDerWaalsContact O-OG 3.04Å; H227-N231 PolarHBondContact O-ND2 3.18Å |
| 228 | D | 32.7 | Very low | 36.9 | Very low | 94 Ų | 94 | 85.4 Ų | 85.4 | 50% | 0.503 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -85.7 | -30.3 | 177.6 | -77 | -27.1 | 0 | 0 | 0 | 113 | V225 N231 L232 | V225-D228 PolarHBondContact O-N 3.21Å; D228-N231 PolarHBondContact O-N 3.48Å; D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 WeakPolarHBondContact O-CD1 3.44Å; D228-L232 WeakPolarHBondContact O-CG 3.45Å; D228-L232 PolarHBondContact O-N 3.33Å |
| 229 | L | 39 | Very low | 36.4 | Very low | 71 Ų | 71 | 83 Ų | 83 | 37% | 0.372 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -70.2 | -32.2 | 174 | -140.8 | 81.9 | 0 | 0 | 0 | 111.5 | V225 L232 S233 | V225-L229 HydrophobicContact CG1-CB 3.64Å; V225-L229 HydrophobicContact CG1-CD1 3.41Å; V225-L229 VanDerWaalsContact CG1-CD1 3.41Å; V225-L229 HydrophobicContact CG1-CG 4.1Å; V225-L229 WeakPolarHBondContact O-CB 3.38Å; V225-L229 PolarHBondContact O-N 3.49Å; L229-L232 PolarHBondContact O-N 3.06Å; L229-S233 WeakPolarHBondContact O-CA 3.27Å; L229-S233 WeakPolarHBondContact O-CB 3.31Å; L229-S233 PolarHBondContact O-N 3.07Å; L229-S233 PolarHBondContact O-OG 3.38Å |
| 230 | S | 36.5 | Very low | 35.8 | Very low | 53 Ų | 53 | 79.2 Ų | 79.2 | 37% | 0.371 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -70.6 | -34.3 | 174.6 | 58.9 | 0 | 0 | 0 | 0 | 112.3 | H227 S233 T234 | H227-S230 PolarHBondContact O-OG 2.99Å; H227-S230 VanDerWaalsContact O-OG 3.04Å; S230-S233 VanDerWaalsContact CA-OG 3.28Å; S230-S233 WeakPolarHBondContact CA-OG 3.47Å; S230-S233 PolarHBondContact O-OG 3.34Å; S230-T234 PolarHBondContact O-N 2.7Å; S230-T234 PolarHBondContact O-OG1 3.47Å |
| 231 | N | 30.4 | Very low | 35.6 | Very low | 79 Ų | 79 | 77 Ų | 77 | 42% | 0.422 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -77.6 | -31.1 | 174.9 | -75.8 | -22.4 | 0 | 0 | 0 | 112.1 | H227 D228 T234 K235 | H227-N231 PolarHBondContact O-ND2 3.18Å; D228-N231 PolarHBondContact O-N 3.48Å; N231-T234 PolarHBondContact O-OG1 2.96Å; N231-K235 WeakPolarHBondContact O-CB 3.25Å; N231-K235 WeakPolarHBondContact O-CD 3.45Å; N231-K235 WeakPolarHBondContact O-CG 3.37Å; N231-K235 PolarHBondContact O-N 3.43Å |
| 232 | L | 37.2 | Very low | 35.2 | Very low | 105 Ų | 105 | 79.9 Ų | 79.9 | 55% | 0.55 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -78.4 | -32.6 | 171.4 | -78.9 | 157.4 | 0 | 0 | 0 | 112.4 | D228 L229 K235 S236 | D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 WeakPolarHBondContact O-CD1 3.44Å; D228-L232 WeakPolarHBondContact O-CG 3.45Å; D228-L232 PolarHBondContact O-N 3.33Å; L229-L232 PolarHBondContact O-N 3.06Å; L232-K235 PolarHBondContact O-N 2.85Å; L232-S236 WeakPolarHBondContact O-CB 3.42Å; L232-S236 PolarHBondContact O-N 3.43Å |
| 233 | S | 40.4 | Very low | 35.1 | Very low | 30 Ų | 30 | 79.4 Ų | 79.4 | 21% | 0.21 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -70.3 | -34.6 | -179.8 | 67.4 | 0 | 0 | 0 | 0 | 111.5 | L229 S230 Y237 | L229-S233 WeakPolarHBondContact O-CA 3.27Å; L229-S233 WeakPolarHBondContact O-CB 3.31Å; L229-S233 PolarHBondContact O-N 3.07Å; L229-S233 PolarHBondContact O-OG 3.38Å; S230-S233 VanDerWaalsContact CA-OG 3.28Å; S230-S233 WeakPolarHBondContact CA-OG 3.47Å; S230-S233 PolarHBondContact O-OG 3.34Å; S233-Y237 WeakPolarHBondContact O-CD2 3.32Å |
| 234 | T | 35.5 | Very low | 35.3 | Very low | 66 Ų | 66 | 80.2 Ų | 80.2 | 41% | 0.405 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -73.7 | -49.6 | 167.8 | 46.3 | 0 | 0 | 0 | 0 | 110.1 | S230 N231 S236 Y237 T238 | S230-T234 PolarHBondContact O-N 2.7Å; S230-T234 PolarHBondContact O-OG1 3.47Å; N231-T234 PolarHBondContact O-OG1 2.96Å; T234-S236 PolarHBondContact O-N 3.47Å; T234-Y237 CarbonylContact O-C 3.48Å; T234-Y237 PolarHBondContact O-N 3.45Å; T234-Y237 VanDerWaalsContact O-N 3.15Å; T234-T238 VanDerWaalsContact C-OG1 3.31Å; T234-T238 WeakPolarHBondContact O-CB 3.11Å; T234-T238 PolarHBondContact O-N 2.71Å; T234-T238 PolarHBondContact O-OG1 2.93Å |
| 235 | K | 33.1 | Very low | 35.4 | Very low | 93 Ų | 93 | 81.1 Ų | 81.1 | 40% | 0.404 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.5 | -28.4 | -175 | -76.8 | 173.7 | -170.8 | 173.3 | 0 | 116.9 | N231 L232 Y237 T238 G239 S240 | N231-K235 WeakPolarHBondContact O-CB 3.25Å; N231-K235 WeakPolarHBondContact O-CD 3.45Å; N231-K235 WeakPolarHBondContact O-CG 3.37Å; N231-K235 PolarHBondContact O-N 3.43Å; L232-K235 PolarHBondContact O-N 2.85Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; K235-T238 CarbonylContact C-O 3.59Å; K235-T238 WeakPolarHBondContact CA-O 3.2Å; K235-T238 CarbonylContact O-C 3.26Å; K235-T238 VanDerWaalsContact O-C 3.22Å; K235-G239 CarbonylContact O-C 3.56Å; K235-G239 WeakPolarHBondContact O-CA 3.4Å; K235-G239 PolarHBondContact O-N 2.82Å; K235-S240 PolarHBondContact O-N 3.2Å |
| 236 | S | 40.1 | Very low | 36.3 | Very low | 26 Ų | 26 | 83.5 Ų | 83.5 | 18% | 0.182 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -70.7 | -27.4 | 175 | 169 | 0 | 0 | 0 | 0 | 111.6 | L232 T234 V373 | L232-S236 WeakPolarHBondContact O-CB 3.42Å; L232-S236 PolarHBondContact O-N 3.43Å; T234-S236 PolarHBondContact O-N 3.47Å; S236-V373 PolarHBondContact OG-O 2.91Å |
| 237 | Y | 42.2 | Very low | 37.6 | Very low | 6 Ų | 6 | 79.1 Ų | 79.1 | 2% | 0.024 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -98.2 | -28.4 | 176.5 | -69.3 | -101.3 | 0 | 0 | 0 | 112.8 | T60 I63 C64 K191 S233 T234 K235 N376 | T60-Y237 HydrophobicContact CG2-CD1 3.56Å; T60-Y237 HydrophobicContact CG2-CE1 4.49Å; T60-Y237 HydrophobicContact CG2-CG 4.33Å; I63-Y237 HydrophobicContact CG2-CE1 4.07Å; C64-Y237 WeakPolarHBondContact SG-CB 3.26Å; C64-Y237 WeakPolarHBondContact SG-CD1 3.24Å; K191-Y237 HydrophobicContact CD-CE2 4.18Å; S233-Y237 WeakPolarHBondContact O-CD2 3.32Å; T234-Y237 CarbonylContact O-C 3.48Å; T234-Y237 PolarHBondContact O-N 3.45Å; T234-Y237 VanDerWaalsContact O-N 3.15Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; Y237-N376 HydrophobicContact CD1-CB 4.19Å; Y237-N376 HydrophobicContact CE1-CB 4.14Å; Y237-N376 WeakPolarHBondContact CE1-ND2 3.33Å; Y237-N376 VanDerWaalsContact CZ-ND2 3.28Å; Y237-N376 PolarHBondContact OH-ND2 3.35Å |
| 238 | T | 34.9 | Very low | 39.9 | Very low | 90 Ų | 90 | 75.7 Ų | 75.7 | 55% | 0.552 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.9 | 76.4 | 170.4 | 70.3 | 0 | 0 | 0 | 0 | 109 | T234 K235 S240 | T234-T238 VanDerWaalsContact C-OG1 3.31Å; T234-T238 WeakPolarHBondContact O-CB 3.11Å; T234-T238 PolarHBondContact O-N 2.71Å; T234-T238 PolarHBondContact O-OG1 2.93Å; K235-T238 CarbonylContact C-O 3.59Å; K235-T238 WeakPolarHBondContact CA-O 3.2Å; K235-T238 CarbonylContact O-C 3.26Å; K235-T238 VanDerWaalsContact O-C 3.22Å; T238-S240 PolarHBondContact O-N 3.09Å |
| 239 | G | 31.2 | Very low | 42.3 | Very low | 52 Ų | 52 | 73.6 Ų | 73.6 | 54% | 0.536 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -11.6 | 107 | -173.9 | 0 | 0 | 0 | 0 | 0 | 118 | K235 | K235-G239 CarbonylContact O-C 3.56Å; K235-G239 WeakPolarHBondContact O-CA 3.4Å; K235-G239 PolarHBondContact O-N 2.82Å |
| 240 | S | 29.5 | Very low | 44.6 | Very low | 46 Ų | 46 | 74.1 Ų | 74.1 | 32% | 0.322 | 42% | 0.42 | S | S | . | . | trans | -79.6 | 126.7 | 162.5 | 131.8 | 0 | 0 | 0 | 0 | 110.3 | K235 T238 Y242 | K235-S240 PolarHBondContact O-N 3.2Å; T238-S240 PolarHBondContact O-N 3.09Å; S240-Y242 PolarHBondContact O-N 2.77Å; S240-Y242 VanDerWaalsContact O-N 3.13Å; S240-Y242 VanDerWaalsContact OG-CD2 3.31Å; S240-Y242 WeakPolarHBondContact OG-CD2 3.17Å | ||
| 241 | S | 33.6 | Very low | 47.2 | Very low | 68 Ų | 68 | 72.3 Ų | 72.3 | 48% | 0.476 | 41% | 0.406 | S | S | . | . | G | 310 helix | trans | -72.8 | 5.1 | -172.3 | 43.2 | 0 | 0 | 0 | 0 | 116.6 | ||
| 242 | Y | 28.8 | Very low | 50.2 | Low | 182 Ų | 182 | 75.4 Ų | 75.4 | 71% | 0.714 | 41% | 0.412 | S | S | * | . | G | 310 helix | trans | -97.6 | 5.5 | -158.9 | -51.8 | -71.4 | 0 | 0 | 0 | 117 | S240 | S240-Y242 PolarHBondContact O-N 2.77Å; S240-Y242 VanDerWaalsContact O-N 3.13Å; S240-Y242 VanDerWaalsContact OG-CD2 3.31Å; S240-Y242 WeakPolarHBondContact OG-CD2 3.17Å |
| 243 | V | 29.6 | Very low | 52.8 | Low | 120 Ų | 120 | 71.4 Ų | 71.4 | 73% | 0.727 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -132.1 | 30.7 | 170.3 | -163.5 | 0 | 0 | 0 | 0 | 111.6 | ||
| 244 | L | 36.2 | Very low | 55.3 | Low | 60 Ų | 60 | 70.1 Ų | 70.1 | 31% | 0.314 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -88.2 | -8.3 | -161.8 | -77.8 | -174.4 | 0 | 0 | 0 | 117 | D246 S247 T248 | L244-D246 PolarHBondContact O-N 3.36Å; L244-S247 PolarHBondContact O-N 3.32Å; L244-T248 HydrophobicContact CB-CG2 3.92Å; L244-T248 VanDerWaalsContact O-CB 3.32Å; L244-T248 WeakPolarHBondContact O-CB 3.28Å; L244-T248 WeakPolarHBondContact O-CG2 3.18Å; L244-T248 PolarHBondContact O-N 3.22Å; L244-T248 PolarHBondContact O-OG1 3.32Å |
| 245 | I | 38.1 | Very low | 58.2 | Low | 163 Ų | 163 | 69.9 Ų | 69.9 | 84% | 0.836 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -66.7 | -40.8 | -171.8 | -56.9 | 175.1 | 0 | 0 | 0 | 111.5 | T248 | I245-T248 PolarHBondContact O-OG1 3.14Å |
| 246 | D | 59.2 | Low | 61.2 | Low | 105 Ų | 105 | 68.2 Ų | 68.2 | 56% | 0.561 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -85.4 | -27.4 | 173 | -168.5 | 40.2 | 0 | 0 | 0 | 112.8 | L244 K250 | L244-D246 PolarHBondContact O-N 3.36Å; D246-K250 WeakPolarHBondContact OD2-CE 3.27Å; D246-K250 IonicContact OD2-NZ 2.72Å; D246-K250 PolarHBondContact OD2-NZ 2.65Å |
| 247 | S | 69.5 | Low | 63.9 | Low | 11 Ų | 11 | 67 Ų | 67 | 8% | 0.077 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -71.9 | -35.2 | -179.6 | -174.2 | 0 | 0 | 0 | 0 | 113.4 | L244 K250 L251 F370 | L244-S247 PolarHBondContact O-N 3.32Å; S247-K250 PolarHBondContact O-N 3.23Å; S247-L251 WeakPolarHBondContact O-CB 3.43Å; S247-L251 WeakPolarHBondContact O-CG 3.36Å; S247-L251 PolarHBondContact O-N 3.21Å; S247-F370 WeakPolarHBondContact OG-CE1 3.49Å |
| 248 | T | 80.2 | Confident | 66.5 | Low | 70 Ų | 70 | 66.9 Ų | 66.9 | 43% | 0.429 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.4 | -40.4 | -178.3 | 48.1 | 0 | 0 | 0 | 0 | 112.3 | L244 I245 L251 R252 | L244-T248 HydrophobicContact CB-CG2 3.92Å; L244-T248 VanDerWaalsContact O-CB 3.32Å; L244-T248 WeakPolarHBondContact O-CB 3.28Å; L244-T248 WeakPolarHBondContact O-CG2 3.18Å; L244-T248 PolarHBondContact O-N 3.22Å; L244-T248 PolarHBondContact O-OG1 3.32Å; I245-T248 PolarHBondContact O-OG1 3.14Å; T248-L251 PolarHBondContact O-N 3.38Å; T248-R252 WeakPolarHBondContact O-CB 3.47Å; T248-R252 PolarHBondContact O-N 3.22Å |
| 249 | S | 84 | Confident | 69.5 | Low | 49 Ų | 49 | 64.6 Ų | 64.6 | 34% | 0.343 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.3 | -45.5 | 174.7 | -168.4 | 0 | 0 | 0 | 0 | 110.9 | R252 T253 | S249-R252 PolarHBondContact O-N 3.1Å; S249-R252 PolarHBondContact OG-NH2 3.23Å; S249-R252 VanDerWaalsContact OG-NH2 3.16Å; S249-T253 PolarHBondContact O-N 3.41Å; S249-T253 PolarHBondContact O-OG1 2.92Å; S249-T253 VanDerWaalsContact O-OG1 3.12Å |
| 250 | K | 87 | Confident | 72.7 | Confident | 82 Ų | 82 | 63.1 Ų | 63.1 | 36% | 0.357 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.1 | -46.9 | 176.4 | -70.4 | 170.4 | 177.2 | 164.2 | 0 | 112.2 | D246 S247 T253 I254 F370 | D246-K250 WeakPolarHBondContact OD2-CE 3.27Å; D246-K250 IonicContact OD2-NZ 2.72Å; D246-K250 PolarHBondContact OD2-NZ 2.65Å; S247-K250 PolarHBondContact O-N 3.23Å; K250-T253 PolarHBondContact O-N 2.88Å; K250-I254 WeakPolarHBondContact O-CG1 3.43Å; K250-I254 PolarHBondContact O-N 3.44Å; K250-F370 HydrophobicContact CB-CE2 3.94Å; K250-F370 HydrophobicContact CB-CZ 3.71Å |
| 251 | L | 90.5 | Very high | 75.9 | Confident | 16 Ų | 16 | 62.1 Ų | 62.1 | 8% | 0.084 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.3 | -44.4 | 176.7 | -79.4 | 175 | 0 | 0 | 0 | 111.8 | S247 T248 T253 I254 F255 F370 Y377 A378 | S247-L251 WeakPolarHBondContact O-CB 3.43Å; S247-L251 WeakPolarHBondContact O-CG 3.36Å; S247-L251 PolarHBondContact O-N 3.21Å; T248-L251 PolarHBondContact O-N 3.38Å; L251-T253 VanDerWaalsContact C-N 3.33Å; L251-T253 PolarHBondContact O-N 3.4Å; L251-I254 PolarHBondContact O-N 3.44Å; L251-F255 HydrophobicContact CD2-CE1 4.42Å; L251-F255 WeakPolarHBondContact O-CD1 3.42Å; L251-F255 WeakPolarHBondContact O-CG 3.42Å; L251-F255 PolarHBondContact O-N 2.96Å; L251-F370 HydrophobicContact CB-CZ 4.46Å; L251-F370 HydrophobicContact CD2-CE1 3.95Å; L251-F370 HydrophobicContact CD2-CE2 4.25Å; L251-F370 HydrophobicContact CD2-CZ 3.61Å; L251-F370 HydrophobicContact CG-CE1 3.95Å; L251-F370 HydrophobicContact CG-CZ 3.59Å; L251-Y377 HydrophobicContact CD1-CD1 4.33Å; L251-Y377 HydrophobicContact CD1-CE1 3.85Å; L251-Y377 HydrophobicContact CD2-CE1 4.46Å; L251-A378 HydrophobicContact CD2-CB 4.07Å |
| 252 | R | 92.5 | Very high | 79 | Confident | 144 Ų | 144 | 59.6 Ų | 59.6 | 54% | 0.543 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.6 | -45.4 | 176.2 | -179.1 | -177.1 | 62.7 | -143.8 | -5.4 | 111.2 | T248 S249 I254 F255 I256 | T248-R252 WeakPolarHBondContact O-CB 3.47Å; T248-R252 PolarHBondContact O-N 3.22Å; S249-R252 PolarHBondContact O-N 3.1Å; S249-R252 PolarHBondContact OG-NH2 3.23Å; S249-R252 VanDerWaalsContact OG-NH2 3.16Å; R252-I254 VanDerWaalsContact C-N 3.32Å; R252-I254 PolarHBondContact O-N 2.78Å; R252-F255 PolarHBondContact O-N 2.6Å; R252-I256 HydrophobicContact CG-CD1 3.99Å; R252-I256 WeakPolarHBondContact O-CG1 3.35Å; R252-I256 PolarHBondContact O-N 2.87Å |
| 253 | T | 92.5 | Very high | 82.3 | Confident | 21 Ų | 21 | 53.4 Ų | 53.4 | 13% | 0.129 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.4 | -41.9 | 177 | -61.1 | 0 | 0 | 0 | 0 | 111.9 | S249 K250 L251 I256 L257 Y423 I428 | S249-T253 PolarHBondContact O-N 3.41Å; S249-T253 PolarHBondContact O-OG1 2.92Å; S249-T253 VanDerWaalsContact O-OG1 3.12Å; K250-T253 PolarHBondContact O-N 2.88Å; L251-T253 VanDerWaalsContact C-N 3.33Å; L251-T253 PolarHBondContact O-N 3.4Å; T253-I256 PolarHBondContact O-N 2.97Å; T253-L257 HydrophobicContact CG2-CD1 4.42Å; T253-L257 WeakPolarHBondContact O-CB 3.44Å; T253-L257 WeakPolarHBondContact O-CG 3.49Å; T253-L257 PolarHBondContact O-N 2.96Å; T253-Y423 WeakPolarHBondContact CA-OH 3.35Å; T253-Y423 HydrophobicContact CG2-CE1 4.5Å; T253-I428 HydrophobicContact CG2-CD1 3.5Å; T253-I428 VanDerWaalsContact CG2-CD1 3.5Å |
| 254 | I | 93.5 | Very high | 85.5 | Confident | 2 Ų | 2 | 47.7 Ų | 47.7 | 1% | 0.01 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.6 | -44 | 176.7 | -71.8 | 167.3 | 0 | 0 | 0 | 112 | K250 L251 R252 I256 L257 M258 T366 F370 | K250-I254 WeakPolarHBondContact O-CG1 3.43Å; K250-I254 PolarHBondContact O-N 3.44Å; L251-I254 PolarHBondContact O-N 3.44Å; R252-I254 VanDerWaalsContact C-N 3.32Å; R252-I254 PolarHBondContact O-N 2.78Å; I254-I256 VanDerWaalsContact C-N 3.28Å; I254-I256 PolarHBondContact O-N 3.33Å; I254-L257 PolarHBondContact O-N 2.88Å; I254-M258 HydrophobicContact CG2-CG 4.28Å; I254-M258 WeakPolarHBondContact O-CG 3.37Å; I254-M258 PolarHBondContact O-N 2.89Å; I254-T366 HydrophobicContact CD1-CG2 4.11Å; I254-T366 HydrophobicContact CG2-CG2 4.34Å; I254-T366 VanDerWaalsContact CG2-OG1 3.26Å; I254-T366 WeakPolarHBondContact CG2-OG1 3.33Å; I254-F370 HydrophobicContact CD1-CD2 3.74Å; I254-F370 HydrophobicContact CD1-CE2 3.24Å; I254-F370 HydrophobicContact CD1-CZ 4.29Å |
| 255 | F | 96.5 | Very high | 88.4 | Confident | 62 Ų | 62 | 44.9 Ų | 44.9 | 27% | 0.272 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.3 | -40.8 | 178.9 | -69.4 | -2.5 | 0 | 0 | 0 | 111.3 | L251 R252 T259 S381 V385 | L251-F255 HydrophobicContact CD2-CE1 4.42Å; L251-F255 WeakPolarHBondContact O-CD1 3.42Å; L251-F255 WeakPolarHBondContact O-CG 3.42Å; L251-F255 PolarHBondContact O-N 2.96Å; R252-F255 PolarHBondContact O-N 2.6Å; F255-T259 WeakPolarHBondContact O-CB 3.39Å; F255-T259 PolarHBondContact O-N 3.36Å; F255-T259 PolarHBondContact O-OG1 2.56Å; F255-S381 WeakPolarHBondContact CE1-OG 3.34Å; F255-V385 HydrophobicContact CB-CG1 4.39Å; F255-V385 HydrophobicContact CB-CG2 4.48Å; F255-V385 HydrophobicContact CD1-CG2 4.04Å; F255-V385 HydrophobicContact CD2-CG2 4.3Å; F255-V385 HydrophobicContact CE1-CG2 4.35Å; F255-V385 HydrophobicContact CG-CG2 4.03Å |
| 256 | I | 96.7 | Very high | 91.2 | Very high | 57 Ų | 57 | 37.2 Ų | 37.2 | 29% | 0.292 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -66.7 | -43.9 | 174.7 | -64 | 166.8 | 0 | 0 | 0 | 110.5 | R252 T253 I254 M258 T259 L260 Y423 | R252-I256 HydrophobicContact CG-CD1 3.99Å; R252-I256 WeakPolarHBondContact O-CG1 3.35Å; R252-I256 PolarHBondContact O-N 2.87Å; T253-I256 PolarHBondContact O-N 2.97Å; I254-I256 VanDerWaalsContact C-N 3.28Å; I254-I256 PolarHBondContact O-N 3.33Å; I256-M258 PolarHBondContact O-N 3.48Å; I256-T259 WeakPolarHBondContact O-CB 3.23Å; I256-T259 PolarHBondContact O-N 3.49Å; I256-L260 HydrophobicContact CG2-CD1 3.8Å; I256-L260 HydrophobicContact CG2-CG 4.11Å; I256-L260 WeakPolarHBondContact O-CB 3.26Å; I256-L260 VanDerWaalsContact O-CG 3.26Å; I256-L260 WeakPolarHBondContact O-CG 3.09Å; I256-L260 PolarHBondContact O-N 3.45Å; I256-Y423 HydrophobicContact CB-CE1 4.11Å; I256-Y423 HydrophobicContact CB-CE2 4.32Å; I256-Y423 HydrophobicContact CD1-CE2 3.84Å; I256-Y423 WeakPolarHBondContact CD1-OH 3.26Å; I256-Y423 HydrophobicContact CG2-CD1 3.95Å; I256-Y423 HydrophobicContact CG2-CD2 4Å; I256-Y423 HydrophobicContact CG2-CE1 3.59Å; I256-Y423 HydrophobicContact CG2-CE2 3.66Å; I256-Y423 HydrophobicContact CG2-CG 4.15Å; I256-Y423 VanDerWaalsContact CG2-CZ 3.45Å |
| 257 | L | 95.9 | Very high | 93 | Very high | 1 Ų | 1 | 33.2 Ų | 33.2 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.7 | -43.4 | 176.3 | -79.5 | 178.2 | 0 | 0 | 0 | 113.1 | T253 I254 T259 L260 Q261 L315 W358 P362 I365 V424 I428 | T253-L257 HydrophobicContact CG2-CD1 4.42Å; T253-L257 WeakPolarHBondContact O-CB 3.44Å; T253-L257 WeakPolarHBondContact O-CG 3.49Å; T253-L257 PolarHBondContact O-N 2.96Å; I254-L257 PolarHBondContact O-N 2.88Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-L260 PolarHBondContact O-N 2.93Å; L257-Q261 WeakPolarHBondContact O-CB 3.35Å; L257-Q261 PolarHBondContact O-N 3.15Å; L257-L315 HydrophobicContact CD2-CD1 4.45Å; L257-W358 HydrophobicContact CD2-CH2 4.44Å; L257-W358 HydrophobicContact CD2-CZ3 4.27Å; L257-P362 HydrophobicContact CB-CB 4.47Å; L257-I365 HydrophobicContact CD1-CB 4.44Å; L257-I365 HydrophobicContact CD1-CD1 3.91Å; L257-I365 HydrophobicContact CD1-CG2 3.97Å; L257-V424 HydrophobicContact CD2-CG2 4.24Å; L257-I428 HydrophobicContact CD1-CD1 3.67Å; L257-I428 HydrophobicContact CD2-CD1 4.16Å; L257-I428 HydrophobicContact CD2-CG1 4.32Å; L257-I428 HydrophobicContact CG-CD1 4.13Å |
| 258 | M | 96.7 | Very high | 94.3 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.02 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.7 | -38.6 | 176.4 | -69.9 | -62.5 | -178.3 | 0 | 0 | 111.5 | I254 I256 Q261 Q262 P362 V385 | I254-M258 HydrophobicContact CG2-CG 4.28Å; I254-M258 WeakPolarHBondContact O-CG 3.37Å; I254-M258 PolarHBondContact O-N 2.89Å; I256-M258 PolarHBondContact O-N 3.48Å; M258-Q261 PolarHBondContact O-N 3.44Å; M258-Q262 WeakPolarHBondContact O-CG 3.25Å; M258-Q262 PolarHBondContact O-N 3.35Å; M258-P362 HydrophobicContact CE-CB 4.12Å; M258-P362 HydrophobicContact SD-CB 3.85Å; M258-V385 HydrophobicContact CB-CG1 4.47Å |
| 259 | T | 98.1 | Very high | 95 | Very high | 41 Ų | 41 | 29.4 Ų | 29.4 | 25% | 0.252 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -62.3 | -49.1 | 173.4 | -58 | 0 | 0 | 0 | 0 | 110.8 | F255 I256 L257 Q261 Q262 L263 V389 | F255-T259 WeakPolarHBondContact O-CB 3.39Å; F255-T259 PolarHBondContact O-N 3.36Å; F255-T259 PolarHBondContact O-OG1 2.56Å; I256-T259 WeakPolarHBondContact O-CB 3.23Å; I256-T259 PolarHBondContact O-N 3.49Å; L257-T259 VanDerWaalsContact C-N 3.32Å; T259-Q261 VanDerWaalsContact C-N 3.31Å; T259-Q261 PolarHBondContact O-N 2.95Å; T259-Q262 PolarHBondContact O-N 3.23Å; T259-L263 HydrophobicContact CG2-CD1 4Å; T259-L263 WeakPolarHBondContact O-CG 3.45Å; T259-L263 PolarHBondContact O-N 3.24Å; T259-L263 VanDerWaalsContact O-N 3.08Å; T259-V389 HydrophobicContact CG2-CG1 4.06Å; T259-V389 HydrophobicContact CG2-CG2 3.93Å |
| 260 | L | 97.9 | Very high | 95.6 | Very high | 21 Ų | 21 | 27.5 Ų | 27.5 | 11% | 0.11 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.5 | -36 | 179.7 | -69.5 | 173.7 | 0 | 0 | 0 | 112.2 | I256 L257 Q262 L263 T264 W358 Y423 | I256-L260 HydrophobicContact CG2-CD1 3.8Å; I256-L260 HydrophobicContact CG2-CG 4.11Å; I256-L260 WeakPolarHBondContact O-CB 3.26Å; I256-L260 VanDerWaalsContact O-CG 3.26Å; I256-L260 WeakPolarHBondContact O-CG 3.09Å; I256-L260 PolarHBondContact O-N 3.45Å; L257-L260 PolarHBondContact O-N 2.93Å; L260-Q262 VanDerWaalsContact C-N 3.33Å; L260-Q262 PolarHBondContact O-N 3.48Å; L260-L263 CarbonylContact O-C 3.49Å; L260-L263 PolarHBondContact O-N 2.98Å; L260-T264 WeakPolarHBondContact O-CG2 3.29Å; L260-T264 PolarHBondContact O-N 3.29Å; L260-T264 VanDerWaalsContact O-N 3.14Å; L260-W358 HydrophobicContact CB-CH2 4.04Å; L260-W358 HydrophobicContact CB-CZ3 3.74Å; L260-W358 HydrophobicContact CD1-CH2 4.39Å; L260-Y423 HydrophobicContact CD1-CD1 3.57Å; L260-Y423 HydrophobicContact CD1-CE1 4.36Å; L260-Y423 HydrophobicContact CD1-CG 3.86Å |
| 261 | Q | 97.8 | Very high | 96 | Very high | 25 Ų | 25 | 23.7 Ų | 23.7 | 12% | 0.117 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -57.3 | -45.5 | 173.9 | -174.4 | -170.1 | 61.2 | 0 | 0 | 111.5 | L257 M258 T259 T264 F354 W358 G359 P362 | L257-Q261 WeakPolarHBondContact O-CB 3.35Å; L257-Q261 PolarHBondContact O-N 3.15Å; M258-Q261 PolarHBondContact O-N 3.44Å; T259-Q261 VanDerWaalsContact C-N 3.31Å; T259-Q261 PolarHBondContact O-N 2.95Å; Q261-T264 WeakPolarHBondContact O-CB 3.4Å; Q261-T264 WeakPolarHBondContact O-CG2 3.32Å; Q261-T264 PolarHBondContact O-N 3.16Å; Q261-T264 PolarHBondContact O-OG1 3.19Å; Q261-F354 HydrophobicContact CG-CE2 4.21Å; Q261-F354 HydrophobicContact CG-CZ 4.46Å; Q261-W358 HydrophobicContact CB-CE3 4.34Å; Q261-W358 WeakPolarHBondContact CG-O 3.43Å; Q261-W358 PolarHBondContact NE2-O 3.45Å; Q261-G359 PolarHBondContact NE2-O 2.68Å; Q261-P362 HydrophobicContact CB-CG 4.07Å; Q261-P362 HydrophobicContact CG-CG 4.16Å |
| 262 | Q | 97.8 | Very high | 96.2 | Very high | 15 Ų | 15 | 22.9 Ų | 22.9 | 7% | 0.07 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -66.5 | -38.6 | 177.5 | -62.2 | -64.2 | -34.7 | 0 | 0 | 111.8 | M258 T259 L260 T264 G265 N267 G386 V389 G390 | M258-Q262 WeakPolarHBondContact O-CG 3.25Å; M258-Q262 PolarHBondContact O-N 3.35Å; T259-Q262 PolarHBondContact O-N 3.23Å; L260-Q262 VanDerWaalsContact C-N 3.33Å; L260-Q262 PolarHBondContact O-N 3.48Å; Q262-T264 PolarHBondContact O-N 3.06Å; Q262-G265 PolarHBondContact O-N 3.21Å; Q262-N267 PolarHBondContact NE2-ND2 3.06Å; Q262-N267 PolarHBondContact OE1-ND2 3.07Å; Q262-G386 WeakPolarHBondContact CG-O 3.21Å; Q262-V389 HydrophobicContact CB-CB 4.14Å; Q262-V389 HydrophobicContact CB-CG1 3.59Å; Q262-V389 HydrophobicContact CG-CB 4.09Å; Q262-V389 HydrophobicContact CG-CG1 4.12Å; Q262-G390 VanDerWaalsContact OE1-CA 3.29Å |
| 263 | L | 97.4 | Very high | 96.2 | Very high | 52 Ų | 52 | 16 Ų | 16 | 27% | 0.272 | 8% | 0.083 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -3.4 | 178.2 | -65.6 | 175.1 | 0 | 0 | 0 | 114.3 | T259 L260 G265 V393 F413 S416 | T259-L263 HydrophobicContact CG2-CD1 4Å; T259-L263 WeakPolarHBondContact O-CG 3.45Å; T259-L263 PolarHBondContact O-N 3.24Å; T259-L263 VanDerWaalsContact O-N 3.08Å; L260-L263 CarbonylContact O-C 3.49Å; L260-L263 PolarHBondContact O-N 2.98Å; L263-G265 PolarHBondContact O-N 2.95Å; L263-V393 HydrophobicContact CD2-CG2 4.01Å; L263-F413 WeakPolarHBondContact O-CD1 3.41Å; L263-S416 WeakPolarHBondContact O-CB 3.37Å |
| 264 | T | 97.9 | Very high | 96.2 | Very high | 1 Ų | 1 | 15 Ų | 15 | 1% | 0.006 | 8% | 0.077 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -12.5 | 169.5 | 63.8 | 0 | 0 | 0 | 0 | 113.4 | L260 Q261 Q262 M266 L322 H326 W358 | L260-T264 WeakPolarHBondContact O-CG2 3.29Å; L260-T264 PolarHBondContact O-N 3.29Å; L260-T264 VanDerWaalsContact O-N 3.14Å; Q261-T264 WeakPolarHBondContact O-CB 3.4Å; Q261-T264 WeakPolarHBondContact O-CG2 3.32Å; Q261-T264 PolarHBondContact O-N 3.16Å; Q261-T264 PolarHBondContact O-OG1 3.19Å; Q262-T264 PolarHBondContact O-N 3.06Å; T264-M266 PolarHBondContact O-N 3.45Å; T264-M266 PolarHBondContact OG1-N 3.38Å; T264-L322 HydrophobicContact CG2-CD1 4.14Å; T264-H326 PolarHBondContact O-CE1 3.48Å; T264-H326 VanDerWaalsContact O-CE1 3.24Å; T264-H326 PolarHBondContact O-NE2 3.4Å; T264-W358 HydrophobicContact CG2-CB 4.19Å; T264-W358 HydrophobicContact CG2-CD2 4.04Å; T264-W358 HydrophobicContact CG2-CE3 4.3Å; T264-W358 HydrophobicContact CG2-CG 3.99Å |
| 265 | G | 96.9 | Very high | 96 | Very high | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 8% | 0.08 | C | C | . | . | S | Bend | trans | 78.8 | -6.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114 | Q262 L263 N267 V268 I269 | Q262-G265 PolarHBondContact O-N 3.21Å; L263-G265 PolarHBondContact O-N 2.95Å; G265-N267 PolarHBondContact O-N 2.88Å; G265-V268 WeakPolarHBondContact O-CB 3.4Å; G265-V268 PolarHBondContact O-N 3.26Å; G265-V268 VanDerWaalsContact O-N 3.13Å; G265-I269 PolarHBondContact O-N 2.99Å; G265-I269 VanDerWaalsContact O-N 3.15Å |
| 266 | M | 97.2 | Very high | 95.7 | Very high | 2 Ų | 2 | 12.6 Ų | 12.6 | 1% | 0.01 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -67.5 | -32.4 | -174.9 | -70.3 | -61.8 | -45.1 | 0 | 0 | 113.7 | T264 V268 I269 I270 L322 C350 F354 | T264-M266 PolarHBondContact O-N 3.45Å; T264-M266 PolarHBondContact OG1-N 3.38Å; M266-V268 VanDerWaalsContact C-N 3.33Å; M266-I269 HydrophobicContact CE-CD1 4.39Å; M266-I269 PolarHBondContact O-N 2.98Å; M266-I269 HydrophobicContact SD-CD1 3.86Å; M266-I270 VanDerWaalsContact O-CG1 3.3Å; M266-I270 WeakPolarHBondContact O-CG1 3.28Å; M266-I270 PolarHBondContact O-N 3.3Å; M266-L322 HydrophobicContact CG-CD1 4.48Å; M266-L322 HydrophobicContact CG-CD2 4.16Å; M266-L322 HydrophobicContact SD-CD2 3.77Å; M266-C350 HydrophobicContact CE-CB 4.2Å; M266-C350 HydrophobicContact SD-CB 3.71Å; M266-F354 HydrophobicContact CB-CB 4.43Å; M266-F354 HydrophobicContact CB-CD1 4.2Å; M266-F354 HydrophobicContact CB-CD2 3.6Å; M266-F354 HydrophobicContact CB-CE1 4.35Å; M266-F354 HydrophobicContact CB-CE2 3.76Å; M266-F354 HydrophobicContact CB-CG 3.82Å; M266-F354 HydrophobicContact CB-CZ 4.13Å; M266-F354 HydrophobicContact CE-CB 3.82Å; M266-F354 HydrophobicContact CE-CD1 4.45Å; M266-F354 HydrophobicContact CE-CG 4.18Å; M266-F354 HydrophobicContact CG-CB 3.76Å; M266-F354 HydrophobicContact CG-CD1 4.44Å; M266-F354 HydrophobicContact CG-CD2 3.42Å; M266-F354 VanDerWaalsContact CG-CD2 3.42Å; M266-F354 HydrophobicContact CG-CE2 4.08Å; M266-F354 HydrophobicContact CG-CG 3.62Å; M266-F354 HydrophobicContact SD-CB 4.07Å; M266-F354 HydrophobicContact SD-CG 4.48Å |
| 267 | N | 96.3 | Very high | 95.4 | Very high | 21 Ų | 21 | 10 Ų | 10 | 11% | 0.112 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -70.3 | -30.2 | 174.4 | -77.3 | -29.6 | 0 | 0 | 0 | 112.6 | Q262 G265 I269 I270 Y271 I394 | Q262-N267 PolarHBondContact NE2-ND2 3.06Å; Q262-N267 PolarHBondContact OE1-ND2 3.07Å; G265-N267 PolarHBondContact O-N 2.88Å; N267-I269 VanDerWaalsContact C-N 3.34Å; N267-I270 PolarHBondContact O-N 3.33Å; N267-Y271 WeakPolarHBondContact O-CB 3.45Å; N267-Y271 WeakPolarHBondContact O-CD2 3.24Å; N267-Y271 PolarHBondContact O-N 3.49Å; N267-I394 HydrophobicContact CB-CD1 4.38Å |
| 268 | V | 96.5 | Very high | 95 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -62.6 | -46.2 | 169.5 | 164.6 | 0 | 0 | 0 | 0 | 110 | G265 M266 I270 Y271 F272 I276 V393 I394 F397 F413 | G265-V268 WeakPolarHBondContact O-CB 3.4Å; G265-V268 PolarHBondContact O-N 3.26Å; G265-V268 VanDerWaalsContact O-N 3.13Å; M266-V268 VanDerWaalsContact C-N 3.33Å; V268-I270 VanDerWaalsContact C-N 3.27Å; V268-I270 PolarHBondContact O-N 3.44Å; V268-Y271 PolarHBondContact O-N 2.95Å; V268-F272 HydrophobicContact CG1-CD2 4.33Å; V268-F272 PolarHBondContact O-N 2.93Å; V268-I276 HydrophobicContact CG1-CD1 4.01Å; V268-V393 HydrophobicContact CG2-CG1 3.59Å; V268-I394 HydrophobicContact CG2-CD1 3.92Å; V268-F397 HydrophobicContact CB-CD2 4.33Å; V268-F397 HydrophobicContact CG1-CB 4.47Å; V268-F397 HydrophobicContact CG1-CD1 4.29Å; V268-F397 HydrophobicContact CG1-CD2 3.15Å; V268-F397 HydrophobicContact CG1-CE1 4.37Å; V268-F397 HydrophobicContact CG1-CE2 3.26Å; V268-F397 HydrophobicContact CG1-CG 3.73Å; V268-F397 HydrophobicContact CG1-CZ 3.91Å; V268-F397 HydrophobicContact CG2-CB 4.32Å; V268-F397 HydrophobicContact CG2-CD2 4.24Å; V268-F397 HydrophobicContact CG2-CG 4.44Å; V268-F413 HydrophobicContact CB-CE2 4.31Å; V268-F413 HydrophobicContact CB-CZ 4.43Å; V268-F413 HydrophobicContact CG1-CE2 4.44Å; V268-F413 HydrophobicContact CG2-CE2 4.18Å; V268-F413 HydrophobicContact CG2-CZ 3.84Å |
| 269 | I | 95.4 | Very high | 94.3 | Very high | 2 Ų | 2 | 18.6 Ų | 18.6 | 1% | 0.01 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -59.9 | -38.7 | 175.4 | -63.2 | 170 | 0 | 0 | 0 | 111.1 | G265 M266 N267 A273 I276 L347 C350 F410 | G265-I269 PolarHBondContact O-N 2.99Å; G265-I269 VanDerWaalsContact O-N 3.15Å; M266-I269 HydrophobicContact CE-CD1 4.39Å; M266-I269 PolarHBondContact O-N 2.98Å; M266-I269 HydrophobicContact SD-CD1 3.86Å; N267-I269 VanDerWaalsContact C-N 3.34Å; I269-A273 WeakPolarHBondContact O-CA 3.45Å; I269-A273 WeakPolarHBondContact O-CB 3.34Å; I269-A273 PolarHBondContact O-N 3.38Å; I269-I276 HydrophobicContact CB-CD1 4.45Å; I269-I276 HydrophobicContact CG1-CD1 4.19Å; I269-L347 HydrophobicContact CD1-CD2 4.13Å; I269-L347 HydrophobicContact CG1-CD2 4.33Å; I269-L347 HydrophobicContact CG2-CD2 3.9Å; I269-C350 HydrophobicContact CD1-CB 4.44Å; I269-F410 HydrophobicContact CD1-CE1 4.13Å; I269-F410 HydrophobicContact CG1-CE1 4.28Å; I269-F410 HydrophobicContact CG1-CZ 4.27Å |
| 270 | I | 96.6 | Very high | 93.2 | Very high | 8 Ų | 8 | 16.8 Ų | 16.8 | 4% | 0.041 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -73.7 | -33.6 | 178.6 | -68.1 | 163 | 0 | 0 | 0 | 112.4 | F24 I149 Y153 M266 N267 V268 L295 F354 | F24-I270 HydrophobicContact CB-CG2 4.09Å; I149-I270 HydrophobicContact CD1-CD1 4.22Å; I149-I270 HydrophobicContact CD1-CG1 4.49Å; I149-I270 HydrophobicContact CD1-CG2 3.72Å; I149-I270 HydrophobicContact CG1-CG2 4.15Å; I149-I270 HydrophobicContact CG2-CG2 4.3Å; Y153-I270 WeakPolarHBondContact OH-CA 3.39Å; Y153-I270 PolarHBondContact OH-O 3.22Å; M266-I270 VanDerWaalsContact O-CG1 3.3Å; M266-I270 WeakPolarHBondContact O-CG1 3.28Å; M266-I270 PolarHBondContact O-N 3.3Å; N267-I270 PolarHBondContact O-N 3.33Å; V268-I270 VanDerWaalsContact C-N 3.27Å; V268-I270 PolarHBondContact O-N 3.44Å; I270-L295 HydrophobicContact CD1-CD2 4.31Å; I270-L295 HydrophobicContact CG1-CD2 4.39Å; I270-F354 HydrophobicContact CD1-CE1 4.46Å |
| 271 | Y | 95.9 | Very high | 91.9 | Very high | 2 Ų | 2 | 18.9 Ų | 18.9 | 1% | 0.008 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -84.9 | -21.6 | -175.7 | -81.5 | -132.4 | 0 | 0 | 0 | 112.4 | F24 S27 S28 G45 L48 N49 N267 V268 I394 | F24-Y271 HydrophobicContact CB-CE2 4.31Å; F24-Y271 AromaticContact CD1-CE2 3.78Å; F24-Y271 HydrophobicContact CD1-CE2 3.78Å; F24-Y271 AromaticContact CD1-CZ 3.81Å; F24-Y271 VanDerWaalsContact CD1-OH 3.27Å; F24-Y271 WeakPolarHBondContact CD1-OH 3.21Å; F24-Y271 WeakPolarHBondContact CE1-OH 3.42Å; F24-Y271 HydrophobicContact CG-CE2 4.37Å; S27-Y271 CarbonylContact C-O 3.39Å; S27-Y271 VanDerWaalsContact CB-O 3.24Å; S27-Y271 WeakPolarHBondContact CB-O 2.84Å; S28-Y271 WeakPolarHBondContact CA-O 3.42Å; S28-Y271 PolarHBondContact N-O 2.82Å; S28-Y271 VanDerWaalsContact N-O 3.14Å; G45-Y271 WeakPolarHBondContact O-CE1 3.11Å; L48-Y271 HydrophobicContact CB-CE1 4.4Å; L48-Y271 HydrophobicContact CD2-CE1 3.82Å; L48-Y271 VanDerWaalsContact CD2-OH 3.31Å; L48-Y271 WeakPolarHBondContact CD2-OH 3.44Å; L48-Y271 HydrophobicContact CG-CE1 4.4Å; N49-Y271 WeakPolarHBondContact ND2-CE1 3.45Å; N267-Y271 WeakPolarHBondContact O-CB 3.45Å; N267-Y271 WeakPolarHBondContact O-CD2 3.24Å; N267-Y271 PolarHBondContact O-N 3.49Å; V268-Y271 PolarHBondContact O-N 2.95Å; Y271-I394 HydrophobicContact CD1-CD1 3.9Å; Y271-I394 HydrophobicContact CD1-CG1 3.89Å; Y271-I394 HydrophobicContact CD1-CG2 3.8Å; Y271-I394 HydrophobicContact CD2-CD1 4.19Å; Y271-I394 HydrophobicContact CE1-CD1 4.46Å; Y271-I394 HydrophobicContact CE1-CG1 4.07Å; Y271-I394 HydrophobicContact CE1-CG2 4.33Å; Y271-I394 HydrophobicContact CG-CD1 3.72Å; Y271-I394 HydrophobicContact CG-CG1 4.22Å |
| 272 | F | 93.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -135.6 | 29.1 | -174.4 | -54.5 | -76.1 | 0 | 0 | 0 | 111.8 | T31 V268 E274 S275 I276 I394 F397 E398 | T31-F272 HydrophobicContact CG2-CD1 4.47Å; T31-F272 HydrophobicContact CG2-CE1 4.2Å; V268-F272 HydrophobicContact CG1-CD2 4.33Å; V268-F272 PolarHBondContact O-N 2.93Å; F272-E274 PolarHBondContact O-N 3.26Å; F272-S275 PolarHBondContact O-N 3.08Å; F272-I276 HydrophobicContact CB-CD1 4.12Å; F272-I276 HydrophobicContact CB-CG1 4.44Å; F272-I276 WeakPolarHBondContact O-CB 3.43Å; F272-I276 WeakPolarHBondContact O-CD1 3.24Å; F272-I276 VanDerWaalsContact O-CG1 3.28Å; F272-I276 WeakPolarHBondContact O-CG1 3.45Å; F272-I276 PolarHBondContact O-N 3.41Å; F272-I394 HydrophobicContact CE2-CD1 4.25Å; F272-I394 HydrophobicContact CE2-CG2 3.87Å; F272-I394 HydrophobicContact CZ-CG2 3.98Å; F272-F397 HydrophobicContact CB-CD1 4.32Å; F272-F397 HydrophobicContact CB-CE1 3.76Å; F272-F397 HydrophobicContact CB-CZ 4.38Å; F272-F397 HydrophobicContact CD1-CD1 4.21Å; F272-F397 HydrophobicContact CD1-CE1 4.23Å; F272-F397 HydrophobicContact CD2-CB 4.49Å; F272-F397 AromaticContact CD2-CD1 3.28Å; F272-F397 HydrophobicContact CD2-CD1 3.28Å; F272-F397 AromaticContact CD2-CE1 3.63Å; F272-F397 HydrophobicContact CD2-CE1 3.63Å; F272-F397 AromaticContact CD2-CG 3.97Å; F272-F397 HydrophobicContact CD2-CG 3.97Å; F272-F397 HydrophobicContact CE1-CD1 4.33Å; F272-F397 HydrophobicContact CE2-CB 4.02Å; F272-F397 AromaticContact CE2-CD1 3.42Å; F272-F397 HydrophobicContact CE2-CD1 3.42Å; F272-F397 VanDerWaalsContact CE2-CD1 3.42Å; F272-F397 HydrophobicContact CE2-CE1 4.22Å; F272-F397 AromaticContact CE2-CG 3.96Å; F272-F397 HydrophobicContact CE2-CG 3.96Å; F272-F397 AromaticContact CG-CD1 3.7Å; F272-F397 HydrophobicContact CG-CD1 3.7Å; F272-F397 AromaticContact CG-CE1 3.63Å; F272-F397 HydrophobicContact CG-CE1 3.63Å; F272-F397 AromaticContact CZ-CD1 3.97Å; F272-F397 HydrophobicContact CZ-CD1 3.97Å; F272-E398 HydrophobicContact CE1-CG 4.17Å; F272-E398 HydrophobicContact CZ-CG 4.37Å |
| 273 | A | 94 | Very high | 89.9 | Confident | 0 Ų | 0 | 23.5 Ų | 23.5 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -51.1 | -51.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S28 Y153 I269 S275 I276 C277 | S28-A273 PolarHBondContact OG-N 2.67Å; Y153-A273 HydrophobicContact CE1-CB 4.41Å; Y153-A273 HydrophobicContact CE2-CB 3.85Å; Y153-A273 WeakPolarHBondContact OH-CB 3.45Å; I269-A273 WeakPolarHBondContact O-CA 3.45Å; I269-A273 WeakPolarHBondContact O-CB 3.34Å; I269-A273 PolarHBondContact O-N 3.38Å; A273-S275 PolarHBondContact O-N 3.11Å; A273-I276 PolarHBondContact O-N 2.92Å; A273-C277 WeakPolarHBondContact O-CB 3.48Å; A273-C277 PolarHBondContact O-N 3.13Å; A273-C277 PolarHBondContact O-SG 3.32Å |
| 274 | E | 91.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -66.5 | -41.4 | -177.1 | 6 | -69 | -108.4 | 0 | 0 | 110.6 | S28 A29 L32 F272 I276 C277 L278 S284 Y285 | S28-E274 WeakPolarHBondContact CB-OE2 3.3Å; S28-E274 VanDerWaalsContact OG-CG 3.3Å; S28-E274 WeakPolarHBondContact OG-CG 3.41Å; S28-E274 PolarHBondContact OG-N 2.8Å; S28-E274 PolarHBondContact OG-OE2 3.39Å; A29-E274 HydrophobicContact CB-CG 4.34Å; L32-E274 HydrophobicContact CD1-CB 3.65Å; L32-E274 HydrophobicContact CD1-CG 4.26Å; F272-E274 PolarHBondContact O-N 3.26Å; E274-I276 VanDerWaalsContact C-N 3.29Å; E274-I276 PolarHBondContact O-N 3.3Å; E274-C277 WeakPolarHBondContact O-CB 3.16Å; E274-C277 PolarHBondContact O-N 3.14Å; E274-L278 PolarHBondContact O-N 3.48Å; E274-L278 VanDerWaalsContact O-N 3.13Å; E274-S284 VanDerWaalsContact CA-OG 3.28Å; E274-S284 WeakPolarHBondContact CA-OG 3.34Å; E274-S284 WeakPolarHBondContact CB-OG 3.41Å; E274-S284 PolarHBondContact O-OG 3.38Å; E274-Y285 HydrophobicContact CG-CD1 4.38Å |
| 275 | S | 89.7 | Confident | 88.9 | Confident | 13 Ų | 13 | 24.5 Ų | 24.5 | 9% | 0.091 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.4 | -39.4 | 172.8 | -56.8 | 0 | 0 | 0 | 0 | 112.4 | L32 F272 A273 L278 | L32-S275 WeakPolarHBondContact CD2-OG 3.32Å; F272-S275 PolarHBondContact O-N 3.08Å; A273-S275 PolarHBondContact O-N 3.11Å; S275-L278 WeakPolarHBondContact O-CB 3.23Å; S275-L278 PolarHBondContact O-N 2.92Å |
| 276 | I | 90.7 | Very high | 88.7 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -69.3 | -37.1 | 177.6 | -69.8 | 160.6 | 0 | 0 | 0 | 111.4 | V268 I269 F272 A273 E274 L278 F279 L347 F397 F410 | V268-I276 HydrophobicContact CG1-CD1 4.01Å; I269-I276 HydrophobicContact CB-CD1 4.45Å; I269-I276 HydrophobicContact CG1-CD1 4.19Å; F272-I276 HydrophobicContact CB-CD1 4.12Å; F272-I276 HydrophobicContact CB-CG1 4.44Å; F272-I276 WeakPolarHBondContact O-CB 3.43Å; F272-I276 WeakPolarHBondContact O-CD1 3.24Å; F272-I276 VanDerWaalsContact O-CG1 3.28Å; F272-I276 WeakPolarHBondContact O-CG1 3.45Å; F272-I276 PolarHBondContact O-N 3.41Å; A273-I276 PolarHBondContact O-N 2.92Å; E274-I276 VanDerWaalsContact C-N 3.29Å; E274-I276 PolarHBondContact O-N 3.3Å; I276-L278 PolarHBondContact O-N 3.46Å; I276-F279 PolarHBondContact O-N 3.07Å; I276-L347 HydrophobicContact CG2-CD1 4.22Å; I276-L347 HydrophobicContact CG2-CD2 4.03Å; I276-F397 HydrophobicContact CD1-CZ 4.1Å; I276-F397 HydrophobicContact CG1-CZ 3.94Å; I276-F410 HydrophobicContact CD1-CZ 4.34Å; I276-F410 HydrophobicContact CG2-CZ 4.27Å |
| 277 | C | 89.8 | Confident | 88.5 | Confident | 1 Ų | 1 | 28.9 Ų | 28.9 | 1% | 0.007 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.2 | -32.4 | 173.5 | -74 | 0 | 0 | 0 | 0 | 112.6 | A273 E274 F279 G280 L282 C287 I291 | A273-C277 WeakPolarHBondContact O-CB 3.48Å; A273-C277 PolarHBondContact O-N 3.13Å; A273-C277 PolarHBondContact O-SG 3.32Å; E274-C277 WeakPolarHBondContact O-CB 3.16Å; E274-C277 PolarHBondContact O-N 3.14Å; C277-F279 PolarHBondContact O-N 3.42Å; C277-G280 PolarHBondContact O-N 2.97Å; C277-G280 VanDerWaalsContact O-N 3.16Å; C277-L282 PolarHBondContact O-N 2.95Å; C277-C287 HydrophobicContact CB-CB 3.49Å; C277-C287 VanDerWaalsContact CB-CB 3.49Å; C277-C287 WeakPolarHBondContact CB-SG 3.44Å; C277-C287 WeakPolarHBondContact SG-CB 3.12Å; C277-C287 CovalentContact SG-SG 2.03Å; C277-C287 PolarHBondContact SG-SG 3.04Å; C277-I291 VanDerWaalsContact SG-CD1 3.56Å |
| 278 | L | 87.5 | Confident | 88.3 | Confident | 89 Ų | 89 | 27.9 Ų | 27.9 | 47% | 0.466 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -65 | -34.7 | 176.4 | -72.6 | 175.4 | 0 | 0 | 0 | 113.1 | L32 E274 S275 I276 G280 G281 | L32-L278 HydrophobicContact CD1-CD1 3.86Å; L32-L278 HydrophobicContact CD2-CD1 3.68Å; L32-L278 HydrophobicContact CG-CD1 4.48Å; E274-L278 PolarHBondContact O-N 3.48Å; E274-L278 VanDerWaalsContact O-N 3.13Å; S275-L278 WeakPolarHBondContact O-CB 3.23Å; S275-L278 PolarHBondContact O-N 2.92Å; I276-L278 PolarHBondContact O-N 3.46Å; L278-G280 PolarHBondContact O-N 3.4Å; L278-G281 PolarHBondContact O-N 2.85Å |
| 279 | F | 82 | Confident | 88.3 | Confident | 98 Ų | 98 | 28.4 Ų | 28.4 | 43% | 0.43 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -60.8 | -26.2 | 174.6 | -72.1 | -68.8 | 0 | 0 | 0 | 112.5 | I276 C277 G281 F329 I401 V406 | I276-F279 PolarHBondContact O-N 3.07Å; C277-F279 PolarHBondContact O-N 3.42Å; F279-G281 VanDerWaalsContact C-N 3.31Å; F279-F329 HydrophobicContact CB-CZ 4.5Å; F279-I401 HydrophobicContact CE2-CD1 4.23Å; F279-I401 HydrophobicContact CZ-CD1 4.01Å; F279-V406 HydrophobicContact CD1-CG1 4.04Å; F279-V406 HydrophobicContact CD2-CB 4.48Å; F279-V406 HydrophobicContact CD2-CG1 4.35Å; F279-V406 HydrophobicContact CD2-CG2 4.18Å; F279-V406 HydrophobicContact CE1-CB 4.49Å; F279-V406 HydrophobicContact CE1-CG1 4.29Å; F279-V406 HydrophobicContact CE2-CB 4.34Å; F279-V406 HydrophobicContact CE2-CG2 4.13Å; F279-V406 HydrophobicContact CG-CG1 4.09Å; F279-V406 HydrophobicContact CZ-CB 4.35Å |
| 280 | G | 74.7 | Confident | 88.2 | Confident | 3 Ų | 3 | 30.4 Ų | 30.4 | 3% | 0.031 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | 0.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | C277 L278 L282 S340 H343 | C277-G280 PolarHBondContact O-N 2.97Å; C277-G280 VanDerWaalsContact O-N 3.16Å; L278-G280 PolarHBondContact O-N 3.4Å; G280-L282 VanDerWaalsContact C-N 3.26Å; G280-L282 PolarHBondContact O-N 3.46Å; G280-S340 VanDerWaalsContact O-CA 3.26Å; G280-S340 WeakPolarHBondContact O-CA 3.24Å; G280-S340 WeakPolarHBondContact O-CB 3.43Å; G280-H343 VanDerWaalsContact CA-CG 3.42Å |
| 281 | G | 71.5 | Confident | 88.2 | Confident | 64 Ų | 64 | 30.3 Ų | 30.3 | 66% | 0.66 | 17% | 0.172 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 68.6 | 21.6 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | L278 F279 | L278-G281 PolarHBondContact O-N 2.85Å; F279-G281 VanDerWaalsContact C-N 3.31Å |
| 282 | L | 74.8 | Confident | 88.3 | Confident | 28 Ų | 28 | 30.2 Ų | 30.2 | 15% | 0.147 | 17% | 0.171 | C | C | . | . | S | Bend | trans | -91 | 160.3 | -179.8 | -72.1 | 165.1 | 0 | 0 | 0 | 112.2 | C277 G280 S284 C287 S340 H343 Q344 | C277-L282 PolarHBondContact O-N 2.95Å; G280-L282 VanDerWaalsContact C-N 3.26Å; G280-L282 PolarHBondContact O-N 3.46Å; L282-S284 PolarHBondContact O-N 3.46Å; L282-C287 HydrophobicContact CB-CB 4.19Å; L282-C287 HydrophobicContact CD1-CB 4.26Å; L282-S340 WeakPolarHBondContact CD1-O 3.41Å; L282-H343 HydrophobicContact CD1-CB 4.22Å; L282-Q344 HydrophobicContact CD1-CB 3.74Å; L282-Q344 HydrophobicContact CD1-CG 4.36Å |
| 283 | V | 77.7 | Confident | 88.5 | Confident | 109 Ų | 109 | 34 Ų | 34 | 66% | 0.661 | 19% | 0.192 | S | C | * | . | trans | -64.8 | 109.3 | 164.7 | -179.4 | 0 | 0 | 0 | 0 | 108.5 | Y285 Q286 C287 | V283-Y285 PolarHBondContact O-N 3.36Å; V283-Q286 HydrophobicContact CG1-CB 4.32Å; V283-Q286 PolarHBondContact O-N 3.43Å; V283-C287 VanDerWaalsContact O-CB 3.32Å; V283-C287 WeakPolarHBondContact O-CB 3.36Å; V283-C287 PolarHBondContact O-N 2.96Å | ||
| 284 | S | 84.6 | Confident | 88.7 | Confident | 9 Ų | 9 | 35.6 Ų | 35.6 | 6% | 0.063 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -47.9 | -58.6 | -171.6 | -168.3 | 0 | 0 | 0 | 0 | 114.3 | L32 E274 L282 C287 G288 | L32-S284 WeakPolarHBondContact CD1-OG 3.13Å; E274-S284 VanDerWaalsContact CA-OG 3.28Å; E274-S284 WeakPolarHBondContact CA-OG 3.34Å; E274-S284 WeakPolarHBondContact CB-OG 3.41Å; E274-S284 PolarHBondContact O-OG 3.38Å; L282-S284 PolarHBondContact O-N 3.46Å; S284-C287 PolarHBondContact O-N 2.77Å; S284-G288 PolarHBondContact O-N 2.89Å |
| 285 | Y | 91.1 | Very high | 89 | Confident | 65 Ų | 65 | 35.8 Ų | 35.8 | 26% | 0.255 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -68.1 | -40.9 | -174.8 | -54.8 | -68.5 | 0 | 0 | 0 | 113.9 | A29 Q33 A156 E274 V283 C287 G288 S289 | A29-Y285 HydrophobicContact CB-CE1 4.25Å; Q33-Y285 HydrophobicContact CG-CE1 4.49Å; Q33-Y285 WeakPolarHBondContact CG-OH 3.29Å; A156-Y285 HydrophobicContact CB-CD1 4.26Å; E274-Y285 HydrophobicContact CG-CD1 4.38Å; V283-Y285 PolarHBondContact O-N 3.36Å; Y285-C287 VanDerWaalsContact C-N 3.33Å; Y285-C287 PolarHBondContact O-N 3.07Å; Y285-G288 PolarHBondContact O-N 3.11Å; Y285-S289 WeakPolarHBondContact O-CB 3.08Å; Y285-S289 PolarHBondContact O-N 3.09Å |
| 286 | Q | 92 | Very high | 89.4 | Confident | 91 Ų | 91 | 37.5 Ų | 37.5 | 43% | 0.425 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -67.2 | -38.8 | 178.2 | -172.5 | 63.1 | 43.1 | 0 | 0 | 111 | V283 N290 | V283-Q286 HydrophobicContact CG1-CB 4.32Å; V283-Q286 PolarHBondContact O-N 3.43Å; Q286-N290 PolarHBondContact NE2-OD1 2.9Å; Q286-N290 VanDerWaalsContact NE2-OD1 3.14Å; Q286-N290 WeakPolarHBondContact O-CB 3.37Å; Q286-N290 PolarHBondContact O-N 3.27Å; Q286-N290 PolarHBondContact O-ND2 3.46Å; Q286-N290 VanDerWaalsContact O-ND2 3.13Å |
| 287 | C | 92 | Very high | 89.8 | Confident | 3 Ų | 3 | 41.8 Ų | 41.8 | 2% | 0.02 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.4 | -48.6 | 174.9 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | C277 L282 V283 S284 Y285 S289 N290 I291 | C277-C287 HydrophobicContact CB-CB 3.49Å; C277-C287 VanDerWaalsContact CB-CB 3.49Å; C277-C287 WeakPolarHBondContact CB-SG 3.44Å; C277-C287 WeakPolarHBondContact SG-CB 3.12Å; C277-C287 CovalentContact SG-SG 2.03Å; C277-C287 PolarHBondContact SG-SG 3.04Å; L282-C287 HydrophobicContact CB-CB 4.19Å; L282-C287 HydrophobicContact CD1-CB 4.26Å; V283-C287 VanDerWaalsContact O-CB 3.32Å; V283-C287 WeakPolarHBondContact O-CB 3.36Å; V283-C287 PolarHBondContact O-N 2.96Å; S284-C287 PolarHBondContact O-N 2.77Å; Y285-C287 VanDerWaalsContact C-N 3.33Å; Y285-C287 PolarHBondContact O-N 3.07Å; C287-S289 PolarHBondContact O-N 3.45Å; C287-N290 PolarHBondContact O-N 3.04Å; C287-I291 WeakPolarHBondContact O-CD1 3.48Å; C287-I291 VanDerWaalsContact O-CG1 3.29Å; C287-I291 WeakPolarHBondContact O-CG1 3.18Å; C287-I291 PolarHBondContact O-N 2.97Å |
| 288 | G | 93.2 | Very high | 90.2 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -53.2 | -55.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y153 S284 Y285 N290 I291 G292 | Y153-G288 VanDerWaalsContact CD2-C 3.48Å; Y153-G288 WeakPolarHBondContact CD2-O 3.46Å; S284-G288 PolarHBondContact O-N 2.89Å; Y285-G288 PolarHBondContact O-N 3.11Å; G288-N290 VanDerWaalsContact C-N 3.3Å; G288-N290 PolarHBondContact O-N 3.18Å; G288-I291 WeakPolarHBondContact O-CB 3.38Å; G288-I291 PolarHBondContact O-N 3.1Å; G288-I291 VanDerWaalsContact O-N 3.08Å; G288-G292 PolarHBondContact O-N 2.91Å |
| 289 | S | 95.2 | Very high | 90.7 | Very high | 11 Ų | 11 | 38 Ų | 38 | 8% | 0.077 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.8 | -37.4 | 179.3 | -173.2 | 0 | 0 | 0 | 0 | 113.5 | T154 Y285 C287 G292 L293 | T154-S289 PolarHBondContact OG1-OG 3.13Å; Y285-S289 WeakPolarHBondContact O-CB 3.08Å; Y285-S289 PolarHBondContact O-N 3.09Å; C287-S289 PolarHBondContact O-N 3.45Å; S289-G292 PolarHBondContact O-N 3.31Å; S289-L293 WeakPolarHBondContact O-CB 3.3Å; S289-L293 PolarHBondContact O-N 3.14Å |
| 290 | N | 95.3 | Very high | 91.4 | Very high | 44 Ų | 44 | 36.7 Ų | 36.7 | 24% | 0.235 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67.2 | -40.8 | 176.6 | -70.8 | -22.1 | 0 | 0 | 0 | 111.7 | Q286 C287 G288 L293 C294 Q344 | Q286-N290 PolarHBondContact NE2-OD1 2.9Å; Q286-N290 VanDerWaalsContact NE2-OD1 3.14Å; Q286-N290 WeakPolarHBondContact O-CB 3.37Å; Q286-N290 PolarHBondContact O-N 3.27Å; Q286-N290 PolarHBondContact O-ND2 3.46Å; Q286-N290 VanDerWaalsContact O-ND2 3.13Å; C287-N290 PolarHBondContact O-N 3.04Å; G288-N290 VanDerWaalsContact C-N 3.3Å; G288-N290 PolarHBondContact O-N 3.18Å; N290-L293 PolarHBondContact O-N 3.15Å; N290-C294 PolarHBondContact O-N 2.86Å; N290-C294 PolarHBondContact O-SG 3.24Å; N290-Q344 VanDerWaalsContact CB-NE2 3.26Å; N290-Q344 PolarHBondContact ND2-NE2 3.08Å |
| 291 | I | 95.3 | Very high | 92.5 | Very high | 6 Ų | 6 | 40 Ų | 40 | 3% | 0.031 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63 | -46.7 | 175.1 | -64.7 | 159.5 | 0 | 0 | 0 | 110 | C277 C287 G288 L293 C294 L295 L347 I348 A351 | C277-I291 VanDerWaalsContact SG-CD1 3.56Å; C287-I291 WeakPolarHBondContact O-CD1 3.48Å; C287-I291 VanDerWaalsContact O-CG1 3.29Å; C287-I291 WeakPolarHBondContact O-CG1 3.18Å; C287-I291 PolarHBondContact O-N 2.97Å; G288-I291 WeakPolarHBondContact O-CB 3.38Å; G288-I291 PolarHBondContact O-N 3.1Å; G288-I291 VanDerWaalsContact O-N 3.08Å; I291-L293 VanDerWaalsContact C-N 3.32Å; I291-L293 PolarHBondContact O-N 3.25Å; I291-C294 PolarHBondContact O-N 3.03Å; I291-L295 WeakPolarHBondContact O-CB 3.33Å; I291-L295 PolarHBondContact O-N 2.7Å; I291-L347 HydrophobicContact CD1-CB 3.57Å; I291-L347 HydrophobicContact CD1-CD1 3.43Å; I291-L347 VanDerWaalsContact CD1-CD1 3.43Å; I291-L347 HydrophobicContact CD1-CG 4Å; I291-L347 HydrophobicContact CG1-CB 3.78Å; I291-L347 HydrophobicContact CG1-CD1 4.49Å; I291-I348 HydrophobicContact CG1-CG1 4.49Å; I291-A351 HydrophobicContact CG2-CB 4.05Å |
| 292 | G | 97.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.2 | -44 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G288 S289 L295 F296 | G288-G292 PolarHBondContact O-N 2.91Å; S289-G292 PolarHBondContact O-N 3.31Å; G292-L295 WeakPolarHBondContact O-CB 3.39Å; G292-L295 PolarHBondContact O-N 2.59Å; G292-F296 WeakPolarHBondContact O-CB 3.48Å; G292-F296 PolarHBondContact O-N 3.45Å |
| 293 | L | 98.1 | Very high | 94.6 | Very high | 81 Ų | 81 | 36.1 Ų | 36.1 | 42% | 0.424 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -63.3 | -46.2 | 178.5 | -176.4 | 63.9 | 0 | 0 | 0 | 112.1 | V150 S289 N290 I291 L295 F296 I297 | V150-L293 HydrophobicContact CG2-CB 4.09Å; S289-L293 WeakPolarHBondContact O-CB 3.3Å; S289-L293 PolarHBondContact O-N 3.14Å; N290-L293 PolarHBondContact O-N 3.15Å; I291-L293 VanDerWaalsContact C-N 3.32Å; I291-L293 PolarHBondContact O-N 3.25Å; L293-L295 VanDerWaalsContact C-N 3.33Å; L293-L295 PolarHBondContact O-N 3.3Å; L293-F296 PolarHBondContact O-N 3.05Å; L293-I297 HydrophobicContact CD1-CD1 4.09Å; L293-I297 HydrophobicContact CD1-CG1 4.42Å; L293-I297 HydrophobicContact CG-CD1 3.99Å; L293-I297 WeakPolarHBondContact O-CG1 3.44Å; L293-I297 PolarHBondContact O-N 2.92Å |
| 294 | C | 98 | Very high | 95.4 | Very high | 33 Ų | 33 | 37.7 Ų | 37.7 | 22% | 0.223 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -63.8 | -38.5 | 175.8 | -69.6 | 0 | 0 | 0 | 0 | 112 | N290 I291 S298 I348 I352 | N290-C294 PolarHBondContact O-N 2.86Å; N290-C294 PolarHBondContact O-SG 3.24Å; I291-C294 PolarHBondContact O-N 3.03Å; C294-S298 WeakPolarHBondContact O-CB 3.34Å; C294-S298 PolarHBondContact O-N 3.13Å; C294-S298 PolarHBondContact O-OG 3.28Å; C294-I348 HydrophobicContact CB-CG1 4.44Å; C294-I348 HydrophobicContact CB-CG2 3.97Å; C294-I352 HydrophobicContact CB-CG1 4.47Å |
| 295 | L | 98.3 | Very high | 95.9 | Very high | 4 Ų | 4 | 38.6 Ų | 38.6 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.7 | -45.4 | 175.1 | -174.6 | 68.5 | 0 | 0 | 0 | 111.2 | T146 I149 I270 I291 G292 L293 S299 A351 F354 A355 | T146-L295 HydrophobicContact CG2-CD1 4.35Å; T146-L295 HydrophobicContact CG2-CD2 3.93Å; T146-L295 HydrophobicContact CG2-CG 3.65Å; I149-L295 HydrophobicContact CD1-CD2 4.11Å; I149-L295 HydrophobicContact CG2-CD2 4.39Å; I270-L295 HydrophobicContact CD1-CD2 4.31Å; I270-L295 HydrophobicContact CG1-CD2 4.39Å; I291-L295 WeakPolarHBondContact O-CB 3.33Å; I291-L295 PolarHBondContact O-N 2.7Å; G292-L295 WeakPolarHBondContact O-CB 3.39Å; G292-L295 PolarHBondContact O-N 2.59Å; L293-L295 VanDerWaalsContact C-N 3.33Å; L293-L295 PolarHBondContact O-N 3.3Å; L295-S299 WeakPolarHBondContact O-CB 3.44Å; L295-S299 PolarHBondContact O-N 3.36Å; L295-A351 HydrophobicContact CB-CB 4.01Å; L295-A351 HydrophobicContact CD1-CB 4.01Å; L295-A351 WeakPolarHBondContact CD1-O 3.5Å; L295-F354 HydrophobicContact CD1-CD1 4.34Å; L295-A355 HydrophobicContact CD1-CB 4.03Å |
| 296 | F | 98.5 | Very high | 95.9 | Very high | 49 Ų | 49 | 35.5 Ų | 35.5 | 22% | 0.215 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.6 | -53.2 | 178.4 | 172.6 | -120.2 | 0 | 0 | 0 | 112.4 | V143 C147 V150 G292 L293 S298 S299 I300 | V143-F296 HydrophobicContact CG1-CE2 3.9Å; C147-F296 HydrophobicContact CB-CD2 3.73Å; C147-F296 HydrophobicContact CB-CE2 3.52Å; C147-F296 HydrophobicContact CB-CZ 4.31Å; V150-F296 HydrophobicContact CB-CB 4.33Å; V150-F296 HydrophobicContact CG1-CB 3.86Å; V150-F296 HydrophobicContact CG1-CD1 4.28Å; V150-F296 HydrophobicContact CG1-CG 4.04Å; G292-F296 WeakPolarHBondContact O-CB 3.48Å; G292-F296 PolarHBondContact O-N 3.45Å; L293-F296 PolarHBondContact O-N 3.05Å; F296-S298 PolarHBondContact O-N 3.28Å; F296-S299 WeakPolarHBondContact O-CB 3.44Å; F296-S299 PolarHBondContact O-N 3.15Å; F296-S299 PolarHBondContact O-OG 3.5Å; F296-I300 HydrophobicContact CE1-CD1 4.05Å; F296-I300 HydrophobicContact CE2-CD1 4.02Å; F296-I300 HydrophobicContact CE2-CG1 4.31Å; F296-I300 HydrophobicContact CZ-CD1 3.73Å; F296-I300 HydrophobicContact CZ-CG1 4.5Å; F296-I300 PolarHBondContact O-N 3.43Å |
| 297 | I | 98.3 | Very high | 95.8 | Very high | 89 Ų | 89 | 37.3 Ų | 37.3 | 46% | 0.456 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -57.5 | -42.8 | 177.9 | -66.5 | 169.5 | 0 | 0 | 0 | 110.4 | L293 S299 I300 V301 | L293-I297 HydrophobicContact CD1-CD1 4.09Å; L293-I297 HydrophobicContact CD1-CG1 4.42Å; L293-I297 HydrophobicContact CG-CD1 3.99Å; L293-I297 WeakPolarHBondContact O-CG1 3.44Å; L293-I297 PolarHBondContact O-N 2.92Å; I297-S299 VanDerWaalsContact C-N 3.31Å; I297-S299 PolarHBondContact O-N 2.89Å; I297-I300 WeakPolarHBondContact O-CB 3.34Å; I297-I300 PolarHBondContact O-N 3.32Å; I297-I300 VanDerWaalsContact O-N 3.15Å; I297-V301 PolarHBondContact O-N 3.34Å; I297-V301 VanDerWaalsContact O-N 3.11Å |
| 298 | S | 98.2 | Very high | 95.7 | Very high | 11 Ų | 11 | 45.5 Ų | 45.5 | 8% | 0.077 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -67.5 | -32.1 | 179.6 | -57.7 | 0 | 0 | 0 | 0 | 112.8 | C294 F296 I300 V301 S302 I352 | C294-S298 WeakPolarHBondContact O-CB 3.34Å; C294-S298 PolarHBondContact O-N 3.13Å; C294-S298 PolarHBondContact O-OG 3.28Å; F296-S298 PolarHBondContact O-N 3.28Å; S298-I300 VanDerWaalsContact C-N 3.3Å; S298-I300 PolarHBondContact O-N 3.1Å; S298-V301 PolarHBondContact O-N 3.48Å; S298-S302 WeakPolarHBondContact O-CB 3.44Å; S298-S302 PolarHBondContact O-N 3.22Å; S298-I352 VanDerWaalsContact OG-CG1 3.26Å; S298-I352 WeakPolarHBondContact OG-CG1 3.38Å |
| 299 | S | 97.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.9 | -33.8 | 173.4 | 73.8 | 0 | 0 | 0 | 0 | 112.1 | V143 T146 L295 F296 I297 S302 | V143-S299 WeakPolarHBondContact CA-OG 3.49Å; V143-S299 WeakPolarHBondContact CG2-O 3.09Å; T146-S299 WeakPolarHBondContact OG1-CB 3.36Å; T146-S299 PolarHBondContact OG1-OG 2.93Å; L295-S299 WeakPolarHBondContact O-CB 3.44Å; L295-S299 PolarHBondContact O-N 3.36Å; F296-S299 WeakPolarHBondContact O-CB 3.44Å; F296-S299 PolarHBondContact O-N 3.15Å; F296-S299 PolarHBondContact O-OG 3.5Å; I297-S299 VanDerWaalsContact C-N 3.31Å; I297-S299 PolarHBondContact O-N 2.89Å; S299-S302 WeakPolarHBondContact O-CB 3.36Å; S299-S302 PolarHBondContact O-N 3.26Å; S299-S302 PolarHBondContact O-OG 3.01Å |
| 300 | I | 97.8 | Very high | 95.5 | Very high | 71 Ų | 71 | 51.2 Ų | 51.2 | 36% | 0.364 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -66.3 | -45.6 | 173 | -61.6 | 170.8 | 0 | 0 | 0 | 109.8 | V143 F296 I297 S298 S302 V303 | V143-I300 HydrophobicContact CG1-CG1 3.88Å; V143-I300 HydrophobicContact CG2-CG1 4.35Å; F296-I300 HydrophobicContact CE1-CD1 4.05Å; F296-I300 HydrophobicContact CE2-CD1 4.02Å; F296-I300 HydrophobicContact CE2-CG1 4.31Å; F296-I300 HydrophobicContact CZ-CD1 3.73Å; F296-I300 HydrophobicContact CZ-CG1 4.5Å; F296-I300 PolarHBondContact O-N 3.43Å; I297-I300 WeakPolarHBondContact O-CB 3.34Å; I297-I300 PolarHBondContact O-N 3.32Å; I297-I300 VanDerWaalsContact O-N 3.15Å; S298-I300 VanDerWaalsContact C-N 3.3Å; S298-I300 PolarHBondContact O-N 3.1Å; I300-S302 PolarHBondContact O-N 3.27Å; I300-V303 WeakPolarHBondContact O-CB 3.5Å; I300-V303 PolarHBondContact O-N 3.1Å |
| 301 | V | 97.3 | Very high | 95.3 | Very high | 72 Ų | 72 | 49.3 Ų | 49.3 | 44% | 0.436 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -59.7 | -37.3 | 175.2 | 176 | 0 | 0 | 0 | 0 | 111.1 | I297 S298 V303 F304 V305 | I297-V301 PolarHBondContact O-N 3.34Å; I297-V301 VanDerWaalsContact O-N 3.11Å; S298-V301 PolarHBondContact O-N 3.48Å; V301-V303 PolarHBondContact O-N 3.03Å; V301-V303 VanDerWaalsContact O-N 3.17Å; V301-F304 PolarHBondContact O-N 3.17Å; V301-V305 HydrophobicContact CG1-CG2 3.9Å; V301-V305 WeakPolarHBondContact O-CG2 3.08Å; V301-V305 PolarHBondContact O-N 2.9Å; V301-V305 VanDerWaalsContact O-N 3.15Å |
| 302 | S | 96.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.3 | -32.1 | 179.9 | 86.1 | 0 | 0 | 0 | 0 | 113 | S298 S299 I300 F304 V305 V306 A355 | S298-S302 WeakPolarHBondContact O-CB 3.44Å; S298-S302 PolarHBondContact O-N 3.22Å; S299-S302 WeakPolarHBondContact O-CB 3.36Å; S299-S302 PolarHBondContact O-N 3.26Å; S299-S302 PolarHBondContact O-OG 3.01Å; I300-S302 PolarHBondContact O-N 3.27Å; S302-F304 PolarHBondContact O-N 3.22Å; S302-V305 PolarHBondContact O-N 2.8Å; S302-V306 WeakPolarHBondContact O-CB 3.49Å; S302-V306 VanDerWaalsContact O-CG2 3.27Å; S302-V306 WeakPolarHBondContact O-CG2 3.44Å; S302-V306 PolarHBondContact O-N 3.15Å; S302-A355 WeakPolarHBondContact CB-O 3.14Å; S302-A355 PolarHBondContact OG-O 3.12Å |
| 303 | V | 95.3 | Very high | 95.1 | Very high | 10 Ų | 10 | 56.9 Ų | 56.9 | 6% | 0.061 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -56.5 | -37.9 | 177.5 | 179.3 | 0 | 0 | 0 | 0 | 111.3 | L136 L140 V143 I300 V301 R307 | L136-V303 HydrophobicContact CD1-CG1 3.43Å; L136-V303 VanDerWaalsContact CD1-CG1 3.43Å; L140-V303 HydrophobicContact CD2-CG2 4.23Å; V143-V303 HydrophobicContact CG2-CG2 3.81Å; I300-V303 WeakPolarHBondContact O-CB 3.5Å; I300-V303 PolarHBondContact O-N 3.1Å; V301-V303 PolarHBondContact O-N 3.03Å; V301-V303 VanDerWaalsContact O-N 3.17Å; V303-R307 WeakPolarHBondContact O-CD 3.25Å; V303-R307 WeakPolarHBondContact O-CG 3.42Å |
| 304 | F | 94.7 | Very high | 95 | Very high | 142 Ų | 142 | 54.2 Ų | 54.2 | 62% | 0.623 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -84.2 | -40.6 | 178.1 | -57.7 | -82.5 | 0 | 0 | 0 | 112.1 | V301 S302 R307 K308 | V301-F304 PolarHBondContact O-N 3.17Å; S302-F304 PolarHBondContact O-N 3.22Å; F304-R307 PolarHBondContact O-N 3.26Å; F304-K308 PolarHBondContact O-N 3.2Å |
| 305 | V | 94 | Very high | 95 | Very high | 28 Ų | 28 | 52.6 Ų | 52.6 | 17% | 0.17 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.7 | -49.1 | -179 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | V301 S302 R307 K308 F309 L314 | V301-V305 HydrophobicContact CG1-CG2 3.9Å; V301-V305 WeakPolarHBondContact O-CG2 3.08Å; V301-V305 PolarHBondContact O-N 2.9Å; V301-V305 VanDerWaalsContact O-N 3.15Å; S302-V305 PolarHBondContact O-N 2.8Å; V305-R307 PolarHBondContact O-N 3.42Å; V305-K308 PolarHBondContact O-N 2.89Å; V305-K308 VanDerWaalsContact O-N 3.1Å; V305-F309 HydrophobicContact CB-CD2 4.4Å; V305-F309 HydrophobicContact CG1-CD2 3.84Å; V305-F309 HydrophobicContact CG1-CE2 4.44Å; V305-F309 WeakPolarHBondContact O-CD2 3.45Å; V305-F309 PolarHBondContact O-N 3.01Å; V305-L314 HydrophobicContact CG1-CD1 4.05Å; V305-L314 HydrophobicContact CG1-CD2 3.53Å; V305-L314 HydrophobicContact CG1-CG 4.45Å |
| 306 | V | 92 | Very high | 94.9 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.7 | -26.2 | -177.5 | 173.3 | 0 | 0 | 0 | 0 | 112.5 | V135 S302 W311 L314 P360 L361 L364 | V135-V306 HydrophobicContact CG1-CG1 4.47Å; S302-V306 WeakPolarHBondContact O-CB 3.49Å; S302-V306 VanDerWaalsContact O-CG2 3.27Å; S302-V306 WeakPolarHBondContact O-CG2 3.44Å; S302-V306 PolarHBondContact O-N 3.15Å; V306-W311 HydrophobicContact CG1-CZ2 4.4Å; V306-W311 PolarHBondContact O-NE1 3.24Å; V306-L314 HydrophobicContact CG2-CD1 4.28Å; V306-P360 HydrophobicContact CG2-CG 4.14Å; V306-L361 HydrophobicContact CB-CD2 4.48Å; V306-L361 HydrophobicContact CG1-CD2 3.7Å; V306-L361 HydrophobicContact CG2-CD2 4.01Å; V306-L361 HydrophobicContact CG2-CG 4.49Å; V306-L364 HydrophobicContact CG1-CD1 3.53Å |
| 307 | R | 89.9 | Confident | 94.9 | Very high | 130 Ų | 130 | 56.4 Ų | 56.4 | 49% | 0.491 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -81.2 | -27.3 | 176.3 | -68.6 | 176.3 | 66.2 | -171.7 | 1 | 113.1 | V135 V303 F304 V305 | V135-R307 HydrophobicContact CG1-CG 4.29Å; V303-R307 WeakPolarHBondContact O-CD 3.25Å; V303-R307 WeakPolarHBondContact O-CG 3.42Å; F304-R307 PolarHBondContact O-N 3.26Å; V305-R307 PolarHBondContact O-N 3.42Å |
| 308 | K | 89.9 | Confident | 94.9 | Very high | 174 Ų | 174 | 52.3 Ų | 52.3 | 76% | 0.757 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -96.5 | -31.2 | -173.4 | -171.3 | 173.1 | -179.5 | 177.9 | 0 | 113.4 | F304 V305 | F304-K308 PolarHBondContact O-N 3.2Å; V305-K308 PolarHBondContact O-N 2.89Å; V305-K308 VanDerWaalsContact O-N 3.1Å |
| 309 | F | 91.4 | Very high | 94.9 | Very high | 113 Ų | 113 | 51.8 Ų | 51.8 | 50% | 0.496 | 25% | 0.245 | S | C | . | . | S | Bend | trans | -108.4 | 156.3 | -173.8 | -64.6 | -81.5 | 0 | 0 | 0 | 112.3 | V305 W311 L314 | V305-F309 HydrophobicContact CB-CD2 4.4Å; V305-F309 HydrophobicContact CG1-CD2 3.84Å; V305-F309 HydrophobicContact CG1-CE2 4.44Å; V305-F309 WeakPolarHBondContact O-CD2 3.45Å; V305-F309 PolarHBondContact O-N 3.01Å; F309-W311 PolarHBondContact O-N 3.09Å; F309-L314 HydrophobicContact CB-CD1 4.02Å; F309-L314 HydrophobicContact CB-CD2 3.99Å; F309-L314 HydrophobicContact CB-CG 3.94Å |
| 310 | S | 91.2 | Very high | 94.9 | Very high | 18 Ų | 18 | 54.6 Ų | 54.6 | 13% | 0.126 | 26% | 0.263 | C | S | . | . | trans | -63.5 | 131.7 | 173.5 | 149.5 | 0 | 0 | 0 | 0 | 110.4 | K312 K313 L314 D430 | S310-K312 VanDerWaalsContact C-N 3.33Å; S310-K312 PolarHBondContact O-N 3.18Å; S310-K312 PolarHBondContact OG-N 2.59Å; S310-K313 PolarHBondContact O-N 3.09Å; S310-K313 PolarHBondContact OG-N 3.06Å; S310-L314 WeakPolarHBondContact O-CG 3.49Å; S310-L314 PolarHBondContact O-N 3.48Å; S310-D430 PolarHBondContact OG-OD1 3.35Å | ||
| 311 | W | 92.8 | Very high | 94.9 | Very high | 4 Ų | 4 | 54.1 Ų | 54.1 | 2% | 0.015 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 178.9 | -61.6 | -5.9 | 0 | 0 | 0 | 112.5 | V135 V306 F309 K313 L314 L315 L361 L364 I365 E368 V431 L433 | V135-W311 HydrophobicContact CG1-CZ2 3.98Å; V135-W311 HydrophobicContact CG2-CH2 4.16Å; V135-W311 HydrophobicContact CG2-CZ2 4.08Å; V306-W311 HydrophobicContact CG1-CZ2 4.4Å; V306-W311 PolarHBondContact O-NE1 3.24Å; F309-W311 PolarHBondContact O-N 3.09Å; W311-K313 PolarHBondContact O-N 3.45Å; W311-L314 PolarHBondContact O-N 3.28Å; W311-L315 WeakPolarHBondContact O-CG 3.36Å; W311-L315 PolarHBondContact O-N 3.45Å; W311-L361 HydrophobicContact CB-CD2 4Å; W311-L361 HydrophobicContact CD2-CD2 4.16Å; W311-L361 HydrophobicContact CG-CD2 3.73Å; W311-L364 HydrophobicContact CH2-CB 4.22Å; W311-L364 HydrophobicContact CZ3-CB 4.49Å; W311-I365 HydrophobicContact CE3-CG1 3.79Å; W311-I365 HydrophobicContact CZ3-CG1 4.17Å; W311-E368 HydrophobicContact CH2-CB 4.39Å; W311-E368 HydrophobicContact CH2-CG 3.5Å; W311-E368 HydrophobicContact CZ3-CB 4.22Å; W311-E368 HydrophobicContact CZ3-CG 3.82Å; W311-V431 HydrophobicContact CE3-CB 4.01Å; W311-V431 HydrophobicContact CE3-CG1 4.13Å; W311-V431 HydrophobicContact CZ3-CB 4.47Å; W311-V431 HydrophobicContact CZ3-CG1 4.13Å; W311-L433 HydrophobicContact CZ2-CD1 3.83Å; W311-L433 HydrophobicContact CZ2-CG 4.48Å |
| 312 | K | 93.5 | Very high | 95 | Very high | 37 Ų | 37 | 50.7 Ų | 50.7 | 16% | 0.161 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.7 | -49.3 | 174.2 | -176.8 | -174.5 | -175.1 | 147.6 | 0 | 110.8 | S310 L314 L315 Q316 V424 S425 I428 D430 | S310-K312 VanDerWaalsContact C-N 3.33Å; S310-K312 PolarHBondContact O-N 3.18Å; S310-K312 PolarHBondContact OG-N 2.59Å; K312-L314 PolarHBondContact O-N 2.86Å; K312-L315 PolarHBondContact O-N 2.99Å; K312-Q316 WeakPolarHBondContact O-CG 3.25Å; K312-Q316 PolarHBondContact O-N 2.86Å; K312-V424 HydrophobicContact CG-CG1 3.97Å; K312-S425 PolarHBondContact NZ-O 3.14Å; K312-I428 HydrophobicContact CB-CG2 4.2Å; K312-I428 VanDerWaalsContact CD-O 3.26Å; K312-I428 WeakPolarHBondContact CD-O 3.45Å; K312-I428 WeakPolarHBondContact CE-O 3.48Å; K312-I428 HydrophobicContact CG-CG2 4.45Å; K312-I428 PolarHBondContact NZ-O 3.34Å; K312-D430 WeakPolarHBondContact CB-OD1 3.35Å |
| 313 | K | 94.5 | Very high | 95.1 | Very high | 129 Ų | 129 | 50.9 Ų | 50.9 | 56% | 0.561 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -64.1 | -40.7 | 179.8 | -68.5 | -173.8 | -178.8 | -175.6 | 0 | 111.7 | S310 W311 Q316 V317 | S310-K313 PolarHBondContact O-N 3.09Å; S310-K313 PolarHBondContact OG-N 3.06Å; W311-K313 PolarHBondContact O-N 3.45Å; K313-Q316 PolarHBondContact O-N 3.27Å; K313-V317 WeakPolarHBondContact O-CB 3.42Å; K313-V317 VanDerWaalsContact O-CG2 3.29Å; K313-V317 WeakPolarHBondContact O-CG2 3.37Å; K313-V317 PolarHBondContact O-N 3.06Å |
| 314 | L | 96.1 | Very high | 95.2 | Very high | 24 Ų | 24 | 55.6 Ų | 55.6 | 13% | 0.126 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.6 | -44.6 | 176.1 | -71.2 | 173.2 | 0 | 0 | 0 | 111.9 | V305 V306 F309 S310 W311 K312 G318 S357 L361 | V305-L314 HydrophobicContact CG1-CD1 4.05Å; V305-L314 HydrophobicContact CG1-CD2 3.53Å; V305-L314 HydrophobicContact CG1-CG 4.45Å; V306-L314 HydrophobicContact CG2-CD1 4.28Å; F309-L314 HydrophobicContact CB-CD1 4.02Å; F309-L314 HydrophobicContact CB-CD2 3.99Å; F309-L314 HydrophobicContact CB-CG 3.94Å; S310-L314 WeakPolarHBondContact O-CG 3.49Å; S310-L314 PolarHBondContact O-N 3.48Å; W311-L314 PolarHBondContact O-N 3.28Å; K312-L314 PolarHBondContact O-N 2.86Å; L314-G318 WeakPolarHBondContact O-CA 3.36Å; L314-G318 PolarHBondContact O-N 3.35Å; L314-S357 VanDerWaalsContact O-CB 3.25Å; L314-S357 WeakPolarHBondContact O-CB 3.45Å; L314-L361 HydrophobicContact CB-CD1 3.62Å; L314-L361 HydrophobicContact CD1-CD1 4.26Å |
| 315 | L | 97 | Very high | 95.3 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.8 | -43.6 | 175.4 | -74.3 | 171.4 | 0 | 0 | 0 | 112.1 | L257 W311 K312 A319 W358 L361 I365 V424 | L257-L315 HydrophobicContact CD2-CD1 4.45Å; W311-L315 WeakPolarHBondContact O-CG 3.36Å; W311-L315 PolarHBondContact O-N 3.45Å; K312-L315 PolarHBondContact O-N 2.99Å; L315-A319 VanDerWaalsContact O-CB 3.25Å; L315-A319 WeakPolarHBondContact O-CB 3.43Å; L315-A319 PolarHBondContact O-N 3.26Å; L315-W358 HydrophobicContact CB-CZ2 4.29Å; L315-W358 HydrophobicContact CD2-CD2 3.6Å; L315-W358 HydrophobicContact CD2-CE3 3.83Å; L315-W358 HydrophobicContact CD2-CG 4Å; L315-W358 HydrophobicContact CD2-CH2 4.3Å; L315-W358 HydrophobicContact CD2-CZ2 4.09Å; L315-W358 HydrophobicContact CD2-CZ3 4.18Å; L315-W358 PolarHBondContact O-NE1 3.46Å; L315-L361 HydrophobicContact CD2-CB 3.92Å; L315-L361 HydrophobicContact CD2-CD1 3.93Å; L315-L361 HydrophobicContact CG-CB 4.27Å; L315-L361 HydrophobicContact CG-CD1 3.75Å; L315-I365 HydrophobicContact CD1-CD1 3.81Å; L315-V424 HydrophobicContact CB-CG1 3.86Å; L315-V424 HydrophobicContact CB-CG2 4.12Å; L315-V424 HydrophobicContact CD1-CG1 4.29Å; L315-V424 HydrophobicContact CD1-CG2 4.21Å |
| 316 | Q | 97.1 | Very high | 95.4 | Very high | 47 Ų | 47 | 47.8 Ų | 47.8 | 22% | 0.22 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -64.1 | -53 | 178.5 | -73 | 172.6 | -40.2 | 0 | 0 | 112 | K312 K313 G318 A319 V320 V424 S425 | K312-Q316 WeakPolarHBondContact O-CG 3.25Å; K312-Q316 PolarHBondContact O-N 2.86Å; K313-Q316 PolarHBondContact O-N 3.27Å; Q316-G318 VanDerWaalsContact C-N 3.31Å; Q316-G318 PolarHBondContact O-N 3.39Å; Q316-A319 PolarHBondContact O-N 2.92Å; Q316-V320 WeakPolarHBondContact O-CG2 3.24Å; Q316-V320 PolarHBondContact O-N 3.27Å; Q316-V424 HydrophobicContact CG-CB 4.43Å; Q316-V424 HydrophobicContact CG-CG1 3.82Å; Q316-S425 PolarHBondContact NE2-OG 3.14Å |
| 317 | V | 97.5 | Very high | 95.5 | Very high | 85 Ų | 85 | 51.2 Ų | 51.2 | 52% | 0.515 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62 | -43.2 | 179.1 | 172.2 | 0 | 0 | 0 | 0 | 110.2 | K313 A319 V320 I321 | K313-V317 WeakPolarHBondContact O-CB 3.42Å; K313-V317 VanDerWaalsContact O-CG2 3.29Å; K313-V317 WeakPolarHBondContact O-CG2 3.37Å; K313-V317 PolarHBondContact O-N 3.06Å; V317-A319 PolarHBondContact O-N 3.46Å; V317-V320 PolarHBondContact O-N 3.28Å; V317-I321 HydrophobicContact CG1-CD1 3.65Å; V317-I321 HydrophobicContact CG1-CG1 4.36Å; V317-I321 WeakPolarHBondContact O-CG1 3.5Å; V317-I321 PolarHBondContact O-N 3.21Å |
| 318 | G | 98 | Very high | 95.7 | Very high | 3 Ų | 3 | 50 Ų | 50 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -58.8 | -45.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L314 Q316 V320 I321 L322 T353 S357 | L314-G318 WeakPolarHBondContact O-CA 3.36Å; L314-G318 PolarHBondContact O-N 3.35Å; Q316-G318 VanDerWaalsContact C-N 3.31Å; Q316-G318 PolarHBondContact O-N 3.39Å; G318-V320 PolarHBondContact O-N 2.89Å; G318-I321 PolarHBondContact O-N 3.41Å; G318-L322 WeakPolarHBondContact O-CB 3.31Å; G318-L322 VanDerWaalsContact O-CG 3.24Å; G318-L322 WeakPolarHBondContact O-CG 3.37Å; G318-L322 PolarHBondContact O-N 3.3Å; G318-T353 WeakPolarHBondContact O-CG2 3.42Å; G318-S357 WeakPolarHBondContact CA-OG 3.45Å |
| 319 | A | 98.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.6 | -42.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L315 Q316 V317 A323 W358 C417 S420 C421 | L315-A319 VanDerWaalsContact O-CB 3.25Å; L315-A319 WeakPolarHBondContact O-CB 3.43Å; L315-A319 PolarHBondContact O-N 3.26Å; Q316-A319 PolarHBondContact O-N 2.92Å; V317-A319 PolarHBondContact O-N 3.46Å; A319-A323 VanDerWaalsContact O-CB 3.31Å; A319-A323 WeakPolarHBondContact O-CB 3.39Å; A319-A323 PolarHBondContact O-N 2.97Å; A319-W358 HydrophobicContact CB-CZ2 4.08Å; A319-C417 WeakPolarHBondContact O-CB 3.48Å; A319-S420 WeakPolarHBondContact CB-OG 3.29Å; A319-C421 HydrophobicContact CB-CB 3.81Å |
| 320 | V | 98.4 | Very high | 95.7 | Very high | 60 Ų | 60 | 36.4 Ų | 36.4 | 36% | 0.364 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -65 | -46 | 177.9 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | Q316 V317 G318 A323 L324 | Q316-V320 WeakPolarHBondContact O-CG2 3.24Å; Q316-V320 PolarHBondContact O-N 3.27Å; V317-V320 PolarHBondContact O-N 3.28Å; G318-V320 PolarHBondContact O-N 2.89Å; V320-A323 PolarHBondContact O-N 3.31Å; V320-L324 HydrophobicContact CG1-CD1 4.17Å; V320-L324 WeakPolarHBondContact O-CG 3.46Å; V320-L324 PolarHBondContact O-N 3.45Å |
| 321 | I | 98.3 | Very high | 95.7 | Very high | 61 Ų | 61 | 39.9 Ų | 39.9 | 31% | 0.313 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64.5 | -45 | 179.3 | -64.2 | 168.1 | 0 | 0 | 0 | 110.5 | V317 G318 A323 L324 C325 I349 T353 | V317-I321 HydrophobicContact CG1-CD1 3.65Å; V317-I321 HydrophobicContact CG1-CG1 4.36Å; V317-I321 WeakPolarHBondContact O-CG1 3.5Å; V317-I321 PolarHBondContact O-N 3.21Å; G318-I321 PolarHBondContact O-N 3.41Å; I321-A323 VanDerWaalsContact C-N 3.32Å; I321-A323 PolarHBondContact O-N 2.85Å; I321-L324 PolarHBondContact O-N 2.92Å; I321-C325 PolarHBondContact O-N 2.96Å; I321-C325 PolarHBondContact O-SG 3.42Å; I321-I349 HydrophobicContact CG2-CG2 3.84Å; I321-T353 HydrophobicContact CB-CG2 3.77Å; I321-T353 HydrophobicContact CD1-CG2 4.49Å; I321-T353 HydrophobicContact CG2-CG2 3.86Å; I321-T353 WeakPolarHBondContact CG2-OG1 3.24Å |
| 322 | L | 98.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.2 | -43.6 | 175.3 | -70.8 | 172.5 | 0 | 0 | 0 | 111.4 | T264 M266 G318 L324 C325 H326 C350 T353 | T264-L322 HydrophobicContact CG2-CD1 4.14Å; M266-L322 HydrophobicContact CG-CD1 4.48Å; M266-L322 HydrophobicContact CG-CD2 4.16Å; M266-L322 HydrophobicContact SD-CD2 3.77Å; G318-L322 WeakPolarHBondContact O-CB 3.31Å; G318-L322 VanDerWaalsContact O-CG 3.24Å; G318-L322 WeakPolarHBondContact O-CG 3.37Å; G318-L322 PolarHBondContact O-N 3.3Å; L322-L324 VanDerWaalsContact C-N 3.35Å; L322-L324 PolarHBondContact O-N 3.49Å; L322-C325 PolarHBondContact O-N 3.04Å; L322-H326 WeakPolarHBondContact O-CB 3.41Å; L322-H326 PolarHBondContact O-N 3.37Å; L322-H326 PolarHBondContact O-ND1 3.05Å; L322-C350 HydrophobicContact CD2-CB 4.17Å; L322-T353 HydrophobicContact CD2-CG2 4.17Å; L322-T353 HydrophobicContact CG-CG2 3.83Å |
| 323 | A | 98.3 | Very high | 95.1 | Very high | 3 Ų | 3 | 39.9 Ų | 39.9 | 3% | 0.025 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.8 | -45.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A319 V320 I321 H326 L327 S414 C417 L418 | A319-A323 VanDerWaalsContact O-CB 3.31Å; A319-A323 WeakPolarHBondContact O-CB 3.39Å; A319-A323 PolarHBondContact O-N 2.97Å; V320-A323 PolarHBondContact O-N 3.31Å; I321-A323 VanDerWaalsContact C-N 3.32Å; I321-A323 PolarHBondContact O-N 2.85Å; A323-H326 PolarHBondContact O-N 3.02Å; A323-L327 WeakPolarHBondContact O-CB 3.42Å; A323-L327 PolarHBondContact O-N 3.38Å; A323-S414 WeakPolarHBondContact O-CB 3.32Å; A323-S414 PolarHBondContact O-OG 3.04Å; A323-C417 HydrophobicContact CB-CB 3.77Å; A323-L418 HydrophobicContact CB-CD2 3.83Å; A323-L418 HydrophobicContact CB-CG 3.88Å |
| 324 | L | 97.8 | Very high | 94.7 | Very high | 110 Ų | 110 | 38.5 Ų | 38.5 | 58% | 0.576 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -64.9 | -41.7 | 177.8 | -68.6 | 174 | 0 | 0 | 0 | 111.9 | V320 I321 L322 L327 W328 | V320-L324 HydrophobicContact CG1-CD1 4.17Å; V320-L324 WeakPolarHBondContact O-CG 3.46Å; V320-L324 PolarHBondContact O-N 3.45Å; I321-L324 PolarHBondContact O-N 2.92Å; L322-L324 VanDerWaalsContact C-N 3.35Å; L322-L324 PolarHBondContact O-N 3.49Å; L324-L327 PolarHBondContact O-N 3.2Å; L324-W328 WeakPolarHBondContact O-CB 3.45Å; L324-W328 PolarHBondContact O-N 3.1Å |
| 325 | C | 96.1 | Very high | 94.2 | Very high | 6 Ų | 6 | 41.5 Ų | 41.5 | 4% | 0.041 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.4 | -42.3 | 177.2 | -68.9 | 0 | 0 | 0 | 0 | 112.5 | I321 L322 W328 F329 I349 C350 | I321-C325 PolarHBondContact O-N 2.96Å; I321-C325 PolarHBondContact O-SG 3.42Å; L322-C325 PolarHBondContact O-N 3.04Å; C325-W328 PolarHBondContact O-N 3.32Å; C325-F329 PolarHBondContact O-N 3.06Å; C325-I349 WeakPolarHBondContact SG-CG2 3.34Å; C325-C350 WeakPolarHBondContact CB-SG 3.35Å |
| 326 | H | 96 | Very high | 93.2 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.8 | -39.2 | 177.3 | -76.1 | 70.6 | 0 | 0 | 0 | 111.9 | T264 L322 A323 S330 F410 F413 | T264-H326 PolarHBondContact O-CE1 3.48Å; T264-H326 VanDerWaalsContact O-CE1 3.24Å; T264-H326 PolarHBondContact O-NE2 3.4Å; L322-H326 WeakPolarHBondContact O-CB 3.41Å; L322-H326 PolarHBondContact O-N 3.37Å; L322-H326 PolarHBondContact O-ND1 3.05Å; A323-H326 PolarHBondContact O-N 3.02Å; H326-S330 WeakPolarHBondContact O-CB 3.45Å; H326-S330 PolarHBondContact O-N 3.47Å; H326-F410 HydrophobicContact CB-CD1 4.37Å; H326-F410 WeakPolarHBondContact CB-O 3.33Å; H326-F410 AromaticContact CD2-CD1 3.36Å; H326-F410 WeakPolarHBondContact CD2-CD1 3.18Å; H326-F410 AromaticContact CD2-CE1 3.98Å; H326-F413 WeakPolarHBondContact CD2-CB 3.38Å |
| 327 | L | 95.2 | Very high | 91.9 | Very high | 72 Ų | 72 | 50.6 Ų | 50.6 | 38% | 0.377 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.5 | -43 | 174.1 | -174.1 | 68.4 | 0 | 0 | 0 | 111.1 | A323 L324 S330 L331 | A323-L327 WeakPolarHBondContact O-CB 3.42Å; A323-L327 PolarHBondContact O-N 3.38Å; L324-L327 PolarHBondContact O-N 3.2Å; L327-S330 PolarHBondContact O-N 3.22Å; L327-L331 HydrophobicContact CG-CD1 4.23Å; L327-L331 WeakPolarHBondContact O-CG 3.45Å; L327-L331 PolarHBondContact O-N 2.7Å |
| 328 | W | 93.4 | Very high | 90.1 | Very high | 105 Ų | 105 | 50.9 Ų | 50.9 | 40% | 0.398 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.4 | -50.2 | 176.7 | -175.4 | 4.5 | 0 | 0 | 0 | 111 | L324 C325 S330 L331 T332 M342 I349 | L324-W328 WeakPolarHBondContact O-CB 3.45Å; L324-W328 PolarHBondContact O-N 3.1Å; C325-W328 PolarHBondContact O-N 3.32Å; W328-S330 VanDerWaalsContact C-N 3.33Å; W328-S330 PolarHBondContact O-N 3.06Å; W328-L331 PolarHBondContact O-N 2.95Å; W328-T332 WeakPolarHBondContact O-CG2 3.49Å; W328-T332 PolarHBondContact O-N 3.33Å; W328-T332 PolarHBondContact O-OG1 3.17Å; W328-M342 HydrophobicContact CZ2-SD 4.22Å; W328-I349 HydrophobicContact CZ3-CD1 4.38Å |
| 329 | F | 91.2 | Very high | 88.5 | Confident | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.2 | -44.6 | 175.9 | 172 | -105.8 | 0 | 0 | 0 | 112.9 | F279 C325 L331 T332 V333 H343 Y346 V406 F410 | F279-F329 HydrophobicContact CB-CZ 4.5Å; C325-F329 PolarHBondContact O-N 3.06Å; F329-L331 VanDerWaalsContact C-N 3.32Å; F329-L331 PolarHBondContact O-N 3.46Å; F329-T332 WeakPolarHBondContact CA-OG1 3.42Å; F329-T332 PolarHBondContact O-N 3.08Å; F329-T332 PolarHBondContact O-OG1 2.92Å; F329-V333 HydrophobicContact CD2-CG2 3.96Å; F329-V333 HydrophobicContact CE1-CG2 4.2Å; F329-V333 HydrophobicContact CE2-CG2 3.54Å; F329-V333 HydrophobicContact CZ-CG2 3.7Å; F329-V333 WeakPolarHBondContact O-CG2 3.25Å; F329-V333 PolarHBondContact O-N 2.93Å; F329-V333 VanDerWaalsContact O-N 3.13Å; F329-H343 AromaticContact CD2-CD2 3.88Å; F329-H343 AromaticContact CE2-CD2 3.85Å; F329-Y346 HydrophobicContact CB-CD1 4.15Å; F329-Y346 HydrophobicContact CB-CD2 3.8Å; F329-Y346 HydrophobicContact CB-CE1 4Å; F329-Y346 HydrophobicContact CB-CE2 3.6Å; F329-Y346 HydrophobicContact CB-CG 4.12Å; F329-Y346 HydrophobicContact CD2-CD1 4.1Å; F329-Y346 AromaticContact CD2-CE1 3.17Å; F329-Y346 HydrophobicContact CD2-CE1 3.17Å; F329-Y346 AromaticContact CD2-CE2 3.71Å; F329-Y346 HydrophobicContact CD2-CE2 3.71Å; F329-Y346 AromaticContact CD2-CZ 2.98Å; F329-Y346 WeakPolarHBondContact CD2-OH 3.49Å; F329-Y346 AromaticContact CE2-CE1 3.91Å; F329-Y346 HydrophobicContact CE2-CE1 3.91Å; F329-Y346 HydrophobicContact CE2-CE2 4.47Å; F329-Y346 AromaticContact CE2-CZ 3.56Å; F329-Y346 WeakPolarHBondContact CE2-OH 3.29Å; F329-Y346 HydrophobicContact CG-CD2 4.39Å; F329-Y346 AromaticContact CG-CE1 3.92Å; F329-Y346 HydrophobicContact CG-CE1 3.92Å; F329-Y346 AromaticContact CG-CE2 3.7Å; F329-Y346 HydrophobicContact CG-CE2 3.7Å; F329-Y346 AromaticContact CG-CZ 3.5Å; F329-Y346 VanDerWaalsContact CG-CZ 3.5Å; F329-V406 HydrophobicContact CE1-CG1 4.14Å; F329-V406 HydrophobicContact CE1-CG2 3.91Å; F329-V406 HydrophobicContact CZ-CG1 4.06Å; F329-V406 HydrophobicContact CZ-CG2 4.1Å; F329-F410 HydrophobicContact CB-CD1 4.4Å; F329-F410 HydrophobicContact CD1-CB 3.72Å; F329-F410 AromaticContact CD1-CD1 3.32Å; F329-F410 HydrophobicContact CD1-CD1 3.32Å; F329-F410 AromaticContact CD1-CD2 3.7Å; F329-F410 HydrophobicContact CD1-CD2 3.7Å; F329-F410 AromaticContact CD1-CE1 3.73Å; F329-F410 HydrophobicContact CD1-CE1 3.73Å; F329-F410 HydrophobicContact CD1-CE2 4.06Å; F329-F410 AromaticContact CD1-CG 3.3Å; F329-F410 HydrophobicContact CD1-CG 3.3Å; F329-F410 HydrophobicContact CD1-CZ 4.07Å; F329-F410 HydrophobicContact CE1-CB 4.24Å; F329-F410 AromaticContact CE1-CD1 3.85Å; F329-F410 HydrophobicContact CE1-CD1 3.85Å; F329-F410 AromaticContact CE1-CD2 3.41Å; F329-F410 HydrophobicContact CE1-CD2 3.41Å; F329-F410 VanDerWaalsContact CE1-CD2 3.41Å; F329-F410 AromaticContact CE1-CE1 3.96Å; F329-F410 HydrophobicContact CE1-CE1 3.96Å; F329-F410 AromaticContact CE1-CE2 3.53Å; F329-F410 HydrophobicContact CE1-CE2 3.53Å; F329-F410 AromaticContact CE1-CG 3.57Å; F329-F410 HydrophobicContact CE1-CG 3.57Å; F329-F410 AromaticContact CE1-CZ 3.8Å; F329-F410 HydrophobicContact CE1-CZ 3.8Å; F329-F410 HydrophobicContact CG-CD1 4.13Å; F329-F410 HydrophobicContact CG-CE1 4.39Å; F329-F410 HydrophobicContact CG-CG 4.45Å; F329-F410 HydrophobicContact CZ-CE2 4.32Å; F329-F410 HydrophobicContact CZ-CZ 4.43Å |
| 330 | S | 91.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59 | -45.9 | 179.4 | 179.6 | 0 | 0 | 0 | 0 | 111.6 | H326 L327 W328 V333 L334 S407 C411 | H326-S330 WeakPolarHBondContact O-CB 3.45Å; H326-S330 PolarHBondContact O-N 3.47Å; L327-S330 PolarHBondContact O-N 3.22Å; W328-S330 VanDerWaalsContact C-N 3.33Å; W328-S330 PolarHBondContact O-N 3.06Å; S330-V333 PolarHBondContact O-N 2.86Å; S330-L334 VanDerWaalsContact O-CG 3.31Å; S330-L334 WeakPolarHBondContact O-CG 3.33Å; S330-L334 PolarHBondContact O-N 2.82Å; S330-S407 WeakPolarHBondContact CB-O 2.98Å; S330-S407 PolarHBondContact O-OG 3.13Å; S330-S407 WeakPolarHBondContact OG-CB 3.21Å; S330-S407 PolarHBondContact OG-O 3Å; S330-C411 PolarHBondContact OG-SG 2.98Å |
| 331 | L | 91.1 | Very high | 86.1 | Confident | 91 Ų | 91 | 59.6 Ų | 59.6 | 48% | 0.476 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63 | -44.4 | 177.6 | -70.1 | 172.7 | 0 | 0 | 0 | 111.9 | L327 W328 F329 V333 L334 T335 | L327-L331 HydrophobicContact CG-CD1 4.23Å; L327-L331 WeakPolarHBondContact O-CG 3.45Å; L327-L331 PolarHBondContact O-N 2.7Å; W328-L331 PolarHBondContact O-N 2.95Å; F329-L331 VanDerWaalsContact C-N 3.32Å; F329-L331 PolarHBondContact O-N 3.46Å; L331-V333 VanDerWaalsContact C-N 3.29Å; L331-V333 PolarHBondContact O-N 3.45Å; L331-L334 PolarHBondContact O-N 3.13Å; L331-T335 WeakPolarHBondContact O-CG2 3.41Å; L331-T335 PolarHBondContact O-N 3.03Å; L331-T335 PolarHBondContact O-OG1 3.34Å |
| 332 | T | 87.5 | Confident | 85.4 | Confident | 14 Ų | 14 | 60.9 Ų | 60.9 | 9% | 0.086 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.3 | -35.1 | -178 | 51.9 | 0 | 0 | 0 | 0 | 113.1 | W328 F329 E336 T337 H343 | W328-T332 WeakPolarHBondContact O-CG2 3.49Å; W328-T332 PolarHBondContact O-N 3.33Å; W328-T332 PolarHBondContact O-OG1 3.17Å; F329-T332 WeakPolarHBondContact CA-OG1 3.42Å; F329-T332 PolarHBondContact O-N 3.08Å; F329-T332 PolarHBondContact O-OG1 2.92Å; T332-E336 PolarHBondContact O-N 3.36Å; T332-T337 WeakPolarHBondContact CA-OG1 3.44Å; T332-T337 PolarHBondContact O-N 3.04Å; T332-T337 VanDerWaalsContact O-N 3.14Å; T332-T337 PolarHBondContact O-OG1 3.1Å; T332-H343 PolarHBondContact OG1-NE2 2.89Å |
| 333 | V | 85.2 | Confident | 84.7 | Confident | 27 Ų | 27 | 61.1 Ų | 61.1 | 16% | 0.164 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -73.1 | -40.1 | 175.1 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | F329 S330 L331 E336 V406 S407 | F329-V333 HydrophobicContact CD2-CG2 3.96Å; F329-V333 HydrophobicContact CE1-CG2 4.2Å; F329-V333 HydrophobicContact CE2-CG2 3.54Å; F329-V333 HydrophobicContact CZ-CG2 3.7Å; F329-V333 WeakPolarHBondContact O-CG2 3.25Å; F329-V333 PolarHBondContact O-N 2.93Å; F329-V333 VanDerWaalsContact O-N 3.13Å; S330-V333 PolarHBondContact O-N 2.86Å; L331-V333 VanDerWaalsContact C-N 3.29Å; L331-V333 PolarHBondContact O-N 3.45Å; V333-E336 PolarHBondContact O-N 3.27Å; V333-V406 HydrophobicContact CG1-CG1 3.83Å; V333-V406 HydrophobicContact CG2-CG1 4.38Å; V333-S407 WeakPolarHBondContact CB-OG 2.98Å; V333-S407 WeakPolarHBondContact CG1-OG 2.8Å |
| 334 | L | 86.7 | Confident | 84.3 | Confident | 101 Ų | 101 | 63 Ų | 63 | 53% | 0.529 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67 | -37.1 | 177.4 | -74.4 | 173.7 | 0 | 0 | 0 | 113.1 | S330 L331 E336 | S330-L334 VanDerWaalsContact O-CG 3.31Å; S330-L334 WeakPolarHBondContact O-CG 3.33Å; S330-L334 PolarHBondContact O-N 2.82Å; L331-L334 PolarHBondContact O-N 3.13Å; L334-E336 PolarHBondContact O-N 2.68Å |
| 335 | T | 86 | Confident | 84 | Confident | 87 Ų | 87 | 61.4 Ų | 61.4 | 53% | 0.534 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 2.9 | 179.4 | 56.2 | 0 | 0 | 0 | 0 | 113 | L331 T337 | L331-T335 WeakPolarHBondContact O-CG2 3.41Å; L331-T335 PolarHBondContact O-N 3.03Å; L331-T335 PolarHBondContact O-OG1 3.34Å; T335-T337 PolarHBondContact O-N 3.35Å; T335-T337 WeakPolarHBondContact OG1-CG2 3.07Å; T335-T337 PolarHBondContact OG1-OG1 3.47Å |
| 336 | E | 76.6 | Confident | 83.7 | Confident | 170 Ų | 170 | 61.2 Ų | 61.2 | 79% | 0.794 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.3 | 28.4 | -174.1 | -61.8 | -176.3 | 176.8 | 0 | 0 | 112.8 | T332 V333 L334 S338 | T332-E336 PolarHBondContact O-N 3.36Å; V333-E336 PolarHBondContact O-N 3.27Å; L334-E336 PolarHBondContact O-N 2.68Å; E336-S338 PolarHBondContact O-N 3.4Å |
| 337 | T | 69.8 | Low | 83.6 | Confident | 68 Ų | 68 | 61.2 Ų | 61.2 | 42% | 0.417 | 33% | 0.33 | S | S | . | . | trans | -77.3 | 81.7 | 178.1 | 46.5 | 0 | 0 | 0 | 0 | 108 | T332 T335 M339 | T332-T337 WeakPolarHBondContact CA-OG1 3.44Å; T332-T337 PolarHBondContact O-N 3.04Å; T332-T337 VanDerWaalsContact O-N 3.14Å; T332-T337 PolarHBondContact O-OG1 3.1Å; T335-T337 PolarHBondContact O-N 3.35Å; T335-T337 WeakPolarHBondContact OG1-CG2 3.07Å; T335-T337 PolarHBondContact OG1-OG1 3.47Å; T337-M339 PolarHBondContact O-N 3.36Å | ||
| 338 | S | 59.3 | Low | 83.6 | Confident | 91 Ų | 91 | 59.5 Ų | 59.5 | 64% | 0.636 | 32% | 0.321 | S | S | * | . | trans | -77.2 | 57.7 | -174.6 | 66.9 | 0 | 0 | 0 | 0 | 112.2 | E336 S340 | E336-S338 PolarHBondContact O-N 3.4Å; S338-S340 PolarHBondContact O-N 3.16Å | ||
| 339 | M | 64.9 | Low | 83.8 | Confident | 120 Ų | 120 | 57.1 Ų | 57.1 | 59% | 0.591 | 32% | 0.316 | S | S | * | . | trans | -85.2 | 96.7 | 164.1 | -66.6 | -63.5 | 106 | 0 | 0 | 107.4 | T337 S341 M342 H343 | T337-M339 PolarHBondContact O-N 3.36Å; M339-S341 PolarHBondContact O-N 3.37Å; M339-M342 HydrophobicContact CB-CB 4.06Å; M339-M342 HydrophobicContact CB-CG 3.67Å; M339-M342 WeakPolarHBondContact O-CB 3.12Å; M339-M342 PolarHBondContact O-N 2.95Å; M339-H343 PolarHBondContact O-N 3.5Å; M339-H343 PolarHBondContact O-ND1 3.29Å | ||
| 340 | S | 71 | Confident | 84.1 | Confident | 45 Ų | 45 | 57.1 Ų | 57.1 | 32% | 0.315 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -54.3 | -41.2 | -177.8 | 62.1 | 0 | 0 | 0 | 0 | 112 | G280 L282 S338 M342 H343 Q344 | G280-S340 VanDerWaalsContact O-CA 3.26Å; G280-S340 WeakPolarHBondContact O-CA 3.24Å; G280-S340 WeakPolarHBondContact O-CB 3.43Å; L282-S340 WeakPolarHBondContact CD1-O 3.41Å; S338-S340 PolarHBondContact O-N 3.16Å; S340-M342 VanDerWaalsContact C-N 3.3Å; S340-M342 PolarHBondContact O-N 3.06Å; S340-H343 WeakPolarHBondContact O-CB 3.25Å; S340-H343 PolarHBondContact O-N 3.47Å; S340-H343 VanDerWaalsContact O-N 3.09Å; S340-Q344 PolarHBondContact O-N 3.14Å |
| 341 | S | 74.7 | Confident | 84.4 | Confident | 81 Ų | 81 | 57.2 Ų | 57.2 | 57% | 0.566 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -58.7 | -35.6 | 175.9 | -47.1 | 0 | 0 | 0 | 0 | 113.8 | M339 H343 Q344 I345 | M339-S341 PolarHBondContact O-N 3.37Å; S341-H343 VanDerWaalsContact C-N 3.31Å; S341-H343 PolarHBondContact O-N 3.03Å; S341-Q344 PolarHBondContact O-N 2.96Å; S341-I345 WeakPolarHBondContact O-CD1 3.45Å; S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.47Å; S341-I345 PolarHBondContact O-N 3.43Å |
| 342 | M | 82.6 | Confident | 84.7 | Confident | 87 Ų | 87 | 56.1 Ų | 56.1 | 43% | 0.429 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -69.4 | -32.9 | 178.8 | -66.5 | -65.4 | -175.6 | 0 | 0 | 111.5 | W328 M339 S340 Q344 I345 Y346 | W328-M342 HydrophobicContact CZ2-SD 4.22Å; M339-M342 HydrophobicContact CB-CB 4.06Å; M339-M342 HydrophobicContact CB-CG 3.67Å; M339-M342 WeakPolarHBondContact O-CB 3.12Å; M339-M342 PolarHBondContact O-N 2.95Å; S340-M342 VanDerWaalsContact C-N 3.3Å; S340-M342 PolarHBondContact O-N 3.06Å; M342-Q344 VanDerWaalsContact C-N 3.34Å; M342-Q344 PolarHBondContact O-N 3.07Å; M342-I345 PolarHBondContact O-N 3.02Å; M342-I345 HydrophobicContact SD-CD1 4.28Å; M342-Y346 PolarHBondContact O-N 3.33Å |
| 343 | H | 84.4 | Confident | 85.3 | Confident | 5 Ų | 5 | 56.1 Ų | 56.1 | 2% | 0.023 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -65.7 | -39.5 | 178.5 | -72.5 | 83.3 | 0 | 0 | 0 | 111.8 | G280 L282 F329 T332 M339 S340 S341 I345 Y346 | G280-H343 VanDerWaalsContact CA-CG 3.42Å; L282-H343 HydrophobicContact CD1-CB 4.22Å; F329-H343 AromaticContact CD2-CD2 3.88Å; F329-H343 AromaticContact CE2-CD2 3.85Å; T332-H343 PolarHBondContact OG1-NE2 2.89Å; M339-H343 PolarHBondContact O-N 3.5Å; M339-H343 PolarHBondContact O-ND1 3.29Å; S340-H343 WeakPolarHBondContact O-CB 3.25Å; S340-H343 PolarHBondContact O-N 3.47Å; S340-H343 VanDerWaalsContact O-N 3.09Å; S341-H343 VanDerWaalsContact C-N 3.31Å; S341-H343 PolarHBondContact O-N 3.03Å; H343-I345 VanDerWaalsContact C-N 3.33Å; H343-I345 PolarHBondContact O-N 2.98Å; H343-Y346 VanDerWaalsContact C-CE1 3.44Å; H343-Y346 VanDerWaalsContact CA-CD1 3.45Å; H343-Y346 HydrophobicContact CB-CD1 4.38Å; H343-Y346 HydrophobicContact CB-CE1 3.79Å; H343-Y346 AromaticContact CD2-CE1 3.85Å; H343-Y346 WeakPolarHBondContact O-CD1 3.35Å; H343-Y346 WeakPolarHBondContact O-CE1 3.43Å |
| 344 | Q | 88.7 | Confident | 85.9 | Confident | 43 Ų | 43 | 55.2 Ų | 55.2 | 20% | 0.201 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -67.4 | -37 | 176.9 | -158.4 | -178 | -21.5 | 0 | 0 | 112.2 | L282 N290 S340 S341 M342 L347 I348 | L282-Q344 HydrophobicContact CD1-CB 3.74Å; L282-Q344 HydrophobicContact CD1-CG 4.36Å; N290-Q344 VanDerWaalsContact CB-NE2 3.26Å; N290-Q344 PolarHBondContact ND2-NE2 3.08Å; S340-Q344 PolarHBondContact O-N 3.14Å; S341-Q344 PolarHBondContact O-N 2.96Å; M342-Q344 VanDerWaalsContact C-N 3.34Å; M342-Q344 PolarHBondContact O-N 3.07Å; Q344-L347 PolarHBondContact O-N 2.84Å; Q344-I348 HydrophobicContact CG-CD1 4.01Å; Q344-I348 WeakPolarHBondContact O-CG1 3.36Å; Q344-I348 PolarHBondContact O-N 2.99Å |
| 345 | I | 91.7 | Very high | 86.4 | Confident | 76 Ų | 76 | 50.4 Ų | 50.4 | 39% | 0.39 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | -177.5 | -69.3 | 165.8 | 0 | 0 | 0 | 111.2 | S341 M342 H343 L347 I348 I349 | S341-I345 WeakPolarHBondContact O-CD1 3.45Å; S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.47Å; S341-I345 PolarHBondContact O-N 3.43Å; M342-I345 PolarHBondContact O-N 3.02Å; M342-I345 HydrophobicContact SD-CD1 4.28Å; H343-I345 VanDerWaalsContact C-N 3.33Å; H343-I345 PolarHBondContact O-N 2.98Å; I345-L347 VanDerWaalsContact C-N 3.35Å; I345-L347 PolarHBondContact O-N 3.36Å; I345-I348 PolarHBondContact O-N 2.7Å; I345-I349 HydrophobicContact CG2-CD1 3.86Å; I345-I349 HydrophobicContact CG2-CG1 4.48Å; I345-I349 WeakPolarHBondContact O-CG1 3.4Å; I345-I349 PolarHBondContact O-N 3.06Å |
| 346 | Y | 90.6 | Very high | 86.9 | Confident | 2 Ų | 2 | 47.4 Ų | 47.4 | 1% | 0.008 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.5 | -38.1 | -179.9 | 83.7 | -98.4 | 0 | 0 | 0 | 111.9 | F329 M342 H343 I348 I349 C350 | F329-Y346 HydrophobicContact CB-CD1 4.15Å; F329-Y346 HydrophobicContact CB-CD2 3.8Å; F329-Y346 HydrophobicContact CB-CE1 4Å; F329-Y346 HydrophobicContact CB-CE2 3.6Å; F329-Y346 HydrophobicContact CB-CG 4.12Å; F329-Y346 HydrophobicContact CD2-CD1 4.1Å; F329-Y346 AromaticContact CD2-CE1 3.17Å; F329-Y346 HydrophobicContact CD2-CE1 3.17Å; F329-Y346 AromaticContact CD2-CE2 3.71Å; F329-Y346 HydrophobicContact CD2-CE2 3.71Å; F329-Y346 AromaticContact CD2-CZ 2.98Å; F329-Y346 WeakPolarHBondContact CD2-OH 3.49Å; F329-Y346 AromaticContact CE2-CE1 3.91Å; F329-Y346 HydrophobicContact CE2-CE1 3.91Å; F329-Y346 HydrophobicContact CE2-CE2 4.47Å; F329-Y346 AromaticContact CE2-CZ 3.56Å; F329-Y346 WeakPolarHBondContact CE2-OH 3.29Å; F329-Y346 HydrophobicContact CG-CD2 4.39Å; F329-Y346 AromaticContact CG-CE1 3.92Å; F329-Y346 HydrophobicContact CG-CE1 3.92Å; F329-Y346 AromaticContact CG-CE2 3.7Å; F329-Y346 HydrophobicContact CG-CE2 3.7Å; F329-Y346 AromaticContact CG-CZ 3.5Å; F329-Y346 VanDerWaalsContact CG-CZ 3.5Å; M342-Y346 PolarHBondContact O-N 3.33Å; H343-Y346 VanDerWaalsContact C-CE1 3.44Å; H343-Y346 VanDerWaalsContact CA-CD1 3.45Å; H343-Y346 HydrophobicContact CB-CD1 4.38Å; H343-Y346 HydrophobicContact CB-CE1 3.79Å; H343-Y346 AromaticContact CD2-CE1 3.85Å; H343-Y346 WeakPolarHBondContact O-CD1 3.35Å; H343-Y346 WeakPolarHBondContact O-CE1 3.43Å; Y346-I348 VanDerWaalsContact C-N 3.32Å; Y346-I348 PolarHBondContact O-N 2.46Å; Y346-I349 PolarHBondContact O-N 3.22Å; Y346-C350 WeakPolarHBondContact O-CB 3.24Å; Y346-C350 PolarHBondContact O-N 2.59Å |
| 347 | L | 93.8 | Very high | 87.8 | Confident | 1 Ų | 1 | 39.5 Ų | 39.5 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.9 | -39.6 | 177.6 | -70.1 | 169.8 | 0 | 0 | 0 | 111.4 | I269 I276 I291 Q344 I345 C350 A351 | I269-L347 HydrophobicContact CD1-CD2 4.13Å; I269-L347 HydrophobicContact CG1-CD2 4.33Å; I269-L347 HydrophobicContact CG2-CD2 3.9Å; I276-L347 HydrophobicContact CG2-CD1 4.22Å; I276-L347 HydrophobicContact CG2-CD2 4.03Å; I291-L347 HydrophobicContact CD1-CB 3.57Å; I291-L347 HydrophobicContact CD1-CD1 3.43Å; I291-L347 VanDerWaalsContact CD1-CD1 3.43Å; I291-L347 HydrophobicContact CD1-CG 4Å; I291-L347 HydrophobicContact CG1-CB 3.78Å; I291-L347 HydrophobicContact CG1-CD1 4.49Å; Q344-L347 PolarHBondContact O-N 2.84Å; I345-L347 VanDerWaalsContact C-N 3.35Å; I345-L347 PolarHBondContact O-N 3.36Å; L347-C350 WeakPolarHBondContact O-CB 3.46Å; L347-C350 PolarHBondContact O-N 2.83Å; L347-A351 WeakPolarHBondContact O-CB 3.46Å; L347-A351 PolarHBondContact O-N 2.93Å |
| 348 | I | 95.7 | Very high | 89.2 | Confident | 35 Ų | 35 | 36.2 Ų | 36.2 | 18% | 0.179 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -64 | -45.5 | 175 | -71.6 | 168.9 | 0 | 0 | 0 | 110.5 | I291 C294 Q344 I345 Y346 C350 A351 I352 | I291-I348 HydrophobicContact CG1-CG1 4.49Å; C294-I348 HydrophobicContact CB-CG1 4.44Å; C294-I348 HydrophobicContact CB-CG2 3.97Å; Q344-I348 HydrophobicContact CG-CD1 4.01Å; Q344-I348 WeakPolarHBondContact O-CG1 3.36Å; Q344-I348 PolarHBondContact O-N 2.99Å; I345-I348 PolarHBondContact O-N 2.7Å; Y346-I348 VanDerWaalsContact C-N 3.32Å; Y346-I348 PolarHBondContact O-N 2.46Å; I348-C350 VanDerWaalsContact C-N 3.33Å; I348-C350 PolarHBondContact O-N 3.07Å; I348-A351 PolarHBondContact O-N 2.93Å; I348-I352 HydrophobicContact CG2-CD1 3.62Å; I348-I352 HydrophobicContact CG2-CG1 4.28Å; I348-I352 WeakPolarHBondContact O-CG1 3.27Å; I348-I352 PolarHBondContact O-N 3.28Å |
| 349 | I | 97.4 | Very high | 90.9 | Very high | 56 Ų | 56 | 32 Ų | 32 | 29% | 0.287 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62 | -42.5 | 177 | -62.8 | 166.3 | 0 | 0 | 0 | 110.5 | I321 C325 W328 I345 Y346 I352 T353 | I321-I349 HydrophobicContact CG2-CG2 3.84Å; C325-I349 WeakPolarHBondContact SG-CG2 3.34Å; W328-I349 HydrophobicContact CZ3-CD1 4.38Å; I345-I349 HydrophobicContact CG2-CD1 3.86Å; I345-I349 HydrophobicContact CG2-CG1 4.48Å; I345-I349 WeakPolarHBondContact O-CG1 3.4Å; I345-I349 PolarHBondContact O-N 3.06Å; Y346-I349 PolarHBondContact O-N 3.22Å; I349-I352 PolarHBondContact O-N 3.19Å; I349-T353 WeakPolarHBondContact O-CB 3.22Å; I349-T353 PolarHBondContact O-N 3.32Å; I349-T353 PolarHBondContact O-OG1 3.11Å |
| 350 | C | 97.4 | Very high | 92.3 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.4 | -50.2 | 173.4 | -84.9 | 0 | 0 | 0 | 0 | 111.9 | M266 I269 L322 C325 Y346 L347 I348 T353 F354 | M266-C350 HydrophobicContact CE-CB 4.2Å; M266-C350 HydrophobicContact SD-CB 3.71Å; I269-C350 HydrophobicContact CD1-CB 4.44Å; L322-C350 HydrophobicContact CD2-CB 4.17Å; C325-C350 WeakPolarHBondContact CB-SG 3.35Å; Y346-C350 WeakPolarHBondContact O-CB 3.24Å; Y346-C350 PolarHBondContact O-N 2.59Å; L347-C350 WeakPolarHBondContact O-CB 3.46Å; L347-C350 PolarHBondContact O-N 2.83Å; I348-C350 VanDerWaalsContact C-N 3.33Å; I348-C350 PolarHBondContact O-N 3.07Å; C350-T353 PolarHBondContact O-N 2.89Å; C350-F354 WeakPolarHBondContact O-CB 3.17Å; C350-F354 PolarHBondContact O-N 3.28Å |
| 351 | A | 97.7 | Very high | 93.4 | Very high | 1 Ų | 1 | 24.3 Ų | 24.3 | 1% | 0.008 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.1 | -48.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | I291 L295 L347 I348 T353 F354 A355 | I291-A351 HydrophobicContact CG2-CB 4.05Å; L295-A351 HydrophobicContact CB-CB 4.01Å; L295-A351 HydrophobicContact CD1-CB 4.01Å; L295-A351 WeakPolarHBondContact CD1-O 3.5Å; L347-A351 WeakPolarHBondContact O-CB 3.46Å; L347-A351 PolarHBondContact O-N 2.93Å; I348-A351 PolarHBondContact O-N 2.93Å; A351-T353 VanDerWaalsContact C-N 3.33Å; A351-T353 PolarHBondContact O-N 3.41Å; A351-F354 PolarHBondContact O-N 2.95Å; A351-A355 WeakPolarHBondContact O-CB 3.29Å; A351-A355 PolarHBondContact O-N 3.47Å |
| 352 | I | 98.1 | Very high | 94.4 | Very high | 68 Ų | 68 | 20.5 Ų | 20.5 | 35% | 0.349 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -58.6 | -48 | 177.2 | -64.7 | 165.6 | 0 | 0 | 0 | 110.3 | C294 S298 I348 I349 A355 C356 | C294-I352 HydrophobicContact CB-CG1 4.47Å; S298-I352 VanDerWaalsContact OG-CG1 3.26Å; S298-I352 WeakPolarHBondContact OG-CG1 3.38Å; I348-I352 HydrophobicContact CG2-CD1 3.62Å; I348-I352 HydrophobicContact CG2-CG1 4.28Å; I348-I352 WeakPolarHBondContact O-CG1 3.27Å; I348-I352 PolarHBondContact O-N 3.28Å; I349-I352 PolarHBondContact O-N 3.19Å; I352-A355 PolarHBondContact O-N 2.68Å; I352-C356 WeakPolarHBondContact O-CB 3.24Å; I352-C356 PolarHBondContact O-N 3.28Å; I352-C356 VanDerWaalsContact O-N 3.1Å; I352-C356 PolarHBondContact O-SG 3.36Å |
| 353 | T | 98.2 | Very high | 94.9 | Very high | 14 Ų | 14 | 17.7 Ų | 17.7 | 9% | 0.086 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -63.2 | -47.9 | -177.4 | -59.4 | 0 | 0 | 0 | 0 | 111.1 | G318 I321 L322 I349 C350 A351 C356 S357 | G318-T353 WeakPolarHBondContact O-CG2 3.42Å; I321-T353 HydrophobicContact CB-CG2 3.77Å; I321-T353 HydrophobicContact CD1-CG2 4.49Å; I321-T353 HydrophobicContact CG2-CG2 3.86Å; I321-T353 WeakPolarHBondContact CG2-OG1 3.24Å; L322-T353 HydrophobicContact CD2-CG2 4.17Å; L322-T353 HydrophobicContact CG-CG2 3.83Å; I349-T353 WeakPolarHBondContact O-CB 3.22Å; I349-T353 PolarHBondContact O-N 3.32Å; I349-T353 PolarHBondContact O-OG1 3.11Å; C350-T353 PolarHBondContact O-N 2.89Å; A351-T353 VanDerWaalsContact C-N 3.33Å; A351-T353 PolarHBondContact O-N 3.41Å; T353-C356 PolarHBondContact O-N 3.41Å; T353-S357 WeakPolarHBondContact O-CB 3.28Å; T353-S357 PolarHBondContact O-N 2.92Å; T353-S357 VanDerWaalsContact O-N 3.09Å; T353-S357 PolarHBondContact O-OG 3.47Å |
| 354 | F | 98.2 | Very high | 95.2 | Very high | 8 Ų | 8 | 17.4 Ų | 17.4 | 4% | 0.035 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -60.9 | -49.3 | 178.9 | -178.6 | -106 | 0 | 0 | 0 | 111.6 | Q261 M266 I270 L295 C350 A351 C356 S357 W358 G359 | Q261-F354 HydrophobicContact CG-CE2 4.21Å; Q261-F354 HydrophobicContact CG-CZ 4.46Å; M266-F354 HydrophobicContact CB-CB 4.43Å; M266-F354 HydrophobicContact CB-CD1 4.2Å; M266-F354 HydrophobicContact CB-CD2 3.6Å; M266-F354 HydrophobicContact CB-CE1 4.35Å; M266-F354 HydrophobicContact CB-CE2 3.76Å; M266-F354 HydrophobicContact CB-CG 3.82Å; M266-F354 HydrophobicContact CB-CZ 4.13Å; M266-F354 HydrophobicContact CE-CB 3.82Å; M266-F354 HydrophobicContact CE-CD1 4.45Å; M266-F354 HydrophobicContact CE-CG 4.18Å; M266-F354 HydrophobicContact CG-CB 3.76Å; M266-F354 HydrophobicContact CG-CD1 4.44Å; M266-F354 HydrophobicContact CG-CD2 3.42Å; M266-F354 VanDerWaalsContact CG-CD2 3.42Å; M266-F354 HydrophobicContact CG-CE2 4.08Å; M266-F354 HydrophobicContact CG-CG 3.62Å; M266-F354 HydrophobicContact SD-CB 4.07Å; M266-F354 HydrophobicContact SD-CG 4.48Å; I270-F354 HydrophobicContact CD1-CE1 4.46Å; L295-F354 HydrophobicContact CD1-CD1 4.34Å; C350-F354 WeakPolarHBondContact O-CB 3.17Å; C350-F354 PolarHBondContact O-N 3.28Å; A351-F354 PolarHBondContact O-N 2.95Å; F354-C356 VanDerWaalsContact C-N 3.26Å; F354-C356 PolarHBondContact O-N 3.22Å; F354-S357 CarbonylContact O-C 3.22Å; F354-S357 PolarHBondContact O-N 3.34Å; F354-S357 VanDerWaalsContact O-N 3.1Å; F354-W358 HydrophobicContact CD2-CB 3.81Å; F354-W358 HydrophobicContact CE2-CB 3.95Å; F354-W358 PolarHBondContact O-N 3.15Å; F354-G359 WeakPolarHBondContact O-CA 3.38Å; F354-G359 PolarHBondContact O-N 2.65Å |
| 355 | A | 97.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -58.1 | -37.8 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | L295 S302 A351 I352 P360 | L295-A355 HydrophobicContact CD1-CB 4.03Å; S302-A355 WeakPolarHBondContact CB-O 3.14Å; S302-A355 PolarHBondContact OG-O 3.12Å; A351-A355 WeakPolarHBondContact O-CB 3.29Å; A351-A355 PolarHBondContact O-N 3.47Å; I352-A355 PolarHBondContact O-N 2.68Å; A355-P360 WeakPolarHBondContact O-CD 3.42Å |
| 356 | C | 96.5 | Very high | 95.3 | Very high | 24 Ų | 24 | 12.3 Ų | 12.3 | 16% | 0.162 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -84.7 | -5.8 | 179.9 | -70 | 0 | 0 | 0 | 0 | 114.7 | I352 T353 F354 | I352-C356 WeakPolarHBondContact O-CB 3.24Å; I352-C356 PolarHBondContact O-N 3.28Å; I352-C356 VanDerWaalsContact O-N 3.1Å; I352-C356 PolarHBondContact O-SG 3.36Å; T353-C356 PolarHBondContact O-N 3.41Å; F354-C356 VanDerWaalsContact C-N 3.26Å; F354-C356 PolarHBondContact O-N 3.22Å |
| 357 | S | 96.4 | Very high | 95.1 | Very high | 4 Ų | 4 | 12.4 Ų | 12.4 | 3% | 0.028 | 7% | 0.068 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -136.7 | -95.6 | -175.8 | 63.3 | 0 | 0 | 0 | 0 | 112.5 | L314 G318 T353 F354 G359 P360 L361 | L314-S357 VanDerWaalsContact O-CB 3.25Å; L314-S357 WeakPolarHBondContact O-CB 3.45Å; G318-S357 WeakPolarHBondContact CA-OG 3.45Å; T353-S357 WeakPolarHBondContact O-CB 3.28Å; T353-S357 PolarHBondContact O-N 2.92Å; T353-S357 VanDerWaalsContact O-N 3.09Å; T353-S357 PolarHBondContact O-OG 3.47Å; F354-S357 CarbonylContact O-C 3.22Å; F354-S357 PolarHBondContact O-N 3.34Å; F354-S357 VanDerWaalsContact O-N 3.1Å; S357-G359 PolarHBondContact O-N 2.98Å; S357-P360 WeakPolarHBondContact O-CD 3.33Å; S357-L361 VanDerWaalsContact O-CB 3.26Å; S357-L361 WeakPolarHBondContact O-CB 3.45Å; S357-L361 VanDerWaalsContact O-CD1 3.26Å; S357-L361 WeakPolarHBondContact O-CD1 3.35Å; S357-L361 WeakPolarHBondContact O-CG 3.16Å; S357-L361 PolarHBondContact O-N 3.34Å |
| 358 | W | 97.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66 | -19.4 | -171 | -74.7 | 87.7 | 0 | 0 | 0 | 114.4 | L257 L260 Q261 T264 L315 A319 F354 P362 S420 V424 | L257-W358 HydrophobicContact CD2-CH2 4.44Å; L257-W358 HydrophobicContact CD2-CZ3 4.27Å; L260-W358 HydrophobicContact CB-CH2 4.04Å; L260-W358 HydrophobicContact CB-CZ3 3.74Å; L260-W358 HydrophobicContact CD1-CH2 4.39Å; Q261-W358 HydrophobicContact CB-CE3 4.34Å; Q261-W358 WeakPolarHBondContact CG-O 3.43Å; Q261-W358 PolarHBondContact NE2-O 3.45Å; T264-W358 HydrophobicContact CG2-CB 4.19Å; T264-W358 HydrophobicContact CG2-CD2 4.04Å; T264-W358 HydrophobicContact CG2-CE3 4.3Å; T264-W358 HydrophobicContact CG2-CG 3.99Å; L315-W358 HydrophobicContact CB-CZ2 4.29Å; L315-W358 HydrophobicContact CD2-CD2 3.6Å; L315-W358 HydrophobicContact CD2-CE3 3.83Å; L315-W358 HydrophobicContact CD2-CG 4Å; L315-W358 HydrophobicContact CD2-CH2 4.3Å; L315-W358 HydrophobicContact CD2-CZ2 4.09Å; L315-W358 HydrophobicContact CD2-CZ3 4.18Å; L315-W358 PolarHBondContact O-NE1 3.46Å; A319-W358 HydrophobicContact CB-CZ2 4.08Å; F354-W358 HydrophobicContact CD2-CB 3.81Å; F354-W358 HydrophobicContact CE2-CB 3.95Å; F354-W358 PolarHBondContact O-N 3.15Å; W358-P362 HydrophobicContact CE3-CG 4.38Å; W358-P362 WeakPolarHBondContact O-CD 3.4Å; W358-P362 WeakPolarHBondContact O-CG 3.45Å; W358-S420 VanDerWaalsContact CZ2-OG 3.23Å; W358-S420 WeakPolarHBondContact CZ2-OG 3.01Å; W358-V424 HydrophobicContact CH2-CG2 3.77Å; W358-V424 HydrophobicContact CZ2-CG2 3.97Å |
| 359 | G | 95.8 | Very high | 94.1 | Very high | 3 Ų | 3 | 16.9 Ų | 16.9 | 3% | 0.031 | 9% | 0.093 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -70.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q142 Q261 F354 S357 | Q142-G359 PolarHBondContact OE1-O 3.38Å; Q261-G359 PolarHBondContact NE2-O 2.68Å; F354-G359 WeakPolarHBondContact O-CA 3.38Å; F354-G359 PolarHBondContact O-N 2.65Å; S357-G359 PolarHBondContact O-N 2.98Å |
| 360 | P | 94.9 | Very high | 93.4 | Very high | 3 Ų | 3 | 14.6 Ų | 14.6 | 2% | 0.019 | 8% | 0.081 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -28.3 | -175.4 | 29.7 | -35.1 | 0 | 0 | 0 | 114.3 | Q142 V306 A355 S357 L363 L364 | Q142-P360 HydrophobicContact CB-CB 4.16Å; V306-P360 HydrophobicContact CG2-CG 4.14Å; A355-P360 WeakPolarHBondContact O-CD 3.42Å; S357-P360 WeakPolarHBondContact O-CD 3.33Å; P360-L363 PolarHBondContact O-N 2.91Å; P360-L364 HydrophobicContact CB-CD1 4.11Å; P360-L364 WeakPolarHBondContact O-CG 3.12Å; P360-L364 PolarHBondContact O-N 2.88Å; P360-L364 VanDerWaalsContact O-N 3.08Å |
| 361 | L | 94.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -66.7 | -43.5 | -163.9 | -71.1 | 175.6 | 0 | 0 | 0 | 115.4 | V306 W311 L314 L315 S357 L363 L364 I365 | V306-L361 HydrophobicContact CB-CD2 4.48Å; V306-L361 HydrophobicContact CG1-CD2 3.7Å; V306-L361 HydrophobicContact CG2-CD2 4.01Å; V306-L361 HydrophobicContact CG2-CG 4.49Å; W311-L361 HydrophobicContact CB-CD2 4Å; W311-L361 HydrophobicContact CD2-CD2 4.16Å; W311-L361 HydrophobicContact CG-CD2 3.73Å; L314-L361 HydrophobicContact CB-CD1 3.62Å; L314-L361 HydrophobicContact CD1-CD1 4.26Å; L315-L361 HydrophobicContact CD2-CB 3.92Å; L315-L361 HydrophobicContact CD2-CD1 3.93Å; L315-L361 HydrophobicContact CG-CB 4.27Å; L315-L361 HydrophobicContact CG-CD1 3.75Å; S357-L361 VanDerWaalsContact O-CB 3.26Å; S357-L361 WeakPolarHBondContact O-CB 3.45Å; S357-L361 VanDerWaalsContact O-CD1 3.26Å; S357-L361 WeakPolarHBondContact O-CD1 3.35Å; S357-L361 WeakPolarHBondContact O-CG 3.16Å; S357-L361 PolarHBondContact O-N 3.34Å; L361-L363 VanDerWaalsContact C-N 3.29Å; L361-L363 PolarHBondContact O-N 3.25Å; L361-L364 HydrophobicContact CD2-CD1 4.36Å; L361-L364 PolarHBondContact O-N 3.49Å; L361-I365 WeakPolarHBondContact O-CB 3.44Å; L361-I365 VanDerWaalsContact O-CG1 3.27Å; L361-I365 WeakPolarHBondContact O-CG1 3.17Å; L361-I365 PolarHBondContact O-N 3.35Å |
| 362 | P | 94.5 | Very high | 90.7 | Very high | 1 Ų | 1 | 19.2 Ų | 19.2 | 1% | 0.006 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.2 | -38.4 | 178.3 | -28.1 | 38.2 | 0 | 0 | 0 | 113.4 | L257 M258 Q261 W358 T366 | L257-P362 HydrophobicContact CB-CB 4.47Å; M258-P362 HydrophobicContact CE-CB 4.12Å; M258-P362 HydrophobicContact SD-CB 3.85Å; Q261-P362 HydrophobicContact CB-CG 4.07Å; Q261-P362 HydrophobicContact CG-CG 4.16Å; W358-P362 HydrophobicContact CE3-CG 4.38Å; W358-P362 WeakPolarHBondContact O-CD 3.4Å; W358-P362 WeakPolarHBondContact O-CG 3.45Å; P362-T366 PolarHBondContact O-N 2.99Å; P362-T366 VanDerWaalsContact O-N 3.14Å; P362-T366 PolarHBondContact O-OG1 3.26Å |
| 363 | L | 92.7 | Very high | 89.2 | Confident | 27 Ų | 27 | 20.4 Ų | 20.4 | 14% | 0.141 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -67.5 | -47.4 | 174.1 | -177.4 | 64.1 | 0 | 0 | 0 | 110.8 | V122 F141 P360 L361 I365 T366 L367 | V122-L363 HydrophobicContact CG1-CD1 4.21Å; V122-L363 HydrophobicContact CG2-CD2 4.09Å; F141-L363 HydrophobicContact CD2-CD2 4.34Å; P360-L363 PolarHBondContact O-N 2.91Å; L361-L363 VanDerWaalsContact C-N 3.29Å; L361-L363 PolarHBondContact O-N 3.25Å; L363-I365 VanDerWaalsContact C-N 3.34Å; L363-I365 PolarHBondContact O-N 3.44Å; L363-T366 WeakPolarHBondContact O-CA 3.26Å; L363-T366 VanDerWaalsContact O-CB 3.25Å; L363-T366 WeakPolarHBondContact O-CB 3.15Å; L363-T366 PolarHBondContact O-N 3.39Å; L363-L367 HydrophobicContact CG-CD1 4.35Å; L363-L367 WeakPolarHBondContact O-CG 3.36Å; L363-L367 PolarHBondContact O-N 2.73Å |
| 364 | L | 91.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.3 | -42.9 | 177.8 | -75.7 | 170.8 | 0 | 0 | 0 | 113 | V135 V306 W311 P360 L361 T366 L367 E368 | V135-L364 HydrophobicContact CG1-CD2 4.23Å; V306-L364 HydrophobicContact CG1-CD1 3.53Å; W311-L364 HydrophobicContact CH2-CB 4.22Å; W311-L364 HydrophobicContact CZ3-CB 4.49Å; P360-L364 HydrophobicContact CB-CD1 4.11Å; P360-L364 WeakPolarHBondContact O-CG 3.12Å; P360-L364 PolarHBondContact O-N 2.88Å; P360-L364 VanDerWaalsContact O-N 3.08Å; L361-L364 HydrophobicContact CD2-CD1 4.36Å; L361-L364 PolarHBondContact O-N 3.49Å; L364-T366 VanDerWaalsContact C-N 3.25Å; L364-T366 PolarHBondContact O-N 3.14Å; L364-L367 PolarHBondContact O-N 2.99Å; L364-L367 VanDerWaalsContact O-N 3.14Å; L364-E368 PolarHBondContact O-N 3.07Å |
| 365 | I | 91.3 | Very high | 87.5 | Confident | 12 Ų | 12 | 22.1 Ų | 22.1 | 6% | 0.062 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -61.2 | -38.2 | 175.4 | -69.5 | 166.2 | 0 | 0 | 0 | 110.4 | L257 W311 L315 L361 L363 S369 | L257-I365 HydrophobicContact CD1-CB 4.44Å; L257-I365 HydrophobicContact CD1-CD1 3.91Å; L257-I365 HydrophobicContact CD1-CG2 3.97Å; W311-I365 HydrophobicContact CE3-CG1 3.79Å; W311-I365 HydrophobicContact CZ3-CG1 4.17Å; L315-I365 HydrophobicContact CD1-CD1 3.81Å; L361-I365 WeakPolarHBondContact O-CB 3.44Å; L361-I365 VanDerWaalsContact O-CG1 3.27Å; L361-I365 WeakPolarHBondContact O-CG1 3.17Å; L361-I365 PolarHBondContact O-N 3.35Å; L363-I365 VanDerWaalsContact C-N 3.34Å; L363-I365 PolarHBondContact O-N 3.44Å; I365-S369 WeakPolarHBondContact O-CB 3.4Å; I365-S369 PolarHBondContact O-N 2.76Å; I365-S369 PolarHBondContact O-OG 3.17Å |
| 366 | T | 90.4 | Very high | 87.1 | Confident | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.2 | -46.3 | 174.1 | -57.6 | 0 | 0 | 0 | 0 | 111.3 | I254 P362 L363 L364 E368 S369 A378 I379 | I254-T366 HydrophobicContact CD1-CG2 4.11Å; I254-T366 HydrophobicContact CG2-CG2 4.34Å; I254-T366 VanDerWaalsContact CG2-OG1 3.26Å; I254-T366 WeakPolarHBondContact CG2-OG1 3.33Å; P362-T366 PolarHBondContact O-N 2.99Å; P362-T366 VanDerWaalsContact O-N 3.14Å; P362-T366 PolarHBondContact O-OG1 3.26Å; L363-T366 WeakPolarHBondContact O-CA 3.26Å; L363-T366 VanDerWaalsContact O-CB 3.25Å; L363-T366 WeakPolarHBondContact O-CB 3.15Å; L363-T366 PolarHBondContact O-N 3.39Å; L364-T366 VanDerWaalsContact C-N 3.25Å; L364-T366 PolarHBondContact O-N 3.14Å; T366-E368 PolarHBondContact O-N 3.47Å; T366-S369 PolarHBondContact O-N 2.94Å; T366-A378 HydrophobicContact CG2-CB 4.26Å; T366-I379 HydrophobicContact CG2-CG1 4.27Å |
| 367 | L | 87.6 | Confident | 86.7 | Confident | 4 Ų | 4 | 25 Ų | 25 | 2% | 0.021 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -66.5 | -34 | -178 | -66.4 | 179.3 | 0 | 0 | 0 | 113.6 | V122 Y126 L363 L364 L375 I379 | V122-L367 HydrophobicContact CG1-CD1 4.24Å; V122-L367 HydrophobicContact CG1-CD2 3.67Å; V122-L367 HydrophobicContact CG1-CG 4.44Å; Y126-L367 HydrophobicContact CD2-CB 4.17Å; Y126-L367 HydrophobicContact CD2-CD1 4.49Å; Y126-L367 HydrophobicContact CD2-CD2 3.85Å; Y126-L367 HydrophobicContact CD2-CG 4.39Å; Y126-L367 HydrophobicContact CE2-CB 3.86Å; Y126-L367 HydrophobicContact CE2-CD2 4.24Å; Y126-L367 VanDerWaalsContact CE2-O 3.29Å; Y126-L367 WeakPolarHBondContact CE2-O 3.46Å; Y126-L367 PolarHBondContact OH-O 3.43Å; L363-L367 HydrophobicContact CG-CD1 4.35Å; L363-L367 WeakPolarHBondContact O-CG 3.36Å; L363-L367 PolarHBondContact O-N 2.73Å; L364-L367 PolarHBondContact O-N 2.99Å; L364-L367 VanDerWaalsContact O-N 3.14Å; L367-L375 HydrophobicContact CD2-CD1 3.97Å; L367-I379 HydrophobicContact CD2-CD1 3.57Å; L367-I379 HydrophobicContact CD2-CG1 3.92Å |
| 368 | E | 85.4 | Confident | 86.4 | Confident | 84 Ų | 84 | 24.8 Ų | 24.8 | 39% | 0.393 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -85.9 | -27.1 | 177.4 | -68.3 | -53.9 | 140.2 | 0 | 0 | 113.3 | V135 W311 L364 T366 F370 | V135-E368 HydrophobicContact CG2-CG 4.41Å; V135-E368 WeakPolarHBondContact CG2-OE1 3.29Å; W311-E368 HydrophobicContact CH2-CB 4.39Å; W311-E368 HydrophobicContact CH2-CG 3.5Å; W311-E368 HydrophobicContact CZ3-CB 4.22Å; W311-E368 HydrophobicContact CZ3-CG 3.82Å; L364-E368 PolarHBondContact O-N 3.07Å; T366-E368 PolarHBondContact O-N 3.47Å; E368-F370 VanDerWaalsContact C-N 3.27Å; E368-F370 PolarHBondContact O-N 3.46Å |
| 369 | S | 83.2 | Confident | 86.2 | Confident | 45 Ų | 45 | 24.8 Ų | 24.8 | 32% | 0.315 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -73.5 | -21 | -178.4 | -63.4 | 0 | 0 | 0 | 0 | 113.1 | I365 T366 | I365-S369 WeakPolarHBondContact O-CB 3.4Å; I365-S369 PolarHBondContact O-N 2.76Å; I365-S369 PolarHBondContact O-OG 3.17Å; T366-S369 PolarHBondContact O-N 2.94Å |
| 370 | F | 81.9 | Confident | 86.1 | Confident | 9 Ų | 9 | 26.3 Ų | 26.3 | 4% | 0.039 | 15% | 0.151 | C | C | . | . | S | Bend | trans | -124.5 | 125.2 | -174.1 | -70.5 | -94.1 | 0 | 0 | 0 | 111.3 | Y126 S247 K250 L251 I254 E368 N374 L375 A378 | Y126-F370 PolarHBondContact OH-O 3.25Å; S247-F370 WeakPolarHBondContact OG-CE1 3.49Å; K250-F370 HydrophobicContact CB-CE2 3.94Å; K250-F370 HydrophobicContact CB-CZ 3.71Å; L251-F370 HydrophobicContact CB-CZ 4.46Å; L251-F370 HydrophobicContact CD2-CE1 3.95Å; L251-F370 HydrophobicContact CD2-CE2 4.25Å; L251-F370 HydrophobicContact CD2-CZ 3.61Å; L251-F370 HydrophobicContact CG-CE1 3.95Å; L251-F370 HydrophobicContact CG-CZ 3.59Å; I254-F370 HydrophobicContact CD1-CD2 3.74Å; I254-F370 HydrophobicContact CD1-CE2 3.24Å; I254-F370 HydrophobicContact CD1-CZ 4.29Å; E368-F370 VanDerWaalsContact C-N 3.27Å; E368-F370 PolarHBondContact O-N 3.46Å; F370-N374 HydrophobicContact CD1-CB 3.82Å; F370-L375 HydrophobicContact CB-CD1 4.27Å; F370-A378 HydrophobicContact CB-CB 4.14Å; F370-A378 HydrophobicContact CD1-CB 3.83Å; F370-A378 HydrophobicContact CD2-CB 3.74Å; F370-A378 HydrophobicContact CE1-CB 4.22Å; F370-A378 HydrophobicContact CE2-CB 4.23Å; F370-A378 HydrophobicContact CG-CB 3.58Å; F370-A378 HydrophobicContact CZ-CB 4.44Å |
| 371 | G | 71.8 | Confident | 86.1 | Confident | 51 Ų | 51 | 26.8 Ų | 26.8 | 53% | 0.526 | 15% | 0.154 | S | C | . | . | trans | -72.4 | 170.9 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V373 N374 L375 | G371-V373 PolarHBondContact O-N 3.29Å; G371-N374 PolarHBondContact O-N 2.92Å; G371-N374 VanDerWaalsContact O-N 3.16Å; G371-L375 WeakPolarHBondContact O-CB 3.47Å; G371-L375 PolarHBondContact O-N 3.25Å; G371-L375 VanDerWaalsContact O-N 3.08Å | ||
| 372 | T | 67 | Low | 86.2 | Confident | 47 Ų | 47 | 26.8 Ų | 26.8 | 29% | 0.288 | 15% | 0.154 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -27.8 | -171.7 | 52.9 | 0 | 0 | 0 | 0 | 115.3 | Y126 E187 | Y126-T372 HydrophobicContact CE1-CG2 4.25Å; E187-T372 WeakPolarHBondContact OE2-CG2 3.19Å |
| 373 | V | 66.7 | Low | 86.3 | Confident | 93 Ų | 93 | 28 Ų | 28 | 56% | 0.564 | 16% | 0.16 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | -39.3 | -177.9 | -178.4 | 0 | 0 | 0 | 0 | 113.1 | S236 G371 | S236-V373 PolarHBondContact OG-O 2.91Å; G371-V373 PolarHBondContact O-N 3.29Å |
| 374 | N | 78.5 | Confident | 86.5 | Confident | 58 Ų | 58 | 27.2 Ų | 27.2 | 31% | 0.31 | 16% | 0.157 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -111.1 | -3.8 | -175.9 | -71.2 | -21.4 | 0 | 0 | 0 | 112.9 | F370 G371 N376 Y377 A378 | F370-N374 HydrophobicContact CD1-CB 3.82Å; G371-N374 PolarHBondContact O-N 2.92Å; G371-N374 VanDerWaalsContact O-N 3.16Å; N374-N376 PolarHBondContact O-N 3.44Å; N374-Y377 PolarHBondContact O-N 2.7Å; N374-A378 WeakPolarHBondContact O-CB 3.21Å; N374-A378 PolarHBondContact O-N 3.28Å |
| 375 | L | 82.6 | Confident | 86.8 | Confident | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -57.2 | -46.1 | -175.9 | -176 | 81 | 0 | 0 | 0 | 112.4 | Y126 L367 F370 G371 Y377 A378 I379 | Y126-L375 HydrophobicContact CD1-CD1 4.37Å; Y126-L375 HydrophobicContact CD1-CD2 3.05Å; Y126-L375 HydrophobicContact CD1-CG 4.27Å; Y126-L375 HydrophobicContact CD2-CD2 4.26Å; Y126-L375 HydrophobicContact CE1-CD1 4.06Å; Y126-L375 HydrophobicContact CE1-CD2 3.41Å; Y126-L375 VanDerWaalsContact CE1-CD2 3.41Å; Y126-L375 HydrophobicContact CE1-CG 4.27Å; Y126-L375 HydrophobicContact CE2-CD1 4.26Å; Y126-L375 HydrophobicContact CG-CD2 3.5Å; L367-L375 HydrophobicContact CD2-CD1 3.97Å; F370-L375 HydrophobicContact CB-CD1 4.27Å; G371-L375 WeakPolarHBondContact O-CB 3.47Å; G371-L375 PolarHBondContact O-N 3.25Å; G371-L375 VanDerWaalsContact O-N 3.08Å; L375-Y377 VanDerWaalsContact C-N 3.32Å; L375-Y377 PolarHBondContact O-N 3.41Å; L375-A378 PolarHBondContact O-N 3.01Å; L375-A378 VanDerWaalsContact O-N 3.07Å; L375-I379 HydrophobicContact CD1-CD1 3.89Å; L375-I379 HydrophobicContact CD1-CG1 4.22Å; L375-I379 HydrophobicContact CD2-CD1 3.86Å; L375-I379 HydrophobicContact CG-CD1 3.52Å; L375-I379 HydrophobicContact CG-CG1 4.15Å; L375-I379 WeakPolarHBondContact O-CG1 3.35Å; L375-I379 PolarHBondContact O-N 3.1Å |
| 376 | N | 87.6 | Confident | 87.1 | Confident | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.005 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.5 | -43.2 | -174.2 | -63.2 | -1.9 | 0 | 0 | 0 | 110.9 | T60 I123 E127 Y237 N374 K380 | T60-N376 HydrophobicContact CG2-CB 4.32Å; I123-N376 HydrophobicContact CD1-CB 4.24Å; I123-N376 WeakPolarHBondContact CG2-OD1 3.45Å; E127-N376 PolarHBondContact OE1-ND2 3.04Å; Y237-N376 HydrophobicContact CD1-CB 4.19Å; Y237-N376 HydrophobicContact CE1-CB 4.14Å; Y237-N376 WeakPolarHBondContact CE1-ND2 3.33Å; Y237-N376 VanDerWaalsContact CZ-ND2 3.28Å; Y237-N376 PolarHBondContact OH-ND2 3.35Å; N374-N376 PolarHBondContact O-N 3.44Å; N376-K380 WeakPolarHBondContact O-CB 3.42Å; N376-K380 PolarHBondContact O-N 3.12Å |
| 377 | Y | 88.5 | Confident | 87.5 | Confident | 83 Ų | 83 | 29.1 Ų | 29.1 | 33% | 0.325 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64 | -43.8 | 173.2 | 179.5 | -93.9 | 0 | 0 | 0 | 112.1 | L251 N374 L375 S381 | L251-Y377 HydrophobicContact CD1-CD1 4.33Å; L251-Y377 HydrophobicContact CD1-CE1 3.85Å; L251-Y377 HydrophobicContact CD2-CE1 4.46Å; N374-Y377 PolarHBondContact O-N 2.7Å; L375-Y377 VanDerWaalsContact C-N 3.32Å; L375-Y377 PolarHBondContact O-N 3.41Å; Y377-S381 VanDerWaalsContact O-CB 3.31Å; Y377-S381 WeakPolarHBondContact O-CB 3.4Å; Y377-S381 PolarHBondContact O-N 3.47Å; Y377-S381 PolarHBondContact O-OG 2.98Å |
| 378 | A | 91.1 | Very high | 88 | Confident | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63 | -47.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L251 T366 F370 N374 L375 S381 S382 | L251-A378 HydrophobicContact CD2-CB 4.07Å; T366-A378 HydrophobicContact CG2-CB 4.26Å; F370-A378 HydrophobicContact CB-CB 4.14Å; F370-A378 HydrophobicContact CD1-CB 3.83Å; F370-A378 HydrophobicContact CD2-CB 3.74Å; F370-A378 HydrophobicContact CE1-CB 4.22Å; F370-A378 HydrophobicContact CE2-CB 4.23Å; F370-A378 HydrophobicContact CG-CB 3.58Å; F370-A378 HydrophobicContact CZ-CB 4.44Å; N374-A378 WeakPolarHBondContact O-CB 3.21Å; N374-A378 PolarHBondContact O-N 3.28Å; L375-A378 PolarHBondContact O-N 3.01Å; L375-A378 VanDerWaalsContact O-N 3.07Å; A378-S381 PolarHBondContact O-OG 3.44Å; A378-S382 WeakPolarHBondContact O-CB 3.44Å; A378-S382 PolarHBondContact O-N 3.08Å; A378-S382 PolarHBondContact O-OG 3.49Å |
| 379 | I | 93.2 | Very high | 88.6 | Confident | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.3 | -47.7 | 177.5 | -62.8 | 166.1 | 0 | 0 | 0 | 110.5 | T119 V122 I123 T366 L367 L375 S381 S382 L383 | T119-I379 HydrophobicContact CG2-CG2 4.11Å; V122-I379 HydrophobicContact CB-CG2 4.34Å; V122-I379 HydrophobicContact CG1-CD1 3.78Å; V122-I379 HydrophobicContact CG1-CG1 4.37Å; V122-I379 HydrophobicContact CG1-CG2 4.09Å; I123-I379 HydrophobicContact CG1-CB 4.28Å; I123-I379 HydrophobicContact CG1-CD1 3.63Å; I123-I379 HydrophobicContact CG1-CG2 4.27Å; T366-I379 HydrophobicContact CG2-CG1 4.27Å; L367-I379 HydrophobicContact CD2-CD1 3.57Å; L367-I379 HydrophobicContact CD2-CG1 3.92Å; L375-I379 HydrophobicContact CD1-CD1 3.89Å; L375-I379 HydrophobicContact CD1-CG1 4.22Å; L375-I379 HydrophobicContact CD2-CD1 3.86Å; L375-I379 HydrophobicContact CG-CD1 3.52Å; L375-I379 HydrophobicContact CG-CG1 4.15Å; L375-I379 WeakPolarHBondContact O-CG1 3.35Å; L375-I379 PolarHBondContact O-N 3.1Å; I379-S381 PolarHBondContact O-N 3.38Å; I379-S382 PolarHBondContact O-N 2.94Å; I379-S382 PolarHBondContact O-OG 3.46Å; I379-S382 VanDerWaalsContact O-OG 3.11Å; I379-L383 HydrophobicContact CG2-CD1 3.76Å; I379-L383 HydrophobicContact CG2-CG 4.3Å; I379-L383 WeakPolarHBondContact O-CB 3.44Å; I379-L383 WeakPolarHBondContact O-CG 3.33Å; I379-L383 PolarHBondContact O-N 2.99Å |
| 380 | K | 94 | Very high | 89.4 | Confident | 35 Ų | 35 | 27.5 Ų | 27.5 | 15% | 0.152 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -53.9 | -55.2 | 177.7 | -177.3 | -164.6 | 70.9 | -175.9 | 0 | 111.3 | S56 T60 T119 N376 T384 | S56-K380 WeakPolarHBondContact O-CG 3.39Å; T60-K380 HydrophobicContact CG2-CD 4.27Å; T60-K380 VanDerWaalsContact OG1-CB 3.28Å; T60-K380 WeakPolarHBondContact OG1-CB 2.99Å; T60-K380 VanDerWaalsContact OG1-CD 3.32Å; T60-K380 WeakPolarHBondContact OG1-CD 3.45Å; T60-K380 WeakPolarHBondContact OG1-CG 3.35Å; T119-K380 HydrophobicContact CG2-CB 4.47Å; N376-K380 WeakPolarHBondContact O-CB 3.42Å; N376-K380 PolarHBondContact O-N 3.12Å; K380-T384 WeakPolarHBondContact O-CB 3.49Å; K380-T384 PolarHBondContact O-N 3.2Å; K380-T384 PolarHBondContact O-OG1 3.19Å |
| 381 | S | 94.8 | Very high | 90.1 | Very high | 13 Ų | 13 | 29.4 Ų | 29.4 | 9% | 0.091 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.7 | -38.5 | -174.5 | 57.3 | 0 | 0 | 0 | 0 | 112.1 | F255 Y377 A378 I379 T384 V385 | F255-S381 WeakPolarHBondContact CE1-OG 3.34Å; Y377-S381 VanDerWaalsContact O-CB 3.31Å; Y377-S381 WeakPolarHBondContact O-CB 3.4Å; Y377-S381 PolarHBondContact O-N 3.47Å; Y377-S381 PolarHBondContact O-OG 2.98Å; A378-S381 PolarHBondContact O-OG 3.44Å; I379-S381 PolarHBondContact O-N 3.38Å; S381-T384 PolarHBondContact O-N 3.34Å; S381-V385 WeakPolarHBondContact O-CG2 3.18Å; S381-V385 PolarHBondContact O-N 2.92Å |
| 382 | S | 95.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.1 | -45.2 | 178 | 71.4 | 0 | 0 | 0 | 0 | 112.3 | A378 I379 V385 G386 | A378-S382 WeakPolarHBondContact O-CB 3.44Å; A378-S382 PolarHBondContact O-N 3.08Å; A378-S382 PolarHBondContact O-OG 3.49Å; I379-S382 PolarHBondContact O-N 2.94Å; I379-S382 PolarHBondContact O-OG 3.46Å; I379-S382 VanDerWaalsContact O-OG 3.11Å; S382-V385 PolarHBondContact O-N 2.89Å; S382-G386 PolarHBondContact O-N 3.01Å |
| 383 | L | 96.6 | Very high | 92.8 | Very high | 26 Ų | 26 | 30.8 Ų | 30.8 | 14% | 0.136 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65.4 | -40.8 | 175.2 | -69.5 | 178 | 0 | 0 | 0 | 111.3 | T119 I379 V385 G386 W387 | T119-L383 HydrophobicContact CG2-CD1 4.19Å; T119-L383 WeakPolarHBondContact OG1-CD1 3.29Å; I379-L383 HydrophobicContact CG2-CD1 3.76Å; I379-L383 HydrophobicContact CG2-CG 4.3Å; I379-L383 WeakPolarHBondContact O-CB 3.44Å; I379-L383 WeakPolarHBondContact O-CG 3.33Å; I379-L383 PolarHBondContact O-N 2.99Å; L383-V385 VanDerWaalsContact C-N 3.33Å; L383-V385 PolarHBondContact O-N 3.17Å; L383-G386 WeakPolarHBondContact O-CA 3.38Å; L383-G386 PolarHBondContact O-N 3.13Å; L383-G386 VanDerWaalsContact O-N 3.13Å; L383-W387 PolarHBondContact O-N 2.93Å |
| 384 | T | 98 | Very high | 94.2 | Very high | 10 Ų | 10 | 26.4 Ų | 26.4 | 6% | 0.061 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -57.2 | -46.5 | 175.2 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | V53 S56 L57 K380 S381 G386 W387 I388 | V53-T384 HydrophobicContact CG1-CG2 4.12Å; S56-T384 PolarHBondContact OG-OG1 2.85Å; L57-T384 HydrophobicContact CD1-CG2 4.25Å; L57-T384 HydrophobicContact CD2-CG2 3.76Å; L57-T384 HydrophobicContact CG-CG2 3.75Å; K380-T384 WeakPolarHBondContact O-CB 3.49Å; K380-T384 PolarHBondContact O-N 3.2Å; K380-T384 PolarHBondContact O-OG1 3.19Å; S381-T384 PolarHBondContact O-N 3.34Å; T384-G386 VanDerWaalsContact C-N 3.33Å; T384-G386 PolarHBondContact O-N 3.41Å; T384-W387 PolarHBondContact O-N 3.35Å; T384-I388 HydrophobicContact CG2-CD1 4Å; T384-I388 HydrophobicContact CG2-CG1 4.48Å; T384-I388 WeakPolarHBondContact O-CG1 3.48Å; T384-I388 PolarHBondContact O-N 2.95Å |
| 385 | V | 97.9 | Very high | 95.1 | Very high | 31 Ų | 31 | 27.2 Ų | 27.2 | 19% | 0.188 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60.6 | -44.6 | 175.8 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | F255 M258 S381 S382 L383 W387 I388 V389 | F255-V385 HydrophobicContact CB-CG1 4.39Å; F255-V385 HydrophobicContact CB-CG2 4.48Å; F255-V385 HydrophobicContact CD1-CG2 4.04Å; F255-V385 HydrophobicContact CD2-CG2 4.3Å; F255-V385 HydrophobicContact CE1-CG2 4.35Å; F255-V385 HydrophobicContact CG-CG2 4.03Å; M258-V385 HydrophobicContact CB-CG1 4.47Å; S381-V385 WeakPolarHBondContact O-CG2 3.18Å; S381-V385 PolarHBondContact O-N 2.92Å; S382-V385 PolarHBondContact O-N 2.89Å; L383-V385 VanDerWaalsContact C-N 3.33Å; L383-V385 PolarHBondContact O-N 3.17Å; V385-W387 VanDerWaalsContact C-N 3.32Å; V385-W387 PolarHBondContact O-N 2.94Å; V385-I388 PolarHBondContact O-N 2.81Å; V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.48Å; V385-V389 PolarHBondContact O-N 3.4Å |
| 386 | G | 98.1 | Very high | 95.6 | Very high | 5 Ų | 5 | 31.1 Ų | 31.1 | 5% | 0.052 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -55.7 | -45.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q262 S382 L383 T384 G390 | Q262-G386 WeakPolarHBondContact CG-O 3.21Å; S382-G386 PolarHBondContact O-N 3.01Å; L383-G386 WeakPolarHBondContact O-CA 3.38Å; L383-G386 PolarHBondContact O-N 3.13Å; L383-G386 VanDerWaalsContact O-N 3.13Å; T384-G386 VanDerWaalsContact C-N 3.33Å; T384-G386 PolarHBondContact O-N 3.41Å; G386-G390 PolarHBondContact O-N 3.35Å |
| 387 | W | 98.3 | Very high | 95.8 | Very high | 16 Ų | 16 | 31.1 Ų | 31.1 | 6% | 0.061 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.5 | -40 | 177 | -69.1 | 122.7 | 0 | 0 | 0 | 113.4 | F24 L48 N49 V53 L118 L383 T384 V385 G390 F391 | F24-W387 AromaticContact CE1-CH2 3.36Å; F24-W387 HydrophobicContact CE1-CH2 3.36Å; F24-W387 HydrophobicContact CE1-CZ2 4.47Å; F24-W387 AromaticContact CE1-CZ3 3.64Å; F24-W387 HydrophobicContact CE1-CZ3 3.64Å; F24-W387 AromaticContact CZ-CH2 3.59Å; F24-W387 HydrophobicContact CZ-CH2 3.59Å; F24-W387 HydrophobicContact CZ-CZ2 4.34Å; F24-W387 HydrophobicContact CZ-CZ3 4.22Å; L48-W387 HydrophobicContact CG-CZ3 4.39Å; N49-W387 HydrophobicContact CB-CE3 4.19Å; N49-W387 VanDerWaalsContact OD1-CE3 3.31Å; V53-W387 HydrophobicContact CB-CB 4.43Å; V53-W387 HydrophobicContact CG2-CB 3.51Å; L118-W387 HydrophobicContact CD1-CH2 4.37Å; L118-W387 HydrophobicContact CD1-CZ2 3.84Å; L383-W387 PolarHBondContact O-N 2.93Å; T384-W387 PolarHBondContact O-N 3.35Å; V385-W387 VanDerWaalsContact C-N 3.32Å; V385-W387 PolarHBondContact O-N 2.94Å; W387-G390 PolarHBondContact O-N 3.5Å; W387-F391 WeakPolarHBondContact O-CB 3.38Å; W387-F391 PolarHBondContact O-N 3.18Å |
| 388 | I | 98.6 | Very high | 95.9 | Very high | 73 Ų | 73 | 28.5 Ų | 28.5 | 37% | 0.374 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -63.1 | -48.8 | 177 | -69.3 | 168.7 | 0 | 0 | 0 | 110.3 | V53 T384 V385 F391 F392 | V53-I388 HydrophobicContact CG1-CG1 4.27Å; V53-I388 HydrophobicContact CG2-CB 4.49Å; V53-I388 HydrophobicContact CG2-CG1 3.61Å; T384-I388 HydrophobicContact CG2-CD1 4Å; T384-I388 HydrophobicContact CG2-CG1 4.48Å; T384-I388 WeakPolarHBondContact O-CG1 3.48Å; T384-I388 PolarHBondContact O-N 2.95Å; V385-I388 PolarHBondContact O-N 2.81Å; I388-F391 WeakPolarHBondContact O-CB 3.31Å; I388-F391 PolarHBondContact O-N 3.26Å; I388-F392 HydrophobicContact CG2-CD2 4.27Å; I388-F392 HydrophobicContact CG2-CE2 3.95Å; I388-F392 WeakPolarHBondContact O-CD2 3.37Å; I388-F392 PolarHBondContact O-N 3.19Å |
| 389 | V | 98.2 | Very high | 96 | Very high | 26 Ų | 26 | 30.6 Ų | 30.6 | 16% | 0.158 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -67.4 | -41.3 | 179.8 | 179.8 | 0 | 0 | 0 | 0 | 110.2 | T259 Q262 V385 F391 F392 V393 | T259-V389 HydrophobicContact CG2-CG1 4.06Å; T259-V389 HydrophobicContact CG2-CG2 3.93Å; Q262-V389 HydrophobicContact CB-CB 4.14Å; Q262-V389 HydrophobicContact CB-CG1 3.59Å; Q262-V389 HydrophobicContact CG-CB 4.09Å; Q262-V389 HydrophobicContact CG-CG1 4.12Å; V385-V389 HydrophobicContact CG1-CG2 4.41Å; V385-V389 WeakPolarHBondContact O-CG2 3.48Å; V385-V389 PolarHBondContact O-N 3.4Å; V389-F391 VanDerWaalsContact C-N 3.31Å; V389-F391 PolarHBondContact O-N 2.86Å; V389-F392 PolarHBondContact O-N 2.9Å; V389-V393 HydrophobicContact CG1-CG2 4.21Å; V389-V393 WeakPolarHBondContact O-CG2 3.48Å; V389-V393 PolarHBondContact O-N 3.13Å |
| 390 | G | 98.1 | Very high | 96 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -57.3 | -42 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q262 G386 W387 F392 V393 I394 | Q262-G390 VanDerWaalsContact OE1-CA 3.29Å; G386-G390 PolarHBondContact O-N 3.35Å; W387-G390 PolarHBondContact O-N 3.5Å; G390-F392 PolarHBondContact O-N 3.47Å; G390-V393 PolarHBondContact O-N 3.08Å; G390-I394 WeakPolarHBondContact O-CB 2.95Å; G390-I394 VanDerWaalsContact O-CG1 3.25Å; G390-I394 WeakPolarHBondContact O-CG1 2.88Å; G390-I394 PolarHBondContact O-N 3.49Å |
| 391 | F | 98.1 | Very high | 95.8 | Very high | 49 Ų | 49 | 32 Ų | 32 | 22% | 0.215 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -53.8 | -53 | 173.4 | 165.4 | -98.3 | 0 | 0 | 0 | 111.6 | N49 V50 W387 I388 V389 I394 F395 | N49-F391 HydrophobicContact CB-CB 3.7Å; V50-F391 HydrophobicContact CG2-CD2 3.42Å; V50-F391 VanDerWaalsContact CG2-CD2 3.42Å; V50-F391 HydrophobicContact CG2-CE2 3.56Å; V50-F391 HydrophobicContact CG2-CG 4.34Å; W387-F391 WeakPolarHBondContact O-CB 3.38Å; W387-F391 PolarHBondContact O-N 3.18Å; I388-F391 WeakPolarHBondContact O-CB 3.31Å; I388-F391 PolarHBondContact O-N 3.26Å; V389-F391 VanDerWaalsContact C-N 3.31Å; V389-F391 PolarHBondContact O-N 2.86Å; F391-I394 PolarHBondContact O-N 3.26Å; F391-F395 HydrophobicContact CE2-CB 4.39Å; F391-F395 HydrophobicContact CE2-CD2 4.43Å; F391-F395 HydrophobicContact CZ-CB 4.4Å; F391-F395 HydrophobicContact CZ-CD2 4.42Å; F391-F395 HydrophobicContact CZ-CG 4.31Å; F391-F395 WeakPolarHBondContact O-CB 3.28Å; F391-F395 PolarHBondContact O-N 2.88Å |
| 392 | F | 97.8 | Very high | 95.5 | Very high | 112 Ų | 112 | 35.1 Ų | 35.1 | 49% | 0.491 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -64.9 | -43.9 | -179.2 | -72.7 | -70.1 | 0 | 0 | 0 | 112.1 | I388 V389 G390 I394 F395 I396 | I388-F392 HydrophobicContact CG2-CD2 4.27Å; I388-F392 HydrophobicContact CG2-CE2 3.95Å; I388-F392 WeakPolarHBondContact O-CD2 3.37Å; I388-F392 PolarHBondContact O-N 3.19Å; V389-F392 PolarHBondContact O-N 2.9Å; G390-F392 PolarHBondContact O-N 3.47Å; F392-I394 VanDerWaalsContact C-N 3.35Å; F392-I394 PolarHBondContact O-N 3.28Å; F392-F395 PolarHBondContact O-N 3.48Å; F392-I396 HydrophobicContact CB-CD1 4.4Å; F392-I396 VanDerWaalsContact O-CB 3.28Å; F392-I396 WeakPolarHBondContact O-CB 3.25Å; F392-I396 WeakPolarHBondContact O-CD1 3.34Å; F392-I396 WeakPolarHBondContact O-CG1 3.3Å; F392-I396 PolarHBondContact O-N 3.32Å |
| 393 | V | 97.2 | Very high | 95.2 | Very high | 16 Ų | 16 | 45 Ų | 45 | 10% | 0.097 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.2 | -44.2 | 179.6 | 167.9 | 0 | 0 | 0 | 0 | 111.4 | L263 V268 V389 G390 F397 F413 | L263-V393 HydrophobicContact CD2-CG2 4.01Å; V268-V393 HydrophobicContact CG2-CG1 3.59Å; V389-V393 HydrophobicContact CG1-CG2 4.21Å; V389-V393 WeakPolarHBondContact O-CG2 3.48Å; V389-V393 PolarHBondContact O-N 3.13Å; G390-V393 PolarHBondContact O-N 3.08Å; V393-F397 PolarHBondContact O-N 3.02Å; V393-F413 HydrophobicContact CG1-CE1 4.25Å; V393-F413 HydrophobicContact CG1-CZ 4.2Å |
| 394 | I | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -74.3 | -41 | 179.3 | -63.7 | -55.3 | 0 | 0 | 0 | 112 | G45 N267 V268 Y271 F272 G390 F391 F392 I396 F397 | G45-I394 VanDerWaalsContact C-CG2 3.43Å; N267-I394 HydrophobicContact CB-CD1 4.38Å; V268-I394 HydrophobicContact CG2-CD1 3.92Å; Y271-I394 HydrophobicContact CD1-CD1 3.9Å; Y271-I394 HydrophobicContact CD1-CG1 3.89Å; Y271-I394 HydrophobicContact CD1-CG2 3.8Å; Y271-I394 HydrophobicContact CD2-CD1 4.19Å; Y271-I394 HydrophobicContact CE1-CD1 4.46Å; Y271-I394 HydrophobicContact CE1-CG1 4.07Å; Y271-I394 HydrophobicContact CE1-CG2 4.33Å; Y271-I394 HydrophobicContact CG-CD1 3.72Å; Y271-I394 HydrophobicContact CG-CG1 4.22Å; F272-I394 HydrophobicContact CE2-CD1 4.25Å; F272-I394 HydrophobicContact CE2-CG2 3.87Å; F272-I394 HydrophobicContact CZ-CG2 3.98Å; G390-I394 WeakPolarHBondContact O-CB 2.95Å; G390-I394 VanDerWaalsContact O-CG1 3.25Å; G390-I394 WeakPolarHBondContact O-CG1 2.88Å; G390-I394 PolarHBondContact O-N 3.49Å; F391-I394 PolarHBondContact O-N 3.26Å; F392-I394 VanDerWaalsContact C-N 3.35Å; F392-I394 PolarHBondContact O-N 3.28Å; I394-I396 VanDerWaalsContact C-N 3.33Å; I394-I396 PolarHBondContact O-N 3.03Å; I394-F397 PolarHBondContact O-N 3.36Å |
| 395 | F | 95.9 | Very high | 94.3 | Very high | 76 Ų | 76 | 49 Ų | 49 | 33% | 0.333 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -67.1 | -33.8 | -179.6 | -177.1 | -96.9 | 0 | 0 | 0 | 112.6 | A42 V43 S46 F391 F392 P399 | A42-F395 HydrophobicContact CB-CD2 4.38Å; A42-F395 WeakPolarHBondContact CB-O 3.42Å; V43-F395 HydrophobicContact CG2-CE2 3.9Å; S46-F395 WeakPolarHBondContact OG-CD2 3.1Å; F391-F395 HydrophobicContact CE2-CB 4.39Å; F391-F395 HydrophobicContact CE2-CD2 4.43Å; F391-F395 HydrophobicContact CZ-CB 4.4Å; F391-F395 HydrophobicContact CZ-CD2 4.42Å; F391-F395 HydrophobicContact CZ-CG 4.31Å; F391-F395 WeakPolarHBondContact O-CB 3.28Å; F391-F395 PolarHBondContact O-N 2.88Å; F392-F395 PolarHBondContact O-N 3.48Å; F395-P399 WeakPolarHBondContact O-CD 3.49Å |
| 396 | I | 94 | Very high | 93.9 | Very high | 81 Ų | 81 | 47.7 Ų | 47.7 | 42% | 0.415 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -77.2 | -27.7 | -179.5 | -68.9 | 167.9 | 0 | 0 | 0 | 111.7 | F392 I394 E398 P399 F400 | F392-I396 HydrophobicContact CB-CD1 4.4Å; F392-I396 VanDerWaalsContact O-CB 3.28Å; F392-I396 WeakPolarHBondContact O-CB 3.25Å; F392-I396 WeakPolarHBondContact O-CD1 3.34Å; F392-I396 WeakPolarHBondContact O-CG1 3.3Å; F392-I396 PolarHBondContact O-N 3.32Å; I394-I396 VanDerWaalsContact C-N 3.33Å; I394-I396 PolarHBondContact O-N 3.03Å; I396-E398 PolarHBondContact O-N 3.26Å; I396-P399 WeakPolarHBondContact O-CD 3.38Å; I396-F400 HydrophobicContact CG2-CB 3.85Å; I396-F400 HydrophobicContact CG2-CD2 4.25Å; I396-F400 HydrophobicContact CG2-CG 4.36Å; I396-F400 WeakPolarHBondContact O-CB 3.03Å; I396-F400 PolarHBondContact O-N 3.42Å |
| 397 | F | 92.7 | Very high | 93.6 | Very high | 1 Ų | 1 | 47.5 Ų | 47.5 | 0% | 0.004 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -47.7 | -66.3 | -171.8 | 176.1 | -110.5 | 0 | 0 | 0 | 113.4 | V268 F272 I276 V393 I394 F400 I401 L409 | V268-F397 HydrophobicContact CB-CD2 4.33Å; V268-F397 HydrophobicContact CG1-CB 4.47Å; V268-F397 HydrophobicContact CG1-CD1 4.29Å; V268-F397 HydrophobicContact CG1-CD2 3.15Å; V268-F397 HydrophobicContact CG1-CE1 4.37Å; V268-F397 HydrophobicContact CG1-CE2 3.26Å; V268-F397 HydrophobicContact CG1-CG 3.73Å; V268-F397 HydrophobicContact CG1-CZ 3.91Å; V268-F397 HydrophobicContact CG2-CB 4.32Å; V268-F397 HydrophobicContact CG2-CD2 4.24Å; V268-F397 HydrophobicContact CG2-CG 4.44Å; F272-F397 HydrophobicContact CB-CD1 4.32Å; F272-F397 HydrophobicContact CB-CE1 3.76Å; F272-F397 HydrophobicContact CB-CZ 4.38Å; F272-F397 HydrophobicContact CD1-CD1 4.21Å; F272-F397 HydrophobicContact CD1-CE1 4.23Å; F272-F397 HydrophobicContact CD2-CB 4.49Å; F272-F397 AromaticContact CD2-CD1 3.28Å; F272-F397 HydrophobicContact CD2-CD1 3.28Å; F272-F397 AromaticContact CD2-CE1 3.63Å; F272-F397 HydrophobicContact CD2-CE1 3.63Å; F272-F397 AromaticContact CD2-CG 3.97Å; F272-F397 HydrophobicContact CD2-CG 3.97Å; F272-F397 HydrophobicContact CE1-CD1 4.33Å; F272-F397 HydrophobicContact CE2-CB 4.02Å; F272-F397 AromaticContact CE2-CD1 3.42Å; F272-F397 HydrophobicContact CE2-CD1 3.42Å; F272-F397 VanDerWaalsContact CE2-CD1 3.42Å; F272-F397 HydrophobicContact CE2-CE1 4.22Å; F272-F397 AromaticContact CE2-CG 3.96Å; F272-F397 HydrophobicContact CE2-CG 3.96Å; F272-F397 AromaticContact CG-CD1 3.7Å; F272-F397 HydrophobicContact CG-CD1 3.7Å; F272-F397 AromaticContact CG-CE1 3.63Å; F272-F397 HydrophobicContact CG-CE1 3.63Å; F272-F397 AromaticContact CZ-CD1 3.97Å; F272-F397 HydrophobicContact CZ-CD1 3.97Å; I276-F397 HydrophobicContact CD1-CZ 4.1Å; I276-F397 HydrophobicContact CG1-CZ 3.94Å; V393-F397 PolarHBondContact O-N 3.02Å; I394-F397 PolarHBondContact O-N 3.36Å; F397-F400 PolarHBondContact O-N 2.92Å; F397-I401 HydrophobicContact CD2-CG2 4.31Å; F397-I401 HydrophobicContact CE1-CD1 4.02Å; F397-I401 HydrophobicContact CE2-CG2 4.04Å; F397-I401 HydrophobicContact CZ-CD1 4.01Å; F397-I401 HydrophobicContact CZ-CG2 4.48Å; F397-I401 WeakPolarHBondContact O-CG2 3.08Å; F397-I401 PolarHBondContact O-N 3.42Å; F397-L409 HydrophobicContact CD2-CD2 3.35Å; F397-L409 HydrophobicContact CE2-CD2 3.84Å; F397-L409 HydrophobicContact CG-CD2 4.43Å |
| 398 | E | 90.2 | Very high | 93.4 | Very high | 29 Ų | 29 | 49.8 Ų | 49.8 | 14% | 0.136 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.5 | -52.3 | -175.8 | -79.7 | -68.8 | 172.2 | 0 | 0 | 112.7 | T38 A41 A42 F272 I396 F400 I401 S402 | T38-E398 HydrophobicContact CG2-CB 3.71Å; T38-E398 WeakPolarHBondContact CG2-O 3.46Å; T38-E398 WeakPolarHBondContact O-CB 3.39Å; A41-E398 HydrophobicContact CB-CG 3.98Å; A42-E398 HydrophobicContact CB-CB 4.04Å; F272-E398 HydrophobicContact CE1-CG 4.17Å; F272-E398 HydrophobicContact CZ-CG 4.37Å; I396-E398 PolarHBondContact O-N 3.26Å; E398-F400 VanDerWaalsContact C-N 3.28Å; E398-F400 PolarHBondContact O-N 3.36Å; E398-I401 WeakPolarHBondContact O-CG1 3.38Å; E398-I401 PolarHBondContact O-N 3.28Å; E398-S402 PolarHBondContact O-N 2.9Å; E398-S402 VanDerWaalsContact O-N 3.12Å |
| 399 | P | 92.6 | Very high | 93.1 | Very high | 44 Ų | 44 | 46.9 Ų | 46.9 | 29% | 0.286 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -58 | -38.9 | 176.2 | -27 | 35.2 | 0 | 0 | 0 | 113.3 | T38 A42 F395 I396 S402 W403 | T38-P399 HydrophobicContact CG2-CG 4.46Å; A42-P399 HydrophobicContact CB-CG 4.2Å; F395-P399 WeakPolarHBondContact O-CD 3.49Å; I396-P399 WeakPolarHBondContact O-CD 3.38Å; P399-S402 PolarHBondContact O-N 3.38Å; P399-S402 PolarHBondContact O-OG 3.26Å; P399-W403 PolarHBondContact O-N 3.46Å; P399-W403 VanDerWaalsContact O-N 3.09Å |
| 400 | F | 92.6 | Very high | 92.9 | Very high | 43 Ų | 43 | 45.7 Ų | 45.7 | 19% | 0.189 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -68.4 | -44 | -177.4 | -171.2 | -84.5 | 0 | 0 | 0 | 112.4 | I396 F397 E398 S402 W403 T404 V408 L409 I412 | I396-F400 HydrophobicContact CG2-CB 3.85Å; I396-F400 HydrophobicContact CG2-CD2 4.25Å; I396-F400 HydrophobicContact CG2-CG 4.36Å; I396-F400 WeakPolarHBondContact O-CB 3.03Å; I396-F400 PolarHBondContact O-N 3.42Å; F397-F400 PolarHBondContact O-N 2.92Å; E398-F400 VanDerWaalsContact C-N 3.28Å; E398-F400 PolarHBondContact O-N 3.36Å; F400-S402 VanDerWaalsContact C-N 3.25Å; F400-S402 PolarHBondContact O-N 3.05Å; F400-W403 PolarHBondContact O-N 3.32Å; F400-T404 WeakPolarHBondContact CD1-OG1 3.43Å; F400-T404 VanDerWaalsContact CE1-OG1 3.25Å; F400-T404 WeakPolarHBondContact CE1-OG1 3.42Å; F400-T404 PolarHBondContact O-N 3.36Å; F400-T404 PolarHBondContact O-OG1 3.44Å; F400-V408 HydrophobicContact CE1-CB 4.3Å; F400-V408 HydrophobicContact CE1-CG1 4.11Å; F400-V408 HydrophobicContact CZ-CG1 4.1Å; F400-L409 HydrophobicContact CD1-CB 3.8Å; F400-L409 HydrophobicContact CD1-CD1 3.85Å; F400-L409 HydrophobicContact CD1-CD2 4.42Å; F400-L409 HydrophobicContact CD1-CG 4.23Å; F400-L409 HydrophobicContact CE1-CB 3.83Å; F400-L409 HydrophobicContact CE1-CD1 4.07Å; F400-L409 HydrophobicContact CG-CD1 4.32Å; F400-I412 HydrophobicContact CE1-CD1 4.2Å; F400-I412 HydrophobicContact CE2-CD1 4.33Å; F400-I412 HydrophobicContact CZ-CD1 3.62Å |
| 401 | I | 90 | Very high | 92.8 | Very high | 20 Ų | 20 | 48 Ų | 48 | 10% | 0.103 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -66.7 | -30.4 | 177 | 66.1 | 175.9 | 0 | 0 | 0 | 111.6 | F279 F397 E398 V406 L409 | F279-I401 HydrophobicContact CE2-CD1 4.23Å; F279-I401 HydrophobicContact CZ-CD1 4.01Å; F397-I401 HydrophobicContact CD2-CG2 4.31Å; F397-I401 HydrophobicContact CE1-CD1 4.02Å; F397-I401 HydrophobicContact CE2-CG2 4.04Å; F397-I401 HydrophobicContact CZ-CD1 4.01Å; F397-I401 HydrophobicContact CZ-CG2 4.48Å; F397-I401 WeakPolarHBondContact O-CG2 3.08Å; F397-I401 PolarHBondContact O-N 3.42Å; E398-I401 WeakPolarHBondContact O-CG1 3.38Å; E398-I401 PolarHBondContact O-N 3.28Å; I401-V406 HydrophobicContact CG2-CB 4.08Å; I401-V406 HydrophobicContact CG2-CG2 4.11Å; I401-L409 HydrophobicContact CG2-CD2 4.02Å |
| 402 | S | 88.4 | Confident | 92.8 | Very high | 79 Ų | 79 | 49.3 Ų | 49.3 | 55% | 0.552 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -71 | -32.1 | 175 | 77.6 | 0 | 0 | 0 | 0 | 113.4 | E398 P399 F400 | E398-S402 PolarHBondContact O-N 2.9Å; E398-S402 VanDerWaalsContact O-N 3.12Å; P399-S402 PolarHBondContact O-N 3.38Å; P399-S402 PolarHBondContact O-OG 3.26Å; F400-S402 VanDerWaalsContact C-N 3.25Å; F400-S402 PolarHBondContact O-N 3.05Å |
| 403 | W | 89.2 | Confident | 92.7 | Very high | 209 Ų | 209 | 44.4 Ų | 44.4 | 79% | 0.792 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -82.4 | -31.2 | 179.2 | -178.9 | 52.8 | 0 | 0 | 0 | 112.8 | P399 F400 | P399-W403 PolarHBondContact O-N 3.46Å; P399-W403 VanDerWaalsContact O-N 3.09Å; F400-W403 PolarHBondContact O-N 3.32Å |
| 404 | T | 88 | Confident | 92.8 | Very high | 58 Ų | 58 | 44.1 Ų | 44.1 | 36% | 0.356 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -123.8 | -108.7 | -175.5 | 59.4 | 0 | 0 | 0 | 0 | 111.4 | F400 | F400-T404 WeakPolarHBondContact CD1-OG1 3.43Å; F400-T404 VanDerWaalsContact CE1-OG1 3.25Å; F400-T404 WeakPolarHBondContact CE1-OG1 3.42Å; F400-T404 PolarHBondContact O-N 3.36Å; F400-T404 PolarHBondContact O-OG1 3.44Å |
| 405 | N | 87.2 | Confident | 92.8 | Very high | 62 Ų | 62 | 49.1 Ų | 49.1 | 33% | 0.332 | 26% | 0.255 | S | S | . | . | trans | -157.2 | 146.6 | 176.4 | -173.3 | -42.6 | 0 | 0 | 0 | 107.5 | S407 V408 | N405-S407 PolarHBondContact O-N 2.99Å; N405-S407 PolarHBondContact OD1-N 3.41Å; N405-S407 PolarHBondContact OD1-OG 2.91Å; N405-V408 HydrophobicContact CB-CG2 4.48Å; N405-V408 PolarHBondContact O-N 3.29Å | ||
| 406 | V | 90.5 | Very high | 92.9 | Very high | 3 Ų | 3 | 46.4 Ų | 46.4 | 2% | 0.018 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -52.1 | -34.5 | 172.8 | 73.9 | 0 | 0 | 0 | 0 | 112.5 | F279 F329 V333 I401 V408 L409 F410 | F279-V406 HydrophobicContact CD1-CG1 4.04Å; F279-V406 HydrophobicContact CD2-CB 4.48Å; F279-V406 HydrophobicContact CD2-CG1 4.35Å; F279-V406 HydrophobicContact CD2-CG2 4.18Å; F279-V406 HydrophobicContact CE1-CB 4.49Å; F279-V406 HydrophobicContact CE1-CG1 4.29Å; F279-V406 HydrophobicContact CE2-CB 4.34Å; F279-V406 HydrophobicContact CE2-CG2 4.13Å; F279-V406 HydrophobicContact CG-CG1 4.09Å; F279-V406 HydrophobicContact CZ-CB 4.35Å; F329-V406 HydrophobicContact CE1-CG1 4.14Å; F329-V406 HydrophobicContact CE1-CG2 3.91Å; F329-V406 HydrophobicContact CZ-CG1 4.06Å; F329-V406 HydrophobicContact CZ-CG2 4.1Å; V333-V406 HydrophobicContact CG1-CG1 3.83Å; V333-V406 HydrophobicContact CG2-CG1 4.38Å; I401-V406 HydrophobicContact CG2-CB 4.08Å; I401-V406 HydrophobicContact CG2-CG2 4.11Å; V406-V408 VanDerWaalsContact C-N 3.35Å; V406-V408 PolarHBondContact O-N 3.4Å; V406-L409 PolarHBondContact O-N 3.39Å; V406-F410 HydrophobicContact CG2-CD2 3.89Å; V406-F410 HydrophobicContact CG2-CE2 3.66Å; V406-F410 WeakPolarHBondContact O-CD2 3.4Å; V406-F410 PolarHBondContact O-N 2.99Å; V406-F410 VanDerWaalsContact O-N 3.14Å |
| 407 | S | 91.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56.5 | -42.7 | 175.1 | -66.2 | 0 | 0 | 0 | 0 | 114.1 | S330 V333 N405 L409 F410 C411 | S330-S407 WeakPolarHBondContact CB-O 2.98Å; S330-S407 PolarHBondContact O-OG 3.13Å; S330-S407 WeakPolarHBondContact OG-CB 3.21Å; S330-S407 PolarHBondContact OG-O 3Å; V333-S407 WeakPolarHBondContact CB-OG 2.98Å; V333-S407 WeakPolarHBondContact CG1-OG 2.8Å; N405-S407 PolarHBondContact O-N 2.99Å; N405-S407 PolarHBondContact OD1-N 3.41Å; N405-S407 PolarHBondContact OD1-OG 2.91Å; S407-L409 VanDerWaalsContact C-N 3.32Å; S407-L409 PolarHBondContact O-N 3.31Å; S407-F410 PolarHBondContact O-N 3.27Å; S407-C411 PolarHBondContact O-N 3.35Å |
| 408 | V | 93.9 | Very high | 93.3 | Very high | 64 Ų | 64 | 46.9 Ų | 46.9 | 39% | 0.388 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -65.6 | -41.4 | -177.7 | 178.3 | 0 | 0 | 0 | 0 | 109.8 | F400 N405 V406 C411 I412 | F400-V408 HydrophobicContact CE1-CB 4.3Å; F400-V408 HydrophobicContact CE1-CG1 4.11Å; F400-V408 HydrophobicContact CZ-CG1 4.1Å; N405-V408 HydrophobicContact CB-CG2 4.48Å; N405-V408 PolarHBondContact O-N 3.29Å; V406-V408 VanDerWaalsContact C-N 3.35Å; V406-V408 PolarHBondContact O-N 3.4Å; V408-C411 WeakPolarHBondContact O-CB 2.88Å; V408-C411 PolarHBondContact O-N 2.91Å; V408-I412 HydrophobicContact CG1-CD1 4.4Å; V408-I412 WeakPolarHBondContact O-CG1 3.49Å; V408-I412 PolarHBondContact O-N 2.86Å |
| 409 | L | 93.9 | Very high | 93.7 | Very high | 12 Ų | 12 | 50.9 Ų | 50.9 | 6% | 0.063 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 178.8 | -173.7 | 62.8 | 0 | 0 | 0 | 112.1 | F397 F400 I401 V406 S407 C411 I412 F413 | F397-L409 HydrophobicContact CD2-CD2 3.35Å; F397-L409 HydrophobicContact CE2-CD2 3.84Å; F397-L409 HydrophobicContact CG-CD2 4.43Å; F400-L409 HydrophobicContact CD1-CB 3.8Å; F400-L409 HydrophobicContact CD1-CD1 3.85Å; F400-L409 HydrophobicContact CD1-CD2 4.42Å; F400-L409 HydrophobicContact CD1-CG 4.23Å; F400-L409 HydrophobicContact CE1-CB 3.83Å; F400-L409 HydrophobicContact CE1-CD1 4.07Å; F400-L409 HydrophobicContact CG-CD1 4.32Å; I401-L409 HydrophobicContact CG2-CD2 4.02Å; V406-L409 PolarHBondContact O-N 3.39Å; S407-L409 VanDerWaalsContact C-N 3.32Å; S407-L409 PolarHBondContact O-N 3.31Å; L409-C411 VanDerWaalsContact C-N 3.31Å; L409-C411 PolarHBondContact O-N 2.97Å; L409-I412 WeakPolarHBondContact O-CA 3.45Å; L409-I412 WeakPolarHBondContact O-CB 3.48Å; L409-I412 PolarHBondContact O-N 2.87Å; L409-F413 HydrophobicContact CD1-CE2 4.24Å; L409-F413 HydrophobicContact CD1-CZ 4.14Å; L409-F413 HydrophobicContact CD2-CE2 4.04Å; L409-F413 HydrophobicContact CD2-CZ 4.38Å; L409-F413 HydrophobicContact CG-CD2 4.29Å; L409-F413 HydrophobicContact CG-CE2 3.74Å; L409-F413 HydrophobicContact CG-CZ 4.13Å; L409-F413 PolarHBondContact O-N 3.36Å |
| 410 | F | 93.8 | Very high | 93.9 | Very high | 1 Ų | 1 | 48.8 Ų | 48.8 | 0% | 0.004 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -68.4 | -30.6 | 177 | -82.4 | -109.7 | 0 | 0 | 0 | 112.3 | I269 I276 H326 F329 V406 S407 I412 F413 S414 | I269-F410 HydrophobicContact CD1-CE1 4.13Å; I269-F410 HydrophobicContact CG1-CE1 4.28Å; I269-F410 HydrophobicContact CG1-CZ 4.27Å; I276-F410 HydrophobicContact CD1-CZ 4.34Å; I276-F410 HydrophobicContact CG2-CZ 4.27Å; H326-F410 HydrophobicContact CB-CD1 4.37Å; H326-F410 WeakPolarHBondContact CB-O 3.33Å; H326-F410 AromaticContact CD2-CD1 3.36Å; H326-F410 WeakPolarHBondContact CD2-CD1 3.18Å; H326-F410 AromaticContact CD2-CE1 3.98Å; F329-F410 HydrophobicContact CB-CD1 4.4Å; F329-F410 HydrophobicContact CD1-CB 3.72Å; F329-F410 AromaticContact CD1-CD1 3.32Å; F329-F410 HydrophobicContact CD1-CD1 3.32Å; F329-F410 AromaticContact CD1-CD2 3.7Å; F329-F410 HydrophobicContact CD1-CD2 3.7Å; F329-F410 AromaticContact CD1-CE1 3.73Å; F329-F410 HydrophobicContact CD1-CE1 3.73Å; F329-F410 HydrophobicContact CD1-CE2 4.06Å; F329-F410 AromaticContact CD1-CG 3.3Å; F329-F410 HydrophobicContact CD1-CG 3.3Å; F329-F410 HydrophobicContact CD1-CZ 4.07Å; F329-F410 HydrophobicContact CE1-CB 4.24Å; F329-F410 AromaticContact CE1-CD1 3.85Å; F329-F410 HydrophobicContact CE1-CD1 3.85Å; F329-F410 AromaticContact CE1-CD2 3.41Å; F329-F410 HydrophobicContact CE1-CD2 3.41Å; F329-F410 VanDerWaalsContact CE1-CD2 3.41Å; F329-F410 AromaticContact CE1-CE1 3.96Å; F329-F410 HydrophobicContact CE1-CE1 3.96Å; F329-F410 AromaticContact CE1-CE2 3.53Å; F329-F410 HydrophobicContact CE1-CE2 3.53Å; F329-F410 AromaticContact CE1-CG 3.57Å; F329-F410 HydrophobicContact CE1-CG 3.57Å; F329-F410 AromaticContact CE1-CZ 3.8Å; F329-F410 HydrophobicContact CE1-CZ 3.8Å; F329-F410 HydrophobicContact CG-CD1 4.13Å; F329-F410 HydrophobicContact CG-CE1 4.39Å; F329-F410 HydrophobicContact CG-CG 4.45Å; F329-F410 HydrophobicContact CZ-CE2 4.32Å; F329-F410 HydrophobicContact CZ-CZ 4.43Å; V406-F410 HydrophobicContact CG2-CD2 3.89Å; V406-F410 HydrophobicContact CG2-CE2 3.66Å; V406-F410 WeakPolarHBondContact O-CD2 3.4Å; V406-F410 PolarHBondContact O-N 2.99Å; V406-F410 VanDerWaalsContact O-N 3.14Å; S407-F410 PolarHBondContact O-N 3.27Å; F410-I412 VanDerWaalsContact C-N 3.32Å; F410-I412 PolarHBondContact O-N 3.32Å; F410-F413 PolarHBondContact O-N 3.42Å; F410-S414 WeakPolarHBondContact O-CB 3.14Å; F410-S414 PolarHBondContact O-N 2.95Å |
| 411 | C | 96.1 | Very high | 94.1 | Very high | 49 Ų | 49 | 47.8 Ų | 47.8 | 33% | 0.331 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.4 | -40.8 | 166.7 | -83.6 | 0 | 0 | 0 | 0 | 112.3 | S330 S407 V408 L409 S414 L415 | S330-C411 PolarHBondContact OG-SG 2.98Å; S407-C411 PolarHBondContact O-N 3.35Å; V408-C411 WeakPolarHBondContact O-CB 2.88Å; V408-C411 PolarHBondContact O-N 2.91Å; L409-C411 VanDerWaalsContact C-N 3.31Å; L409-C411 PolarHBondContact O-N 2.97Å; C411-S414 WeakPolarHBondContact O-CB 3.35Å; C411-S414 PolarHBondContact O-N 3.38Å; C411-L415 PolarHBondContact O-N 3.04Å |
| 412 | I | 96.3 | Very high | 94.3 | Very high | 76 Ų | 76 | 48.2 Ų | 48.2 | 39% | 0.39 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.1 | -42.9 | 176.6 | -65.9 | 166.4 | 0 | 0 | 0 | 110.8 | F400 V408 L409 F410 S414 L415 S416 | F400-I412 HydrophobicContact CE1-CD1 4.2Å; F400-I412 HydrophobicContact CE2-CD1 4.33Å; F400-I412 HydrophobicContact CZ-CD1 3.62Å; V408-I412 HydrophobicContact CG1-CD1 4.4Å; V408-I412 WeakPolarHBondContact O-CG1 3.49Å; V408-I412 PolarHBondContact O-N 2.86Å; L409-I412 WeakPolarHBondContact O-CA 3.45Å; L409-I412 WeakPolarHBondContact O-CB 3.48Å; L409-I412 PolarHBondContact O-N 2.87Å; F410-I412 VanDerWaalsContact C-N 3.32Å; F410-I412 PolarHBondContact O-N 3.32Å; I412-S414 VanDerWaalsContact C-N 3.34Å; I412-L415 PolarHBondContact O-N 3.44Å; I412-S416 WeakPolarHBondContact O-CB 3.38Å; I412-S416 PolarHBondContact O-N 3.42Å; I412-S416 PolarHBondContact O-OG 2.9Å |
| 413 | F | 97.2 | Very high | 94.7 | Very high | 9 Ų | 9 | 46.4 Ų | 46.4 | 4% | 0.039 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.5 | -37.8 | 173.9 | -68.4 | -40.1 | 0 | 0 | 0 | 112.4 | L263 V268 H326 V393 L409 F410 S416 C417 | L263-F413 WeakPolarHBondContact O-CD1 3.41Å; V268-F413 HydrophobicContact CB-CE2 4.31Å; V268-F413 HydrophobicContact CB-CZ 4.43Å; V268-F413 HydrophobicContact CG1-CE2 4.44Å; V268-F413 HydrophobicContact CG2-CE2 4.18Å; V268-F413 HydrophobicContact CG2-CZ 3.84Å; H326-F413 WeakPolarHBondContact CD2-CB 3.38Å; V393-F413 HydrophobicContact CG1-CE1 4.25Å; V393-F413 HydrophobicContact CG1-CZ 4.2Å; L409-F413 HydrophobicContact CD1-CE2 4.24Å; L409-F413 HydrophobicContact CD1-CZ 4.14Å; L409-F413 HydrophobicContact CD2-CE2 4.04Å; L409-F413 HydrophobicContact CD2-CZ 4.38Å; L409-F413 HydrophobicContact CG-CD2 4.29Å; L409-F413 HydrophobicContact CG-CE2 3.74Å; L409-F413 HydrophobicContact CG-CZ 4.13Å; L409-F413 PolarHBondContact O-N 3.36Å; F410-F413 PolarHBondContact O-N 3.42Å; F413-S416 PolarHBondContact O-N 3.5Å; F413-C417 WeakPolarHBondContact O-CB 3.31Å; F413-C417 PolarHBondContact O-N 3.19Å; F413-C417 PolarHBondContact O-SG 2.93Å |
| 414 | S | 97.8 | Very high | 94.9 | Very high | 10 Ų | 10 | 36.5 Ų | 36.5 | 7% | 0.07 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.5 | -48.7 | 174 | -177 | 0 | 0 | 0 | 0 | 111.6 | A323 F410 C411 I412 S416 C417 L418 | A323-S414 WeakPolarHBondContact O-CB 3.32Å; A323-S414 PolarHBondContact O-OG 3.04Å; F410-S414 WeakPolarHBondContact O-CB 3.14Å; F410-S414 PolarHBondContact O-N 2.95Å; C411-S414 WeakPolarHBondContact O-CB 3.35Å; C411-S414 PolarHBondContact O-N 3.38Å; I412-S414 VanDerWaalsContact C-N 3.34Å; S414-S416 VanDerWaalsContact C-N 3.34Å; S414-S416 PolarHBondContact O-N 3.24Å; S414-C417 WeakPolarHBondContact O-CB 3.47Å; S414-C417 PolarHBondContact O-N 3.36Å; S414-L418 PolarHBondContact O-N 3.37Å; S414-L418 VanDerWaalsContact O-N 3.07Å |
| 415 | L | 97.8 | Very high | 95.1 | Very high | 106 Ų | 106 | 35.7 Ų | 35.7 | 56% | 0.555 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -62.7 | -41.3 | 176.1 | -175.4 | 63.9 | 0 | 0 | 0 | 111.8 | C411 I412 C417 L418 L419 | C411-L415 PolarHBondContact O-N 3.04Å; I412-L415 PolarHBondContact O-N 3.44Å; L415-C417 VanDerWaalsContact C-N 3.3Å; L415-C417 PolarHBondContact O-N 3.16Å; L415-L418 PolarHBondContact O-N 3.13Å; L415-L418 VanDerWaalsContact O-N 3.15Å; L415-L419 HydrophobicContact CG-CD1 4.49Å; L415-L419 WeakPolarHBondContact O-CG 2.98Å; L415-L419 PolarHBondContact O-N 2.89Å |
| 416 | S | 97.6 | Very high | 95.2 | Very high | 19 Ų | 19 | 41.2 Ų | 41.2 | 13% | 0.133 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.4 | -38.8 | 176.5 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | L263 I412 F413 S414 L419 S420 | L263-S416 WeakPolarHBondContact O-CB 3.37Å; I412-S416 WeakPolarHBondContact O-CB 3.38Å; I412-S416 PolarHBondContact O-N 3.42Å; I412-S416 PolarHBondContact O-OG 2.9Å; F413-S416 PolarHBondContact O-N 3.5Å; S414-S416 VanDerWaalsContact C-N 3.34Å; S414-S416 PolarHBondContact O-N 3.24Å; S416-L419 PolarHBondContact O-N 3.01Å; S416-S420 WeakPolarHBondContact O-CB 3.39Å; S416-S420 PolarHBondContact O-N 3.49Å |
| 417 | C | 98.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.7 | -43.2 | 173.2 | -70.2 | 0 | 0 | 0 | 0 | 111.6 | A319 A323 F413 S414 L415 L419 S420 C421 | A319-C417 WeakPolarHBondContact O-CB 3.48Å; A323-C417 HydrophobicContact CB-CB 3.77Å; F413-C417 WeakPolarHBondContact O-CB 3.31Å; F413-C417 PolarHBondContact O-N 3.19Å; F413-C417 PolarHBondContact O-SG 2.93Å; S414-C417 WeakPolarHBondContact O-CB 3.47Å; S414-C417 PolarHBondContact O-N 3.36Å; L415-C417 VanDerWaalsContact C-N 3.3Å; L415-C417 PolarHBondContact O-N 3.16Å; C417-L419 PolarHBondContact O-N 3.41Å; C417-S420 WeakPolarHBondContact O-CB 3.44Å; C417-S420 PolarHBondContact O-N 3.3Å; C417-S420 PolarHBondContact O-OG 3.49Å; C417-C421 PolarHBondContact O-N 2.03Å |
| 418 | L | 97.6 | Very high | 94.9 | Very high | 92 Ų | 92 | 44.9 Ų | 44.9 | 48% | 0.482 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63 | -42.3 | 175.7 | -66.3 | 175.9 | 0 | 0 | 0 | 112.3 | A323 S414 L415 S420 C421 G422 | A323-L418 HydrophobicContact CB-CD2 3.83Å; A323-L418 HydrophobicContact CB-CG 3.88Å; S414-L418 PolarHBondContact O-N 3.37Å; S414-L418 VanDerWaalsContact O-N 3.07Å; L415-L418 PolarHBondContact O-N 3.13Å; L415-L418 VanDerWaalsContact O-N 3.15Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.35Å; L418-C421 WeakPolarHBondContact O-CB 3.32Å; L418-C421 PolarHBondContact O-N 3.05Å; L418-G422 PolarHBondContact O-N 3.09Å |
| 419 | L | 97.2 | Very high | 94.1 | Very high | 112 Ų | 112 | 49.1 Ų | 49.1 | 59% | 0.586 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -61.1 | -40.1 | 173.5 | -69.1 | 174.2 | 0 | 0 | 0 | 111.6 | L415 S416 C417 C421 G422 Y423 | L415-L419 HydrophobicContact CG-CD1 4.49Å; L415-L419 WeakPolarHBondContact O-CG 2.98Å; L415-L419 PolarHBondContact O-N 2.89Å; S416-L419 PolarHBondContact O-N 3.01Å; C417-L419 PolarHBondContact O-N 3.41Å; L419-C421 VanDerWaalsContact C-N 3.33Å; L419-C421 PolarHBondContact O-N 3.49Å; L419-G422 PolarHBondContact O-N 3.32Å; L419-Y423 PolarHBondContact O-N 3.45Å |
| 420 | S | 97.1 | Very high | 92.8 | Very high | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.007 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.4 | -39.5 | 176.1 | 83.9 | 0 | 0 | 0 | 0 | 112.1 | A319 W358 S416 C417 L418 Y423 V424 | A319-S420 WeakPolarHBondContact CB-OG 3.29Å; W358-S420 VanDerWaalsContact CZ2-OG 3.23Å; W358-S420 WeakPolarHBondContact CZ2-OG 3.01Å; S416-S420 WeakPolarHBondContact O-CB 3.39Å; S416-S420 PolarHBondContact O-N 3.49Å; C417-S420 WeakPolarHBondContact O-CB 3.44Å; C417-S420 PolarHBondContact O-N 3.3Å; C417-S420 PolarHBondContact O-OG 3.49Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.35Å; S420-Y423 PolarHBondContact O-N 3.46Å; S420-V424 WeakPolarHBondContact O-CB 3.36Å; S420-V424 VanDerWaalsContact O-CG2 3.26Å; S420-V424 WeakPolarHBondContact O-CG2 3.46Å; S420-V424 PolarHBondContact O-N 3.41Å |
| 421 | C | 96.6 | Very high | 91.2 | Very high | 22 Ų | 22 | 55.9 Ų | 55.9 | 15% | 0.149 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63 | -44 | 175 | -173.6 | 0 | 0 | 0 | 0 | 111.5 | A319 C417 L418 L419 V424 S425 | A319-C421 HydrophobicContact CB-CB 3.81Å; C417-C421 PolarHBondContact O-N 2.03Å; L418-C421 WeakPolarHBondContact O-CB 3.32Å; L418-C421 PolarHBondContact O-N 3.05Å; L419-C421 VanDerWaalsContact C-N 3.33Å; L419-C421 PolarHBondContact O-N 3.49Å; C421-V424 PolarHBondContact O-N 3.32Å; C421-S425 WeakPolarHBondContact O-CB 3.37Å; C421-S425 PolarHBondContact O-N 3.01Å; C421-S425 PolarHBondContact O-OG 3.42Å |
| 422 | G | 95.3 | Very high | 89 | Confident | 29 Ų | 29 | 61.5 Ų | 61.5 | 30% | 0.299 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -57.5 | -51.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | L418 L419 V424 S425 F426 | L418-G422 PolarHBondContact O-N 3.09Å; L419-G422 PolarHBondContact O-N 3.32Å; G422-V424 PolarHBondContact O-N 3.2Å; G422-S425 WeakPolarHBondContact O-CB 3.32Å; G422-S425 PolarHBondContact O-N 3.36Å; G422-S425 VanDerWaalsContact O-N 3.14Å; G422-F426 WeakPolarHBondContact O-CD2 3.46Å; G422-F426 PolarHBondContact O-N 3.45Å |
| 423 | Y | 95.5 | Very high | 86.7 | Confident | 41 Ų | 41 | 60.4 Ų | 60.4 | 16% | 0.161 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -57.5 | -47.8 | 179.1 | -178.7 | -95.2 | 0 | 0 | 0 | 112.9 | T253 I256 L260 L419 S420 S425 F426 N427 | T253-Y423 WeakPolarHBondContact CA-OH 3.35Å; T253-Y423 HydrophobicContact CG2-CE1 4.5Å; I256-Y423 HydrophobicContact CB-CE1 4.11Å; I256-Y423 HydrophobicContact CB-CE2 4.32Å; I256-Y423 HydrophobicContact CD1-CE2 3.84Å; I256-Y423 WeakPolarHBondContact CD1-OH 3.26Å; I256-Y423 HydrophobicContact CG2-CD1 3.95Å; I256-Y423 HydrophobicContact CG2-CD2 4Å; I256-Y423 HydrophobicContact CG2-CE1 3.59Å; I256-Y423 HydrophobicContact CG2-CE2 3.66Å; I256-Y423 HydrophobicContact CG2-CG 4.15Å; I256-Y423 VanDerWaalsContact CG2-CZ 3.45Å; L260-Y423 HydrophobicContact CD1-CD1 3.57Å; L260-Y423 HydrophobicContact CD1-CE1 4.36Å; L260-Y423 HydrophobicContact CD1-CG 3.86Å; L419-Y423 PolarHBondContact O-N 3.45Å; S420-Y423 PolarHBondContact O-N 3.46Å; Y423-S425 VanDerWaalsContact C-N 3.26Å; Y423-S425 PolarHBondContact O-N 3.48Å; Y423-F426 PolarHBondContact O-N 2.93Å; Y423-N427 HydrophobicContact CD1-CB 4.44Å; Y423-N427 VanDerWaalsContact CD2-ND2 3.3Å; Y423-N427 WeakPolarHBondContact CD2-ND2 3.32Å; Y423-N427 HydrophobicContact CE1-CB 3.94Å; Y423-N427 HydrophobicContact CE2-CB 4.05Å; Y423-N427 VanDerWaalsContact CE2-ND2 3.25Å; Y423-N427 WeakPolarHBondContact CE2-ND2 3.41Å; Y423-N427 WeakPolarHBondContact O-CB 3.36Å; Y423-N427 PolarHBondContact O-N 2.89Å; Y423-N427 PolarHBondContact O-ND2 3.14Å |
| 424 | V | 94.1 | Very high | 83.8 | Confident | 0 Ų | 0 | 68.4 Ų | 68.4 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60.5 | -37.4 | 178.4 | 169.5 | 0 | 0 | 0 | 0 | 111.3 | L257 K312 L315 Q316 W358 S420 C421 G422 F426 I428 | L257-V424 HydrophobicContact CD2-CG2 4.24Å; K312-V424 HydrophobicContact CG-CG1 3.97Å; L315-V424 HydrophobicContact CB-CG1 3.86Å; L315-V424 HydrophobicContact CB-CG2 4.12Å; L315-V424 HydrophobicContact CD1-CG1 4.29Å; L315-V424 HydrophobicContact CD1-CG2 4.21Å; Q316-V424 HydrophobicContact CG-CB 4.43Å; Q316-V424 HydrophobicContact CG-CG1 3.82Å; W358-V424 HydrophobicContact CH2-CG2 3.77Å; W358-V424 HydrophobicContact CZ2-CG2 3.97Å; S420-V424 WeakPolarHBondContact O-CB 3.36Å; S420-V424 VanDerWaalsContact O-CG2 3.26Å; S420-V424 WeakPolarHBondContact O-CG2 3.46Å; S420-V424 PolarHBondContact O-N 3.41Å; C421-V424 PolarHBondContact O-N 3.32Å; G422-V424 PolarHBondContact O-N 3.2Å; V424-F426 VanDerWaalsContact C-N 3.3Å; V424-F426 PolarHBondContact O-N 2.91Å; V424-I428 HydrophobicContact CB-CG1 4.35Å; V424-I428 HydrophobicContact CG1-CB 4.09Å; V424-I428 HydrophobicContact CG1-CG1 4.15Å; V424-I428 HydrophobicContact CG2-CG1 4.29Å; V424-I428 WeakPolarHBondContact O-CB 3.26Å; V424-I428 PolarHBondContact O-N 3.42Å; V424-I428 VanDerWaalsContact O-N 3.15Å |
| 425 | S | 91.8 | Very high | 80.6 | Confident | 42 Ų | 42 | 75.2 Ų | 75.2 | 29% | 0.294 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.9 | -39.4 | 179.9 | -58.8 | 0 | 0 | 0 | 0 | 112.5 | K312 Q316 C421 G422 Y423 | K312-S425 PolarHBondContact NZ-O 3.14Å; Q316-S425 PolarHBondContact NE2-OG 3.14Å; C421-S425 WeakPolarHBondContact O-CB 3.37Å; C421-S425 PolarHBondContact O-N 3.01Å; C421-S425 PolarHBondContact O-OG 3.42Å; G422-S425 WeakPolarHBondContact O-CB 3.32Å; G422-S425 PolarHBondContact O-N 3.36Å; G422-S425 VanDerWaalsContact O-N 3.14Å; Y423-S425 VanDerWaalsContact C-N 3.26Å; Y423-S425 PolarHBondContact O-N 3.48Å |
| 426 | F | 89.9 | Confident | 77.5 | Confident | 177 Ų | 177 | 74.8 Ų | 74.8 | 78% | 0.776 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -90.2 | -34.5 | -177.5 | -64.6 | -68.9 | 0 | 0 | 0 | 114.4 | G422 Y423 V424 | G422-F426 WeakPolarHBondContact O-CD2 3.46Å; G422-F426 PolarHBondContact O-N 3.45Å; Y423-F426 PolarHBondContact O-N 2.93Å; V424-F426 VanDerWaalsContact C-N 3.3Å; V424-F426 PolarHBondContact O-N 2.91Å |
| 427 | N | 89.1 | Confident | 74.3 | Confident | 67 Ų | 67 | 83.3 Ų | 83.3 | 36% | 0.358 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -109.4 | -16.8 | -166.6 | -63.2 | -85.9 | 0 | 0 | 0 | 114.7 | Y423 | Y423-N427 HydrophobicContact CD1-CB 4.44Å; Y423-N427 VanDerWaalsContact CD2-ND2 3.3Å; Y423-N427 WeakPolarHBondContact CD2-ND2 3.32Å; Y423-N427 HydrophobicContact CE1-CB 3.94Å; Y423-N427 HydrophobicContact CE2-CB 4.05Å; Y423-N427 VanDerWaalsContact CE2-ND2 3.25Å; Y423-N427 WeakPolarHBondContact CE2-ND2 3.41Å; Y423-N427 WeakPolarHBondContact O-CB 3.36Å; Y423-N427 PolarHBondContact O-N 2.89Å; Y423-N427 PolarHBondContact O-ND2 3.14Å |
| 428 | I | 85.2 | Confident | 73.1 | Confident | 13 Ų | 13 | 87.5 Ų | 87.5 | 7% | 0.067 | 46% | 0.463 | C | S | . | . | trans | -101.1 | 118.7 | 177.9 | -55.4 | -58.9 | 0 | 0 | 0 | 108.9 | T253 L257 K312 V424 | T253-I428 HydrophobicContact CG2-CD1 3.5Å; T253-I428 VanDerWaalsContact CG2-CD1 3.5Å; L257-I428 HydrophobicContact CD1-CD1 3.67Å; L257-I428 HydrophobicContact CD2-CD1 4.16Å; L257-I428 HydrophobicContact CD2-CG1 4.32Å; L257-I428 HydrophobicContact CG-CD1 4.13Å; K312-I428 HydrophobicContact CB-CG2 4.2Å; K312-I428 VanDerWaalsContact CD-O 3.26Å; K312-I428 WeakPolarHBondContact CD-O 3.45Å; K312-I428 WeakPolarHBondContact CE-O 3.48Å; K312-I428 HydrophobicContact CG-CG2 4.45Å; K312-I428 PolarHBondContact NZ-O 3.34Å; V424-I428 HydrophobicContact CB-CG1 4.35Å; V424-I428 HydrophobicContact CG1-CB 4.09Å; V424-I428 HydrophobicContact CG1-CG1 4.15Å; V424-I428 HydrophobicContact CG2-CG1 4.29Å; V424-I428 WeakPolarHBondContact O-CB 3.26Å; V424-I428 PolarHBondContact O-N 3.42Å; V424-I428 VanDerWaalsContact O-N 3.15Å | ||
| 429 | H | 78.4 | Confident | 71.8 | Confident | 154 Ų | 154 | 87.3 Ų | 87.3 | 71% | 0.713 | 46% | 0.463 | S | S | * | . | trans | -79.6 | 149.8 | 170.3 | -65.2 | -69.5 | 0 | 0 | 0 | 109.9 | V431 | H429-V431 VanDerWaalsContact C-N 3.35Å; H429-V431 PolarHBondContact O-N 3.27Å | ||
| 430 | D | 65.6 | Low | 70.4 | Confident | 89 Ų | 89 | 85.9 Ų | 85.9 | 48% | 0.476 | 46% | 0.456 | S | S | . | . | trans | -64.3 | 95.4 | 175.6 | -88.2 | -41.9 | 0 | 0 | 0 | 109.7 | S310 K312 K432 | S310-D430 PolarHBondContact OG-OD1 3.35Å; K312-D430 WeakPolarHBondContact CB-OD1 3.35Å; D430-K432 VanDerWaalsContact C-N 3.32Å; D430-K432 PolarHBondContact O-N 3.25Å; D430-K432 VanDerWaalsContact O-N 3.1Å | ||
| 431 | V | 61.1 | Low | 68.9 | Low | 65 Ų | 65 | 90.9 Ų | 90.9 | 39% | 0.394 | 48% | 0.482 | S | S | . | . | trans | -75.8 | 93.2 | 161 | -173.5 | 0 | 0 | 0 | 0 | 105.8 | W311 H429 | W311-V431 HydrophobicContact CE3-CB 4.01Å; W311-V431 HydrophobicContact CE3-CG1 4.13Å; W311-V431 HydrophobicContact CZ3-CB 4.47Å; W311-V431 HydrophobicContact CZ3-CG1 4.13Å; H429-V431 VanDerWaalsContact C-N 3.35Å; H429-V431 PolarHBondContact O-N 3.27Å | ||
| 432 | K | 49 | Very low | 67.1 | Low | 168 Ų | 168 | 95.2 Ų | 95.2 | 73% | 0.73 | 50% | 0.503 | S | S | * | . | trans | -71.2 | 126.7 | 151.5 | -73.3 | -178 | 179.4 | 177.5 | 0 | 104.6 | D430 M434 | D430-K432 VanDerWaalsContact C-N 3.32Å; D430-K432 PolarHBondContact O-N 3.25Å; D430-K432 VanDerWaalsContact O-N 3.1Å; K432-M434 PolarHBondContact O-N 3Å | ||
| 433 | L | 48.3 | Very low | 65.3 | Low | 52 Ų | 52 | 99.6 Ų | 99.6 | 27% | 0.272 | 52% | 0.516 | S | S | . | . | trans | -43.1 | 119.1 | 160.2 | -97.8 | 111.3 | 0 | 0 | 0 | 106 | V135 W311 N435 | V135-L433 HydrophobicContact CB-CD2 4.3Å; V135-L433 HydrophobicContact CG1-CD1 4.19Å; V135-L433 HydrophobicContact CG2-CD1 4.49Å; V135-L433 HydrophobicContact CG2-CD2 3.93Å; V135-L433 HydrophobicContact CG2-CG 4.32Å; W311-L433 HydrophobicContact CZ2-CD1 3.83Å; W311-L433 HydrophobicContact CZ2-CG 4.48Å; L433-N435 PolarHBondContact O-N 2.84Å | ||
| 434 | M | 36.3 | Very low | 63.1 | Low | 178 Ų | 178 | 103.8 Ų | 103.8 | 88% | 0.877 | 54% | 0.542 | S | S | * | . | trans | -50.8 | 113.5 | 166.5 | -78 | -179.1 | 171 | 0 | 0 | 104.9 | K432 T436 | K432-M434 PolarHBondContact O-N 3Å; M434-T436 PolarHBondContact O-N 2.85Å | ||
| 435 | N | 31.5 | Very low | 60.7 | Low | 152 Ų | 152 | 111.8 Ų | 111.8 | 81% | 0.813 | 58% | 0.584 | S | S | * | * | trans | -47 | 104.4 | -178.4 | -75.2 | -24.8 | 0 | 0 | 0 | 108.7 | L433 T437 | L433-N435 PolarHBondContact O-N 2.84Å; N435-T437 PolarHBondContact O-N 2.96Å | ||
| 436 | T | 32.9 | Very low | 58.1 | Low | 97 Ų | 97 | 117.6 Ų | 117.6 | 60% | 0.595 | 61% | 0.608 | S | S | * | * | trans | -78.5 | 92.1 | 150.6 | 55.1 | 0 | 0 | 0 | 0 | 104.6 | M434 | M434-T436 PolarHBondContact O-N 2.85Š| ||
| 437 | T | 30.3 | Very low | 55.2 | Low | 199 Ų | 199 | 112.2 Ų | 112.2 | 100% | 1.221 | 59% | 0.592 | S | S | * | * | trans | -43.3 | 0 | 154 | 46.3 | 0 | 0 | 0 | 0 | 111.2 | N435 | N435-T437 PolarHBondContact O-N 2.96Š|
Retrieved 437 of 437 residues in 346 ms
(Link to these results)