A0A087Y434_POEFO Loading...

Aquaporin

AlphaFold DB , UniProt , Accession A0A087Y434, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 aa.

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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
1P51.6Low78.7Confident158 Ų15872.8 Ų72.8100%1.02648%0.481SS*.  0-48.40-3.523.3000112.9G4 S5P1-G4 PolarHBondContact O-N 3.33Å; P1-S5 PolarHBondContact O-N 3.17Å
2E55.4Low80.3Confident170 Ų17069.5 Ų69.579%0.79446%0.457SS*.Hα-helixtrans-68.2-38-177.9-64.8-175.2153.700114G4 S5 M6E2-G4 VanDerWaalsContact C-N 3.31Å; E2-G4 PolarHBondContact O-N 3.48Å; E2-S5 PolarHBondContact O-N 3.16Å; E2-M6 PolarHBondContact O-N 3.32Å
3T60.4Low81.6Confident109 Ų10964.2 Ų64.267%0.66942%0.422SS*.Hα-helixtrans-64.1-33.417749.10000113.3A7T3-A7 PolarHBondContact O-N 3.33Å
4G62.8Low82.8Confident54 Ų5465.1 Ų65.156%0.55742%0.421SS*.Hα-helixtrans-71.4-33.7176.300000113.3P1 E2 G8P1-G4 PolarHBondContact O-N 3.33Å; E2-G4 VanDerWaalsContact C-N 3.31Å; E2-G4 PolarHBondContact O-N 3.48Å; G4-G8 PolarHBondContact O-N 2.9Å
5S77.3Confident83.8Confident60 Ų6065.6 Ų65.642%0.4243%0.427SS..Hα-helixtrans-67.8-45.5174.6-171.50000111.2P1 E2 A7 G8 D9P1-S5 PolarHBondContact O-N 3.17Å; E2-S5 PolarHBondContact O-N 3.16Å; S5-A7 PolarHBondContact O-N 3.1Å; S5-G8 PolarHBondContact O-N 3.41Å; S5-D9 PolarHBondContact O-N 2.71Å
6M87.8Confident84.7Confident69 Ų6962.4 Ų62.434%0.3441%0.406SS..Hα-helixtrans-63.7-43.4-179.6-176.4-176.866.300112.2E2 G8 D9 V10 I69E2-M6 PolarHBondContact O-N 3.32Å; M6-G8 VanDerWaalsContact C-N 3.28Å; M6-G8 PolarHBondContact O-N 2.87Å; M6-D9 PolarHBondContact O-N 3.15Å; M6-V10 WeakPolarHBondContact O-CG2 3.25Å; M6-V10 PolarHBondContact O-N 3.01Å; M6-I69 HydrophobicContact CG-CG2 4.36Å
7A89.6Confident85.5Confident61 Ų6159.4 Ų59.450%0.50439%0.385SS..Hα-helixtrans-61.4-38.7177.300000112.1T3 S5 A11T3-A7 PolarHBondContact O-N 3.33Å; S5-A7 PolarHBondContact O-N 3.1Å; A7-A11 WeakPolarHBondContact O-CB 3.35Å; A7-A11 PolarHBondContact O-N 3.04Å
8G93.1Very high86.2Confident35 Ų3558.8 Ų58.836%0.36139%0.386SS..Hα-helixtrans-63.9-46.9173.900000112.7G4 S5 M6 V10 A11 V12G4-G8 PolarHBondContact O-N 2.9Å; S5-G8 PolarHBondContact O-N 3.41Å; M6-G8 VanDerWaalsContact C-N 3.28Å; M6-G8 PolarHBondContact O-N 2.87Å; G8-V10 PolarHBondContact O-N 3.33Å; G8-A11 PolarHBondContact O-N 3.41Å; G8-V12 WeakPolarHBondContact O-CG2 3.31Å; G8-V12 PolarHBondContact O-N 2.98Å
9D94.8Very high86.8Confident14 Ų1459.9 Ų59.98%0.07539%0.391CS..Hα-helixtrans-60-44.9177.8-67.3-36.4000111.2S5 M6 V12 S13 S140 G141 L142S5-D9 PolarHBondContact O-N 2.71Å; M6-D9 PolarHBondContact O-N 3.15Å; D9-V12 PolarHBondContact O-N 3.26Å; D9-S13 WeakPolarHBondContact O-CB 3.46Å; D9-S13 PolarHBondContact O-N 2.97Å; D9-S13 PolarHBondContact O-OG 2.79Å; D9-S140 VanDerWaalsContact OD1-CB 3.23Å; D9-S140 WeakPolarHBondContact OD1-CB 3.34Å; D9-S140 PolarHBondContact OD1-OG 3.12Å; D9-G141 PolarHBondContact OD1-N 3.36Å; D9-G141 VanDerWaalsContact OD1-N 3.09Å; D9-L142 HydrophobicContact CB-CB 4.02Å; D9-L142 HydrophobicContact CB-CD2 4.44Å; D9-L142 WeakPolarHBondContact OD1-CB 3.42Å; D9-L142 PolarHBondContact OD1-N 3.22Å
10V96.4Very high87.4Confident20 Ų2057.7 Ų57.712%0.12138%0.376CS..Hα-helixtrans-61.5-45.8175.9172.70000111.7M6 G8 V12 S13 L14 L63 I69 L73M6-V10 WeakPolarHBondContact O-CG2 3.25Å; M6-V10 PolarHBondContact O-N 3.01Å; G8-V10 PolarHBondContact O-N 3.33Å; V10-V12 VanDerWaalsContact C-N 3.34Å; V10-V12 PolarHBondContact O-N 3.43Å; V10-S13 PolarHBondContact O-N 3.45Å; V10-L14 HydrophobicContact CG1-CD1 3.95Å; V10-L14 HydrophobicContact CG1-CG 4.31Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.24Å; V10-L14 PolarHBondContact O-N 3.15Å; V10-L63 HydrophobicContact CG2-CD1 4.11Å; V10-L63 HydrophobicContact CG2-CD2 4.36Å; V10-I69 HydrophobicContact CG2-CG2 3.66Å; V10-L73 HydrophobicContact CG2-CD2 4.23Å
11A96.8Very high87.9Confident51 Ų5156.1 Ų56.142%0.42137%0.365SS..Hα-helixtrans-63-40.4-179.600000112.1A7 G8 S15A7-A11 WeakPolarHBondContact O-CB 3.35Å; A7-A11 PolarHBondContact O-N 3.04Å; G8-A11 PolarHBondContact O-N 3.41Å; A11-S15 WeakPolarHBondContact O-CB 3.41Å; A11-S15 PolarHBondContact O-N 2.86Å; A11-S15 PolarHBondContact O-OG 3.45Å
12V97.3Very high90.2Very high33 Ų3354 Ų5420%0.235%0.345CS..Hα-helixtrans-66.1-46.7175.4172.90000110.6G8 D9 V10 L14 S15 V16 M139G8-V12 WeakPolarHBondContact O-CG2 3.31Å; G8-V12 PolarHBondContact O-N 2.98Å; D9-V12 PolarHBondContact O-N 3.26Å; V10-V12 VanDerWaalsContact C-N 3.34Å; V10-V12 PolarHBondContact O-N 3.43Å; V12-L14 PolarHBondContact O-N 3.21Å; V12-S15 WeakPolarHBondContact O-CA 3.34Å; V12-S15 WeakPolarHBondContact O-CB 3.33Å; V12-S15 PolarHBondContact O-N 3.41Å; V12-S15 VanDerWaalsContact O-N 3.09Å; V12-V16 WeakPolarHBondContact O-CG2 3.33Å; V12-V16 PolarHBondContact O-N 3.12Å; V12-M139 HydrophobicContact CG1-CB 3.73Å
13S97.6Very high92.2Very high0 Ų051.1 Ų51.10%034%0.335CS..Hα-helixtrans-59.6-44.2176.6-68.40000112.3D9 V10 S15 V16 L17 E59D9-S13 WeakPolarHBondContact O-CB 3.46Å; D9-S13 PolarHBondContact O-N 2.97Å; D9-S13 PolarHBondContact O-OG 2.79Å; V10-S13 PolarHBondContact O-N 3.45Å; S13-S15 VanDerWaalsContact C-N 3.27Å; S13-S15 PolarHBondContact O-N 2.79Å; S13-V16 PolarHBondContact O-N 2.98Å; S13-L17 VanDerWaalsContact O-CG 3.27Å; S13-L17 WeakPolarHBondContact O-CG 3.2Å; S13-L17 PolarHBondContact O-N 3.36Å; S13-E59 VanDerWaalsContact CA-OE1 3.27Å; S13-E59 WeakPolarHBondContact CA-OE1 3.4Å; S13-E59 WeakPolarHBondContact CB-OE1 3.32Å; S13-E59 PolarHBondContact OG-OE1 2.61Å
14L97.9Very high94Very high78 Ų7846.2 Ų46.241%0.40830%0.304SS..Hα-helixtrans-58.9-39.6174-75.7174.7000112.2V10 V12 L17 A18 L77V10-L14 HydrophobicContact CG1-CD1 3.95Å; V10-L14 HydrophobicContact CG1-CG 4.31Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.31Å; V10-L14 WeakPolarHBondContact O-CG 3.24Å; V10-L14 PolarHBondContact O-N 3.15Å; V12-L14 PolarHBondContact O-N 3.21Å; L14-L17 HydrophobicContact CD2-CD1 4.47Å; L14-L17 PolarHBondContact O-N 2.87Å; L14-A18 WeakPolarHBondContact O-CB 3.16Å; L14-A18 PolarHBondContact O-N 3.18Å; L14-L77 HydrophobicContact CD2-CD2 3.6Å
15S98.1Very high95.6Very high72 Ų7245 Ų4550%0.50329%0.285SS..Hα-helixtrans-65.5-43.2176.4-57.80000111.3A11 V12 S13 A18 V19A11-S15 WeakPolarHBondContact O-CB 3.41Å; A11-S15 PolarHBondContact O-N 2.86Å; A11-S15 PolarHBondContact O-OG 3.45Å; V12-S15 WeakPolarHBondContact O-CA 3.34Å; V12-S15 WeakPolarHBondContact O-CB 3.33Å; V12-S15 PolarHBondContact O-N 3.41Å; V12-S15 VanDerWaalsContact O-N 3.09Å; S13-S15 VanDerWaalsContact C-N 3.27Å; S13-S15 PolarHBondContact O-N 2.79Å; S15-A18 PolarHBondContact O-N 2.76Å; S15-V19 WeakPolarHBondContact O-CB 3.49Å; S15-V19 VanDerWaalsContact O-CG2 3.29Å; S15-V19 WeakPolarHBondContact O-CG2 3.44Å; S15-V19 PolarHBondContact O-N 3.13Å
16V98.1Very high96.6Very high15 Ų1545.8 Ų45.89%0.09129%0.288CS..Hα-helixtrans-59.7-47.8174171.60000110.8V12 S13 A18 V19 V20 E59 I134 M139V12-V16 WeakPolarHBondContact O-CG2 3.33Å; V12-V16 PolarHBondContact O-N 3.12Å; S13-V16 PolarHBondContact O-N 2.98Å; V16-A18 PolarHBondContact O-N 2.95Å; V16-V19 PolarHBondContact O-N 2.89Å; V16-V20 HydrophobicContact CG1-CG2 4.33Å; V16-V20 WeakPolarHBondContact O-CB 3.4Å; V16-V20 VanDerWaalsContact O-CG2 3.29Å; V16-V20 WeakPolarHBondContact O-CG2 3.27Å; V16-V20 PolarHBondContact O-N 3.19Å; V16-E59 HydrophobicContact CB-CG 4.39Å; V16-E59 HydrophobicContact CG1-CG 4.19Å; V16-I134 HydrophobicContact CG1-CG2 4.06Å; V16-I134 HydrophobicContact CG2-CG2 4.15Å; V16-M139 HydrophobicContact CG2-CE 3.61Å
17L98.4Very high97.1Very high11 Ų1145.3 Ų45.36%0.05829%0.289CS..Hα-helixtrans-57.2-48.8176.8-66.7175000111.3S13 L14 V19 V20 V21 C56 E59 L60S13-L17 VanDerWaalsContact O-CG 3.27Å; S13-L17 WeakPolarHBondContact O-CG 3.2Å; S13-L17 PolarHBondContact O-N 3.36Å; L14-L17 HydrophobicContact CD2-CD1 4.47Å; L14-L17 PolarHBondContact O-N 2.87Å; L17-V19 PolarHBondContact O-N 2.87Å; L17-V20 PolarHBondContact O-N 3.37Å; L17-V21 WeakPolarHBondContact O-CG2 3.32Å; L17-V21 PolarHBondContact O-N 3.16Å; L17-C56 VanDerWaalsContact CD2-CA 3.43Å; L17-C56 HydrophobicContact CD2-CB 3.57Å; L17-E59 HydrophobicContact CD2-CB 4.02Å; L17-E59 HydrophobicContact CD2-CG 4.25Å; L17-E59 HydrophobicContact CG-CG 4.34Å; L17-L60 HydrophobicContact CD1-CD2 3.69Å; L17-L60 HydrophobicContact CD1-CG 4.18Å; L17-L60 HydrophobicContact CD2-CG 4.36Å
18A98.4Very high97.4Very high49 Ų4942.4 Ų42.441%0.40527%0.265SS..Hα-helixtrans-60.6-46.5179.200000111.9L14 S15 V16 V21 L22L14-A18 WeakPolarHBondContact O-CB 3.16Å; L14-A18 PolarHBondContact O-N 3.18Å; S15-A18 PolarHBondContact O-N 2.76Å; V16-A18 PolarHBondContact O-N 2.95Å; A18-V21 PolarHBondContact O-N 2.7Å; A18-L22 WeakPolarHBondContact O-CB 3.35Å; A18-L22 VanDerWaalsContact O-CG 3.23Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 3.47Å
19V98.4Very high97.5Very high79 Ų7946.1 Ų46.148%0.47927%0.268SS..Hα-helixtrans-61.9-46.1178.3169.70000111.1S15 V16 L17 V21 L22 L23S15-V19 WeakPolarHBondContact O-CB 3.49Å; S15-V19 VanDerWaalsContact O-CG2 3.29Å; S15-V19 WeakPolarHBondContact O-CG2 3.44Å; S15-V19 PolarHBondContact O-N 3.13Å; V16-V19 PolarHBondContact O-N 2.89Å; L17-V19 PolarHBondContact O-N 2.87Å; V19-V21 VanDerWaalsContact C-N 3.33Å; V19-V21 PolarHBondContact O-N 3.37Å; V19-L22 PolarHBondContact O-N 2.96Å; V19-L23 HydrophobicContact CG1-CD1 3.68Å; V19-L23 HydrophobicContact CG1-CG 4.1Å; V19-L23 WeakPolarHBondContact O-CB 3.45Å; V19-L23 VanDerWaalsContact O-CG 3.29Å; V19-L23 WeakPolarHBondContact O-CG 3.39Å; V19-L23 PolarHBondContact O-N 3.14Å
20V98.5Very high97.6Very high15 Ų1550.5 Ų50.59%0.09129%0.291CS..Hα-helixtrans-59.2-45177.5167.70000111V16 L17 S24 Q52 C55V16-V20 HydrophobicContact CG1-CG2 4.33Å; V16-V20 WeakPolarHBondContact O-CB 3.4Å; V16-V20 VanDerWaalsContact O-CG2 3.29Å; V16-V20 WeakPolarHBondContact O-CG2 3.27Å; V16-V20 PolarHBondContact O-N 3.19Å; L17-V20 PolarHBondContact O-N 3.37Å; V20-S24 WeakPolarHBondContact O-CB 3.44Å; V20-S24 PolarHBondContact O-N 2.89Å; V20-S24 PolarHBondContact O-OG 2.88Å; V20-Q52 HydrophobicContact CG1-CG 4.13Å; V20-C55 HydrophobicContact CG1-CB 3.71Å; V20-C55 HydrophobicContact CG2-CB 4.26Å
21V98.4Very high97.5Very high25 Ų2552.8 Ų52.815%0.15230%0.301CS..Hα-helixtrans-63.5-46.5177.8173.60000111.3L17 A18 V19 S24 D25 Q52 T88L17-V21 WeakPolarHBondContact O-CG2 3.32Å; L17-V21 PolarHBondContact O-N 3.16Å; A18-V21 PolarHBondContact O-N 2.7Å; V19-V21 VanDerWaalsContact C-N 3.33Å; V19-V21 PolarHBondContact O-N 3.37Å; V21-S24 PolarHBondContact O-N 2.91Å; V21-D25 PolarHBondContact O-N 3.47Å; V21-Q52 HydrophobicContact CG2-CG 4.14Å; V21-T88 HydrophobicContact CG1-CG2 4.03Å
22L98.2Very high97.4Very high114 Ų11452.7 Ų52.760%0.59730%0.295SS*.Hα-helixtrans-64.2-50-179.4-72.7171000111.8A18 V19 S24 D25 V26A18-L22 WeakPolarHBondContact O-CB 3.35Å; A18-L22 VanDerWaalsContact O-CG 3.23Å; A18-L22 WeakPolarHBondContact O-CG 3.47Å; A18-L22 PolarHBondContact O-N 3.47Å; V19-L22 PolarHBondContact O-N 2.96Å; L22-S24 VanDerWaalsContact C-N 3.27Å; L22-S24 PolarHBondContact O-N 3.25Å; L22-D25 PolarHBondContact O-N 3.25Å; L22-V26 WeakPolarHBondContact O-CG2 3.38Å; L22-V26 PolarHBondContact O-N 3.23Å
23L98.3Very high97.2Very high110 Ų11059.9 Ų59.958%0.57632%0.318SS*.Hα-helixtrans-61.4-38.6177.8-68.6179.8000111.3V19 T27V19-L23 HydrophobicContact CG1-CD1 3.68Å; V19-L23 HydrophobicContact CG1-CG 4.1Å; V19-L23 WeakPolarHBondContact O-CB 3.45Å; V19-L23 VanDerWaalsContact O-CG 3.29Å; V19-L23 WeakPolarHBondContact O-CG 3.39Å; V19-L23 PolarHBondContact O-N 3.14Å; L23-T27 VanDerWaalsContact O-CB 3.27Å; L23-T27 WeakPolarHBondContact O-CB 3.23Å; L23-T27 PolarHBondContact O-N 3Å; L23-T27 PolarHBondContact O-OG1 3.3Å
24S98.3Very high97.1Very high5 Ų562.9 Ų62.94%0.03535%0.35CS..Hα-helixtrans-66.7-39.8176-61.80000112.2V20 V21 L22 T27 R28 V48 Q52V20-S24 WeakPolarHBondContact O-CB 3.44Å; V20-S24 PolarHBondContact O-N 2.89Å; V20-S24 PolarHBondContact O-OG 2.88Å; V21-S24 PolarHBondContact O-N 2.91Å; L22-S24 VanDerWaalsContact C-N 3.27Å; L22-S24 PolarHBondContact O-N 3.25Å; S24-T27 PolarHBondContact O-N 3.09Å; S24-R28 VanDerWaalsContact C-NH2 3.34Å; S24-R28 WeakPolarHBondContact O-CB 3.28Å; S24-R28 WeakPolarHBondContact O-CG 3.36Å; S24-R28 PolarHBondContact O-N 2.95Å; S24-V48 WeakPolarHBondContact O-CG1 3.25Å; S24-Q52 VanDerWaalsContact CB-OE1 3.28Å
25D97.1Very high96.9Very high28 Ų2861.2 Ų61.215%0.1534%0.341CS..Hα-helixtrans-67.2-44.1176.1-173.357.3000111.9V21 L22 T27 R28 R29 R90V21-D25 PolarHBondContact O-N 3.47Å; L22-D25 PolarHBondContact O-N 3.25Å; D25-T27 VanDerWaalsContact C-N 3.34Å; D25-T27 PolarHBondContact O-N 3.06Å; D25-R28 VanDerWaalsContact N-NH2 3.19Å; D25-R28 PolarHBondContact O-N 3.12Å; D25-R29 WeakPolarHBondContact O-CG 3.33Å; D25-R29 PolarHBondContact O-N 3.43Å; D25-R29 IonicContact OD1-NE 3.64Å; D25-R29 IonicContact OD1-NH2 3.91Å; D25-R29 IonicContact OD2-CZ 3.2Å; D25-R29 IonicContact OD2-NE 2.76Å; D25-R29 PolarHBondContact OD2-NE 2.97Å; D25-R29 IonicContact OD2-NH2 2.79Å; D25-R29 PolarHBondContact OD2-NH2 3.31Å; D25-R90 IonicContact OD1-NE 3.6Å; D25-R90 IonicContact OD1-NH2 3.72Å
26V97.7Very high96.5Very high78 Ų7860.8 Ų60.847%0.47334%0.342SS..Hα-helixtrans-58.3-49174.1173.20000110.1L22 R28 R29 L30L22-V26 WeakPolarHBondContact O-CG2 3.38Å; L22-V26 PolarHBondContact O-N 3.23Å; V26-R28 PolarHBondContact O-N 3.26Å; V26-R29 PolarHBondContact O-N 2.83Å; V26-L30 HydrophobicContact CG1-CD1 3.95Å; V26-L30 HydrophobicContact CG1-CG 4.4Å; V26-L30 WeakPolarHBondContact O-CG 3.34Å; V26-L30 PolarHBondContact O-N 3.25Å
27T97.6Very high96.2Very high59 Ų5968 Ų6836%0.36238%0.38SS..Hα-helixtrans-60.4-46.5179.6-57.60000111.4L23 S24 D25 R29 L30 M31 V48L23-T27 VanDerWaalsContact O-CB 3.27Å; L23-T27 WeakPolarHBondContact O-CB 3.23Å; L23-T27 PolarHBondContact O-N 3Å; L23-T27 PolarHBondContact O-OG1 3.3Å; S24-T27 PolarHBondContact O-N 3.09Å; D25-T27 VanDerWaalsContact C-N 3.34Å; D25-T27 PolarHBondContact O-N 3.06Å; T27-R29 PolarHBondContact O-N 3.13Å; T27-L30 PolarHBondContact O-N 3.24Å; T27-M31 HydrophobicContact CG2-CG 4.23Å; T27-M31 HydrophobicContact CG2-SD 4.19Å; T27-M31 WeakPolarHBondContact O-CB 3.38Å; T27-M31 WeakPolarHBondContact O-CG 3.29Å; T27-M31 PolarHBondContact O-N 3.07Å; T27-V48 HydrophobicContact CG2-CG1 4.33Å; T27-V48 HydrophobicContact CG2-CG2 3.89Å
28R96.7Very high95.9Very high0 Ų071.1 Ų71.10%040%0.399CS..Hα-helixtrans-57.1-47.2174.9-82-177.3-65.2-102.1-10.7111.9S24 D25 V26 L30 M31 V32 V48 S49 Q52 T88S24-R28 VanDerWaalsContact C-NH2 3.34Å; S24-R28 WeakPolarHBondContact O-CB 3.28Å; S24-R28 WeakPolarHBondContact O-CG 3.36Å; S24-R28 PolarHBondContact O-N 2.95Å; D25-R28 VanDerWaalsContact N-NH2 3.19Å; D25-R28 PolarHBondContact O-N 3.12Å; V26-R28 PolarHBondContact O-N 3.26Å; R28-L30 VanDerWaalsContact C-N 3.33Å; R28-L30 PolarHBondContact O-N 2.97Å; R28-M31 PolarHBondContact O-N 3.11Å; R28-V32 WeakPolarHBondContact O-CB 3.37Å; R28-V32 WeakPolarHBondContact O-CG2 3.34Å; R28-V32 PolarHBondContact O-N 2.99Å; R28-V48 HydrophobicContact CG-CB 3.64Å; R28-V48 HydrophobicContact CG-CG1 3.63Å; R28-V48 HydrophobicContact CG-CG2 4.35Å; R28-S49 WeakPolarHBondContact CD-OG 3.46Å; R28-S49 VanDerWaalsContact NH1-CA 3.27Å; R28-S49 PolarHBondContact NH1-OG 2.95Å; R28-S49 VanDerWaalsContact NH1-OG 3.09Å; R28-Q52 VanDerWaalsContact CZ-OE1 3.23Å; R28-T88 PolarHBondContact NE-O 2.96Å
29R95.1Very high95.5Very high113 Ų11371.4 Ų71.443%0.42641%0.407SS..Hα-helixtrans-61-42.5179.7-70.5177.8-164.2-125.65.3111.7D25 V26 T27 R33D25-R29 WeakPolarHBondContact O-CG 3.33Å; D25-R29 PolarHBondContact O-N 3.43Å; D25-R29 IonicContact OD1-NE 3.64Å; D25-R29 IonicContact OD1-NH2 3.91Å; D25-R29 IonicContact OD2-CZ 3.2Å; D25-R29 IonicContact OD2-NE 2.76Å; D25-R29 PolarHBondContact OD2-NE 2.97Å; D25-R29 IonicContact OD2-NH2 2.79Å; D25-R29 PolarHBondContact OD2-NH2 3.31Å; V26-R29 PolarHBondContact O-N 2.83Å; T27-R29 PolarHBondContact O-N 3.13Å; R29-R33 WeakPolarHBondContact O-CB 3.41Å; R29-R33 VanDerWaalsContact O-CG 3.24Å; R29-R33 WeakPolarHBondContact O-CG 3.46Å; R29-R33 PolarHBondContact O-N 3.4Å; R29-R33 VanDerWaalsContact O-N 3.15Å
30L96.4Very high95.3Very high106 Ų10671.7 Ų71.756%0.55541%0.406SS*.Hα-helixtrans-65.8-46.8177.7-67.2175.8000111.5V26 T27 R28 R33 G34V26-L30 HydrophobicContact CG1-CD1 3.95Å; V26-L30 HydrophobicContact CG1-CG 4.4Å; V26-L30 WeakPolarHBondContact O-CG 3.34Å; V26-L30 PolarHBondContact O-N 3.25Å; T27-L30 PolarHBondContact O-N 3.24Å; R28-L30 VanDerWaalsContact C-N 3.33Å; R28-L30 PolarHBondContact O-N 2.97Å; L30-R33 PolarHBondContact O-N 2.99Å; L30-G34 PolarHBondContact O-N 3.04Å
31M94.9Very high95.2Very high67 Ų6772.2 Ų72.233%0.3341%0.41SS..Hα-helixtrans-66-41.9179.6-67.5-163.287.400112.5T27 R28 R33 G34 L35 A44 V48T27-M31 HydrophobicContact CG2-CG 4.23Å; T27-M31 HydrophobicContact CG2-SD 4.19Å; T27-M31 WeakPolarHBondContact O-CB 3.38Å; T27-M31 WeakPolarHBondContact O-CG 3.29Å; T27-M31 PolarHBondContact O-N 3.07Å; R28-M31 PolarHBondContact O-N 3.11Å; M31-R33 VanDerWaalsContact C-N 3.3Å; M31-R33 PolarHBondContact O-N 3.28Å; M31-G34 PolarHBondContact O-N 3.46Å; M31-L35 HydrophobicContact CB-CD1 4.49Å; M31-L35 HydrophobicContact CE-CD1 4.25Å; M31-L35 WeakPolarHBondContact O-CB 3.46Å; M31-L35 VanDerWaalsContact O-CG 3.31Å; M31-L35 WeakPolarHBondContact O-CG 3.45Å; M31-L35 PolarHBondContact O-N 3.05Å; M31-A44 HydrophobicContact CB-CB 4Å; M31-A44 HydrophobicContact CE-CB 3.88Å; M31-A44 HydrophobicContact SD-CB 3.96Å; M31-V48 HydrophobicContact SD-CG2 3.96Å
32V94.1Very high95Very high50 Ų5073.6 Ų73.630%0.30342%0.419SS..Hα-helixtrans-60.1-42.7176.1168.90000110.9R28 A36 V45R28-V32 WeakPolarHBondContact O-CB 3.37Å; R28-V32 WeakPolarHBondContact O-CG2 3.34Å; R28-V32 PolarHBondContact O-N 2.99Å; V32-A36 PolarHBondContact O-N 3.43Å; V32-A36 VanDerWaalsContact O-N 3.15Å; V32-V45 HydrophobicContact CG2-CG2 3.3Å
33R93.7Very high94.9Very high183 Ų18369.3 Ų69.369%0.69140%0.395SS*.Hα-helixtrans-65.7-47.5176.6-73.7172.9-179.5172.7-1.3111.7R29 L30 M31 L35R29-R33 WeakPolarHBondContact O-CB 3.41Å; R29-R33 VanDerWaalsContact O-CG 3.24Å; R29-R33 WeakPolarHBondContact O-CG 3.46Å; R29-R33 PolarHBondContact O-N 3.4Å; R29-R33 VanDerWaalsContact O-N 3.15Å; L30-R33 PolarHBondContact O-N 2.99Å; M31-R33 VanDerWaalsContact C-N 3.3Å; M31-R33 PolarHBondContact O-N 3.28Å; R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.39Å
34G94.2Very high94.9Very high64 Ų6464.5 Ų64.566%0.6637%0.371SS*.Hα-helixtrans-67.5-28.5-179.200000113.9L30 M31L30-G34 PolarHBondContact O-N 3.04Å; M31-G34 PolarHBondContact O-N 3.46Å
35L94.4Very high94.8Very high42 Ų4264.7 Ų64.722%0.2237%0.372CS..THydrogen-bonded Turntrans-104.18.8-176.2-62.8174.7000113.9M31 R33 N37 T38 L40 A44M31-L35 HydrophobicContact CB-CD1 4.49Å; M31-L35 HydrophobicContact CE-CD1 4.25Å; M31-L35 WeakPolarHBondContact O-CB 3.46Å; M31-L35 VanDerWaalsContact O-CG 3.31Å; M31-L35 WeakPolarHBondContact O-CG 3.45Å; M31-L35 PolarHBondContact O-N 3.05Å; R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.39Å; L35-N37 PolarHBondContact O-N 2.89Å; L35-T38 HydrophobicContact CD2-CG2 4.25Å; L35-T38 PolarHBondContact O-N 3.5Å; L35-T38 PolarHBondContact O-OG1 3.33Å; L35-L40 HydrophobicContact CD1-CB 4.3Å; L35-A44 HydrophobicContact CD1-CB 3.65Å
36A90.3Very high94.9Very high64 Ų6463.3 Ų63.353%0.52937%0.365SS..THydrogen-bonded Turntrans-50.9-37.4-170.900000113.8V32V32-A36 PolarHBondContact O-N 3.43Å; V32-A36 VanDerWaalsContact O-N 3.15Å
37N91.6Very high94.9Very high167 Ų16762.4 Ų62.489%0.89336%0.357SS*.THydrogen-bonded Turntrans-99.54-175.1-59.6-33.5000114.4L35L35-N37 PolarHBondContact O-N 2.89Å
38T91.3Very high95Very high75 Ų7560.2 Ų60.246%0.4634%0.343SS..THydrogen-bonded Turntrans-100.1-11.8-17266.60000113.7L35 L40L35-T38 HydrophobicContact CD2-CG2 4.25Å; L35-T38 PolarHBondContact O-N 3.5Å; L35-T38 PolarHBondContact O-OG1 3.33Å; T38-L40 PolarHBondContact O-N 2.9Å; T38-L40 WeakPolarHBondContact OG1-CB 3.29Å; T38-L40 PolarHBondContact OG1-N 3.1Å; T38-L40 VanDerWaalsContact OG1-N 3.16Å
39G91.1Very high95.1Very high55 Ų5560.2 Ų60.257%0.56734%0.343SS*.SBendtrans69.5-0.5-168.900000114.5P42G39-P42 WeakPolarHBondContact O-CD 3.47Å
40L94.2Very high95.2Very high86 Ų8654.8 Ų54.845%0.4532%0.323SS..  trans-87.6-11.3-178.4-59.7177.7000114L35 T38 P42 Y43 A44L35-L40 HydrophobicContact CD1-CB 4.3Å; T38-L40 PolarHBondContact O-N 2.9Å; T38-L40 WeakPolarHBondContact OG1-CB 3.29Å; T38-L40 PolarHBondContact OG1-N 3.1Å; T38-L40 VanDerWaalsContact OG1-N 3.16Å; L40-P42 VanDerWaalsContact C-CD 3.47Å; L40-Y43 HydrophobicContact CD2-CD2 4.05Å; L40-Y43 HydrophobicContact CD2-CE2 4.42Å; L40-Y43 WeakPolarHBondContact O-CB 3.47Å; L40-Y43 PolarHBondContact O-N 3.11Å; L40-A44 PolarHBondContact O-N 3.2Å; L40-A44 VanDerWaalsContact O-N 3.14Å
41S95.1Very high95.3Very high25 Ų2552.5 Ų52.518%0.17531%0.309CS..Hα-helixtrans-49-46.1-179.2175.30000113.9Y43 A44 V45S41-Y43 VanDerWaalsContact C-N 3.27Å; S41-Y43 PolarHBondContact O-N 2.79Å; S41-A44 PolarHBondContact O-N 2.92Å; S41-V45 WeakPolarHBondContact O-CG2 3.36Å; S41-V45 PolarHBondContact O-N 3.34Å
42P95Very high95.5Very high54 Ų5449.3 Ų49.335%0.35129%0.293SS..Hα-helixtrans-61.6-32.5178.3-22.934.6000113.9G39 L40 E46G39-P42 WeakPolarHBondContact O-CD 3.47Å; L40-P42 VanDerWaalsContact C-CD 3.47Å; P42-E46 WeakPolarHBondContact O-CB 3.16Å; P42-E46 PolarHBondContact O-N 3.42Å
43Y96.9Very high95.8Very high25 Ų2548 Ų4810%0.09828%0.284CS..Hα-helixtrans-75.9-38179.1-56-60.7000111.8L40 S41 E46 L47 C112 R115 R116L40-Y43 HydrophobicContact CD2-CD2 4.05Å; L40-Y43 HydrophobicContact CD2-CE2 4.42Å; L40-Y43 WeakPolarHBondContact O-CB 3.47Å; L40-Y43 PolarHBondContact O-N 3.11Å; S41-Y43 VanDerWaalsContact C-N 3.27Å; S41-Y43 PolarHBondContact O-N 2.79Å; Y43-E46 WeakPolarHBondContact O-CB 3.5Å; Y43-E46 PolarHBondContact O-N 3.38Å; Y43-L47 WeakPolarHBondContact O-CB 3.49Å; Y43-L47 PolarHBondContact O-N 2.92Å; Y43-C112 PolarHBondContact OH-SG 3.41Å; Y43-R115 HydrophobicContact CD1-CB 3.83Å; Y43-R115 HydrophobicContact CE1-CB 3.45Å; Y43-R115 VanDerWaalsContact CE1-CB 3.45Å; Y43-R115 VanDerWaalsContact OH-CZ 3.29Å; Y43-R115 PolarHBondContact OH-NE 3.3Å; Y43-R115 VanDerWaalsContact OH-NE 3.1Å; Y43-R115 PolarHBondContact OH-NH2 2.89Å; Y43-R116 HydrophobicContact CD1-CG 3.83Å; Y43-R116 HydrophobicContact CE1-CG 3.88Å
44A96.4Very high96Very high8 Ų839.2 Ų39.27%0.06625%0.251CS..Hα-helixtrans-64-42.6172.600000111.5M31 L35 L40 S41 E46 L47 V48M31-A44 HydrophobicContact CB-CB 4Å; M31-A44 HydrophobicContact CE-CB 3.88Å; M31-A44 HydrophobicContact SD-CB 3.96Å; L35-A44 HydrophobicContact CD1-CB 3.65Å; L40-A44 PolarHBondContact O-N 3.2Å; L40-A44 VanDerWaalsContact O-N 3.14Å; S41-A44 PolarHBondContact O-N 2.92Å; A44-E46 VanDerWaalsContact C-N 3.33Å; A44-E46 PolarHBondContact O-N 2.91Å; A44-L47 PolarHBondContact O-N 2.99Å; A44-V48 WeakPolarHBondContact O-CG2 3.4Å; A44-V48 PolarHBondContact O-N 2.99Å
45V97.6Very high96.2Very high9 Ų936.4 Ų36.46%0.05522%0.221CC..Hα-helixtrans-62.4-42174.61740000110.9V32 S41 S49 F89 R90 A92V32-V45 HydrophobicContact CG2-CG2 3.3Å; S41-V45 WeakPolarHBondContact O-CG2 3.36Å; S41-V45 PolarHBondContact O-N 3.34Å; V45-S49 WeakPolarHBondContact O-CB 3.44Å; V45-S49 PolarHBondContact O-N 3.34Å; V45-S49 PolarHBondContact O-OG 3.41Å; V45-F89 VanDerWaalsContact CG1-O 3.28Å; V45-F89 WeakPolarHBondContact CG1-O 3.2Å; V45-R90 HydrophobicContact CG1-CB 4.23Å; V45-A92 HydrophobicContact CG1-CB 4.08Å
46E98.3Very high96.4Very high0 Ų034.5 Ų34.50%021%0.211CC..Hα-helixtrans-59.8-51.1174.8-161.775.5-149.300111.9P42 Y43 A44 V48 S49 T50 A92 V93 G94 R116 C119 Q120P42-E46 WeakPolarHBondContact O-CB 3.16Å; P42-E46 PolarHBondContact O-N 3.42Å; Y43-E46 WeakPolarHBondContact O-CB 3.5Å; Y43-E46 PolarHBondContact O-N 3.38Å; A44-E46 VanDerWaalsContact C-N 3.33Å; A44-E46 PolarHBondContact O-N 2.91Å; E46-V48 PolarHBondContact O-N 3.36Å; E46-S49 PolarHBondContact O-N 3Å; E46-T50 PolarHBondContact O-N 2.81Å; E46-T50 PolarHBondContact O-OG1 3.42Å; E46-T50 VanDerWaalsContact O-OG1 3.11Å; E46-A92 WeakPolarHBondContact OE2-CA 3.18Å; E46-V93 WeakPolarHBondContact OE1-CA 3.33Å; E46-V93 WeakPolarHBondContact OE1-CB 3.45Å; E46-V93 PolarHBondContact OE1-N 3.49Å; E46-V93 PolarHBondContact OE2-N 3.33Å; E46-G94 PolarHBondContact OE1-N 3.33Å; E46-R116 HydrophobicContact CB-CG 4.48Å; E46-R116 HydrophobicContact CG-CB 4Å; E46-R116 HydrophobicContact CG-CG 4.1Å; E46-R116 WeakPolarHBondContact OE2-CD 3.4Å; E46-R116 IonicContact OE2-CZ 3.22Å; E46-R116 IonicContact OE2-NE 2.71Å; E46-R116 IonicContact OE2-NH1 2.88Å; E46-R116 PolarHBondContact OE2-NH1 3.44Å; E46-C119 HydrophobicContact CB-CB 4.31Å; E46-C119 HydrophobicContact CG-CB 4.39Å; E46-Q120 HydrophobicContact CG-CG 3.93Å; E46-Q120 PolarHBondContact OE1-NE2 3.19Å
47L98.5Very high96.8Very high59 Ų5933.3 Ų33.331%0.30920%0.197SC..Hα-helixtrans-55.1-53.4179.1-178.972.9000111.5Y43 A44 F51 C119 A122 A123Y43-L47 WeakPolarHBondContact O-CB 3.49Å; Y43-L47 PolarHBondContact O-N 2.92Å; A44-L47 PolarHBondContact O-N 2.99Å; L47-F51 WeakPolarHBondContact O-CB 3.45Å; L47-F51 PolarHBondContact O-N 2.68Å; L47-C119 HydrophobicContact CB-CB 4.11Å; L47-C119 HydrophobicContact CD1-CB 4.44Å; L47-C119 VanDerWaalsContact CD1-O 3.29Å; L47-C119 WeakPolarHBondContact CD1-O 3.36Å; L47-A122 HydrophobicContact CD1-CB 3.82Å; L47-A123 HydrophobicContact CD1-CB 4.02Å; L47-A123 WeakPolarHBondContact O-CB 3.2Å
48V98.6Very high97.1Very high12 Ų1226.1 Ų26.17%0.07316%0.158CC..Hα-helixtrans-70.6-36.2-175-178.90000111.6S24 T27 R28 M31 A44 E46 F51 Q52S24-V48 WeakPolarHBondContact O-CG1 3.25Å; T27-V48 HydrophobicContact CG2-CG1 4.33Å; T27-V48 HydrophobicContact CG2-CG2 3.89Å; R28-V48 HydrophobicContact CG-CB 3.64Å; R28-V48 HydrophobicContact CG-CG1 3.63Å; R28-V48 HydrophobicContact CG-CG2 4.35Å; M31-V48 HydrophobicContact SD-CG2 3.96Å; A44-V48 WeakPolarHBondContact O-CG2 3.4Å; A44-V48 PolarHBondContact O-N 2.99Å; E46-V48 PolarHBondContact O-N 3.36Å; V48-F51 PolarHBondContact O-N 3.09Å; V48-Q52 PolarHBondContact O-N 2.94Å
49S98.6Very high97.5Very high0 Ų022.7 Ų22.70%014%0.137CC..Hα-helixtrans-67.1-43.6176.1-67.10000113R28 V45 E46 F51 Q52 L53 F89 A92R28-S49 WeakPolarHBondContact CD-OG 3.46Å; R28-S49 VanDerWaalsContact NH1-CA 3.27Å; R28-S49 PolarHBondContact NH1-OG 2.95Å; R28-S49 VanDerWaalsContact NH1-OG 3.09Å; V45-S49 WeakPolarHBondContact O-CB 3.44Å; V45-S49 PolarHBondContact O-N 3.34Å; V45-S49 PolarHBondContact O-OG 3.41Å; E46-S49 PolarHBondContact O-N 3Å; S49-F51 VanDerWaalsContact C-N 3.28Å; S49-F51 PolarHBondContact O-N 2.65Å; S49-Q52 PolarHBondContact O-N 3.25Å; S49-L53 PolarHBondContact O-N 3.07Å; S49-F89 WeakPolarHBondContact O-CE1 3.49Å; S49-F89 WeakPolarHBondContact O-CZ 3.4Å; S49-F89 WeakPolarHBondContact OG-CA 3.46Å; S49-F89 PolarHBondContact OG-O 3.03Å; S49-A92 VanDerWaalsContact CB-CB 3.4Å
50T98.8Very high97.8Very high0 Ų021.2 Ų21.20%012%0.116CC..Hα-helixtrans-67-32.3174.4-55.60000111.7E46 L53 C54 G94 Q120 A123E46-T50 PolarHBondContact O-N 2.81Å; E46-T50 PolarHBondContact O-OG1 3.42Å; E46-T50 VanDerWaalsContact O-OG1 3.11Å; T50-L53 WeakPolarHBondContact O-CB 3.09Å; T50-L53 PolarHBondContact O-N 3.39Å; T50-C54 WeakPolarHBondContact O-CB 3.15Å; T50-C54 PolarHBondContact O-N 2.98Å; T50-C54 PolarHBondContact O-SG 3.36Å; T50-G94 WeakPolarHBondContact OG1-CA 3.32Å; T50-Q120 HydrophobicContact CG2-CB 4.04Å; T50-Q120 HydrophobicContact CG2-CG 4.37Å; T50-Q120 WeakPolarHBondContact CG2-O 3.44Å; T50-Q120 WeakPolarHBondContact OG1-CG 3.45Å; T50-A123 HydrophobicContact CG2-CB 3.86Å
51F98.8Very high97.9Very high57 Ų5718.5 Ų18.525%0.2510%0.101CC..Hα-helixtrans-64.9-46.9176.2174.1-97.2000110.7L47 V48 S49 L53 C54 C55 A123 A126 A127 A130L47-F51 WeakPolarHBondContact O-CB 3.45Å; L47-F51 PolarHBondContact O-N 2.68Å; V48-F51 PolarHBondContact O-N 3.09Å; S49-F51 VanDerWaalsContact C-N 3.28Å; S49-F51 PolarHBondContact O-N 2.65Å; F51-L53 VanDerWaalsContact C-N 3.35Å; F51-L53 PolarHBondContact O-N 3.25Å; F51-C54 PolarHBondContact O-N 2.97Å; F51-C55 VanDerWaalsContact CE2-SG 3.59Å; F51-C55 WeakPolarHBondContact CZ-SG 3.42Å; F51-C55 WeakPolarHBondContact O-CB 3.35Å; F51-C55 PolarHBondContact O-N 3.04Å; F51-C55 PolarHBondContact O-SG 3.35Å; F51-A123 HydrophobicContact CB-CB 4.03Å; F51-A126 HydrophobicContact CD2-CB 3.87Å; F51-A126 HydrophobicContact CE2-CB 4.06Å; F51-A127 HydrophobicContact CD2-CB 4.01Å; F51-A127 HydrophobicContact CE2-CB 4.2Å; F51-A130 HydrophobicContact CE2-CB 3.99Å; F51-A130 HydrophobicContact CZ-CB 3.96Å
52Q98.8Very high98Very high0 Ų017.6 Ų17.60%09%0.094CC..Hα-helixtrans-56.4-48.3172.8-174.6-171.7-45.100111.4V20 V21 S24 R28 V48 S49 C54 C55 C56 H85 T88 F89V20-Q52 HydrophobicContact CG1-CG 4.13Å; V21-Q52 HydrophobicContact CG2-CG 4.14Å; S24-Q52 VanDerWaalsContact CB-OE1 3.28Å; R28-Q52 VanDerWaalsContact CZ-OE1 3.23Å; V48-Q52 PolarHBondContact O-N 2.94Å; S49-Q52 PolarHBondContact O-N 3.25Å; Q52-C54 PolarHBondContact O-N 3.48Å; Q52-C55 PolarHBondContact O-N 3.15Å; Q52-C56 VanDerWaalsContact O-CB 3.31Å; Q52-C56 WeakPolarHBondContact O-CB 3.46Å; Q52-C56 PolarHBondContact O-N 3.16Å; Q52-C56 PolarHBondContact O-SG 2.82Å; Q52-H85 PolarHBondContact NE2-ND1 2.95Å; Q52-T88 PolarHBondContact NE2-OG1 3.43Å; Q52-F89 HydrophobicContact CB-CE1 4.39Å
53L98.8Very high98Very high22 Ų2215.1 Ų15.112%0.1158%0.077CC..Hα-helixtrans-53.1-54.8177.3-17358.2000110.8S49 T50 F51 C55 C56 T57 F89 L217S49-L53 PolarHBondContact O-N 3.07Å; T50-L53 WeakPolarHBondContact O-CB 3.09Å; T50-L53 PolarHBondContact O-N 3.39Å; F51-L53 VanDerWaalsContact C-N 3.35Å; F51-L53 PolarHBondContact O-N 3.25Å; L53-C55 PolarHBondContact O-N 2.89Å; L53-C56 PolarHBondContact O-N 2.97Å; L53-T57 WeakPolarHBondContact O-CB 3.29Å; L53-T57 PolarHBondContact O-N 3.35Å; L53-T57 PolarHBondContact O-OG1 2.9Å; L53-F89 HydrophobicContact CB-CE2 4.37Å; L53-F89 HydrophobicContact CB-CZ 3.78Å; L53-F89 HydrophobicContact CD1-CZ 4.25Å; L53-F89 HydrophobicContact CD2-CE2 4.49Å; L53-F89 HydrophobicContact CG-CZ 4.43Å; L53-L217 HydrophobicContact CD2-CD2 4.31Å; L53-L217 HydrophobicContact CG-CD1 4.09Å; L53-L217 HydrophobicContact CG-CD2 4.28Å
54C98.8Very high97.9Very high0 Ų016.4 Ų16.40%09%0.09CC..Hα-helixtrans-65.1-41-174.8-67.30000112.4T50 F51 Q52 Q58 A127 L217 S220T50-C54 WeakPolarHBondContact O-CB 3.15Å; T50-C54 PolarHBondContact O-N 2.98Å; T50-C54 PolarHBondContact O-SG 3.36Å; F51-C54 PolarHBondContact O-N 2.97Å; Q52-C54 PolarHBondContact O-N 3.48Å; C54-Q58 WeakPolarHBondContact O-CB 3.15Å; C54-Q58 VanDerWaalsContact O-CG 3.29Å; C54-Q58 WeakPolarHBondContact O-CG 3.5Å; C54-Q58 PolarHBondContact O-N 2.92Å; C54-Q58 PolarHBondContact O-NE2 2.9Å; C54-A127 HydrophobicContact CB-CB 3.37Å; C54-L217 HydrophobicContact CB-CD1 4.4Å; C54-S220 WeakPolarHBondContact CB-OG 3.49Å
55C98.8Very high97.6Very high5 Ų521.1 Ų21.13%0.03411%0.111CC..Hα-helixtrans-65.2-47.1177.1-68.20000111.4V20 F51 Q52 L53 Q58 E59 V131V20-C55 HydrophobicContact CG1-CB 3.71Å; V20-C55 HydrophobicContact CG2-CB 4.26Å; F51-C55 VanDerWaalsContact CE2-SG 3.59Å; F51-C55 WeakPolarHBondContact CZ-SG 3.42Å; F51-C55 WeakPolarHBondContact O-CB 3.35Å; F51-C55 PolarHBondContact O-N 3.04Å; F51-C55 PolarHBondContact O-SG 3.35Å; Q52-C55 PolarHBondContact O-N 3.15Å; L53-C55 PolarHBondContact O-N 2.89Å; C55-Q58 PolarHBondContact O-N 3.5Å; C55-E59 PolarHBondContact O-N 2.98Å; C55-E59 VanDerWaalsContact O-N 3.11Å; C55-V131 HydrophobicContact CB-CG2 3.98Å
56C98.8Very high97.1Very high1 Ų123.4 Ų23.41%0.00713%0.128CC..Hα-helixtrans-63.8-43.7179.8-70.40000112.2L17 Q52 L53 Q58 E59 L60 T81L17-C56 VanDerWaalsContact CD2-CA 3.43Å; L17-C56 HydrophobicContact CD2-CB 3.57Å; Q52-C56 VanDerWaalsContact O-CB 3.31Å; Q52-C56 WeakPolarHBondContact O-CB 3.46Å; Q52-C56 PolarHBondContact O-N 3.16Å; Q52-C56 PolarHBondContact O-SG 2.82Å; L53-C56 PolarHBondContact O-N 2.97Å; C56-Q58 PolarHBondContact O-N 3.19Å; C56-E59 PolarHBondContact O-N 3.23Å; C56-L60 WeakPolarHBondContact O-CG 3.36Å; C56-L60 PolarHBondContact O-N 3Å; C56-T81 HydrophobicContact CB-CG2 3.88Å
57T98.6Very high96.4Very high39 Ų3924.2 Ų24.224%0.23914%0.136CC..Hα-helixtrans-66.1-37.1177.7-56.70000112.2L53 L60 K61 L217 T221L53-T57 WeakPolarHBondContact O-CB 3.29Å; L53-T57 PolarHBondContact O-N 3.35Å; L53-T57 PolarHBondContact O-OG1 2.9Å; T57-L60 PolarHBondContact O-N 3.44Å; T57-K61 VanDerWaalsContact O-CB 3.26Å; T57-K61 WeakPolarHBondContact O-CB 3.4Å; T57-K61 PolarHBondContact O-N 3.42Å; T57-L217 HydrophobicContact CG2-CD1 4.07Å; T57-L217 HydrophobicContact CG2-CD2 4.26Å; T57-L217 HydrophobicContact CG2-CG 4.39Å; T57-T221 HydrophobicContact CG2-CG2 3.91Å
58Q98.4Very high95.8Very high17 Ų1724.2 Ų24.28%0.07915%0.15CC..Hα-helixtrans-63-43.4174.8-76.8-179.187.500111.9C54 C55 C56 K61 L62 A127 V131 W135 S220 T221C54-Q58 WeakPolarHBondContact O-CB 3.15Å; C54-Q58 VanDerWaalsContact O-CG 3.29Å; C54-Q58 WeakPolarHBondContact O-CG 3.5Å; C54-Q58 PolarHBondContact O-N 2.92Å; C54-Q58 PolarHBondContact O-NE2 2.9Å; C55-Q58 PolarHBondContact O-N 3.5Å; C56-Q58 PolarHBondContact O-N 3.19Å; Q58-K61 PolarHBondContact O-N 3.13Å; Q58-L62 PolarHBondContact O-N 3.42Å; Q58-A127 PolarHBondContact NE2-O 2.9Å; Q58-V131 HydrophobicContact CB-CG1 3.94Å; Q58-V131 HydrophobicContact CB-CG2 4.29Å; Q58-W135 HydrophobicContact CB-CH2 4.14Å; Q58-W135 HydrophobicContact CB-CZ2 4.05Å; Q58-S220 PolarHBondContact NE2-OG 3.45Å; Q58-T221 HydrophobicContact CG-CG2 3.74Å
59E98.3Very high95.6Very high3 Ų324.2 Ų24.21%0.01415%0.15CC..Hα-helixtrans-63.3-44.8176.6-175.862.9-165.700111.8S13 V16 L17 C55 C56 K61 L62 L63 W135 H143S13-E59 VanDerWaalsContact CA-OE1 3.27Å; S13-E59 WeakPolarHBondContact CA-OE1 3.4Å; S13-E59 WeakPolarHBondContact CB-OE1 3.32Å; S13-E59 PolarHBondContact OG-OE1 2.61Å; V16-E59 HydrophobicContact CB-CG 4.39Å; V16-E59 HydrophobicContact CG1-CG 4.19Å; L17-E59 HydrophobicContact CD2-CB 4.02Å; L17-E59 HydrophobicContact CD2-CG 4.25Å; L17-E59 HydrophobicContact CG-CG 4.34Å; C55-E59 PolarHBondContact O-N 2.98Å; C55-E59 VanDerWaalsContact O-N 3.11Å; C56-E59 PolarHBondContact O-N 3.23Å; E59-K61 PolarHBondContact O-N 3.37Å; E59-L62 PolarHBondContact O-N 2.9Å; E59-L63 WeakPolarHBondContact O-CB 3.38Å; E59-L63 PolarHBondContact O-N 3.5Å; E59-W135 PolarHBondContact OE2-NE1 3.45Å; E59-H143 IonicContact OE1-CE1 3.93Å; E59-H143 IonicContact OE1-NE2 2.81Å; E59-H143 PolarHBondContact OE1-NE2 3.12Å; E59-H143 IonicContact OE2-NE2 3.88Å; E59-H143 PolarHBondContact OE2-NE2 2.98Å
60L97.8Very high95.4Very high23 Ų2327.1 Ų27.112%0.1217%0.168CC..Hα-helixtrans-63.8-39.7176.4-72179.6000112.5L17 C56 T57 L63 S64 L77 T81L17-L60 HydrophobicContact CD1-CD2 3.69Å; L17-L60 HydrophobicContact CD1-CG 4.18Å; L17-L60 HydrophobicContact CD2-CG 4.36Å; C56-L60 WeakPolarHBondContact O-CG 3.36Å; C56-L60 PolarHBondContact O-N 3Å; T57-L60 PolarHBondContact O-N 3.44Å; L60-L63 PolarHBondContact O-N 3.4Å; L60-S64 WeakPolarHBondContact O-CB 3.36Å; L60-S64 PolarHBondContact O-N 3.38Å; L60-L77 HydrophobicContact CD2-CB 3.74Å; L60-L77 HydrophobicContact CD2-CD1 4.22Å; L60-T81 HydrophobicContact CD1-CG2 3.9Å
61K96.6Very high95.2Very high30 Ų3031.4 Ų31.413%0.1320%0.196CC..Hα-helixtrans-59.9-48.8174.8-178.3179.6174.9-178.90110.2T57 Q58 E59 L63 S64 E65 T221 C225T57-K61 VanDerWaalsContact O-CB 3.26Å; T57-K61 WeakPolarHBondContact O-CB 3.4Å; T57-K61 PolarHBondContact O-N 3.42Å; Q58-K61 PolarHBondContact O-N 3.13Å; E59-K61 PolarHBondContact O-N 3.37Å; K61-L63 PolarHBondContact O-N 3.43Å; K61-S64 PolarHBondContact O-N 2.9Å; K61-E65 VanDerWaalsContact CE-CD 3.43Å; K61-E65 WeakPolarHBondContact CE-OE1 3.18Å; K61-E65 WeakPolarHBondContact CE-OE2 3.46Å; K61-E65 HydrophobicContact CG-CG 4.28Å; K61-E65 WeakPolarHBondContact CG-OE1 3.4Å; K61-E65 WeakPolarHBondContact O-CB 3.43Å; K61-E65 WeakPolarHBondContact O-CG 3.46Å; K61-E65 PolarHBondContact O-N 2.95Å; K61-T221 PolarHBondContact NZ-O 3.32Å; K61-C225 PolarHBondContact NZ-SG 2.92Å; K61-C225 VanDerWaalsContact NZ-SG 3.41Å
62L96.4Very high95.1Very high6 Ų635.1 Ų35.13%0.03121%0.214CC..Hα-helixtrans-59.1-46.9177.5178.762.9000111.8Q58 E59 S64 S66 G67 W135 L142 H146Q58-L62 PolarHBondContact O-N 3.42Å; E59-L62 PolarHBondContact O-N 2.9Å; L62-S64 VanDerWaalsContact C-N 3.35Å; L62-S64 PolarHBondContact O-N 2.82Å; L62-S66 WeakPolarHBondContact O-CA 3.47Å; L62-S66 WeakPolarHBondContact O-CB 3.44Å; L62-S66 PolarHBondContact O-N 2.93Å; L62-G67 PolarHBondContact O-N 3.01Å; L62-W135 HydrophobicContact CB-CZ2 3.96Å; L62-W135 HydrophobicContact CD2-CD2 3.98Å; L62-W135 HydrophobicContact CD2-CG 4.15Å; L62-W135 HydrophobicContact CD2-CZ2 3.89Å; L62-W135 HydrophobicContact CG-CZ2 4.5Å; L62-L142 HydrophobicContact CD1-CD1 4.16Å; L62-L142 HydrophobicContact CD2-CD2 4.45Å; L62-L142 HydrophobicContact CD2-CG 4.22Å; L62-L142 HydrophobicContact CG-CD1 4.11Å; L62-L142 HydrophobicContact CG-CD2 4.12Å; L62-L142 HydrophobicContact CG-CG 4.05Å; L62-H146 HydrophobicContact CD1-CB 3.9Å; L62-H146 VanDerWaalsContact CD1-CG 3.46Å; L62-H146 HydrophobicContact CD2-CB 4.28Å
63L96.1Very high95Very high1 Ų138 Ų381%0.00523%0.229CC..Hα-helixtrans-63.3-40179.5-174.465.8000112.2V10 E59 L60 K61 G67 G68 I69 L77 L142V10-L63 HydrophobicContact CG2-CD1 4.11Å; V10-L63 HydrophobicContact CG2-CD2 4.36Å; E59-L63 WeakPolarHBondContact O-CB 3.38Å; E59-L63 PolarHBondContact O-N 3.5Å; L60-L63 PolarHBondContact O-N 3.4Å; K61-L63 PolarHBondContact O-N 3.43Å; L63-G67 CarbonylContact O-C 3.57Å; L63-G67 WeakPolarHBondContact O-CA 3.3Å; L63-G67 PolarHBondContact O-N 3.32Å; L63-G67 VanDerWaalsContact O-N 3.08Å; L63-G68 PolarHBondContact O-N 3.31Å; L63-I69 HydrophobicContact CD1-CG2 3.96Å; L63-I69 HydrophobicContact CD2-CD1 3.99Å; L63-I69 HydrophobicContact CG-CD1 3.92Å; L63-I69 HydrophobicContact CG-CG1 4.34Å; L63-I69 HydrophobicContact CG-CG2 3.96Å; L63-L77 HydrophobicContact CD2-CD1 3.7Å; L63-L142 HydrophobicContact CB-CD2 4.34Å; L63-L142 HydrophobicContact CD1-CD2 3.77Å
64S94Very high94.9Very high53 Ų5337.5 Ų37.537%0.37123%0.229SC..Hα-helixtrans-71.9-46.8179.1-169.90000112.7L60 K61 L62L60-S64 WeakPolarHBondContact O-CB 3.36Å; L60-S64 PolarHBondContact O-N 3.38Å; K61-S64 PolarHBondContact O-N 2.9Å; L62-S64 VanDerWaalsContact C-N 3.35Å; L62-S64 PolarHBondContact O-N 2.82Å
65E89.9Confident94.9Very high106 Ų10639.3 Ų39.350%0.49524%0.238SC..Hα-helixtrans-82.3-39.9-172.7-67.8177.9177.900112.5K61K61-E65 VanDerWaalsContact CE-CD 3.43Å; K61-E65 WeakPolarHBondContact CE-OE1 3.18Å; K61-E65 WeakPolarHBondContact CE-OE2 3.46Å; K61-E65 HydrophobicContact CG-CG 4.28Å; K61-E65 WeakPolarHBondContact CG-OE1 3.4Å; K61-E65 WeakPolarHBondContact O-CB 3.43Å; K61-E65 WeakPolarHBondContact O-CG 3.46Å; K61-E65 PolarHBondContact O-N 2.95Å
66S88.3Confident94.9Very high58 Ų5842.9 Ų42.941%0.40626%0.26SS..THydrogen-bonded Turntrans-109.8-25.2-174.5-61.10000113.6L62 G68L62-S66 WeakPolarHBondContact O-CA 3.47Å; L62-S66 WeakPolarHBondContact O-CB 3.44Å; L62-S66 PolarHBondContact O-N 2.93Å; S66-G68 VanDerWaalsContact C-N 3.33Å
67G82.6Confident94.9Very high17 Ų1743.4 Ų43.418%0.17526%0.262CS..SBendtrans-79.7-15175.900000113.7L62 L63 I69L62-G67 PolarHBondContact O-N 3.01Å; L63-G67 CarbonylContact O-C 3.57Å; L63-G67 WeakPolarHBondContact O-CA 3.3Å; L63-G67 PolarHBondContact O-N 3.32Å; L63-G67 VanDerWaalsContact O-N 3.08Å; G67-I69 PolarHBondContact O-N 3.08Å
68G86.8Confident94.9Very high59 Ų5942.8 Ų42.861%0.60826%0.259SS*.  trans65.624.9173.700000114.1L63 S66L63-G68 PolarHBondContact O-N 3.31Å; S66-G68 VanDerWaalsContact C-N 3.33Å
69I94.1Very high94.9Very high12 Ų1245.7 Ų45.76%0.06227%0.269CS..  trans-65.214917960.5165.2000111M6 V10 L63 G67 L73 A74 L77M6-I69 HydrophobicContact CG-CG2 4.36Å; V10-I69 HydrophobicContact CG2-CG2 3.66Å; L63-I69 HydrophobicContact CD1-CG2 3.96Å; L63-I69 HydrophobicContact CD2-CD1 3.99Å; L63-I69 HydrophobicContact CG-CD1 3.92Å; L63-I69 HydrophobicContact CG-CG1 4.34Å; L63-I69 HydrophobicContact CG-CG2 3.96Å; G67-I69 PolarHBondContact O-N 3.08Å; I69-L73 HydrophobicContact CB-CD2 4.19Å; I69-L73 HydrophobicContact CD1-CB 4.48Å; I69-L73 HydrophobicContact CD1-CG 4.26Å; I69-L73 HydrophobicContact CG2-CD2 4.29Å; I69-A74 HydrophobicContact CD1-CB 3.73Å; I69-A74 HydrophobicContact CG1-CB 4.16Å; I69-L77 HydrophobicContact CD1-CD1 4.02Å
70P94.7Very high94.9Very high60 Ų6049.5 Ų49.539%0.3929%0.292SS..  trans-57.2143.3176.2-25.134.1000111.8Q72 L73 A74P70-Q72 PolarHBondContact O-N 3.34Å; P70-Q72 VanDerWaalsContact O-N 3.11Å; P70-L73 WeakPolarHBondContact O-CB 3.38Å; P70-L73 PolarHBondContact O-N 3.5Å; P70-A74 PolarHBondContact O-N 3.25Å; P70-A74 VanDerWaalsContact O-N 3.08Å
71P94.4Very high94.9Very high90 Ų9049 Ų4958%0.58429%0.291SS*.Hα-helixtrans-53.9-35.8-179.6-28.135000113.7L73 A74 L75P71-L73 VanDerWaalsContact C-N 3.32Å; P71-L73 PolarHBondContact O-N 3.4Å; P71-A74 PolarHBondContact O-N 2.98Å; P71-L75 WeakPolarHBondContact O-CB 3.37Å; P71-L75 VanDerWaalsContact O-CG 3.25Å; P71-L75 WeakPolarHBondContact O-CG 3.29Å; P71-L75 PolarHBondContact O-N 3.14Å
72Q96.5Very high95Very high136 Ų13648.5 Ų48.564%0.63629%0.291SS*.Hα-helixtrans-63.5-38.6177.8-60.3811.200111.8P70 T76P70-Q72 PolarHBondContact O-N 3.34Å; P70-Q72 VanDerWaalsContact O-N 3.11Å; Q72-T76 WeakPolarHBondContact O-CB 3.45Å; Q72-T76 PolarHBondContact O-N 3.16Å; Q72-T76 PolarHBondContact O-OG1 3.41Å
73L96.8Very high95.1Very high60 Ų6049 Ų4931%0.31429%0.294SS..Hα-helixtrans-69.8-43.7175.9-17758.3000110.3V10 I69 P70 P71 L75 T76 L77V10-L73 HydrophobicContact CG2-CD2 4.23Å; I69-L73 HydrophobicContact CB-CD2 4.19Å; I69-L73 HydrophobicContact CD1-CB 4.48Å; I69-L73 HydrophobicContact CD1-CG 4.26Å; I69-L73 HydrophobicContact CG2-CD2 4.29Å; P70-L73 WeakPolarHBondContact O-CB 3.38Å; P70-L73 PolarHBondContact O-N 3.5Å; P71-L73 VanDerWaalsContact C-N 3.32Å; P71-L73 PolarHBondContact O-N 3.4Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.88Å; L73-T76 PolarHBondContact O-N 3.36Å; L73-L77 HydrophobicContact CD1-CD1 4.48Å; L73-L77 HydrophobicContact CD1-CG 4.25Å; L73-L77 HydrophobicContact CG-CD1 4.25Å; L73-L77 HydrophobicContact CG-CG 4.44Å; L73-L77 VanDerWaalsContact O-CG 3.3Å; L73-L77 WeakPolarHBondContact O-CG 3.45Å; L73-L77 PolarHBondContact O-N 3.11Å
74A97.3Very high95.2Very high12 Ų1250.3 Ų50.310%0.09931%0.305CS..Hα-helixtrans-58.3-43.1176.600000112.2I69 P70 P71 L77 T78I69-A74 HydrophobicContact CD1-CB 3.73Å; I69-A74 HydrophobicContact CG1-CB 4.16Å; P70-A74 PolarHBondContact O-N 3.25Å; P70-A74 VanDerWaalsContact O-N 3.08Å; P71-A74 PolarHBondContact O-N 2.98Å; A74-L77 PolarHBondContact O-N 3.04Å; A74-T78 WeakPolarHBondContact O-CB 3.45Å; A74-T78 PolarHBondContact O-N 3.43Å; A74-T78 PolarHBondContact O-OG1 3.45Å
75L98.1Very high95.3Very high37 Ų3748.3 Ų48.319%0.19429%0.29CS..Hα-helixtrans-67.6-39.8176.3-67.8168.1000112.2P71 L73 T78 Y79 T199 V202 Y203P71-L75 WeakPolarHBondContact O-CB 3.37Å; P71-L75 VanDerWaalsContact O-CG 3.25Å; P71-L75 WeakPolarHBondContact O-CG 3.29Å; P71-L75 PolarHBondContact O-N 3.14Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.88Å; L75-T78 WeakPolarHBondContact O-CB 3.47Å; L75-T78 PolarHBondContact O-N 3.13Å; L75-Y79 PolarHBondContact O-N 3.38Å; L75-T199 HydrophobicContact CB-CG2 4Å; L75-T199 HydrophobicContact CD2-CG2 4.06Å; L75-T199 WeakPolarHBondContact O-CG2 3.29Å; L75-V202 HydrophobicContact CD2-CB 4.43Å; L75-V202 HydrophobicContact CD2-CG1 4.06Å; L75-Y203 HydrophobicContact CD1-CD2 3.75Å; L75-Y203 HydrophobicContact CD1-CG 4.38Å
76T98.3Very high95.6Very high80 Ų8044.5 Ų44.549%0.49128%0.279SS..Hα-helixtrans-61.3-45.5174.8-59.20000111Q72 L73 T78 Y79 V80Q72-T76 WeakPolarHBondContact O-CB 3.45Å; Q72-T76 PolarHBondContact O-N 3.16Å; Q72-T76 PolarHBondContact O-OG1 3.41Å; L73-T76 PolarHBondContact O-N 3.36Å; T76-T78 VanDerWaalsContact C-N 3.35Å; T76-Y79 PolarHBondContact O-N 3.48Å; T76-V80 HydrophobicContact CG2-CG2 4.5Å; T76-V80 WeakPolarHBondContact O-CG2 3.42Å; T76-V80 PolarHBondContact O-N 2.88Å
77L98.4Very high95.9Very high13 Ų1346.7 Ų46.77%0.06829%0.286CS..Hα-helixtrans-65.7-38.1176.9-66.8178.9000112L14 L60 L63 I69 L73 A74 T81L14-L77 HydrophobicContact CD2-CD2 3.6Å; L60-L77 HydrophobicContact CD2-CB 3.74Å; L60-L77 HydrophobicContact CD2-CD1 4.22Å; L63-L77 HydrophobicContact CD2-CD1 3.7Å; I69-L77 HydrophobicContact CD1-CD1 4.02Å; L73-L77 HydrophobicContact CD1-CD1 4.48Å; L73-L77 HydrophobicContact CD1-CG 4.25Å; L73-L77 HydrophobicContact CG-CD1 4.25Å; L73-L77 HydrophobicContact CG-CG 4.44Å; L73-L77 VanDerWaalsContact O-CG 3.3Å; L73-L77 WeakPolarHBondContact O-CG 3.45Å; L73-L77 PolarHBondContact O-N 3.11Å; A74-L77 PolarHBondContact O-N 3.04Å; L77-T81 WeakPolarHBondContact O-CB 3.4Å; L77-T81 PolarHBondContact O-N 3.14Å; L77-T81 PolarHBondContact O-OG1 3.29Å
78T98.5Very high96.5Very high26 Ų2647 Ų4716%0.1629%0.285CS..Hα-helixtrans-59.7-46.5172.9-61.30000111A74 L75 T76 S82 I198 V202A74-T78 WeakPolarHBondContact O-CB 3.45Å; A74-T78 PolarHBondContact O-N 3.43Å; A74-T78 PolarHBondContact O-OG1 3.45Å; L75-T78 WeakPolarHBondContact O-CB 3.47Å; L75-T78 PolarHBondContact O-N 3.13Å; T76-T78 VanDerWaalsContact C-N 3.35Å; T78-S82 VanDerWaalsContact O-CB 3.24Å; T78-S82 WeakPolarHBondContact O-CB 3.31Å; T78-S82 PolarHBondContact O-N 2.89Å; T78-S82 PolarHBondContact O-OG 3.09Å; T78-I198 HydrophobicContact CG2-CG2 4.4Å; T78-V202 HydrophobicContact CG2-CB 4.43Å; T78-V202 HydrophobicContact CG2-CG2 4.12Å
79Y98.8Very high96.8Very high78 Ų7845.2 Ų45.231%0.30626%0.26SS..Hα-helixtrans-61-54.9176.9176-96.5000111.8L75 T76 T81 S82 V83 H192 A195 A196 T199L75-Y79 PolarHBondContact O-N 3.38Å; T76-Y79 PolarHBondContact O-N 3.48Å; Y79-T81 VanDerWaalsContact C-N 3.29Å; Y79-T81 PolarHBondContact O-N 3.4Å; Y79-S82 WeakPolarHBondContact O-CB 3.33Å; Y79-S82 PolarHBondContact O-N 3.19Å; Y79-S82 VanDerWaalsContact O-N 3.14Å; Y79-V83 HydrophobicContact CD1-CG2 4.32Å; Y79-V83 HydrophobicContact CE1-CG2 3.9Å; Y79-V83 HydrophobicContact CE2-CG2 4.23Å; Y79-V83 WeakPolarHBondContact O-CG2 3.47Å; Y79-V83 PolarHBondContact O-N 3.09Å; Y79-H192 AromaticContact CZ-ND1 3.71Å; Y79-H192 PolarHBondContact OH-ND1 3.48Å; Y79-A195 HydrophobicContact CD2-CB 3.97Å; Y79-A195 HydrophobicContact CE2-CB 3.95Å; Y79-A196 HydrophobicContact CE2-CB 4.21Å; Y79-T199 VanDerWaalsContact CA-OG1 3.26Å; Y79-T199 WeakPolarHBondContact CA-OG1 3.35Å; Y79-T199 WeakPolarHBondContact CB-OG1 3.32Å; Y79-T199 PolarHBondContact N-OG1 3.42Å
80V98.5Very high96.5Very high82 Ų8250.9 Ų50.950%0.49728%0.281SS..Hα-helixtrans-59.2-43.4-177.8170.70000110.9T76 V83 A84T76-V80 HydrophobicContact CG2-CG2 4.5Å; T76-V80 WeakPolarHBondContact O-CG2 3.42Å; T76-V80 PolarHBondContact O-N 2.88Å; V80-V83 PolarHBondContact O-N 3.48Å; V80-A84 WeakPolarHBondContact O-CB 3.46Å; V80-A84 PolarHBondContact O-N 3.43Å
81T98.4Very high96.1Very high13 Ų1350.9 Ų50.98%0.0829%0.291CS..Hα-helixtrans-68.1-38.5178.6-57.30000111.5C56 L60 L77 Y79 V83 A84 H85C56-T81 HydrophobicContact CB-CG2 3.88Å; L60-T81 HydrophobicContact CD1-CG2 3.9Å; L77-T81 WeakPolarHBondContact O-CB 3.4Å; L77-T81 PolarHBondContact O-N 3.14Å; L77-T81 PolarHBondContact O-OG1 3.29Å; Y79-T81 VanDerWaalsContact C-N 3.29Å; Y79-T81 PolarHBondContact O-N 3.4Å; T81-V83 PolarHBondContact O-N 3Å; T81-A84 WeakPolarHBondContact O-CB 3.27Å; T81-A84 PolarHBondContact O-N 2.89Å; T81-H85 VanDerWaalsContact CG2-NE2 3.29Å; T81-H85 WeakPolarHBondContact CG2-NE2 3.21Å; T81-H85 PolarHBondContact O-CD2 3.34Å; T81-H85 VanDerWaalsContact O-CG 3.25Å; T81-H85 PolarHBondContact O-N 3.28Å
82S98.3Very high96.1Very high20 Ų2047.2 Ų47.214%0.1427%0.269CS..Hα-helixtrans-63.7-40.2174.1-61.60000112.3T78 Y79 H85 G86T78-S82 VanDerWaalsContact O-CB 3.24Å; T78-S82 WeakPolarHBondContact O-CB 3.31Å; T78-S82 PolarHBondContact O-N 2.89Å; T78-S82 PolarHBondContact O-OG 3.09Å; Y79-S82 WeakPolarHBondContact O-CB 3.33Å; Y79-S82 PolarHBondContact O-N 3.19Å; Y79-S82 VanDerWaalsContact O-N 3.14Å; S82-H85 PolarHBondContact O-N 3.37Å; S82-G86 PolarHBondContact O-N 3.45Å
83V98.2Very high96Very high15 Ų1542.5 Ų42.59%0.09125%0.249CC..Hα-helixtrans-61.9-47.8172.21720000110.3Y79 V80 T81 H85 G86 L87 V191 H192 A195Y79-V83 HydrophobicContact CD1-CG2 4.32Å; Y79-V83 HydrophobicContact CE1-CG2 3.9Å; Y79-V83 HydrophobicContact CE2-CG2 4.23Å; Y79-V83 WeakPolarHBondContact O-CG2 3.47Å; Y79-V83 PolarHBondContact O-N 3.09Å; V80-V83 PolarHBondContact O-N 3.48Å; T81-V83 PolarHBondContact O-N 3Å; V83-H85 VanDerWaalsContact C-N 3.3Å; V83-H85 PolarHBondContact O-N 2.96Å; V83-G86 PolarHBondContact O-N 3.44Å; V83-G86 VanDerWaalsContact O-N 3.16Å; V83-L87 HydrophobicContact CG1-CD1 3.84Å; V83-L87 HydrophobicContact CG1-CG 4.28Å; V83-L87 WeakPolarHBondContact O-CG 3.35Å; V83-L87 PolarHBondContact O-N 3.27Å; V83-V191 HydrophobicContact CB-CG1 4.37Å; V83-V191 HydrophobicContact CG1-CG1 4.14Å; V83-H192 WeakPolarHBondContact CG2-ND1 3.5Å; V83-A195 HydrophobicContact CG2-CB 3.52Å
84A97.7Very high96Very high29 Ų2939.7 Ų39.724%0.2423%0.234CC..Hα-helixtrans-58.2-42.3178.400000111.8V80 T81 L87 T88V80-A84 WeakPolarHBondContact O-CB 3.46Å; V80-A84 PolarHBondContact O-N 3.43Å; T81-A84 WeakPolarHBondContact O-CB 3.27Å; T81-A84 PolarHBondContact O-N 2.89Å; A84-L87 PolarHBondContact O-N 3.41Å; A84-T88 WeakPolarHBondContact O-CB 3.37Å; A84-T88 VanDerWaalsContact O-CG2 3.25Å; A84-T88 WeakPolarHBondContact O-CG2 3.42Å; A84-T88 PolarHBondContact O-N 3.38Å; A84-T88 PolarHBondContact O-OG1 3.15Å
85H97.4Very high96.1Very high11 Ų1140.5 Ų40.55%0.05124%0.237CC..Hα-helixtrans-60.1-51.5172.9-67.9-37.7000112Q52 T81 S82 V83 L87 T88 F89Q52-H85 PolarHBondContact NE2-ND1 2.95Å; T81-H85 VanDerWaalsContact CG2-NE2 3.29Å; T81-H85 WeakPolarHBondContact CG2-NE2 3.21Å; T81-H85 PolarHBondContact O-CD2 3.34Å; T81-H85 VanDerWaalsContact O-CG 3.25Å; T81-H85 PolarHBondContact O-N 3.28Å; S82-H85 PolarHBondContact O-N 3.37Å; V83-H85 VanDerWaalsContact C-N 3.3Å; V83-H85 PolarHBondContact O-N 2.96Å; H85-L87 VanDerWaalsContact C-N 3.27Å; H85-L87 PolarHBondContact O-N 3.47Å; H85-T88 PolarHBondContact O-N 3.33Å; H85-T88 VanDerWaalsContact O-N 3.09Å; H85-T88 PolarHBondContact O-OG1 2.93Å; H85-F89 HydrophobicContact CB-CD1 4.21Å; H85-F89 HydrophobicContact CB-CE1 3.67Å; H85-F89 HydrophobicContact CB-CE2 4.05Å; H85-F89 HydrophobicContact CB-CZ 3.54Å; H85-F89 AromaticContact CG-CE1 3.81Å; H85-F89 AromaticContact CG-CZ 3.63Å; H85-F89 AromaticContact ND1-CE1 3.46Å; H85-F89 WeakPolarHBondContact ND1-CE1 3.31Å; H85-F89 AromaticContact ND1-CZ 3.61Å; H85-F89 VanDerWaalsContact O-CB 3.32Å; H85-F89 WeakPolarHBondContact O-CB 3.49Å; H85-F89 WeakPolarHBondContact O-CD1 3.27Å; H85-F89 WeakPolarHBondContact O-CG 3.49Å; H85-F89 PolarHBondContact O-N 3.11Å
86G95.1Very high96.1Very high27 Ų2738.8 Ų38.828%0.27823%0.228SC..Hα-helixtrans-57.1-38.3179.300000113.5S82 V83S82-G86 PolarHBondContact O-N 3.45Å; V83-G86 PolarHBondContact O-N 3.44Å; V83-G86 VanDerWaalsContact O-N 3.16Å
87L95.2Very high96.1Very high104 Ų10435 Ų3555%0.54521%0.205SC..Hα-helixtrans-77.3-25.2178.1-64.5177.1000113.9V83 A84 H85 V191V83-L87 HydrophobicContact CG1-CD1 3.84Å; V83-L87 HydrophobicContact CG1-CG 4.28Å; V83-L87 WeakPolarHBondContact O-CG 3.35Å; V83-L87 PolarHBondContact O-N 3.27Å; A84-L87 PolarHBondContact O-N 3.41Å; H85-L87 VanDerWaalsContact C-N 3.27Å; H85-L87 PolarHBondContact O-N 3.47Å; L87-V191 HydrophobicContact CD2-CB 4.41Å; L87-V191 HydrophobicContact CD2-CG1 4.29Å; L87-V191 HydrophobicContact CD2-CG2 4.26Å; L87-V191 HydrophobicContact CG-CG1 4.16Å
88T95.4Very high95.9Very high24 Ų2434.8 Ų34.815%0.14721%0.206CC..Hα-helixtrans-102.6-15.9-172.956.30000114.4V21 R28 Q52 A84 H85 R90V21-T88 HydrophobicContact CG1-CG2 4.03Å; R28-T88 PolarHBondContact NE-O 2.96Å; Q52-T88 PolarHBondContact NE2-OG1 3.43Å; A84-T88 WeakPolarHBondContact O-CB 3.37Å; A84-T88 VanDerWaalsContact O-CG2 3.25Å; A84-T88 WeakPolarHBondContact O-CG2 3.42Å; A84-T88 PolarHBondContact O-N 3.38Å; A84-T88 PolarHBondContact O-OG1 3.15Å; H85-T88 PolarHBondContact O-N 3.33Å; H85-T88 VanDerWaalsContact O-N 3.09Å; H85-T88 PolarHBondContact O-OG1 2.93Å; T88-R90 VanDerWaalsContact C-N 3.27Å; T88-R90 PolarHBondContact O-N 2.93Å
89F93.5Very high95.8Very high21 Ų2133.5 Ų33.59%0.09220%0.198CC..SBendtrans-72.9-13.1-171.9-82.416.8000115V45 S49 Q52 L53 H85 G91 A92V45-F89 VanDerWaalsContact CG1-O 3.28Å; V45-F89 WeakPolarHBondContact CG1-O 3.2Å; S49-F89 WeakPolarHBondContact O-CE1 3.49Å; S49-F89 WeakPolarHBondContact O-CZ 3.4Å; S49-F89 WeakPolarHBondContact OG-CA 3.46Å; S49-F89 PolarHBondContact OG-O 3.03Å; Q52-F89 HydrophobicContact CB-CE1 4.39Å; L53-F89 HydrophobicContact CB-CE2 4.37Å; L53-F89 HydrophobicContact CB-CZ 3.78Å; L53-F89 HydrophobicContact CD1-CZ 4.25Å; L53-F89 HydrophobicContact CD2-CE2 4.49Å; L53-F89 HydrophobicContact CG-CZ 4.43Å; H85-F89 HydrophobicContact CB-CD1 4.21Å; H85-F89 HydrophobicContact CB-CE1 3.67Å; H85-F89 HydrophobicContact CB-CE2 4.05Å; H85-F89 HydrophobicContact CB-CZ 3.54Å; H85-F89 AromaticContact CG-CE1 3.81Å; H85-F89 AromaticContact CG-CZ 3.63Å; H85-F89 AromaticContact ND1-CE1 3.46Å; H85-F89 WeakPolarHBondContact ND1-CE1 3.31Å; H85-F89 AromaticContact ND1-CZ 3.61Å; H85-F89 VanDerWaalsContact O-CB 3.32Å; H85-F89 WeakPolarHBondContact O-CB 3.49Å; H85-F89 WeakPolarHBondContact O-CD1 3.27Å; H85-F89 WeakPolarHBondContact O-CG 3.49Å; H85-F89 PolarHBondContact O-N 3.11Å; F89-G91 PolarHBondContact O-N 2.93Å; F89-G91 VanDerWaalsContact O-N 3.12Å; F89-A92 HydrophobicContact CB-CB 4.2Å; F89-A92 WeakPolarHBondContact O-CB 3.29Å; F89-A92 PolarHBondContact O-N 2.75Å
90R87Confident95.7Very high131 Ų13133 Ų3349%0.49420%0.2SC..THydrogen-bonded Turntrans47.442.5173.7-64.6-178.2179.3-111.4-3.8113.6D25 V45 T88D25-R90 IonicContact OD1-NE 3.6Å; D25-R90 IonicContact OD1-NH2 3.72Å; V45-R90 HydrophobicContact CG1-CB 4.23Å; T88-R90 VanDerWaalsContact C-N 3.27Å; T88-R90 PolarHBondContact O-N 2.93Å
91G86.1Confident95.5Very high59 Ų5929.3 Ų29.361%0.60818%0.177SC*.THydrogen-bonded Turntrans85.17.5179.100000116F89 R116F89-G91 PolarHBondContact O-N 2.93Å; F89-G91 VanDerWaalsContact O-N 3.12Å; G91-R116 PolarHBondContact O-NH1 3.43Å
92A94.9Very high95.3Very high14 Ų1430.9 Ų30.912%0.11618%0.184CC..  trans-64.9144.7161.500000110.6V45 E46 S49 F89V45-A92 HydrophobicContact CG1-CB 4.08Å; E46-A92 WeakPolarHBondContact OE2-CA 3.18Å; S49-A92 VanDerWaalsContact CB-CB 3.4Å; F89-A92 HydrophobicContact CB-CB 4.2Å; F89-A92 WeakPolarHBondContact O-CB 3.29Å; F89-A92 PolarHBondContact O-N 2.75Å
93V95.2Very high95.1Very high36 Ų3631.4 Ų31.422%0.21819%0.189CC..  trans-85.8-39.6178-177.60000110.9E46 N95E46-V93 WeakPolarHBondContact OE1-CA 3.33Å; E46-V93 WeakPolarHBondContact OE1-CB 3.45Å; E46-V93 PolarHBondContact OE1-N 3.49Å; E46-V93 PolarHBondContact OE2-N 3.33Å; V93-N95 WeakPolarHBondContact CG1-O 3.5Å; V93-N95 PolarHBondContact O-N 2.73Å; V93-N95 VanDerWaalsContact O-N 3.12Å
94G96.8Very high94.8Very high1 Ų136.3 Ų36.31%0.0121%0.207CC..  trans71.1-0.3177.700000115.2E46 T50 N214E46-G94 PolarHBondContact OE1-N 3.33Å; T50-G94 WeakPolarHBondContact OG1-CA 3.32Å; G94-N214 PolarHBondContact O-ND2 3.4Å
95N98Very high94.5Very high30 Ų3037.9 Ų37.916%0.1621%0.207CC..  trans-141.4125.6-173.1-173.1-20.3000111V93 C97 G98 A99 Q120 F213 N214 P215V93-N95 WeakPolarHBondContact CG1-O 3.5Å; V93-N95 PolarHBondContact O-N 2.73Å; V93-N95 VanDerWaalsContact O-N 3.12Å; N95-C97 VanDerWaalsContact C-N 3.26Å; N95-C97 PolarHBondContact O-N 3.03Å; N95-C97 WeakPolarHBondContact OD1-CB 3.41Å; N95-C97 PolarHBondContact OD1-N 3.2Å; N95-G98 PolarHBondContact O-N 2.91Å; N95-G98 VanDerWaalsContact O-N 3.14Å; N95-A99 PolarHBondContact O-N 2.98Å; N95-A99 VanDerWaalsContact O-N 3.08Å; N95-Q120 PolarHBondContact O-NE2 3.43Å; N95-F213 PolarHBondContact ND2-O 3.45Å; N95-F213 VanDerWaalsContact ND2-O 3.1Å; N95-N214 HydrophobicContact CB-CB 4.48Å; N95-P215 WeakPolarHBondContact OD1-CD 3.48Å
96P98.3Very high94Very high0 Ų041.6 Ų41.60%024%0.239CC..Hα-helixtrans-55.7-37.9175.6-29.335.3000113.9G98 A99 L100 I117 Q120 F121 N214 P215 A216 W238P96-G98 PolarHBondContact O-N 2.98Å; P96-A99 PolarHBondContact O-N 3.45Å; P96-L100 WeakPolarHBondContact O-CG 3.46Å; P96-L100 PolarHBondContact O-N 3Å; P96-I117 HydrophobicContact CB-CG1 4.19Å; P96-I117 HydrophobicContact CB-CG2 4.31Å; P96-I117 HydrophobicContact CG-CG2 4.46Å; P96-Q120 VanDerWaalsContact CA-OE1 3.22Å; P96-Q120 VanDerWaalsContact CG-OE1 3.25Å; P96-F121 HydrophobicContact CG-CE2 3.86Å; P96-F121 HydrophobicContact CG-CZ 4.19Å; P96-N214 VanDerWaalsContact CD-OD1 3.32Å; P96-N214 WeakPolarHBondContact CD-OD1 3.31Å; P96-P215 HydrophobicContact CB-CB 4.37Å; P96-P215 HydrophobicContact CB-CG 4.21Å; P96-P215 HydrophobicContact CG-CB 4.1Å; P96-P215 HydrophobicContact CG-CG 4.36Å; P96-A216 HydrophobicContact CG-CB 3.7Å; P96-W238 HydrophobicContact CB-CH2 4.42Å; P96-W238 HydrophobicContact CB-CZ3 4.44Å
97C97.6Very high93.4Very high2 Ų246.2 Ų46.21%0.01425%0.248CC..Hα-helixtrans-61.4-45.3177-61.80000111.3N95 A99 L100 E101 P215 L242 M245N95-C97 VanDerWaalsContact C-N 3.26Å; N95-C97 PolarHBondContact O-N 3.03Å; N95-C97 WeakPolarHBondContact OD1-CB 3.41Å; N95-C97 PolarHBondContact OD1-N 3.2Å; C97-A99 VanDerWaalsContact C-N 3.33Å; C97-A99 PolarHBondContact O-N 3.27Å; C97-L100 PolarHBondContact O-N 3.45Å; C97-E101 PolarHBondContact O-N 3.01Å; C97-P215 VanDerWaalsContact SG-CD 3.6Å; C97-L242 HydrophobicContact CB-CD2 4.32Å; C97-L242 VanDerWaalsContact SG-CD2 3.6Å; C97-M245 HydrophobicContact CB-CB 4.2Å; C97-M245 HydrophobicContact CB-CE 4.25Å; C97-M245 HydrophobicContact CB-CG 4.2Å; C97-M245 VanDerWaalsContact O-CE 3.24Å; C97-M245 WeakPolarHBondContact O-CE 3.46Å
98G95.6Very high92.9Very high7 Ų742.8 Ų42.87%0.07223%0.23CC..Hα-helixtrans-66.4-33.117700000113.1N95 P96 L100 E101 H102N95-G98 PolarHBondContact O-N 2.91Å; N95-G98 VanDerWaalsContact O-N 3.14Å; P96-G98 PolarHBondContact O-N 2.98Å; G98-L100 VanDerWaalsContact C-N 3.33Å; G98-E101 WeakPolarHBondContact O-CB 3.3Å; G98-E101 PolarHBondContact O-N 2.98Å; G98-H102 PolarHBondContact O-N 3.4Å
99A95.9Very high92.8Very high0 Ų045 Ų450%025%0.247CC..Hα-helixtrans-66.3-38.5175.500000111.4N95 P96 C97 A103 I117N95-A99 PolarHBondContact O-N 2.98Å; N95-A99 VanDerWaalsContact O-N 3.08Å; P96-A99 PolarHBondContact O-N 3.45Å; C97-A99 VanDerWaalsContact C-N 3.33Å; C97-A99 PolarHBondContact O-N 3.27Å; A99-A103 PolarHBondContact O-N 3.12Å; A99-A103 VanDerWaalsContact O-N 3.1Å; A99-I117 HydrophobicContact CB-CD1 4.24Å; A99-I117 HydrophobicContact CB-CG1 3.83Å
100L96.2Very high92.6Very high67 Ų6746.3 Ų46.335%0.35127%0.266SS..Hα-helixtrans-69.3-38.8173.7-67.2170000112P96 C97 G98 H102 A103 Y104 I117 L242P96-L100 WeakPolarHBondContact O-CG 3.46Å; P96-L100 PolarHBondContact O-N 3Å; C97-L100 PolarHBondContact O-N 3.45Å; G98-L100 VanDerWaalsContact C-N 3.33Å; L100-H102 VanDerWaalsContact C-N 3.35Å; L100-H102 PolarHBondContact O-N 3.36Å; L100-A103 WeakPolarHBondContact O-CB 3.49Å; L100-A103 PolarHBondContact O-N 2.82Å; L100-Y104 WeakPolarHBondContact O-CB 3.14Å; L100-Y104 PolarHBondContact O-N 3.12Å; L100-I117 HydrophobicContact CD2-CD1 4Å; L100-I117 HydrophobicContact CG-CD1 4.01Å; L100-L242 HydrophobicContact CD1-CD2 3.45Å; L100-L242 VanDerWaalsContact CD1-CD2 3.45Å
101E95.4Very high92.8Very high4 Ų442.2 Ų42.22%0.01926%0.264CS..Hα-helixtrans-57.1-47.7172.3-168.2-120.714800111.6C97 G98 A103 Y104 R105 Q176 M245 V249C97-E101 PolarHBondContact O-N 3.01Å; G98-E101 WeakPolarHBondContact O-CB 3.3Å; G98-E101 PolarHBondContact O-N 2.98Å; E101-A103 VanDerWaalsContact C-N 3.3Å; E101-A103 PolarHBondContact O-N 3.14Å; E101-Y104 WeakPolarHBondContact O-CB 3.18Å; E101-Y104 PolarHBondContact O-N 3.05Å; E101-R105 PolarHBondContact O-N 3.27Å; E101-R105 WeakPolarHBondContact OE1-CD 3.24Å; E101-R105 IonicContact OE1-CZ 3.99Å; E101-R105 IonicContact OE1-NE 3.62Å; E101-R105 PolarHBondContact OE1-NE 2.87Å; E101-Q176 PolarHBondContact OE2-NE2 3.33Å; E101-M245 HydrophobicContact CB-CE 4.24Å; E101-M245 HydrophobicContact CB-CG 4.46Å; E101-M245 HydrophobicContact CB-SD 3.58Å; E101-M245 VanDerWaalsContact CB-SD 3.58Å; E101-M245 HydrophobicContact CG-SD 3.75Å; E101-V249 HydrophobicContact CG-CG2 3.5Å; E101-V249 VanDerWaalsContact CG-CG2 3.5Å
102H93.2Very high93.2Very high47 Ų4740.7 Ų40.722%0.21824%0.244CC..Hα-helixtrans-63-36.2177-77-170000112.4G98 L100 A106 R107 L108G98-H102 PolarHBondContact O-N 3.4Å; L100-H102 VanDerWaalsContact C-N 3.35Å; L100-H102 PolarHBondContact O-N 3.36Å; H102-A106 PolarHBondContact O-N 2.94Å; H102-R107 HydrophobicContact CB-CB 4.24Å; H102-R107 WeakPolarHBondContact O-CA 3.49Å; H102-R107 WeakPolarHBondContact O-CB 3.4Å; H102-R107 PolarHBondContact O-N 3.44Å; H102-L108 HydrophobicContact CB-CB 4.39Å; H102-L108 HydrophobicContact CB-CD1 3.76Å; H102-L108 HydrophobicContact CB-CG 3.97Å; H102-L108 PolarHBondContact O-N 3.36Å; H102-L108 VanDerWaalsContact O-N 3.15Å
103A93.6Very high93.2Very high30 Ų3040.1 Ų40.125%0.24824%0.24CC..Hα-helixtrans-66.6-44.3173.200000111.8A99 L100 E101 R105 A106 L108 A113A99-A103 PolarHBondContact O-N 3.12Å; A99-A103 VanDerWaalsContact O-N 3.1Å; L100-A103 WeakPolarHBondContact O-CB 3.49Å; L100-A103 PolarHBondContact O-N 2.82Å; E101-A103 VanDerWaalsContact C-N 3.3Å; E101-A103 PolarHBondContact O-N 3.14Å; A103-R105 PolarHBondContact O-N 3.29Å; A103-A106 PolarHBondContact O-N 3.08Å; A103-L108 WeakPolarHBondContact CA-O 3.37Å; A103-A113 HydrophobicContact CB-CB 3.84Å
104Y92.6Very high93.3Very high119 Ų11943.1 Ų43.147%0.46726%0.258SS..Hα-helixtrans-60.1-43.1177.1171.5-98.6000112.1L100 E101 A106 M246 V249 L250L100-Y104 WeakPolarHBondContact O-CB 3.14Å; L100-Y104 PolarHBondContact O-N 3.12Å; E101-Y104 WeakPolarHBondContact O-CB 3.18Å; E101-Y104 PolarHBondContact O-N 3.05Å; Y104-A106 PolarHBondContact O-N 3.24Å; Y104-M246 HydrophobicContact CD1-CE 4.5Å; Y104-M246 HydrophobicContact CD2-CE 4.16Å; Y104-M246 HydrophobicContact CE2-CE 4.35Å; Y104-M246 HydrophobicContact CG-CE 4.24Å; Y104-V249 HydrophobicContact CD1-CG1 3.74Å; Y104-V249 HydrophobicContact CE1-CG1 3.52Å; Y104-L250 VanDerWaalsContact OH-CD2 3.31Å; Y104-L250 WeakPolarHBondContact OH-CD2 3.31Å
105R91.2Very high93.3Very high62 Ų6249.3 Ų49.323%0.23428%0.281CS..THydrogen-bonded Turntrans-76.68.6175-66.9-169.1-179.9-82-2.2114.2E101 A103 R107 D253E101-R105 PolarHBondContact O-N 3.27Å; E101-R105 WeakPolarHBondContact OE1-CD 3.24Å; E101-R105 IonicContact OE1-CZ 3.99Å; E101-R105 IonicContact OE1-NE 3.62Å; E101-R105 PolarHBondContact OE1-NE 2.87Å; A103-R105 PolarHBondContact O-N 3.29Å; R105-R107 HydrophobicContact CB-CG 4.1Å; R105-R107 PolarHBondContact O-N 2.97Å; R105-D253 IonicContact CZ-OD1 2.87Å; R105-D253 IonicContact NH1-OD1 3.58Å; R105-D253 PolarHBondContact NH1-OD1 3.26Å; R105-D253 IonicContact NH1-OD2 3.67Å; R105-D253 IonicContact NH2-OD1 3.36Å; R105-D253 PolarHBondContact NH2-OD1 3.32Å; R105-D253 IonicContact NH2-OD2 3.43Å
106A87.3Confident93.3Very high88 Ų8849.3 Ų49.373%0.72728%0.279SS*.THydrogen-bonded Turntrans54.123.2-175.100000114.7H102 A103 Y104 L108H102-A106 PolarHBondContact O-N 2.94Å; A103-A106 PolarHBondContact O-N 3.08Å; Y104-A106 PolarHBondContact O-N 3.24Å; A106-L108 VanDerWaalsContact C-N 3.34Å
107R82.9Confident93.3Very high124 Ų12450.6 Ų50.647%0.46829%0.285SS..SBendtrans-77.2-23.6172.8-64.7-178.3176.3177.8-1.2111.9H102 R105H102-R107 HydrophobicContact CB-CB 4.24Å; H102-R107 WeakPolarHBondContact O-CA 3.49Å; H102-R107 WeakPolarHBondContact O-CB 3.4Å; H102-R107 PolarHBondContact O-N 3.44Å; R105-R107 HydrophobicContact CB-CG 4.1Å; R105-R107 PolarHBondContact O-N 2.97Å
108L84.6Confident93.3Very high32 Ų3253.3 Ų53.317%0.16831%0.308CS..SBendtrans-132.2146.4172.7-67.4175.8000109.5H102 A103 A106 C112H102-L108 HydrophobicContact CB-CB 4.39Å; H102-L108 HydrophobicContact CB-CD1 3.76Å; H102-L108 HydrophobicContact CB-CG 3.97Å; H102-L108 PolarHBondContact O-N 3.36Å; H102-L108 VanDerWaalsContact O-N 3.15Å; A103-L108 WeakPolarHBondContact CA-O 3.37Å; A106-L108 VanDerWaalsContact C-N 3.34Å; L108-C112 HydrophobicContact CB-CB 4.39Å; L108-C112 HydrophobicContact CD2-CB 4.45Å
109S92.2Very high93.5Very high71 Ų7154.1 Ų54.150%0.49731%0.312SS..  trans-68.1153.8165.772.40000110.4G111 C112 A113S109-G111 VanDerWaalsContact C-N 3.29Å; S109-G111 PolarHBondContact O-N 2.86Å; S109-C112 WeakPolarHBondContact O-CA 3.26Å; S109-C112 WeakPolarHBondContact O-CB 3.4Å; S109-C112 PolarHBondContact O-N 3.21Å; S109-C112 WeakPolarHBondContact OG-CB 3.44Å; S109-C112 PolarHBondContact OG-N 3.2Å; S109-C112 PolarHBondContact OG-SG 3.48Å; S109-A113 PolarHBondContact O-N 3.03Å
110G89.6Confident93.6Very high48 Ų4854.1 Ų54.150%0.49531%0.312SS..Hα-helixtrans-54.7-43.5178.300000112.8C112 A113 V114G110-C112 VanDerWaalsContact C-N 3.34Å; G110-C112 PolarHBondContact O-N 3.1Å; G110-A113 PolarHBondContact O-N 3.46Å; G110-V114 WeakPolarHBondContact O-CG2 3.36Å; G110-V114 PolarHBondContact O-N 2.89Å
111G92.4Very high93.7Very high45 Ų4552.9 Ų52.946%0.46430%0.304SS..Hα-helixtrans-63-35.8175.300000113.6S109 R115S109-G111 VanDerWaalsContact C-N 3.29Å; S109-G111 PolarHBondContact O-N 2.86Å; G111-R115 WeakPolarHBondContact O-CG 3.47Å; G111-R115 PolarHBondContact O-N 2.74Å; G111-R115 VanDerWaalsContact O-N 3.14Å
112C93.7Very high93.9Very high28 Ų2855.1 Ų55.119%0.18932%0.323CS..Hα-helixtrans-67.1-39.8173.5-73.50000112.3Y43 L108 S109 G110 R115 R116Y43-C112 PolarHBondContact OH-SG 3.41Å; L108-C112 HydrophobicContact CB-CB 4.39Å; L108-C112 HydrophobicContact CD2-CB 4.45Å; S109-C112 WeakPolarHBondContact O-CA 3.26Å; S109-C112 WeakPolarHBondContact O-CB 3.4Å; S109-C112 PolarHBondContact O-N 3.21Å; S109-C112 WeakPolarHBondContact OG-CB 3.44Å; S109-C112 PolarHBondContact OG-N 3.2Å; S109-C112 PolarHBondContact OG-SG 3.48Å; G110-C112 VanDerWaalsContact C-N 3.34Å; G110-C112 PolarHBondContact O-N 3.1Å; C112-R115 PolarHBondContact O-N 2.91Å; C112-R115 PolarHBondContact SG-NH2 3Å; C112-R115 VanDerWaalsContact SG-NH2 3.43Å; C112-R116 PolarHBondContact O-N 2.8Å; C112-R116 VanDerWaalsContact O-N 3.09Å
113A95.5Very high94.2Very high2 Ų252.9 Ų52.92%0.01731%0.312CS..Hα-helixtrans-64.6-46176.600000111.7A103 S109 G110 R115 R116 I117A103-A113 HydrophobicContact CB-CB 3.84Å; S109-A113 PolarHBondContact O-N 3.03Å; G110-A113 PolarHBondContact O-N 3.46Å; A113-R115 VanDerWaalsContact C-N 3.34Å; A113-R115 PolarHBondContact O-N 3.35Å; A113-R116 PolarHBondContact O-N 2.9Å; A113-R116 VanDerWaalsContact O-N 3.13Å; A113-I117 WeakPolarHBondContact O-CG1 3.4Å; A113-I117 PolarHBondContact O-N 2.88Å
114V96.6Very high94.4Very high99 Ų9951.4 Ų51.460%0.630%0.301SS*.Hα-helixtrans-58-44.9176.4172.20000111.5G110 R116 I117 A118G110-V114 WeakPolarHBondContact O-CG2 3.36Å; G110-V114 PolarHBondContact O-N 2.89Å; V114-R116 VanDerWaalsContact C-N 3.34Å; V114-R116 PolarHBondContact O-N 2.89Å; V114-I117 PolarHBondContact O-N 3.14Å; V114-A118 PolarHBondContact O-N 2.94Å
115R97.1Very high94.7Very high130 Ų13049.6 Ų49.649%0.49130%0.301SS..Hα-helixtrans-62.5-38.3176.7-74.7-173.3-65.7-154.82.4112.9Y43 G111 C112 A113 A118 C119Y43-R115 HydrophobicContact CD1-CB 3.83Å; Y43-R115 HydrophobicContact CE1-CB 3.45Å; Y43-R115 VanDerWaalsContact CE1-CB 3.45Å; Y43-R115 VanDerWaalsContact OH-CZ 3.29Å; Y43-R115 PolarHBondContact OH-NE 3.3Å; Y43-R115 VanDerWaalsContact OH-NE 3.1Å; Y43-R115 PolarHBondContact OH-NH2 2.89Å; G111-R115 WeakPolarHBondContact O-CG 3.47Å; G111-R115 PolarHBondContact O-N 2.74Å; G111-R115 VanDerWaalsContact O-N 3.14Å; C112-R115 PolarHBondContact O-N 2.91Å; C112-R115 PolarHBondContact SG-NH2 3Å; C112-R115 VanDerWaalsContact SG-NH2 3.43Å; A113-R115 VanDerWaalsContact C-N 3.34Å; A113-R115 PolarHBondContact O-N 3.35Å; R115-A118 PolarHBondContact O-N 2.71Å; R115-C119 PolarHBondContact O-N 3.19Å; R115-C119 PolarHBondContact O-SG 2.9Å
116R97.4Very high95Very high31 Ų3148.7 Ų48.712%0.11731%0.308CS..Hα-helixtrans-65.4-44.2173.9-76.2-172.5-177.9-137.211.2111.6Y43 E46 G91 C112 A113 V114 A118 C119 Q120Y43-R116 HydrophobicContact CD1-CG 3.83Å; Y43-R116 HydrophobicContact CE1-CG 3.88Å; E46-R116 HydrophobicContact CB-CG 4.48Å; E46-R116 HydrophobicContact CG-CB 4Å; E46-R116 HydrophobicContact CG-CG 4.1Å; E46-R116 WeakPolarHBondContact OE2-CD 3.4Å; E46-R116 IonicContact OE2-CZ 3.22Å; E46-R116 IonicContact OE2-NE 2.71Å; E46-R116 IonicContact OE2-NH1 2.88Å; E46-R116 PolarHBondContact OE2-NH1 3.44Å; G91-R116 PolarHBondContact O-NH1 3.43Å; C112-R116 PolarHBondContact O-N 2.8Å; C112-R116 VanDerWaalsContact O-N 3.09Å; A113-R116 PolarHBondContact O-N 2.9Å; A113-R116 VanDerWaalsContact O-N 3.13Å; V114-R116 VanDerWaalsContact C-N 3.34Å; V114-R116 PolarHBondContact O-N 2.89Å; R116-A118 VanDerWaalsContact C-N 3.31Å; R116-A118 PolarHBondContact O-N 3.29Å; R116-C119 WeakPolarHBondContact O-CB 3.42Å; R116-C119 PolarHBondContact O-N 2.99Å; R116-C119 VanDerWaalsContact O-N 3.11Å; R116-Q120 VanDerWaalsContact O-CG 3.27Å; R116-Q120 WeakPolarHBondContact O-CG 3.32Å; R116-Q120 PolarHBondContact O-N 2.94Å
117I98.4Very high95.6Very high26 Ų2644.5 Ų44.513%0.13327%0.273CS..Hα-helixtrans-60-43176.2-66.2168.6000110.6P96 A99 L100 A113 V114 C119 Q120 F121P96-I117 HydrophobicContact CB-CG1 4.19Å; P96-I117 HydrophobicContact CB-CG2 4.31Å; P96-I117 HydrophobicContact CG-CG2 4.46Å; A99-I117 HydrophobicContact CB-CD1 4.24Å; A99-I117 HydrophobicContact CB-CG1 3.83Å; L100-I117 HydrophobicContact CD2-CD1 4Å; L100-I117 HydrophobicContact CG-CD1 4.01Å; A113-I117 WeakPolarHBondContact O-CG1 3.4Å; A113-I117 PolarHBondContact O-N 2.88Å; V114-I117 PolarHBondContact O-N 3.14Å; I117-C119 VanDerWaalsContact C-N 3.33Å; I117-C119 PolarHBondContact O-N 3.44Å; I117-Q120 WeakPolarHBondContact O-CB 3.34Å; I117-Q120 PolarHBondContact O-N 3.46Å; I117-Q120 VanDerWaalsContact O-N 3.14Å; I117-F121 HydrophobicContact CG2-CD2 3.75Å; I117-F121 HydrophobicContact CG2-CE2 3.72Å; I117-F121 WeakPolarHBondContact O-CD2 3.37Å; I117-F121 PolarHBondContact O-N 3.4Å
118A98.5Very high96.3Very high59 Ų5942.5 Ų42.549%0.48827%0.265SS..Hα-helixtrans-59.7-42.1174.400000112.1V114 R115 R116 F121 A122V114-A118 PolarHBondContact O-N 2.94Å; R115-A118 PolarHBondContact O-N 2.71Å; R116-A118 VanDerWaalsContact C-N 3.31Å; R116-A118 PolarHBondContact O-N 3.29Å; A118-F121 PolarHBondContact O-N 2.93Å; A118-A122 WeakPolarHBondContact O-CB 3.31Å; A118-A122 PolarHBondContact O-N 3.48Å
119C98.6Very high96.9Very high24 Ų2444.1 Ų44.116%0.16228%0.283CS..Hα-helixtrans-62.7-41.3173.7-64.60000112E46 L47 R115 R116 I117 F121 A122 A123E46-C119 HydrophobicContact CB-CB 4.31Å; E46-C119 HydrophobicContact CG-CB 4.39Å; L47-C119 HydrophobicContact CB-CB 4.11Å; L47-C119 HydrophobicContact CD1-CB 4.44Å; L47-C119 VanDerWaalsContact CD1-O 3.29Å; L47-C119 WeakPolarHBondContact CD1-O 3.36Å; R115-C119 PolarHBondContact O-N 3.19Å; R115-C119 PolarHBondContact O-SG 2.9Å; R116-C119 WeakPolarHBondContact O-CB 3.42Å; R116-C119 PolarHBondContact O-N 2.99Å; R116-C119 VanDerWaalsContact O-N 3.11Å; I117-C119 VanDerWaalsContact C-N 3.33Å; I117-C119 PolarHBondContact O-N 3.44Å; C119-F121 PolarHBondContact O-N 2.73Å; C119-A122 PolarHBondContact O-N 2.89Å; C119-A123 VanDerWaalsContact O-CB 3.3Å; C119-A123 WeakPolarHBondContact O-CB 3.3Å; C119-A123 PolarHBondContact O-N 3.49Å
120Q98.8Very high97.2Very high0 Ų042.1 Ų42.10%027%0.271CS..Hα-helixtrans-62.2-42.7178.2-67.4162.1-3.700111.6E46 T50 N95 P96 R116 I117 A123 A124 A216E46-Q120 HydrophobicContact CG-CG 3.93Å; E46-Q120 PolarHBondContact OE1-NE2 3.19Å; T50-Q120 HydrophobicContact CG2-CB 4.04Å; T50-Q120 HydrophobicContact CG2-CG 4.37Å; T50-Q120 WeakPolarHBondContact CG2-O 3.44Å; T50-Q120 WeakPolarHBondContact OG1-CG 3.45Å; N95-Q120 PolarHBondContact O-NE2 3.43Å; P96-Q120 VanDerWaalsContact CA-OE1 3.22Å; P96-Q120 VanDerWaalsContact CG-OE1 3.25Å; R116-Q120 VanDerWaalsContact O-CG 3.27Å; R116-Q120 WeakPolarHBondContact O-CG 3.32Å; R116-Q120 PolarHBondContact O-N 2.94Å; I117-Q120 WeakPolarHBondContact O-CB 3.34Å; I117-Q120 PolarHBondContact O-N 3.46Å; I117-Q120 VanDerWaalsContact O-N 3.14Å; Q120-A123 WeakPolarHBondContact O-CB 3.43Å; Q120-A123 PolarHBondContact O-N 2.81Å; Q120-A124 PolarHBondContact O-N 3.24Å; Q120-A216 HydrophobicContact CB-CB 3.84Å
121F98.8Very high97.6Very high42 Ų4240 Ų4018%0.18425%0.249CC..Hα-helixtrans-71.7-38.5175.7-80.8-73.4000113P96 I117 A118 C119 A123 A124 V125 P215 A216 F219 W238P96-F121 HydrophobicContact CG-CE2 3.86Å; P96-F121 HydrophobicContact CG-CZ 4.19Å; I117-F121 HydrophobicContact CG2-CD2 3.75Å; I117-F121 HydrophobicContact CG2-CE2 3.72Å; I117-F121 WeakPolarHBondContact O-CD2 3.37Å; I117-F121 PolarHBondContact O-N 3.4Å; A118-F121 PolarHBondContact O-N 2.93Å; C119-F121 PolarHBondContact O-N 2.73Å; F121-A123 VanDerWaalsContact C-N 3.27Å; F121-A123 PolarHBondContact O-N 2.88Å; F121-A124 WeakPolarHBondContact O-CB 3.39Å; F121-A124 PolarHBondContact O-N 3.36Å; F121-V125 WeakPolarHBondContact O-CG2 3.32Å; F121-V125 PolarHBondContact O-N 3.37Å; F121-P215 HydrophobicContact CZ-CB 4.39Å; F121-A216 HydrophobicContact CE1-CB 4.36Å; F121-A216 HydrophobicContact CZ-CB 4.27Å; F121-F219 HydrophobicContact CD1-CB 4.14Å; F121-F219 AromaticContact CD1-CD1 3.9Å; F121-F219 HydrophobicContact CD1-CD1 3.9Å; F121-F219 HydrophobicContact CD1-CE1 4.49Å; F121-F219 AromaticContact CD1-CG 3.95Å; F121-F219 HydrophobicContact CD1-CG 3.95Å; F121-F219 HydrophobicContact CE1-CB 3.66Å; F121-F219 HydrophobicContact CE1-CD1 4.27Å; F121-F219 HydrophobicContact CE1-CD2 4.37Å; F121-F219 AromaticContact CE1-CG 3.85Å; F121-F219 HydrophobicContact CE1-CG 3.85Å; F121-W238 HydrophobicContact CE1-CZ2 4.23Å; F121-W238 AromaticContact CE2-CH2 3.79Å; F121-W238 HydrophobicContact CE2-CH2 3.79Å; F121-W238 AromaticContact CE2-CZ2 3.52Å; F121-W238 HydrophobicContact CE2-CZ2 3.52Å; F121-W238 AromaticContact CZ-CE2 3.92Å; F121-W238 AromaticContact CZ-CH2 3.91Å; F121-W238 HydrophobicContact CZ-CH2 3.91Å; F121-W238 AromaticContact CZ-CZ2 3.18Å; F121-W238 HydrophobicContact CZ-CZ2 3.18Å
122A98.8Very high97.8Very high50 Ų5039.6 Ų39.641%0.41324%0.238SC..Hα-helixtrans-59.6-41.2173.100000111.3L47 A118 C119 V125 A126L47-A122 HydrophobicContact CD1-CB 3.82Å; A118-A122 WeakPolarHBondContact O-CB 3.31Å; A118-A122 PolarHBondContact O-N 3.48Å; C119-A122 PolarHBondContact O-N 2.89Å; A122-V125 PolarHBondContact O-N 2.88Å; A122-A126 WeakPolarHBondContact O-CB 3.36Å; A122-A126 PolarHBondContact O-N 3.01Å
123A98.8Very high98Very high0 Ų043.1 Ų43.10%026%0.258CS..Hα-helixtrans-63.5-42.6173.900000112.9L47 T50 F51 C119 Q120 F121 A126 A127L47-A123 HydrophobicContact CD1-CB 4.02Å; L47-A123 WeakPolarHBondContact O-CB 3.2Å; T50-A123 HydrophobicContact CG2-CB 3.86Å; F51-A123 HydrophobicContact CB-CB 4.03Å; C119-A123 VanDerWaalsContact O-CB 3.3Å; C119-A123 WeakPolarHBondContact O-CB 3.3Å; C119-A123 PolarHBondContact O-N 3.49Å; Q120-A123 WeakPolarHBondContact O-CB 3.43Å; Q120-A123 PolarHBondContact O-N 2.81Å; F121-A123 VanDerWaalsContact C-N 3.27Å; F121-A123 PolarHBondContact O-N 2.88Å; A123-A126 PolarHBondContact O-N 2.87Å; A123-A127 WeakPolarHBondContact O-CB 3.34Å; A123-A127 PolarHBondContact O-N 3.06Å
124A98.8Very high98Very high0 Ų044.8 Ų44.80%027%0.266CS..Hα-helixtrans-62.3-42.117600000111.9Q120 F121 A127 R128 A216 F219 S220Q120-A124 PolarHBondContact O-N 3.24Å; F121-A124 WeakPolarHBondContact O-CB 3.39Å; F121-A124 PolarHBondContact O-N 3.36Å; A124-A127 PolarHBondContact O-N 3.29Å; A124-R128 VanDerWaalsContact O-CG 3.3Å; A124-R128 WeakPolarHBondContact O-CG 3.29Å; A124-R128 PolarHBondContact O-N 3.18Å; A124-A216 WeakPolarHBondContact CB-O 3.47Å; A124-F219 HydrophobicContact CB-CD1 4Å; A124-S220 PolarHBondContact O-OG 3.23Å
125V98.8Very high98Very high80 Ų8040.9 Ų40.949%0.48524%0.241SC..Hα-helixtrans-62.3-47.1173.2173.20000110.9F121 A122 A127 R128 A129 F219F121-V125 WeakPolarHBondContact O-CG2 3.32Å; F121-V125 PolarHBondContact O-N 3.37Å; A122-V125 PolarHBondContact O-N 2.88Å; V125-A127 VanDerWaalsContact C-N 3.32Å; V125-A127 PolarHBondContact O-N 2.71Å; V125-R128 WeakPolarHBondContact O-CB 3.03Å; V125-R128 PolarHBondContact O-N 2.75Å; V125-A129 PolarHBondContact O-N 2.97Å; V125-A129 VanDerWaalsContact O-N 3.11Å; V125-F219 HydrophobicContact CG2-CE1 3.75Å; V125-F219 HydrophobicContact CG2-CZ 4.46Å
126A98.7Very high98Very high44 Ų4435.5 Ų35.536%0.36423%0.226SC..Hα-helixtrans-60.6-41.6178.400000111.7F51 A122 A123 A129 A130F51-A126 HydrophobicContact CD2-CB 3.87Å; F51-A126 HydrophobicContact CE2-CB 4.06Å; A122-A126 WeakPolarHBondContact O-CB 3.36Å; A122-A126 PolarHBondContact O-N 3.01Å; A123-A126 PolarHBondContact O-N 2.87Å; A126-A129 PolarHBondContact O-N 3.41Å; A126-A130 WeakPolarHBondContact O-CB 3.47Å; A126-A130 PolarHBondContact O-N 3.4Å
127A98.7Very high98Very high0 Ų039.6 Ų39.60%025%0.248CC..Hα-helixtrans-65-39.7176.800000112.2F51 C54 Q58 A123 A124 V125 A129 A130 V131F51-A127 HydrophobicContact CD2-CB 4.01Å; F51-A127 HydrophobicContact CE2-CB 4.2Å; C54-A127 HydrophobicContact CB-CB 3.37Å; Q58-A127 PolarHBondContact NE2-O 2.9Å; A123-A127 WeakPolarHBondContact O-CB 3.34Å; A123-A127 PolarHBondContact O-N 3.06Å; A124-A127 PolarHBondContact O-N 3.29Å; V125-A127 VanDerWaalsContact C-N 3.32Å; V125-A127 PolarHBondContact O-N 2.71Å; A127-A129 PolarHBondContact O-N 2.91Å; A127-A130 PolarHBondContact O-N 3.35Å; A127-V131 WeakPolarHBondContact O-CB 3.34Å; A127-V131 VanDerWaalsContact O-CG2 3.27Å; A127-V131 WeakPolarHBondContact O-CG2 3.43Å; A127-V131 PolarHBondContact O-N 3.07Å
128R97.3Very high97.8Very high82 Ų8239.5 Ų39.531%0.30925%0.253SS..Hα-helixtrans-62-31173.7-74.7169.561.8160.92.7113.1A124 V125 P132 F219 S220 P224A124-R128 VanDerWaalsContact O-CG 3.3Å; A124-R128 WeakPolarHBondContact O-CG 3.29Å; A124-R128 PolarHBondContact O-N 3.18Å; V125-R128 WeakPolarHBondContact O-CB 3.03Å; V125-R128 PolarHBondContact O-N 2.75Å; R128-P132 WeakPolarHBondContact O-CD 3.35Å; R128-P132 WeakPolarHBondContact O-CG 3.27Å; R128-F219 WeakPolarHBondContact CD-O 3.41Å; R128-F219 PolarHBondContact NH1-O 2.93Å; R128-F219 VanDerWaalsContact NH1-O 3.13Å; R128-S220 WeakPolarHBondContact CG-O 3.35Å; R128-P224 HydrophobicContact CG-CG 4.36Å
129A97.8Very high97.5Very high65 Ų6540.9 Ų40.954%0.53725%0.251SS..Hα-helixtrans-80.8-41.6175.600000112V125 A126 A127V125-A129 PolarHBondContact O-N 2.97Å; V125-A129 VanDerWaalsContact O-N 3.11Å; A126-A129 PolarHBondContact O-N 3.41Å; A127-A129 PolarHBondContact O-N 2.91Å
130A97.9Very high97.4Very high30 Ų3040.3 Ų40.325%0.24825%0.247CC..Hα-helixtrans-74.5-41.2-173.900000113.3F51 A126 A127 V133 I134F51-A130 HydrophobicContact CE2-CB 3.99Å; F51-A130 HydrophobicContact CZ-CB 3.96Å; A126-A130 WeakPolarHBondContact O-CB 3.47Å; A126-A130 PolarHBondContact O-N 3.4Å; A127-A130 PolarHBondContact O-N 3.35Å; A130-V133 WeakPolarHBondContact O-CB 3.37Å; A130-V133 PolarHBondContact O-N 3Å; A130-V133 VanDerWaalsContact O-N 3.12Å; A130-I134 PolarHBondContact O-N 3.14Å; A130-I134 VanDerWaalsContact O-N 3.13Å
131V97.8Very high97.2Very high4 Ų442.1 Ų42.12%0.02427%0.266CS..Hα-helixtrans-64.9-43.3-171.9170.60000113.2C55 Q58 A127 V133 I134 W135C55-V131 HydrophobicContact CB-CG2 3.98Å; Q58-V131 HydrophobicContact CB-CG1 3.94Å; Q58-V131 HydrophobicContact CB-CG2 4.29Å; A127-V131 WeakPolarHBondContact O-CB 3.34Å; A127-V131 VanDerWaalsContact O-CG2 3.27Å; A127-V131 WeakPolarHBondContact O-CG2 3.43Å; A127-V131 PolarHBondContact O-N 3.07Å; V131-V133 PolarHBondContact O-N 3.12Å; V131-I134 WeakPolarHBondContact O-CB 3.3Å; V131-I134 PolarHBondContact O-N 3.19Å; V131-W135 HydrophobicContact CG1-CD2 3.54Å; V131-W135 HydrophobicContact CG1-CE3 3.77Å; V131-W135 HydrophobicContact CG1-CG 4.36Å; V131-W135 HydrophobicContact CG1-CH2 3.4Å; V131-W135 HydrophobicContact CG1-CZ2 3.1Å; V131-W135 HydrophobicContact CG1-CZ3 3.71Å; V131-W135 PolarHBondContact O-N 3.43Å
132P97Very high97Very high35 Ų3540.3 Ų40.323%0.22726%0.258CS..Hα-helixtrans-60.7-29.5172.8-26.136.2000114R128 G136 F151R128-P132 WeakPolarHBondContact O-CD 3.35Å; R128-P132 WeakPolarHBondContact O-CG 3.27Å; P132-G136 WeakPolarHBondContact O-CA 3.34Å; P132-G136 PolarHBondContact O-N 3.44Å; P132-F151 HydrophobicContact CB-CD1 4.47Å; P132-F151 HydrophobicContact CB-CD2 4.07Å; P132-F151 HydrophobicContact CB-CE2 4.21Å; P132-F151 HydrophobicContact CB-CG 4.2Å; P132-F151 HydrophobicContact CB-CZ 4.47Å; P132-F151 WeakPolarHBondContact O-CZ 3.4Å
133V97.6Very high96.9Very high102 Ų10238 Ų3862%0.61824%0.238SC*.Hα-helixtrans-66.3-43.41731780000110.1A130 V131 G136 M137A130-V133 WeakPolarHBondContact O-CB 3.37Å; A130-V133 PolarHBondContact O-N 3Å; A130-V133 VanDerWaalsContact O-N 3.12Å; V131-V133 PolarHBondContact O-N 3.12Å; V133-G136 PolarHBondContact O-N 3.38Å; V133-M137 PolarHBondContact O-N 2.98Å
134I96.3Very high96.7Very high37 Ų3740.2 Ų40.219%0.1925%0.254CS..Hα-helixtrans-61.5-51.1177.1-62.5168.9000110.6V16 A130 V131 G136 M137 M139V16-I134 HydrophobicContact CG1-CG2 4.06Å; V16-I134 HydrophobicContact CG2-CG2 4.15Å; A130-I134 PolarHBondContact O-N 3.14Å; A130-I134 VanDerWaalsContact O-N 3.13Å; V131-I134 WeakPolarHBondContact O-CB 3.3Å; V131-I134 PolarHBondContact O-N 3.19Å; I134-G136 VanDerWaalsContact C-N 3.25Å; I134-G136 PolarHBondContact O-N 2.93Å; I134-M137 HydrophobicContact CB-CE 4.18Å; I134-M137 HydrophobicContact CG1-CE 4.39Å; I134-M137 HydrophobicContact CG2-CE 3.94Å; I134-M137 WeakPolarHBondContact O-CB 3.41Å; I134-M137 PolarHBondContact O-N 3.43Å; I134-M139 HydrophobicContact CG2-CE 3.76Å
135W97.4Very high96.5Very high17 Ų1747.6 Ų47.66%0.06428%0.282CS..Hα-helixtrans-62.1-34.9176.5-61-26.3000112.3Q58 E59 L62 V131 M137 G138 H143 H146 F151Q58-W135 HydrophobicContact CB-CH2 4.14Å; Q58-W135 HydrophobicContact CB-CZ2 4.05Å; E59-W135 PolarHBondContact OE2-NE1 3.45Å; L62-W135 HydrophobicContact CB-CZ2 3.96Å; L62-W135 HydrophobicContact CD2-CD2 3.98Å; L62-W135 HydrophobicContact CD2-CG 4.15Å; L62-W135 HydrophobicContact CD2-CZ2 3.89Å; L62-W135 HydrophobicContact CG-CZ2 4.5Å; V131-W135 HydrophobicContact CG1-CD2 3.54Å; V131-W135 HydrophobicContact CG1-CE3 3.77Å; V131-W135 HydrophobicContact CG1-CG 4.36Å; V131-W135 HydrophobicContact CG1-CH2 3.4Å; V131-W135 HydrophobicContact CG1-CZ2 3.1Å; V131-W135 HydrophobicContact CG1-CZ3 3.71Å; V131-W135 PolarHBondContact O-N 3.43Å; W135-M137 PolarHBondContact O-N 3.16Å; W135-M137 VanDerWaalsContact O-N 3.16Å; W135-G138 PolarHBondContact O-N 3.37Å; W135-H143 AromaticContact CD1-CD2 3.49Å; W135-H143 VanDerWaalsContact CD1-CD2 3.49Å; W135-H143 AromaticContact CD1-NE2 3.56Å; W135-H143 AromaticContact NE1-NE2 3.99Å; W135-H146 AromaticContact CD2-CD2 3.88Å; W135-H146 AromaticContact CE3-CD2 3.39Å; W135-H146 AromaticContact CE3-NE2 3.59Å; W135-H146 AromaticContact CZ3-CD2 3.68Å; W135-H146 AromaticContact CZ3-NE2 3.35Å; W135-H146 VanDerWaalsContact CZ3-NE2 3.35Å; W135-H146 WeakPolarHBondContact CZ3-NE2 3.5Å; W135-F151 HydrophobicContact CB-CD1 4.18Å; W135-F151 HydrophobicContact CB-CE1 3.66Å; W135-F151 AromaticContact CE3-CD1 3.87Å; W135-F151 HydrophobicContact CE3-CD1 3.87Å; W135-F151 HydrophobicContact CE3-CE1 4.47Å
136G96.6Very high96.4Very high18 Ų1844.5 Ų44.519%0.18626%0.262CS..Hα-helixtrans-61.2-20.6177.800000114.4P132 V133 I134 G138 K147P132-G136 WeakPolarHBondContact O-CA 3.34Å; P132-G136 PolarHBondContact O-N 3.44Å; V133-G136 PolarHBondContact O-N 3.38Å; I134-G136 VanDerWaalsContact C-N 3.25Å; I134-G136 PolarHBondContact O-N 2.93Å; G136-G138 PolarHBondContact O-N 2.91Å; G136-K147 WeakPolarHBondContact O-CE 3.45Å; G136-K147 PolarHBondContact O-NZ 3.45Å
137M96.1Very high96.2Very high117 Ų11747.6 Ų47.658%0.57627%0.267SS*.THydrogen-bonded Turntrans-69.7-17.9173-59.6-170.2-76.700112.9V133 I134 W135 M139V133-M137 PolarHBondContact O-N 2.98Å; I134-M137 HydrophobicContact CB-CE 4.18Å; I134-M137 HydrophobicContact CG1-CE 4.39Å; I134-M137 HydrophobicContact CG2-CE 3.94Å; I134-M137 WeakPolarHBondContact O-CB 3.41Å; I134-M137 PolarHBondContact O-N 3.43Å; W135-M137 PolarHBondContact O-N 3.16Å; W135-M137 VanDerWaalsContact O-N 3.16Å; M137-M139 HydrophobicContact CB-CG 4.09Å; M137-M139 HydrophobicContact CE-CE 3.77Å; M137-M139 HydrophobicContact CE-SD 3.96Å; M137-M139 PolarHBondContact O-N 3.19Å
138G94Very high96Very high24 Ų2454.9 Ų54.925%0.24731%0.306CS..  trans65.634173.500000114.2W135 G136 S140 S144W135-G138 PolarHBondContact O-N 3.37Å; G136-G138 PolarHBondContact O-N 2.91Å; G138-S140 PolarHBondContact O-N 3.13Å; G138-S140 VanDerWaalsContact O-N 3.12Å; G138-S144 PolarHBondContact O-OG 3.04Å
139M93.9Very high95.9Very high87 Ų8756.1 Ų56.143%0.42932%0.318SS..  trans-65.1-15.4-174.9-64.1179-66.900114V12 V16 I134 M137V12-M139 HydrophobicContact CG1-CB 3.73Å; V16-M139 HydrophobicContact CG2-CE 3.61Å; I134-M139 HydrophobicContact CG2-CE 3.76Å; M137-M139 HydrophobicContact CB-CG 4.09Å; M137-M139 HydrophobicContact CE-CE 3.77Å; M137-M139 HydrophobicContact CE-SD 3.96Å; M137-M139 PolarHBondContact O-N 3.19Å
140S95.3Very high95.7Very high12 Ų1255.3 Ų55.38%0.08432%0.316CS..SBendtrans-140.2169.3177.7720000111.8D9 G138 L142 H143 S144D9-S140 VanDerWaalsContact OD1-CB 3.23Å; D9-S140 WeakPolarHBondContact OD1-CB 3.34Å; D9-S140 PolarHBondContact OD1-OG 3.12Å; G138-S140 PolarHBondContact O-N 3.13Å; G138-S140 VanDerWaalsContact O-N 3.12Å; S140-L142 VanDerWaalsContact C-N 3.27Å; S140-L142 PolarHBondContact O-N 3.3Å; S140-H143 PolarHBondContact O-N 3.26Å; S140-H143 PolarHBondContact OG-N 3.26Å; S140-H143 VanDerWaalsContact OG-N 3.08Å; S140-S144 WeakPolarHBondContact O-CB 3.23Å; S140-S144 PolarHBondContact O-N 3.35Å; S140-S144 PolarHBondContact O-OG 3Å
141G94.1Very high95.5Very high38 Ų3857.1 Ų57.139%0.39232%0.318SS..Hα-helixtrans-63.8-37.3174.500000111.2D9 R145D9-G141 PolarHBondContact OD1-N 3.36Å; D9-G141 VanDerWaalsContact OD1-N 3.09Å; G141-R145 VanDerWaalsContact O-CB 3.3Å; G141-R145 WeakPolarHBondContact O-CB 3.43Å; G141-R145 PolarHBondContact O-N 2.88Å
142L95Very high95.3Very high5 Ų567 Ų673%0.02636%0.355CS..Hα-helixtrans-59.1-52172.5176.962.3000112.3D9 L62 L63 S140 S144 R145 H146D9-L142 HydrophobicContact CB-CB 4.02Å; D9-L142 HydrophobicContact CB-CD2 4.44Å; D9-L142 WeakPolarHBondContact OD1-CB 3.42Å; D9-L142 PolarHBondContact OD1-N 3.22Å; L62-L142 HydrophobicContact CD1-CD1 4.16Å; L62-L142 HydrophobicContact CD2-CD2 4.45Å; L62-L142 HydrophobicContact CD2-CG 4.22Å; L62-L142 HydrophobicContact CG-CD1 4.11Å; L62-L142 HydrophobicContact CG-CD2 4.12Å; L62-L142 HydrophobicContact CG-CG 4.05Å; L63-L142 HydrophobicContact CB-CD2 4.34Å; L63-L142 HydrophobicContact CD1-CD2 3.77Å; S140-L142 VanDerWaalsContact C-N 3.27Å; S140-L142 PolarHBondContact O-N 3.3Å; L142-S144 PolarHBondContact O-N 2.95Å; L142-R145 PolarHBondContact O-N 2.92Å; L142-H146 WeakPolarHBondContact O-CB 3.27Å; L142-H146 PolarHBondContact O-N 3.11Å
143H96.4Very high95.1Very high0 Ų067 Ų670%036%0.355CS..Hα-helixtrans-63.5-42.2179.5-68.5165.3000111.8E59 W135 S140 R145 H146 K147E59-H143 IonicContact OE1-CE1 3.93Å; E59-H143 IonicContact OE1-NE2 2.81Å; E59-H143 PolarHBondContact OE1-NE2 3.12Å; E59-H143 IonicContact OE2-NE2 3.88Å; E59-H143 PolarHBondContact OE2-NE2 2.98Å; W135-H143 AromaticContact CD1-CD2 3.49Å; W135-H143 VanDerWaalsContact CD1-CD2 3.49Å; W135-H143 AromaticContact CD1-NE2 3.56Å; W135-H143 AromaticContact NE1-NE2 3.99Å; S140-H143 PolarHBondContact O-N 3.26Å; S140-H143 PolarHBondContact OG-N 3.26Å; S140-H143 VanDerWaalsContact OG-N 3.08Å; H143-R145 PolarHBondContact O-N 3.23Å; H143-H146 PolarHBondContact O-N 3.41Å; H143-K147 WeakPolarHBondContact O-CB 3.45Å; H143-K147 PolarHBondContact O-N 3.36Å
144S96.1Very high95Very high47 Ų4766.8 Ų66.833%0.32935%0.354SS..Hα-helixtrans-62-44.1177.2-62.80000111.9G138 S140 L142 K147 L148G138-S144 PolarHBondContact O-OG 3.04Å; S140-S144 WeakPolarHBondContact O-CB 3.23Å; S140-S144 PolarHBondContact O-N 3.35Å; S140-S144 PolarHBondContact O-OG 3Å; L142-S144 PolarHBondContact O-N 2.95Å; S144-K147 WeakPolarHBondContact O-CB 3.29Å; S144-K147 PolarHBondContact O-N 2.99Å; S144-L148 WeakPolarHBondContact O-CG 3.5Å; S144-L148 PolarHBondContact O-N 3.33Å
145R94.6Very high95Very high155 Ų15565.3 Ų65.359%0.58535%0.347SS*.Hα-helixtrans-64.2-44.4176.3-170.7-175.9-54.1-168.63.2111.7G141 L142 H143 K147 L148 L149G141-R145 VanDerWaalsContact O-CB 3.3Å; G141-R145 WeakPolarHBondContact O-CB 3.43Å; G141-R145 PolarHBondContact O-N 2.88Å; L142-R145 PolarHBondContact O-N 2.92Å; H143-R145 PolarHBondContact O-N 3.23Å; R145-K147 VanDerWaalsContact C-N 3.32Å; R145-K147 PolarHBondContact O-N 2.84Å; R145-L148 PolarHBondContact O-N 3.41Å; R145-L149 HydrophobicContact CG-CD1 4.38Å; R145-L149 WeakPolarHBondContact O-CG 3.18Å; R145-L149 PolarHBondContact O-N 2.92Å
146H95.1Very high94.8Very high15 Ų1564.7 Ų64.77%0.06935%0.346CS..Hα-helixtrans-64.5-37.6179.2-164.856.7000112.1L62 W135 L142 H143 L149 G150 F151 R152L62-H146 HydrophobicContact CD1-CB 3.9Å; L62-H146 VanDerWaalsContact CD1-CG 3.46Å; L62-H146 HydrophobicContact CD2-CB 4.28Å; W135-H146 AromaticContact CD2-CD2 3.88Å; W135-H146 AromaticContact CE3-CD2 3.39Å; W135-H146 AromaticContact CE3-NE2 3.59Å; W135-H146 AromaticContact CZ3-CD2 3.68Å; W135-H146 AromaticContact CZ3-NE2 3.35Å; W135-H146 VanDerWaalsContact CZ3-NE2 3.35Å; W135-H146 WeakPolarHBondContact CZ3-NE2 3.5Å; L142-H146 WeakPolarHBondContact O-CB 3.27Å; L142-H146 PolarHBondContact O-N 3.11Å; H143-H146 PolarHBondContact O-N 3.41Å; H146-L149 PolarHBondContact O-N 3.19Å; H146-G150 PolarHBondContact O-N 3.41Å; H146-F151 AromaticContact CD2-CD1 3.62Å; H146-F151 PolarHBondContact O-N 3.42Å; H146-R152 PolarHBondContact CE1-O 2.89Å
147K95.7Very high94.9Very high109 Ų10964.7 Ų64.747%0.47434%0.341SS..Hα-helixtrans-60.4-46.2170.6-179.4-175-175.7171.50112.3G136 H143 S144 R145 L149 G150 F151G136-K147 WeakPolarHBondContact O-CE 3.45Å; G136-K147 PolarHBondContact O-NZ 3.45Å; H143-K147 WeakPolarHBondContact O-CB 3.45Å; H143-K147 PolarHBondContact O-N 3.36Å; S144-K147 WeakPolarHBondContact O-CB 3.29Å; S144-K147 PolarHBondContact O-N 2.99Å; R145-K147 VanDerWaalsContact C-N 3.32Å; R145-K147 PolarHBondContact O-N 2.84Å; K147-L149 PolarHBondContact O-N 3Å; K147-G150 PolarHBondContact O-N 3.47Å; K147-F151 HydrophobicContact CB-CE1 3.89Å; K147-F151 HydrophobicContact CB-CZ 4.02Å; K147-F151 HydrophobicContact CG-CE1 4.36Å; K147-F151 HydrophobicContact CG-CZ 3.96Å
148L94.9Very high94.8Very high154 Ų15465.7 Ų65.781%0.80634%0.344SS*.Hα-helixtrans-61.7-32.2177.7-72.3169.6000112.6S144 R145 G150S144-L148 WeakPolarHBondContact O-CG 3.5Å; S144-L148 PolarHBondContact O-N 3.33Å; R145-L148 PolarHBondContact O-N 3.41Å; L148-G150 PolarHBondContact O-N 2.9Å
149L93.5Very high94.9Very high108 Ų10865.9 Ų65.957%0.56534%0.343SS*.THydrogen-bonded Turntrans-81.85174.7-64.6172.6000113.4R145 H146 K147 F151 R152R145-L149 HydrophobicContact CG-CD1 4.38Å; R145-L149 WeakPolarHBondContact O-CG 3.18Å; R145-L149 PolarHBondContact O-N 2.92Å; H146-L149 PolarHBondContact O-N 3.19Å; K147-L149 PolarHBondContact O-N 3Å; L149-F151 PolarHBondContact O-N 3.42Å; L149-R152 WeakPolarHBondContact O-CG 3.45Å
150G94.1Very high95.1Very high48 Ų4865 Ų6550%0.49535%0.346SS..THydrogen-bonded Turntrans69.529.4177.700000114H146 K147 L148 R152H146-G150 PolarHBondContact O-N 3.41Å; K147-G150 PolarHBondContact O-N 3.47Å; L148-G150 PolarHBondContact O-N 2.9Å; G150-R152 PolarHBondContact O-N 2.99Å; G150-R152 VanDerWaalsContact O-N 3.14Å
151F95.1Very high95.3Very high67 Ų6766.8 Ų66.829%0.29435%0.354SS..THydrogen-bonded Turntrans57.226.5-178.8-45-67.8000114.2P132 W135 H146 K147 L149P132-F151 HydrophobicContact CB-CD1 4.47Å; P132-F151 HydrophobicContact CB-CD2 4.07Å; P132-F151 HydrophobicContact CB-CE2 4.21Å; P132-F151 HydrophobicContact CB-CG 4.2Å; P132-F151 HydrophobicContact CB-CZ 4.47Å; P132-F151 WeakPolarHBondContact O-CZ 3.4Å; W135-F151 HydrophobicContact CB-CD1 4.18Å; W135-F151 HydrophobicContact CB-CE1 3.66Å; W135-F151 AromaticContact CE3-CD1 3.87Å; W135-F151 HydrophobicContact CE3-CD1 3.87Å; W135-F151 HydrophobicContact CE3-CE1 4.47Å; H146-F151 AromaticContact CD2-CD1 3.62Å; H146-F151 PolarHBondContact O-N 3.42Å; K147-F151 HydrophobicContact CB-CE1 3.89Å; K147-F151 HydrophobicContact CB-CZ 4.02Å; K147-F151 HydrophobicContact CG-CE1 4.36Å; K147-F151 HydrophobicContact CG-CZ 3.96Å; L149-F151 PolarHBondContact O-N 3.42Å
152R92.4Very high95.5Very high212 Ų21269.1 Ų69.180%0.836%0.362SS*.  trans-71.3144.7179.5-72.3177.8138.8-179.5-5.1111.1H146 L149 G150H146-R152 PolarHBondContact CE1-O 2.89Å; L149-R152 WeakPolarHBondContact O-CG 3.45Å; G150-R152 PolarHBondContact O-N 2.99Å; G150-R152 VanDerWaalsContact O-N 3.14Å
153C94.1Very high95.6Very high34 Ų3474 Ų7423%0.2339%0.385CS..  trans-138.7157.8172.959.90000111C225 S226C153-C225 HydrophobicContact CB-CB 4Å; C153-C225 WeakPolarHBondContact CB-SG 3.13Å; C153-C225 WeakPolarHBondContact O-CA 3.41Å; C153-C225 WeakPolarHBondContact O-CB 3.24Å; C153-C225 WeakPolarHBondContact SG-CA 3.26Å; C153-C225 WeakPolarHBondContact SG-CB 3.45Å; C153-C225 CovalentContact SG-SG 2.04Å; C153-C225 PolarHBondContact SG-SG 3.46Å; C153-S226 PolarHBondContact O-N 2.84Å; C153-S226 PolarHBondContact O-OG 3.42Å
154V94.8Very high95.7Very high99 Ų9974 Ų7460%0.639%0.385SS*.BIsolated β-bridgetrans-108.8150177.1-178.50000109A156 S226V154-A156 PolarHBondContact O-N 3.25Å; V154-S226 CarbonylContact C-O 3.42Å; V154-S226 WeakPolarHBondContact CA-O 3.45Å
155S95.3Very high95.9Very high6 Ų672.1 Ų72.14%0.04237%0.373CS..  trans-52.9131.8175.4-166.80000111.3I157 S226 N228 Y233S155-I157 PolarHBondContact O-N 3.45Å; S155-I157 PolarHBondContact OG-N 3.08Å; S155-S226 PolarHBondContact N-O 3.47Å; S155-N228 VanDerWaalsContact CB-OD1 3.31Å; S155-N228 WeakPolarHBondContact CB-OD1 3.33Å; S155-N228 PolarHBondContact OG-OD1 3.33Å; S155-Y233 WeakPolarHBondContact CB-OH 3.08Å; S155-Y233 WeakPolarHBondContact OG-CE1 3.34Å; S155-Y233 PolarHBondContact OG-OH 3.02Å
156A94.1Very high96Very high4 Ų467 Ų673%0.03336%0.364CS..SBendtrans-79.64.8172.700000112.9V154 H158 V208 T209V154-A156 PolarHBondContact O-N 3.25Å; A156-H158 PolarHBondContact O-CD2 2.57Å; A156-H158 PolarHBondContact O-N 3.36Å; A156-V208 CarbonylContact O-C 3.49Å; A156-V208 VanDerWaalsContact O-C 3.25Å; A156-T209 CarbonylContact O-C 3.25Å; A156-T209 WeakPolarHBondContact O-CA 3.08Å; A156-T209 PolarHBondContact O-N 2.87Å
157I97.4Very high96.2Very high18 Ų1867.8 Ų67.89%0.09237%0.369CS..  trans-83.2107.2175.4-61.6172.4000108.5S155 A159 A164 V208 Y233 V236 Y237S155-I157 PolarHBondContact O-N 3.45Å; S155-I157 PolarHBondContact OG-N 3.08Å; I157-A159 WeakPolarHBondContact CG2-O 3.32Å; I157-A164 HydrophobicContact CG2-CB 3.88Å; I157-V208 WeakPolarHBondContact CA-O 3.41Å; I157-Y233 HydrophobicContact CD1-CD1 3.7Å; I157-Y233 HydrophobicContact CD1-CE1 3.75Å; I157-Y233 HydrophobicContact CG1-CE1 4.46Å; I157-V236 HydrophobicContact CD1-CB 4.11Å; I157-V236 HydrophobicContact CD1-CG1 4.18Å; I157-V236 HydrophobicContact CD1-CG2 3.96Å; I157-V236 HydrophobicContact CG1-CG1 4.49Å; I157-Y237 HydrophobicContact CD1-CE2 4.02Å; I157-Y237 HydrophobicContact CG1-CE2 4.28Å
158H95.4Very high96.4Very high137 Ų13762.6 Ų62.663%0.63435%0.347SS*.  trans-109.614.6-178.6-60.1-53.4000113.5A156 G207 V208A156-H158 PolarHBondContact O-CD2 2.57Å; A156-H158 PolarHBondContact O-N 3.36Å; H158-G207 PolarHBondContact CD2-O 2.7Å; H158-V208 PolarHBondContact N-O 3.39Å
159A96.5Very high96.5Very high28 Ų2857.3 Ų57.323%0.23132%0.319CS..SBendtrans-138.6174.8-178.200000111.9I157 Q163 V208I157-A159 WeakPolarHBondContact CG2-O 3.32Å; A159-Q163 HydrophobicContact CB-CB 4.2Å; A159-Q163 HydrophobicContact CB-CG 4.04Å; A159-V208 HydrophobicContact CB-CG1 3.61Å
160S98Very high96.8Very high68 Ų6857.8 Ų57.848%0.47632%0.32SS..  trans-58.2147.4172700000111.2Q163 A164S160-Q163 WeakPolarHBondContact O-CB 3.33Å; S160-Q163 PolarHBondContact O-N 3.24Å; S160-Q163 VanDerWaalsContact OG-CB 3.3Å; S160-Q163 WeakPolarHBondContact OG-CB 3.44Å; S160-A164 PolarHBondContact O-N 3.46Å
161L98.3Very high97Very high50 Ų5055.9 Ų55.926%0.26230%0.299SS..Hα-helixtrans-53.8-44.1-177.1-60.9171.6000113.4Q163 A164 A165 E232 F235 V236L161-Q163 PolarHBondContact O-N 3.35Å; L161-A164 PolarHBondContact O-N 3.11Å; L161-A165 WeakPolarHBondContact O-CB 3.38Å; L161-A165 PolarHBondContact O-N 3.38Å; L161-E232 HydrophobicContact CD1-CB 4.27Å; L161-E232 HydrophobicContact CD1-CG 3.69Å; L161-E232 HydrophobicContact CD2-CB 3.85Å; L161-E232 HydrophobicContact CD2-CG 4.12Å; L161-F235 HydrophobicContact CB-CD1 4.02Å; L161-F235 HydrophobicContact CB-CE1 4.11Å; L161-F235 WeakPolarHBondContact O-CE1 3.27Å; L161-V236 HydrophobicContact CD2-CG2 4.11Å
162P98.3Very high97.2Very high87 Ų8753 Ų5357%0.56529%0.288SS*.Hα-helixtrans-64.2-39.2176.9-22.335.6000112.9A165 A166P162-A165 PolarHBondContact O-N 3.24Å; P162-A166 WeakPolarHBondContact O-CB 3.33Å; P162-A166 PolarHBondContact O-N 3.16Å
163Q98.3Very high97.5Very high107 Ų10745.5 Ų45.550%0.526%0.261SS..Hα-helixtrans-66.2-43.4176.9-177.5-179.3-200111.3A159 S160 L161 A166 V167A159-Q163 HydrophobicContact CB-CB 4.2Å; A159-Q163 HydrophobicContact CB-CG 4.04Å; S160-Q163 WeakPolarHBondContact O-CB 3.33Å; S160-Q163 PolarHBondContact O-N 3.24Å; S160-Q163 VanDerWaalsContact OG-CB 3.3Å; S160-Q163 WeakPolarHBondContact OG-CB 3.44Å; L161-Q163 PolarHBondContact O-N 3.35Å; Q163-A166 WeakPolarHBondContact O-CB 3.43Å; Q163-A166 PolarHBondContact O-N 3.35Å; Q163-V167 WeakPolarHBondContact O-CG2 3.29Å; Q163-V167 PolarHBondContact O-N 3.26Å
164A98.4Very high97.7Very high0 Ų046 Ų460%027%0.268CS..Hα-helixtrans-61.4-46.5175.500000111.5I157 S160 L161 A166 V167 E168 T209 V236I157-A164 HydrophobicContact CG2-CB 3.88Å; S160-A164 PolarHBondContact O-N 3.46Å; L161-A164 PolarHBondContact O-N 3.11Å; A164-A166 VanDerWaalsContact C-N 3.29Å; A164-A166 PolarHBondContact O-N 3.05Å; A164-V167 PolarHBondContact O-N 3.3Å; A164-E168 PolarHBondContact O-N 3.5Å; A164-T209 HydrophobicContact CB-CG2 3.64Å; A164-T209 WeakPolarHBondContact O-CG2 3.38Å; A164-V236 HydrophobicContact CB-CG1 3.88Å; A164-V236 HydrophobicContact CB-CG2 3.78Å
165A98.6Very high97.8Very high9 Ų941.8 Ų41.87%0.07424%0.242CC..Hα-helixtrans-61.4-37.3175.200000112.3L161 P162 E168 L169 F235 V236 G240L161-A165 WeakPolarHBondContact O-CB 3.38Å; L161-A165 PolarHBondContact O-N 3.38Å; P162-A165 PolarHBondContact O-N 3.24Å; A165-E168 PolarHBondContact O-N 2.98Å; A165-L169 VanDerWaalsContact O-CB 3.3Å; A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 PolarHBondContact O-N 3.26Å; A165-F235 HydrophobicContact CB-CD1 4.04Å; A165-F235 HydrophobicContact CB-CE1 3.65Å; A165-F235 HydrophobicContact CB-CZ 4.31Å; A165-V236 HydrophobicContact CB-CG2 4.49Å; A165-G240 WeakPolarHBondContact O-CA 3.34Å
166A98.6Very high98Very high48 Ų4842.1 Ų42.140%0.39724%0.243SC..Hα-helixtrans-66-39.917500000112.3P162 Q163 A164 L169 M170P162-A166 WeakPolarHBondContact O-CB 3.33Å; P162-A166 PolarHBondContact O-N 3.16Å; Q163-A166 WeakPolarHBondContact O-CB 3.43Å; Q163-A166 PolarHBondContact O-N 3.35Å; A164-A166 VanDerWaalsContact C-N 3.29Å; A164-A166 PolarHBondContact O-N 3.05Å; A166-L169 WeakPolarHBondContact O-CB 3.49Å; A166-L169 PolarHBondContact O-N 3.45Å; A166-M170 VanDerWaalsContact O-CG 3.29Å; A166-M170 WeakPolarHBondContact O-CG 3.24Å; A166-M170 PolarHBondContact O-N 2.97Å
167V98.6Very high98.1Very high31 Ų3143.1 Ų43.119%0.18825%0.248CC..Hα-helixtrans-61.6-48174.3169.20000110.8Q163 A164 L169 M170 C171 V208 T209Q163-V167 WeakPolarHBondContact O-CG2 3.29Å; Q163-V167 PolarHBondContact O-N 3.26Å; A164-V167 PolarHBondContact O-N 3.3Å; V167-L169 VanDerWaalsContact C-N 3.32Å; V167-L169 PolarHBondContact O-N 3.4Å; V167-M170 PolarHBondContact O-N 3.2Å; V167-C171 PolarHBondContact O-N 3.29Å; V167-C171 PolarHBondContact O-SG 3.49Å; V167-V208 HydrophobicContact CG1-CB 4.45Å; V167-V208 HydrophobicContact CG2-CB 4.33Å; V167-V208 HydrophobicContact CG2-CG1 4.03Å; V167-T209 HydrophobicContact CB-CG2 4.2Å; V167-T209 HydrophobicContact CG1-CG2 4.22Å
168E98.8Very high98.1Very high0 Ų044.2 Ų44.20%026%0.256CS..Hα-helixtrans-62.3-38.3177.5-75.5-63.1157.700112.6A164 A165 A172 T209 A211 V212 F213 V236 Y237 P241A164-E168 PolarHBondContact O-N 3.5Å; A165-E168 PolarHBondContact O-N 2.98Å; E168-A172 WeakPolarHBondContact O-CB 3.38Å; E168-A172 PolarHBondContact O-N 3.49Å; E168-T209 HydrophobicContact CG-CG2 4.14Å; E168-T209 VanDerWaalsContact OE1-CB 3.27Å; E168-T209 WeakPolarHBondContact OE1-CB 3.38Å; E168-T209 PolarHBondContact OE1-OG1 3.31Å; E168-A211 WeakPolarHBondContact OE1-CA 3.32Å; E168-V212 PolarHBondContact OE1-N 3.29Å; E168-V212 PolarHBondContact OE2-N 3.41Å; E168-F213 WeakPolarHBondContact OE2-CA 3.37Å; E168-F213 PolarHBondContact OE2-N 3.14Å; E168-V236 HydrophobicContact CG-CG1 3.8Å; E168-Y237 HydrophobicContact CG-CD1 3.99Å; E168-Y237 HydrophobicContact CG-CE1 4.15Å; E168-Y237 WeakPolarHBondContact OE1-CE1 3.19Å; E168-P241 HydrophobicContact CB-CG 4.02Å
169L98.7Very high98.1Very high43 Ų4340.2 Ų40.223%0.22524%0.239CC..Hα-helixtrans-59.2-51.2171.4-178.2162.3000111.4A165 A166 V167 C171 A172 F173 G240 L243 G244A165-L169 VanDerWaalsContact O-CB 3.3Å; A165-L169 WeakPolarHBondContact O-CB 3.45Å; A165-L169 PolarHBondContact O-N 3.26Å; A166-L169 WeakPolarHBondContact O-CB 3.49Å; A166-L169 PolarHBondContact O-N 3.45Å; V167-L169 VanDerWaalsContact C-N 3.32Å; V167-L169 PolarHBondContact O-N 3.4Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.45Å; L169-A172 PolarHBondContact O-N 2.85Å; L169-F173 VanDerWaalsContact O-CB 3.31Å; L169-F173 WeakPolarHBondContact O-CB 3.4Å; L169-F173 PolarHBondContact O-N 2.91Å; L169-G240 VanDerWaalsContact CA-O 3.24Å; L169-G240 WeakPolarHBondContact CA-O 3.48Å; L169-G240 WeakPolarHBondContact CB-O 3.44Å; L169-L243 HydrophobicContact CD1-CB 3.74Å; L169-L243 HydrophobicContact CD1-CD1 4.35Å; L169-L243 HydrophobicContact CG-CB 4.26Å; L169-G244 WeakPolarHBondContact O-CA 3.25Å
170M98.6Very high97.9Very high117 Ų11739.9 Ų39.958%0.57623%0.234SC*.Hα-helixtrans-64.8-38.9-178.3-69.1-56.9-67.400111.9A166 V167 F173 A174A166-M170 VanDerWaalsContact O-CG 3.29Å; A166-M170 WeakPolarHBondContact O-CG 3.24Å; A166-M170 PolarHBondContact O-N 2.97Å; V167-M170 PolarHBondContact O-N 3.2Å; M170-F173 PolarHBondContact O-N 3Å; M170-A174 WeakPolarHBondContact O-CB 3.42Å; M170-A174 PolarHBondContact O-N 3.48Å
171C98.7Very high97.7Very high9 Ų941.6 Ų41.66%0.06123%0.234CC..Hα-helixtrans-61.7-50.4174.2-66.10000111.2V167 L169 F173 A174 V175 A201 F213V167-C171 PolarHBondContact O-N 3.29Å; V167-C171 PolarHBondContact O-SG 3.49Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.45Å; C171-F173 VanDerWaalsContact C-N 3.34Å; C171-F173 PolarHBondContact O-N 2.98Å; C171-A174 PolarHBondContact O-N 2.95Å; C171-V175 WeakPolarHBondContact O-CG2 3.41Å; C171-V175 PolarHBondContact O-N 3.32Å; C171-A201 HydrophobicContact CB-CB 4.04Å; C171-F213 HydrophobicContact CB-CB 4.11Å; C171-F213 HydrophobicContact CB-CD1 3.67Å; C171-F213 HydrophobicContact CB-CG 4.17Å
172A98.6Very high97.5Very high7 Ų740.2 Ų40.26%0.05823%0.228CC..Hα-helixtrans-61.7-41.6178.100000112.2E168 L169 Q176 F213 P241E168-A172 WeakPolarHBondContact O-CB 3.38Å; E168-A172 PolarHBondContact O-N 3.49Å; L169-A172 PolarHBondContact O-N 2.85Å; A172-Q176 WeakPolarHBondContact O-CB 3.16Å; A172-Q176 PolarHBondContact O-N 3.38Å; A172-F213 HydrophobicContact CB-CB 3.9Å; A172-P241 HydrophobicContact CB-CB 4.05Å; A172-P241 WeakPolarHBondContact CB-O 3.27Å
173F98.6Very high97Very high54 Ų5439.1 Ų39.124%0.23722%0.215CC..Hα-helixtrans-59.9-48.3175.8175.7-89000111.6L169 M170 C171 T177 G244 L251L169-F173 VanDerWaalsContact O-CB 3.31Å; L169-F173 WeakPolarHBondContact O-CB 3.4Å; L169-F173 PolarHBondContact O-N 2.91Å; M170-F173 PolarHBondContact O-N 3Å; C171-F173 VanDerWaalsContact C-N 3.34Å; C171-F173 PolarHBondContact O-N 2.98Å; F173-T177 VanDerWaalsContact O-CB 3.24Å; F173-T177 WeakPolarHBondContact O-CB 3.4Å; F173-T177 PolarHBondContact O-N 3.1Å; F173-T177 PolarHBondContact O-OG1 2.93Å; F173-G244 WeakPolarHBondContact CA-O 3.45Å; F173-L251 HydrophobicContact CE2-CD2 4.22Å; F173-L251 HydrophobicContact CZ-CD2 3.92Å
174A98.4Very high96.6Very high45 Ų4539.7 Ų39.737%0.37223%0.231SC..Hα-helixtrans-63.8-47.9-17900000111.6M170 C171 T177 V178M170-A174 WeakPolarHBondContact O-CB 3.42Å; M170-A174 PolarHBondContact O-N 3.48Å; C171-A174 PolarHBondContact O-N 2.95Å; A174-T177 WeakPolarHBondContact O-CB 3.26Å; A174-T177 PolarHBondContact O-N 2.93Å; A174-V178 PolarHBondContact O-N 3.38Å
175V98.3Very high96.3Very high9 Ų942.5 Ų42.56%0.05525%0.248CC..Hα-helixtrans-64.3-45.5178.7174.40000111C171 T177 V178 I179 A197 I198 A201 F213C171-V175 WeakPolarHBondContact O-CG2 3.41Å; C171-V175 PolarHBondContact O-N 3.32Å; V175-T177 VanDerWaalsContact C-N 3.27Å; V175-T177 PolarHBondContact O-N 3.2Å; V175-V178 PolarHBondContact O-N 3.18Å; V175-I179 HydrophobicContact CG1-CD1 3.91Å; V175-I179 HydrophobicContact CG1-CG1 4.48Å; V175-I179 WeakPolarHBondContact O-CG1 3.42Å; V175-I179 PolarHBondContact O-N 3.28Å; V175-A197 HydrophobicContact CG2-CB 4.4Å; V175-I198 HydrophobicContact CG1-CG1 4.1Å; V175-I198 HydrophobicContact CG2-CG1 4.05Å; V175-A201 HydrophobicContact CG2-CB 4.39Å; V175-F213 HydrophobicContact CG1-CE2 4.4Å; V175-F213 HydrophobicContact CG2-CD2 4.49Å; V175-F213 HydrophobicContact CG2-CE2 4.15Å; V175-F213 HydrophobicContact CG2-CZ 4.26Å
176Q97.9Very high96Very high13 Ų1347.5 Ų47.56%0.06127%0.27CS..Hα-helixtrans-62.5-35.9177.1-174.463.831.300112.2E101 A172 I179 T180 M245 V249E101-Q176 PolarHBondContact OE2-NE2 3.33Å; A172-Q176 WeakPolarHBondContact O-CB 3.16Å; A172-Q176 PolarHBondContact O-N 3.38Å; Q176-I179 PolarHBondContact O-N 3.08Å; Q176-T180 WeakPolarHBondContact O-CB 3.42Å; Q176-T180 PolarHBondContact O-N 3.45Å; Q176-T180 PolarHBondContact O-OG1 2.79Å; Q176-M245 HydrophobicContact CB-CG 4.38Å; Q176-M245 HydrophobicContact CG-CB 4.45Å; Q176-M245 HydrophobicContact CG-CG 3.87Å; Q176-V249 HydrophobicContact CG-CG2 4.18Å
177T97.1Very high95.5Very high25 Ų2550.3 Ų50.315%0.15328%0.275CS..Hα-helixtrans-62.4-48.4176.1-650000110.7F173 A174 V175 I179 T180 Q181 S248 F252F173-T177 VanDerWaalsContact O-CB 3.24Å; F173-T177 WeakPolarHBondContact O-CB 3.4Å; F173-T177 PolarHBondContact O-N 3.1Å; F173-T177 PolarHBondContact O-OG1 2.93Å; A174-T177 WeakPolarHBondContact O-CB 3.26Å; A174-T177 PolarHBondContact O-N 2.93Å; V175-T177 VanDerWaalsContact C-N 3.27Å; V175-T177 PolarHBondContact O-N 3.2Å; T177-I179 PolarHBondContact O-N 3.27Å; T177-T180 PolarHBondContact O-N 3.16Å; T177-Q181 HydrophobicContact CG2-CG 4.34Å; T177-Q181 WeakPolarHBondContact O-CB 3.24Å; T177-Q181 WeakPolarHBondContact O-CG 3.31Å; T177-Q181 PolarHBondContact O-N 3.44Å; T177-S248 VanDerWaalsContact CA-OG 3.31Å; T177-S248 WeakPolarHBondContact CA-OG 3.46Å; T177-S248 PolarHBondContact N-OG 3.43Å; T177-S248 PolarHBondContact OG1-OG 3.21Å; T177-F252 HydrophobicContact CG2-CD2 4.49Å; T177-F252 HydrophobicContact CG2-CE2 3.36Å; T177-F252 HydrophobicContact CG2-CZ 3.47Å; T177-F252 VanDerWaalsContact CG2-CZ 3.47Å
178V97.3Very high95Very high41 Ų4153.7 Ų53.725%0.24829%0.287CS..Hα-helixtrans-62-44.5176.8173.20000110.8A174 V175 T180 Q181 T182 A193 V194 A197A174-V178 PolarHBondContact O-N 3.38Å; V175-V178 PolarHBondContact O-N 3.18Å; V178-T180 VanDerWaalsContact C-N 3.31Å; V178-T180 PolarHBondContact O-N 3.41Å; V178-Q181 PolarHBondContact O-N 2.93Å; V178-T182 HydrophobicContact CG1-CG2 4.26Å; V178-T182 WeakPolarHBondContact O-CB 3.24Å; V178-T182 WeakPolarHBondContact O-CG2 3.38Å; V178-T182 PolarHBondContact O-N 3.3Å; V178-T182 PolarHBondContact O-OG1 3.2Å; V178-A193 HydrophobicContact CG1-CB 4.09Å; V178-V194 HydrophobicContact CG1-CG2 4.31Å; V178-A197 HydrophobicContact CB-CB 3.96Å; V178-A197 HydrophobicContact CG1-CB 4.08Å; V178-A197 HydrophobicContact CG2-CB 3.77Å
179I95.1Very high94.7Very high53 Ų5360 Ų6027%0.27231%0.312SS..Hα-helixtrans-55.6-47.3175.2-70.1167.8000110.7V175 Q176 T177 Q183 V194V175-I179 HydrophobicContact CG1-CD1 3.91Å; V175-I179 HydrophobicContact CG1-CG1 4.48Å; V175-I179 WeakPolarHBondContact O-CG1 3.42Å; V175-I179 PolarHBondContact O-N 3.28Å; Q176-I179 PolarHBondContact O-N 3.08Å; T177-I179 PolarHBondContact O-N 3.27Å; I179-Q183 WeakPolarHBondContact O-CG 3.37Å; I179-Q183 PolarHBondContact O-N 2.87Å; I179-V194 HydrophobicContact CD1-CG1 4.44Å; I179-V194 HydrophobicContact CG1-CG1 4.11Å; I179-V194 HydrophobicContact CG1-CG2 3.7Å
180T93.1Very high94.5Very high21 Ų2161.8 Ų61.813%0.12932%0.316CS..Hα-helixtrans-66.4-44.5-177.7-57.40000112Q176 T177 V178 T182 Q183 F252Q176-T180 WeakPolarHBondContact O-CB 3.42Å; Q176-T180 PolarHBondContact O-N 3.45Å; Q176-T180 PolarHBondContact O-OG1 2.79Å; T177-T180 PolarHBondContact O-N 3.16Å; V178-T180 VanDerWaalsContact C-N 3.31Å; V178-T180 PolarHBondContact O-N 3.41Å; T180-T182 VanDerWaalsContact C-N 3.3Å; T180-T182 PolarHBondContact O-N 3Å; T180-Q183 WeakPolarHBondContact O-CG 3.49Å; T180-Q183 PolarHBondContact O-N 3.39Å; T180-F252 HydrophobicContact CG2-CB 4.15Å; T180-F252 HydrophobicContact CG2-CG 4.48Å
181Q93.1Very high94.4Very high105 Ų10556.7 Ų56.749%0.49129%0.291SS..Hα-helixtrans-72.3-24-178.3-70.3-60.3-37.400113.4T177 V178 F252T177-Q181 HydrophobicContact CG2-CG 4.34Å; T177-Q181 WeakPolarHBondContact O-CB 3.24Å; T177-Q181 WeakPolarHBondContact O-CG 3.31Å; T177-Q181 PolarHBondContact O-N 3.44Å; V178-Q181 PolarHBondContact O-N 2.93Å; Q181-F252 HydrophobicContact CG-CE1 4.36Å; Q181-F252 HydrophobicContact CG-CZ 4.43Å
182T93.9Very high94.3Very high21 Ų2160 Ų6013%0.12931%0.306CS..THydrogen-bonded Turntrans-100.310-178.7590000113.2V178 T180 S184 V185 R190 A193V178-T182 HydrophobicContact CG1-CG2 4.26Å; V178-T182 WeakPolarHBondContact O-CB 3.24Å; V178-T182 WeakPolarHBondContact O-CG2 3.38Å; V178-T182 PolarHBondContact O-N 3.3Å; V178-T182 PolarHBondContact O-OG1 3.2Å; T180-T182 VanDerWaalsContact C-N 3.3Å; T180-T182 PolarHBondContact O-N 3Å; T182-S184 VanDerWaalsContact C-N 3.26Å; T182-S184 PolarHBondContact O-N 2.88Å; T182-V185 WeakPolarHBondContact O-CB 3.47Å; T182-V185 PolarHBondContact O-N 3.03Å; T182-V185 VanDerWaalsContact O-N 3.11Å; T182-R190 WeakPolarHBondContact O-CD 3.41Å; T182-R190 WeakPolarHBondContact OG1-CG 3.38Å; T182-A193 HydrophobicContact CG2-CB 4.02Å
183Q89.1Confident94.3Very high64 Ų6461.3 Ų61.330%0.29932%0.316SS..THydrogen-bonded Turntrans-61.4-32.2-179.6-69.5-171.6-2.700113.5I179 T180I179-Q183 WeakPolarHBondContact O-CG 3.37Å; I179-Q183 PolarHBondContact O-N 2.87Å; T180-Q183 WeakPolarHBondContact O-CG 3.49Å; T180-Q183 PolarHBondContact O-N 3.39Å
184S89.2Confident94.3Very high118 Ų11860 Ų6083%0.82531%0.313SS*.THydrogen-bonded Turntrans-84.2-9.5178.455.60000113.9T182T182-S184 VanDerWaalsContact C-N 3.26Å; T182-S184 PolarHBondContact O-N 2.88Å
185V92.4Very high94.3Very high60 Ų6058 Ų5836%0.36430%0.295SS..SBendtrans-82.7146.2-179.5-177.80000109.5T182 E187 Y189T182-V185 WeakPolarHBondContact O-CB 3.47Å; T182-V185 PolarHBondContact O-N 3.03Å; T182-V185 VanDerWaalsContact O-N 3.11Å; V185-E187 PolarHBondContact O-N 3.34Å; V185-Y189 HydrophobicContact CG1-CD2 4.39Å
186E91Very high94.3Very high113 Ų11359.5 Ų59.553%0.52831%0.309SS..  trans-51.6139173.2-69-179.8-11300111.6K188 Y189 R190E186-K188 HydrophobicContact CB-CG 4.36Å; E186-K188 PolarHBondContact O-N 2.86Å; E186-K188 VanDerWaalsContact O-N 3.13Å; E186-K188 IonicContact OE1-NZ 3.62Å; E186-K188 VanDerWaalsContact OE2-CE 3.25Å; E186-K188 WeakPolarHBondContact OE2-CE 3.44Å; E186-K188 IonicContact OE2-NZ 2.71Å; E186-K188 PolarHBondContact OE2-NZ 2.95Å; E186-Y189 HydrophobicContact CB-CD2 4.01Å; E186-Y189 HydrophobicContact CB-CE2 4.49Å; E186-Y189 PolarHBondContact O-N 2.93Å; E186-R190 PolarHBondContact O-N 3.4Å
187E89.5Confident94.3Very high108 Ų10859.6 Ų59.651%0.50531%0.312SS..Hα-helixtrans-54.2-39.3-174.4-179.7165.8-148.100112.9V185 Y189 R190 V191V185-E187 PolarHBondContact O-N 3.34Å; E187-Y189 VanDerWaalsContact C-N 3.25Å; E187-Y189 PolarHBondContact O-N 3.43Å; E187-R190 PolarHBondContact O-N 2.91Å; E187-R190 IonicContact OE1-NH2 2.8Å; E187-R190 PolarHBondContact OE1-NH2 3.41Å; E187-V191 HydrophobicContact CG-CG2 4.22Å; E187-V191 WeakPolarHBondContact O-CG2 3.38Å; E187-V191 PolarHBondContact O-N 3.28Å
188K88.5Confident94.4Very high102 Ų10260.1 Ų60.144%0.44331%0.314SS..Hα-helixtrans-57.1-36.6179.274.7-168.1-173.5-146.50112.8E186 H192E186-K188 HydrophobicContact CB-CG 4.36Å; E186-K188 PolarHBondContact O-N 2.86Å; E186-K188 VanDerWaalsContact O-N 3.13Å; E186-K188 IonicContact OE1-NZ 3.62Å; E186-K188 VanDerWaalsContact OE2-CE 3.25Å; E186-K188 WeakPolarHBondContact OE2-CE 3.44Å; E186-K188 IonicContact OE2-NZ 2.71Å; E186-K188 PolarHBondContact OE2-NZ 2.95Å; K188-H192 PolarHBondContact O-CD2 2.96Å
189Y91.8Very high94.5Very high133 Ų13359 Ų5952%0.52231%0.307SS..Hα-helixtrans-88.3-37.6177.5-57.1-58.2000112V185 E186 E187 V191 H192 A193V185-Y189 HydrophobicContact CG1-CD2 4.39Å; E186-Y189 HydrophobicContact CB-CD2 4.01Å; E186-Y189 HydrophobicContact CB-CE2 4.49Å; E186-Y189 PolarHBondContact O-N 2.93Å; E187-Y189 VanDerWaalsContact C-N 3.25Å; E187-Y189 PolarHBondContact O-N 3.43Å; Y189-V191 VanDerWaalsContact C-N 3.26Å; Y189-V191 PolarHBondContact O-N 3.07Å; Y189-H192 PolarHBondContact O-N 2.81Å; Y189-H192 VanDerWaalsContact O-N 3.13Å; Y189-A193 PolarHBondContact O-N 2.68Å
190R94.9Very high94.6Very high80 Ų8060.8 Ų60.830%0.30232%0.321SS..Hα-helixtrans-54.2-43.5176.8-175.9-178.969.5-171.3-1.2111.6T182 E186 E187 H192 A193 V194T182-R190 WeakPolarHBondContact O-CD 3.41Å; T182-R190 WeakPolarHBondContact OG1-CG 3.38Å; E186-R190 PolarHBondContact O-N 3.4Å; E187-R190 PolarHBondContact O-N 2.91Å; E187-R190 IonicContact OE1-NH2 2.8Å; E187-R190 PolarHBondContact OE1-NH2 3.41Å; R190-H192 VanDerWaalsContact C-N 3.33Å; R190-H192 PolarHBondContact O-N 3.36Å; R190-A193 PolarHBondContact O-N 2.83Å; R190-V194 HydrophobicContact CG-CG2 4.49Å; R190-V194 WeakPolarHBondContact O-CG2 3.34Å; R190-V194 PolarHBondContact O-N 2.91Å
191V96Very high94.9Very high10 Ų1060.2 Ų60.26%0.06132%0.318CS..Hα-helixtrans-59.4-43.8178.9168.80000111.5V83 L87 E187 Y189 V194 A195V83-V191 HydrophobicContact CB-CG1 4.37Å; V83-V191 HydrophobicContact CG1-CG1 4.14Å; L87-V191 HydrophobicContact CD2-CB 4.41Å; L87-V191 HydrophobicContact CD2-CG1 4.29Å; L87-V191 HydrophobicContact CD2-CG2 4.26Å; L87-V191 HydrophobicContact CG-CG1 4.16Å; E187-V191 HydrophobicContact CG-CG2 4.22Å; E187-V191 WeakPolarHBondContact O-CG2 3.38Å; E187-V191 PolarHBondContact O-N 3.28Å; Y189-V191 VanDerWaalsContact C-N 3.26Å; Y189-V191 PolarHBondContact O-N 3.07Å; V191-V194 PolarHBondContact O-N 2.83Å; V191-A195 VanDerWaalsContact O-CB 3.29Å; V191-A195 WeakPolarHBondContact O-CB 3.47Å; V191-A195 PolarHBondContact O-N 3.42Å
192H97.5Very high95.1Very high79 Ų7956.9 Ų56.937%0.36631%0.305SS..Hα-helixtrans-67.1-37.7177.6-71.9-70.4000112.6Y79 V83 K188 Y189 R190 A195 A196Y79-H192 AromaticContact CZ-ND1 3.71Å; Y79-H192 PolarHBondContact OH-ND1 3.48Å; V83-H192 WeakPolarHBondContact CG2-ND1 3.5Å; K188-H192 PolarHBondContact O-CD2 2.96Å; Y189-H192 PolarHBondContact O-N 2.81Å; Y189-H192 VanDerWaalsContact O-N 3.13Å; R190-H192 VanDerWaalsContact C-N 3.33Å; R190-H192 PolarHBondContact O-N 3.36Å; H192-A195 PolarHBondContact O-N 3.48Å; H192-A196 VanDerWaalsContact O-CB 3.32Å; H192-A196 WeakPolarHBondContact O-CB 3.38Å; H192-A196 PolarHBondContact O-N 2.94Å
193A97.8Very high95.3Very high34 Ų3464.4 Ų64.428%0.28133%0.332SS..Hα-helixtrans-63.1-45.8175.900000111.7V178 T182 Y189 R190 A196 A197V178-A193 HydrophobicContact CG1-CB 4.09Å; T182-A193 HydrophobicContact CG2-CB 4.02Å; Y189-A193 PolarHBondContact O-N 2.68Å; R190-A193 PolarHBondContact O-N 2.83Å; A193-A196 PolarHBondContact O-N 2.93Å; A193-A197 PolarHBondContact O-N 2.93Å
194V97.9Very high95.8Very high27 Ų2765 Ų6516%0.16435%0.348CS..Hα-helixtrans-66-43.11771760000111.2V178 I179 R190 V191 A196 A197 I198V178-V194 HydrophobicContact CG1-CG2 4.31Å; I179-V194 HydrophobicContact CD1-CG1 4.44Å; I179-V194 HydrophobicContact CG1-CG1 4.11Å; I179-V194 HydrophobicContact CG1-CG2 3.7Å; R190-V194 HydrophobicContact CG-CG2 4.49Å; R190-V194 WeakPolarHBondContact O-CG2 3.34Å; R190-V194 PolarHBondContact O-N 2.91Å; V191-V194 PolarHBondContact O-N 2.83Å; V194-A196 VanDerWaalsContact C-N 3.33Å; V194-A196 PolarHBondContact O-N 3.34Å; V194-A197 WeakPolarHBondContact O-CB 3.09Å; V194-A197 PolarHBondContact O-N 3.5Å; V194-I198 HydrophobicContact CG1-CD1 3.91Å; V194-I198 HydrophobicContact CG1-CG1 4.46Å; V194-I198 WeakPolarHBondContact O-CG1 3.42Å; V194-I198 PolarHBondContact O-N 3.35Å
195A98.4Very high96.2Very high1 Ų159.5 Ų59.51%0.00831%0.31CS..Hα-helixtrans-62-39.4176.500000112.5Y79 V83 V191 H192 T199Y79-A195 HydrophobicContact CD2-CB 3.97Å; Y79-A195 HydrophobicContact CE2-CB 3.95Å; V83-A195 HydrophobicContact CG2-CB 3.52Å; V191-A195 VanDerWaalsContact O-CB 3.29Å; V191-A195 WeakPolarHBondContact O-CB 3.47Å; V191-A195 PolarHBondContact O-N 3.42Å; H192-A195 PolarHBondContact O-N 3.48Å; A195-T199 WeakPolarHBondContact O-CB 3.35Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 PolarHBondContact O-OG1 3.3Å
196A98.5Very high96.4Very high41 Ų4157.7 Ų57.734%0.33930%0.303SS..Hα-helixtrans-64.4-43.1173.500000111.4Y79 H192 A193 V194 I198 T199 T200Y79-A196 HydrophobicContact CE2-CB 4.21Å; H192-A196 VanDerWaalsContact O-CB 3.32Å; H192-A196 WeakPolarHBondContact O-CB 3.38Å; H192-A196 PolarHBondContact O-N 2.94Å; A193-A196 PolarHBondContact O-N 2.93Å; V194-A196 VanDerWaalsContact C-N 3.33Å; V194-A196 PolarHBondContact O-N 3.34Å; A196-I198 PolarHBondContact O-N 2.97Å; A196-T199 PolarHBondContact O-N 2.99Å; A196-T200 WeakPolarHBondContact O-CB 3.47Å; A196-T200 PolarHBondContact O-N 3.09Å; A196-T200 PolarHBondContact O-OG1 3.38Å
197A98.6Very high96.6Very high16 Ų1655.3 Ų55.313%0.13231%0.309CS..Hα-helixtrans-61.5-44.4176.700000112.4V175 V178 A193 V194 T200 A201V175-A197 HydrophobicContact CG2-CB 4.4Å; V178-A197 HydrophobicContact CB-CB 3.96Å; V178-A197 HydrophobicContact CG1-CB 4.08Å; V178-A197 HydrophobicContact CG2-CB 3.77Å; A193-A197 PolarHBondContact O-N 2.93Å; V194-A197 WeakPolarHBondContact O-CB 3.09Å; V194-A197 PolarHBondContact O-N 3.5Å; A197-T200 PolarHBondContact O-N 3.15Å; A197-A201 WeakPolarHBondContact O-CB 3.44Å; A197-A201 PolarHBondContact O-N 3.4Å
198I98.8Very high97Very high35 Ų3551.9 Ų51.918%0.17930%0.295CS..Hα-helixtrans-59.2-48.6173.9-71.9168000110.4T78 V175 V194 A196 T200 A201 V202 F213T78-I198 HydrophobicContact CG2-CG2 4.4Å; V175-I198 HydrophobicContact CG1-CG1 4.1Å; V175-I198 HydrophobicContact CG2-CG1 4.05Å; V194-I198 HydrophobicContact CG1-CD1 3.91Å; V194-I198 HydrophobicContact CG1-CG1 4.46Å; V194-I198 WeakPolarHBondContact O-CG1 3.42Å; V194-I198 PolarHBondContact O-N 3.35Å; A196-I198 PolarHBondContact O-N 2.97Å; I198-T200 VanDerWaalsContact C-N 3.33Å; I198-T200 PolarHBondContact O-N 3.37Å; I198-A201 WeakPolarHBondContact O-CB 3.3Å; I198-A201 PolarHBondContact O-N 2.95Å; I198-A201 VanDerWaalsContact O-N 3.16Å; I198-V202 WeakPolarHBondContact O-CG2 3.29Å; I198-V202 PolarHBondContact O-N 3.27Å; I198-F213 HydrophobicContact CB-CZ 4.26Å; I198-F213 HydrophobicContact CG1-CE2 4.13Å; I198-F213 HydrophobicContact CG1-CZ 3.87Å; I198-F213 HydrophobicContact CG2-CZ 3.95Å
199T98.7Very high97.4Very high19 Ų1947 Ų4712%0.11727%0.274CS..Hα-helixtrans-63.2-40.5-178.7-54.30000111.5L75 Y79 A195 A196 V202 Y203L75-T199 HydrophobicContact CB-CG2 4Å; L75-T199 HydrophobicContact CD2-CG2 4.06Å; L75-T199 WeakPolarHBondContact O-CG2 3.29Å; Y79-T199 VanDerWaalsContact CA-OG1 3.26Å; Y79-T199 WeakPolarHBondContact CA-OG1 3.35Å; Y79-T199 WeakPolarHBondContact CB-OG1 3.32Å; Y79-T199 PolarHBondContact N-OG1 3.42Å; A195-T199 WeakPolarHBondContact O-CB 3.35Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 PolarHBondContact O-OG1 3.3Å; A196-T199 PolarHBondContact O-N 2.99Å; T199-V202 PolarHBondContact O-N 2.82Å; T199-Y203 PolarHBondContact O-N 3Å
200T98.6Very high97.6Very high90 Ų9041.9 Ų41.955%0.55226%0.261SS*.Hα-helixtrans-64.8-40.4174.2-61.30000111.8A196 A197 I198 V202 Y203 A204A196-T200 WeakPolarHBondContact O-CB 3.47Å; A196-T200 PolarHBondContact O-N 3.09Å; A196-T200 PolarHBondContact O-OG1 3.38Å; A197-T200 PolarHBondContact O-N 3.15Å; I198-T200 VanDerWaalsContact C-N 3.33Å; I198-T200 PolarHBondContact O-N 3.37Å; T200-V202 VanDerWaalsContact C-N 3.34Å; T200-Y203 PolarHBondContact O-N 3.19Å; T200-A204 WeakPolarHBondContact O-CB 3.46Å; T200-A204 PolarHBondContact O-N 3.08Å
201A98.6Very high97.8Very high8 Ų838.2 Ų38.27%0.06625%0.249CC..Hα-helixtrans-63-41.4174.300000111.5C171 V175 A197 I198 A204 G205 A211 F213C171-A201 HydrophobicContact CB-CB 4.04Å; V175-A201 HydrophobicContact CG2-CB 4.39Å; A197-A201 WeakPolarHBondContact O-CB 3.44Å; A197-A201 PolarHBondContact O-N 3.4Å; I198-A201 WeakPolarHBondContact O-CB 3.3Å; I198-A201 PolarHBondContact O-N 2.95Å; I198-A201 VanDerWaalsContact O-N 3.16Å; A201-A204 PolarHBondContact O-N 3Å; A201-G205 PolarHBondContact O-N 3.22Å; A201-A211 WeakPolarHBondContact O-CB 3.41Å; A201-F213 HydrophobicContact CB-CE1 4.21Å
202V98.4Very high97.8Very high36 Ų3638.2 Ų38.222%0.21825%0.249CC..Hα-helixtrans-64.3-41.5174.21730000111.7L75 T78 I198 T199 T200 A204 G206 A211L75-V202 HydrophobicContact CD2-CB 4.43Å; L75-V202 HydrophobicContact CD2-CG1 4.06Å; T78-V202 HydrophobicContact CG2-CB 4.43Å; T78-V202 HydrophobicContact CG2-CG2 4.12Å; I198-V202 WeakPolarHBondContact O-CG2 3.29Å; I198-V202 PolarHBondContact O-N 3.27Å; T199-V202 PolarHBondContact O-N 2.82Å; T200-V202 VanDerWaalsContact C-N 3.34Å; V202-A204 PolarHBondContact O-N 3.32Å; V202-G206 WeakPolarHBondContact O-CA 3.35Å; V202-G206 PolarHBondContact O-N 3.13Å; V202-A211 HydrophobicContact CG2-CB 4.17Å
203Y98.2Very high97.9Very high178 Ų17835.5 Ų35.570%0.69824%0.236SC*.Hα-helixtrans-60.1-45.3173.3171.6-104.6000112.2L75 T199 T200L75-Y203 HydrophobicContact CD1-CD2 3.75Å; L75-Y203 HydrophobicContact CD1-CG 4.38Å; T199-Y203 PolarHBondContact O-N 3Å; T200-Y203 PolarHBondContact O-N 3.19Å
204A98Very high97.9Very high78 Ų7834.3 Ų34.365%0.64522%0.224SC*.Hα-helixtrans-79.6-38.4-17400000114T200 A201 V202T200-A204 WeakPolarHBondContact O-CB 3.46Å; T200-A204 PolarHBondContact O-N 3.08Å; A201-A204 PolarHBondContact O-N 3Å; V202-A204 PolarHBondContact O-N 3.32Å
205G97.5Very high97.9Very high2 Ų233 Ų332%0.02122%0.217CC..Hα-helixtrans-113.6-10.7-172.700000114.9A201 G207 V208 T209A201-G205 PolarHBondContact O-N 3.22Å; G205-G207 VanDerWaalsContact C-N 3.31Å; G205-G207 PolarHBondContact O-N 3.47Å; G205-V208 PolarHBondContact O-N 3.45Å; G205-T209 PolarHBondContact O-N 2.89Å; G205-T209 VanDerWaalsContact O-N 3.12Å
206G96.8Very high97.9Very high21 Ų2133 Ų3322%0.21622%0.216CC..Hα-helixtrans-59.7-39.1-173.700000113.1V202 V208 G210V202-G206 WeakPolarHBondContact O-CA 3.35Å; V202-G206 PolarHBondContact O-N 3.13Å; G206-V208 PolarHBondContact O-N 2.9Å; G206-G210 VanDerWaalsContact O-CA 3.22Å; G206-G210 WeakPolarHBondContact O-CA 3.44Å; G206-G210 PolarHBondContact O-N 2.89Å
207G95.8Very high98Very high63 Ų6331.7 Ų31.765%0.64920%0.204SC*.Hα-helixtrans-70.9-6.1176.200000115.1H158 G205H158-G207 PolarHBondContact CD2-O 2.7Å; G205-G207 VanDerWaalsContact C-N 3.31Å; G205-G207 PolarHBondContact O-N 3.47Å
208V97.6Very high98Very high36 Ų3631 Ų3122%0.21820%0.198CC..Hα-helixtrans-109.2-40.2-178.9-174.50000112.2A156 I157 H158 A159 V167 G205 G206A156-V208 CarbonylContact O-C 3.49Å; A156-V208 VanDerWaalsContact O-C 3.25Å; I157-V208 WeakPolarHBondContact CA-O 3.41Å; H158-V208 PolarHBondContact N-O 3.39Å; A159-V208 HydrophobicContact CB-CG1 3.61Å; V167-V208 HydrophobicContact CG1-CB 4.45Å; V167-V208 HydrophobicContact CG2-CB 4.33Å; V167-V208 HydrophobicContact CG2-CG1 4.03Å; G205-V208 PolarHBondContact O-N 3.45Å; G206-V208 PolarHBondContact O-N 2.9Å
209T97.7Very high98Very high0 Ų031.2 Ų31.20%020%0.197CC..Hα-helixtrans-137-1.6-175.864.90000114.2A156 A164 V167 E168 G205 A211 V236 Y237A156-T209 CarbonylContact O-C 3.25Å; A156-T209 WeakPolarHBondContact O-CA 3.08Å; A156-T209 PolarHBondContact O-N 2.87Å; A164-T209 HydrophobicContact CB-CG2 3.64Å; A164-T209 WeakPolarHBondContact O-CG2 3.38Å; V167-T209 HydrophobicContact CB-CG2 4.2Å; V167-T209 HydrophobicContact CG1-CG2 4.22Å; E168-T209 HydrophobicContact CG-CG2 4.14Å; E168-T209 VanDerWaalsContact OE1-CB 3.27Å; E168-T209 WeakPolarHBondContact OE1-CB 3.38Å; E168-T209 PolarHBondContact OE1-OG1 3.31Å; G205-T209 PolarHBondContact O-N 2.89Å; G205-T209 VanDerWaalsContact O-N 3.12Å; T209-A211 PolarHBondContact O-N 2.89Å; T209-A211 PolarHBondContact OG1-N 3.05Å; T209-A211 VanDerWaalsContact OG1-N 3.14Å; T209-V236 HydrophobicContact CG2-CG1 4.32Å; T209-Y237 WeakPolarHBondContact O-CE1 3.47Å; T209-Y237 PolarHBondContact O-OH 2.98Å
210G96.4Very high97.9Very high25 Ų2530.3 Ų30.326%0.25819%0.192SC..  trans76.5-0.6-163.900000114.3G206G206-G210 VanDerWaalsContact O-CA 3.22Å; G206-G210 WeakPolarHBondContact O-CA 3.44Å; G206-G210 PolarHBondContact O-N 2.89Å
211A97.4Very high97.9Very high4 Ų426.3 Ų26.33%0.03317%0.167CC..  trans44.767.8-179.900000112.8E168 A201 V202 T209 F213E168-A211 WeakPolarHBondContact OE1-CA 3.32Å; A201-A211 WeakPolarHBondContact O-CB 3.41Å; V202-A211 HydrophobicContact CG2-CB 4.17Å; T209-A211 PolarHBondContact O-N 2.89Å; T209-A211 PolarHBondContact OG1-N 3.05Å; T209-A211 VanDerWaalsContact OG1-N 3.14Å; A211-F213 HydrophobicContact CB-CE1 4.49Å; A211-F213 WeakPolarHBondContact O-CD1 3.42Å; A211-F213 WeakPolarHBondContact O-CE1 3.43Å
212V97.5Very high97.8Very high10 Ų1026.2 Ų26.26%0.06117%0.165CC..  trans-93.1-40.8-170.9-173.20000112.3E168 N214 L217 A218 Q222 Y237E168-V212 PolarHBondContact OE1-N 3.29Å; E168-V212 PolarHBondContact OE2-N 3.41Å; V212-N214 WeakPolarHBondContact O-CB 3.21Å; V212-N214 PolarHBondContact O-N 2.85Å; V212-L217 HydrophobicContact CG1-CB 3.9Å; V212-L217 HydrophobicContact CG1-CD2 4Å; V212-L217 HydrophobicContact CG1-CG 3.82Å; V212-A218 HydrophobicContact CB-CB 4.3Å; V212-A218 HydrophobicContact CG1-CB 3.74Å; V212-Q222 HydrophobicContact CG2-CG 4.03Å; V212-Y237 HydrophobicContact CB-CD1 4.12Å; V212-Y237 HydrophobicContact CB-CE1 4.1Å; V212-Y237 HydrophobicContact CG2-CD1 4.33Å; V212-Y237 HydrophobicContact CG2-CE1 3.83Å
213F97.9Very high97.8Very high22 Ų2225.6 Ų25.610%0.09616%0.16CC..  trans44.226.9176.253.9-94.5000115.5N95 E168 C171 A172 V175 I198 A201 A211 P241N95-F213 PolarHBondContact ND2-O 3.45Å; N95-F213 VanDerWaalsContact ND2-O 3.1Å; E168-F213 WeakPolarHBondContact OE2-CA 3.37Å; E168-F213 PolarHBondContact OE2-N 3.14Å; C171-F213 HydrophobicContact CB-CB 4.11Å; C171-F213 HydrophobicContact CB-CD1 3.67Å; C171-F213 HydrophobicContact CB-CG 4.17Å; A172-F213 HydrophobicContact CB-CB 3.9Å; V175-F213 HydrophobicContact CG1-CE2 4.4Å; V175-F213 HydrophobicContact CG2-CD2 4.49Å; V175-F213 HydrophobicContact CG2-CE2 4.15Å; V175-F213 HydrophobicContact CG2-CZ 4.26Å; I198-F213 HydrophobicContact CB-CZ 4.26Å; I198-F213 HydrophobicContact CG1-CE2 4.13Å; I198-F213 HydrophobicContact CG1-CZ 3.87Å; I198-F213 HydrophobicContact CG2-CZ 3.95Å; A201-F213 HydrophobicContact CB-CE1 4.21Å; A211-F213 HydrophobicContact CB-CE1 4.49Å; A211-F213 WeakPolarHBondContact O-CD1 3.42Å; A211-F213 WeakPolarHBondContact O-CE1 3.43Å; F213-P241 HydrophobicContact CB-CG 4.49Å
214N98.6Very high97.7Very high8 Ų820.2 Ų20.24%0.04315%0.147CC..  trans-149.6109.1-174.1177.6-22000108.7G94 N95 P96 V212 A216 L217 A218G94-N214 PolarHBondContact O-ND2 3.4Å; N95-N214 HydrophobicContact CB-CB 4.48Å; P96-N214 VanDerWaalsContact CD-OD1 3.32Å; P96-N214 WeakPolarHBondContact CD-OD1 3.31Å; V212-N214 WeakPolarHBondContact O-CB 3.21Å; V212-N214 PolarHBondContact O-N 2.85Å; N214-A216 VanDerWaalsContact C-N 3.34Å; N214-A216 PolarHBondContact O-N 2.65Å; N214-A216 PolarHBondContact OD1-N 3.41Å; N214-A216 VanDerWaalsContact OD1-N 3.13Å; N214-L217 HydrophobicContact CB-CB 3.77Å; N214-L217 HydrophobicContact CB-CD2 4.48Å; N214-L217 PolarHBondContact O-N 2.92Å; N214-L217 PolarHBondContact OD1-N 3.24Å; N214-L217 VanDerWaalsContact OD1-N 3.16Å; N214-A218 WeakPolarHBondContact O-CB 2.97Å; N214-A218 PolarHBondContact O-N 3.33Å
215P98.7Very high97.6Very high0 Ų016.8 Ų16.80%012%0.118CC..Hα-helixtrans-61.3-36-174.8-23.229.1000114.9N95 P96 C97 F121 F219 Y237 W238N95-P215 WeakPolarHBondContact OD1-CD 3.48Å; P96-P215 HydrophobicContact CB-CB 4.37Å; P96-P215 HydrophobicContact CB-CG 4.21Å; P96-P215 HydrophobicContact CG-CB 4.1Å; P96-P215 HydrophobicContact CG-CG 4.36Å; C97-P215 VanDerWaalsContact SG-CD 3.6Å; F121-P215 HydrophobicContact CZ-CB 4.39Å; P215-F219 WeakPolarHBondContact O-CB 3.28Å; P215-F219 PolarHBondContact O-N 2.92Å; P215-Y237 WeakPolarHBondContact CG-O 3.03Å; P215-W238 HydrophobicContact CB-CD2 3.49Å; P215-W238 VanDerWaalsContact CB-CD2 3.49Å; P215-W238 VanDerWaalsContact CB-CE2 3.5Å; P215-W238 HydrophobicContact CB-CE3 3.93Å; P215-W238 HydrophobicContact CB-CG 3.84Å; P215-W238 HydrophobicContact CB-CH2 4.41Å; P215-W238 HydrophobicContact CB-CZ2 4.03Å; P215-W238 HydrophobicContact CB-CZ3 4.35Å; P215-W238 HydrophobicContact CG-CD2 3.89Å; P215-W238 HydrophobicContact CG-CE3 3.92Å; P215-W238 HydrophobicContact CG-CG 4.22Å; P215-W238 HydrophobicContact CG-CZ3 4.44Å
216A98.8Very high97.5Very high0 Ų020.4 Ų20.40%014%0.143CC..Hα-helixtrans-71.6-40.3178.500000111.5P96 Q120 F121 A124 N214 F219 S220P96-A216 HydrophobicContact CG-CB 3.7Å; Q120-A216 HydrophobicContact CB-CB 3.84Å; F121-A216 HydrophobicContact CE1-CB 4.36Å; F121-A216 HydrophobicContact CZ-CB 4.27Å; A124-A216 WeakPolarHBondContact CB-O 3.47Å; N214-A216 VanDerWaalsContact C-N 3.34Å; N214-A216 PolarHBondContact O-N 2.65Å; N214-A216 PolarHBondContact OD1-N 3.41Å; N214-A216 VanDerWaalsContact OD1-N 3.13Å; A216-F219 PolarHBondContact O-N 3.11Å; A216-S220 PolarHBondContact O-N 2.85Å; A216-S220 VanDerWaalsContact O-N 3.15Å
217L98.7Very high97.4Very high15 Ų1522.5 Ų22.58%0.07916%0.164CC..Hα-helixtrans-64.9-44.7175.6-174.956.6000111.4L53 C54 T57 V212 N214 F219 S220 T221L53-L217 HydrophobicContact CD2-CD2 4.31Å; L53-L217 HydrophobicContact CG-CD1 4.09Å; L53-L217 HydrophobicContact CG-CD2 4.28Å; C54-L217 HydrophobicContact CB-CD1 4.4Å; T57-L217 HydrophobicContact CG2-CD1 4.07Å; T57-L217 HydrophobicContact CG2-CD2 4.26Å; T57-L217 HydrophobicContact CG2-CG 4.39Å; V212-L217 HydrophobicContact CG1-CB 3.9Å; V212-L217 HydrophobicContact CG1-CD2 4Å; V212-L217 HydrophobicContact CG1-CG 3.82Å; N214-L217 HydrophobicContact CB-CB 3.77Å; N214-L217 HydrophobicContact CB-CD2 4.48Å; N214-L217 PolarHBondContact O-N 2.92Å; N214-L217 PolarHBondContact OD1-N 3.24Å; N214-L217 VanDerWaalsContact OD1-N 3.16Å; L217-F219 VanDerWaalsContact C-N 3.3Å; L217-F219 PolarHBondContact O-N 2.99Å; L217-S220 WeakPolarHBondContact O-CA 3.4Å; L217-S220 VanDerWaalsContact O-CB 3.32Å; L217-S220 WeakPolarHBondContact O-CB 3.32Å; L217-S220 PolarHBondContact O-N 3.46Å; L217-T221 HydrophobicContact CD1-CG2 4.06Å; L217-T221 PolarHBondContact O-N 3.32Å; L217-T221 PolarHBondContact O-OG1 2.95Å
218A98.6Very high97.5Very high0 Ų021.3 Ų21.30%014%0.143CC..Hα-helixtrans-61.3-40.2176.600000111.7V212 N214 S220 T221 Q222 F223 Y237V212-A218 HydrophobicContact CB-CB 4.3Å; V212-A218 HydrophobicContact CG1-CB 3.74Å; N214-A218 WeakPolarHBondContact O-CB 2.97Å; N214-A218 PolarHBondContact O-N 3.33Å; A218-S220 PolarHBondContact O-N 3.49Å; A218-T221 PolarHBondContact O-N 2.8Å; A218-Q222 HydrophobicContact CB-CG 4.48Å; A218-Q222 WeakPolarHBondContact O-CA 3.22Å; A218-Q222 WeakPolarHBondContact O-CB 3.45Å; A218-Q222 PolarHBondContact O-N 3.45Å; A218-F223 HydrophobicContact CB-CE2 4.23Å; A218-F223 VanDerWaalsContact O-CD2 3.29Å; A218-F223 WeakPolarHBondContact O-CD2 3.11Å; A218-F223 PolarHBondContact O-N 3Å; A218-Y237 VanDerWaalsContact CB-CB 3.49Å; A218-Y237 HydrophobicContact CB-CD1 3.91Å; A218-Y237 HydrophobicContact CB-CD2 4.04Å; A218-Y237 HydrophobicContact CB-CG 3.56Å
219F98.6Very high97.5Very high40 Ų4022.3 Ų22.318%0.17515%0.152CC..Hα-helixtrans-60.6-31.9173.4-178.1-94.7000112.9F121 A124 V125 R128 P215 A216 L217 F223 F230F121-F219 HydrophobicContact CD1-CB 4.14Å; F121-F219 AromaticContact CD1-CD1 3.9Å; F121-F219 HydrophobicContact CD1-CD1 3.9Å; F121-F219 HydrophobicContact CD1-CE1 4.49Å; F121-F219 AromaticContact CD1-CG 3.95Å; F121-F219 HydrophobicContact CD1-CG 3.95Å; F121-F219 HydrophobicContact CE1-CB 3.66Å; F121-F219 HydrophobicContact CE1-CD1 4.27Å; F121-F219 HydrophobicContact CE1-CD2 4.37Å; F121-F219 AromaticContact CE1-CG 3.85Å; F121-F219 HydrophobicContact CE1-CG 3.85Å; A124-F219 HydrophobicContact CB-CD1 4Å; V125-F219 HydrophobicContact CG2-CE1 3.75Å; V125-F219 HydrophobicContact CG2-CZ 4.46Å; R128-F219 WeakPolarHBondContact CD-O 3.41Å; R128-F219 PolarHBondContact NH1-O 2.93Å; R128-F219 VanDerWaalsContact NH1-O 3.13Å; P215-F219 WeakPolarHBondContact O-CB 3.28Å; P215-F219 PolarHBondContact O-N 2.92Å; A216-F219 PolarHBondContact O-N 3.11Å; L217-F219 VanDerWaalsContact C-N 3.3Å; L217-F219 PolarHBondContact O-N 2.99Å; F219-F223 HydrophobicContact CB-CD2 4.46Å; F219-F223 HydrophobicContact CD2-CB 4.29Å; F219-F223 AromaticContact CD2-CD1 3.71Å; F219-F223 HydrophobicContact CD2-CD1 3.71Å; F219-F223 HydrophobicContact CD2-CE1 4.16Å; F219-F223 HydrophobicContact CD2-CG 4Å; F219-F223 HydrophobicContact CE2-CD1 4.29Å; F219-F230 HydrophobicContact CE2-CE2 4.36Å
220S98.4Very high97.5Very high0 Ų028.2 Ų28.20%018%0.178CC..Hα-helixtrans-74.6-43.6174.1-1660000113C54 Q58 A124 R128 A216 L217 A218C54-S220 WeakPolarHBondContact CB-OG 3.49Å; Q58-S220 PolarHBondContact NE2-OG 3.45Å; A124-S220 PolarHBondContact O-OG 3.23Å; R128-S220 WeakPolarHBondContact CG-O 3.35Å; A216-S220 PolarHBondContact O-N 2.85Å; A216-S220 VanDerWaalsContact O-N 3.15Å; L217-S220 WeakPolarHBondContact O-CA 3.4Å; L217-S220 VanDerWaalsContact O-CB 3.32Å; L217-S220 WeakPolarHBondContact O-CB 3.32Å; L217-S220 PolarHBondContact O-N 3.46Å; A218-S220 PolarHBondContact O-N 3.49Å
221T97.6Very high97.6Very high6 Ų633.4 Ų33.44%0.03720%0.199CC..Hα-helixtrans-104.6-25.1-163.656.80000114.8T57 Q58 K61 L217 A218T57-T221 HydrophobicContact CG2-CG2 3.91Å; Q58-T221 HydrophobicContact CG-CG2 3.74Å; K61-T221 PolarHBondContact NZ-O 3.32Å; L217-T221 HydrophobicContact CD1-CG2 4.06Å; L217-T221 PolarHBondContact O-N 3.32Å; L217-T221 PolarHBondContact O-OG1 2.95Å; A218-T221 PolarHBondContact O-N 2.8Å
222Q97.3Very high97.6Very high6 Ų636.2 Ų36.23%0.02821%0.211CC..THydrogen-bonded Turntrans-113.2-43.8-172-52.9-58.1-10.500112.8V212 A218 P224 C225 Y237V212-Q222 HydrophobicContact CG2-CG 4.03Å; A218-Q222 HydrophobicContact CB-CG 4.48Å; A218-Q222 WeakPolarHBondContact O-CA 3.22Å; A218-Q222 WeakPolarHBondContact O-CB 3.45Å; A218-Q222 PolarHBondContact O-N 3.45Å; Q222-P224 VanDerWaalsContact C-N 3.3Å; Q222-C225 VanDerWaalsContact O-CB 3.27Å; Q222-C225 WeakPolarHBondContact O-CB 3.44Å; Q222-C225 PolarHBondContact O-N 3.17Å; Q222-Y237 HydrophobicContact CB-CD2 4.37Å; Q222-Y237 HydrophobicContact CB-CE2 3.74Å; Q222-Y237 HydrophobicContact CG-CE1 4.34Å; Q222-Y237 HydrophobicContact CG-CE2 3.87Å
223F97.4Very high97.6Very high24 Ų2435.9 Ų35.911%0.10521%0.209CC..THydrogen-bonded Turntrans-61-25.5-176.8-77.3-127.3000115.4A218 F219 C225 F230 Y233 Y237A218-F223 HydrophobicContact CB-CE2 4.23Å; A218-F223 VanDerWaalsContact O-CD2 3.29Å; A218-F223 WeakPolarHBondContact O-CD2 3.11Å; A218-F223 PolarHBondContact O-N 3Å; F219-F223 HydrophobicContact CB-CD2 4.46Å; F219-F223 HydrophobicContact CD2-CB 4.29Å; F219-F223 AromaticContact CD2-CD1 3.71Å; F219-F223 HydrophobicContact CD2-CD1 3.71Å; F219-F223 HydrophobicContact CD2-CE1 4.16Å; F219-F223 HydrophobicContact CD2-CG 4Å; F219-F223 HydrophobicContact CE2-CD1 4.29Å; F223-C225 VanDerWaalsContact C-N 3.27Å; F223-F230 AromaticContact CD1-CD2 3.63Å; F223-F230 HydrophobicContact CD1-CD2 3.63Å; F223-F230 AromaticContact CD1-CE2 3.63Å; F223-F230 HydrophobicContact CD1-CE2 3.63Å; F223-F230 AromaticContact CE1-CD2 3.76Å; F223-F230 HydrophobicContact CE1-CD2 3.76Å; F223-F230 AromaticContact CE1-CE2 3.58Å; F223-F230 HydrophobicContact CE1-CE2 3.58Å; F223-F230 HydrophobicContact CE1-CG 4.45Å; F223-F230 HydrophobicContact CE1-CZ 4.13Å; F223-Y233 HydrophobicContact CD2-CD2 4.33Å; F223-Y233 HydrophobicContact CD2-CG 4.15Å; F223-Y233 HydrophobicContact CE2-CG 4.28Å; F223-Y233 HydrophobicContact CG-CD2 4.2Å; F223-Y233 HydrophobicContact CG-CG 4.44Å; F223-Y237 HydrophobicContact CE2-CD2 4.14Å
224P95.9Very high97.6Very high64 Ų6436.2 Ų36.242%0.41621%0.214SC..THydrogen-bonded Turntrans-72.3-17.1171-16.429.8000114.4R128 Q222R128-P224 HydrophobicContact CG-CG 4.36Å; Q222-P224 VanDerWaalsContact C-N 3.3Å
225C96.2Very high97.6Very high7 Ų739.8 Ų39.85%0.04723%0.229CC..SBendtrans-81151-171.9-56.20000112.1K61 C153 Q222 F223 Y233K61-C225 PolarHBondContact NZ-SG 2.92Å; K61-C225 VanDerWaalsContact NZ-SG 3.41Å; C153-C225 HydrophobicContact CB-CB 4Å; C153-C225 WeakPolarHBondContact CB-SG 3.13Å; C153-C225 WeakPolarHBondContact O-CA 3.41Å; C153-C225 WeakPolarHBondContact O-CB 3.24Å; C153-C225 WeakPolarHBondContact SG-CA 3.26Å; C153-C225 WeakPolarHBondContact SG-CB 3.45Å; C153-C225 CovalentContact SG-SG 2.04Å; C153-C225 PolarHBondContact SG-SG 3.46Å; Q222-C225 VanDerWaalsContact O-CB 3.27Å; Q222-C225 WeakPolarHBondContact O-CB 3.44Å; Q222-C225 PolarHBondContact O-N 3.17Å; F223-C225 VanDerWaalsContact C-N 3.27Å; C225-Y233 PolarHBondContact O-OH 3.42Å
226S95.4Very high97.6Very high78 Ų7839.8 Ų39.855%0.54523%0.229SC..BIsolated β-bridgetrans-80.6144.817558.20000111.3C153 V154 S155C153-S226 PolarHBondContact O-N 2.84Å; C153-S226 PolarHBondContact O-OG 3.42Å; V154-S226 CarbonylContact C-O 3.42Å; V154-S226 WeakPolarHBondContact CA-O 3.45Å; S155-S226 PolarHBondContact N-O 3.47Å
227G95.3Very high97.6Very high64 Ų6439.8 Ų39.866%0.6623%0.229SC*.SBendtrans136.3-26.7169.300000114
228N97.6Very high97.6Very high38 Ų3842.5 Ų42.520%0.20324%0.238CC..SBendtrans-134.2155.3175.4-69.5100.9000111.2S155 E232 Y233S155-N228 VanDerWaalsContact CB-OD1 3.31Å; S155-N228 WeakPolarHBondContact CB-OD1 3.33Å; S155-N228 PolarHBondContact OG-OD1 3.33Å; N228-E232 WeakPolarHBondContact CA-OE2 3.34Å; N228-E232 HydrophobicContact CB-CB 4.1Å; N228-E232 VanDerWaalsContact CB-OE2 3.28Å; N228-E232 WeakPolarHBondContact CB-OE2 3.31Å; N228-E232 PolarHBondContact ND2-OE2 3.32Å; N228-Y233 HydrophobicContact CB-CD1 4.04Å; N228-Y233 HydrophobicContact CB-CD2 4.39Å; N228-Y233 HydrophobicContact CB-CE1 3.67Å; N228-Y233 HydrophobicContact CB-CE2 4.04Å; N228-Y233 HydrophobicContact CB-CG 4.39Å; N228-Y233 WeakPolarHBondContact O-CE2 3.43Å
229S97.6Very high97.5Very high58 Ų5846 Ų4641%0.40626%0.257SS..  trans-76.9163.4174.677.90000111.8L231 E232 Y233S229-L231 VanDerWaalsContact C-N 3.26Å; S229-L231 PolarHBondContact O-N 2.93Å; S229-E232 PolarHBondContact N-OE2 2.95Å; S229-E232 PolarHBondContact O-N 3.21Å; S229-E232 VanDerWaalsContact OG-CG 3.32Å; S229-E232 WeakPolarHBondContact OG-CG 3.22Å; S229-E232 PolarHBondContact OG-N 3.41Å; S229-Y233 WeakPolarHBondContact O-CD2 3.39Å; S229-Y233 PolarHBondContact O-N 3.09Å
230F97.3Very high97.5Very high123 Ų12344.2 Ų44.254%0.53925%0.25SC..Hα-helixtrans-54.6-41.3175.3-177.9-91.1000112.7F219 F223 Y233 C234F219-F230 HydrophobicContact CE2-CE2 4.36Å; F223-F230 AromaticContact CD1-CD2 3.63Å; F223-F230 HydrophobicContact CD1-CD2 3.63Å; F223-F230 AromaticContact CD1-CE2 3.63Å; F223-F230 HydrophobicContact CD1-CE2 3.63Å; F223-F230 AromaticContact CE1-CD2 3.76Å; F223-F230 HydrophobicContact CE1-CD2 3.76Å; F223-F230 AromaticContact CE1-CE2 3.58Å; F223-F230 HydrophobicContact CE1-CE2 3.58Å; F223-F230 HydrophobicContact CE1-CG 4.45Å; F223-F230 HydrophobicContact CE1-CZ 4.13Å; F230-Y233 PolarHBondContact O-N 2.68Å; F230-C234 VanDerWaalsContact CE1-SG 3.52Å; F230-C234 PolarHBondContact O-N 2.88Å; F230-C234 PolarHBondContact O-SG 3.33Å; F230-C234 VanDerWaalsContact O-SG 3.35Å
231L98Very high97.5Very high134 Ų13444.2 Ų44.270%0.70225%0.25SC*.Hα-helixtrans-71-36.1-179.3-67.8179.6000112.5S229 Y233 C234 F235S229-L231 VanDerWaalsContact C-N 3.26Å; S229-L231 PolarHBondContact O-N 2.93Å; L231-Y233 VanDerWaalsContact C-N 3.34Å; L231-C234 PolarHBondContact O-N 2.97Å; L231-F235 WeakPolarHBondContact O-CB 3.05Å; L231-F235 PolarHBondContact O-N 3.31Å
232E98.3Very high97.6Very high63 Ų6346.1 Ų46.129%0.29426%0.259SS..Hα-helixtrans-64.1-41.9173.9-69.1176155.800111.2L161 N228 S229 F235 V236L161-E232 HydrophobicContact CD1-CB 4.27Å; L161-E232 HydrophobicContact CD1-CG 3.69Å; L161-E232 HydrophobicContact CD2-CB 3.85Å; L161-E232 HydrophobicContact CD2-CG 4.12Å; N228-E232 WeakPolarHBondContact CA-OE2 3.34Å; N228-E232 HydrophobicContact CB-CB 4.1Å; N228-E232 VanDerWaalsContact CB-OE2 3.28Å; N228-E232 WeakPolarHBondContact CB-OE2 3.31Å; N228-E232 PolarHBondContact ND2-OE2 3.32Å; S229-E232 PolarHBondContact N-OE2 2.95Å; S229-E232 PolarHBondContact O-N 3.21Å; S229-E232 VanDerWaalsContact OG-CG 3.32Å; S229-E232 WeakPolarHBondContact OG-CG 3.22Å; S229-E232 PolarHBondContact OG-N 3.41Å; E232-F235 WeakPolarHBondContact O-CB 3.29Å; E232-F235 PolarHBondContact O-N 3.07Å; E232-V236 PolarHBondContact O-N 3.21Å
233Y98.2Very high97.6Very high3 Ų349.8 Ų49.81%0.01228%0.278CS..Hα-helixtrans-64.2-39.9173.2-74.2-42.6000112.9S155 I157 F223 C225 N228 S229 F230 L231 F235 V236 Y237S155-Y233 WeakPolarHBondContact CB-OH 3.08Å; S155-Y233 WeakPolarHBondContact OG-CE1 3.34Å; S155-Y233 PolarHBondContact OG-OH 3.02Å; I157-Y233 HydrophobicContact CD1-CD1 3.7Å; I157-Y233 HydrophobicContact CD1-CE1 3.75Å; I157-Y233 HydrophobicContact CG1-CE1 4.46Å; F223-Y233 HydrophobicContact CD2-CD2 4.33Å; F223-Y233 HydrophobicContact CD2-CG 4.15Å; F223-Y233 HydrophobicContact CE2-CG 4.28Å; F223-Y233 HydrophobicContact CG-CD2 4.2Å; F223-Y233 HydrophobicContact CG-CG 4.44Å; C225-Y233 PolarHBondContact O-OH 3.42Å; N228-Y233 HydrophobicContact CB-CD1 4.04Å; N228-Y233 HydrophobicContact CB-CD2 4.39Å; N228-Y233 HydrophobicContact CB-CE1 3.67Å; N228-Y233 HydrophobicContact CB-CE2 4.04Å; N228-Y233 HydrophobicContact CB-CG 4.39Å; N228-Y233 WeakPolarHBondContact O-CE2 3.43Å; S229-Y233 WeakPolarHBondContact O-CD2 3.39Å; S229-Y233 PolarHBondContact O-N 3.09Å; F230-Y233 PolarHBondContact O-N 2.68Å; L231-Y233 VanDerWaalsContact C-N 3.34Å; Y233-F235 VanDerWaalsContact C-N 3.34Å; Y233-V236 PolarHBondContact O-N 2.92Å; Y233-Y237 AromaticContact CD1-CD2 3.89Å; Y233-Y237 HydrophobicContact CD1-CD2 3.89Å; Y233-Y237 AromaticContact CD1-CE2 3.57Å; Y233-Y237 HydrophobicContact CD1-CE2 3.57Å; Y233-Y237 HydrophobicContact CE1-CE2 4.03Å; Y233-Y237 HydrophobicContact CG-CD2 4.47Å; Y233-Y237 WeakPolarHBondContact O-CB 3.15Å; Y233-Y237 PolarHBondContact O-N 3.45Å
234C97.9Very high97.6Very high30 Ų3048.6 Ų48.620%0.20327%0.273CS..Hα-helixtrans-61.5-43.4172-73.10000111.4F230 L231 V236 W238 L239F230-C234 VanDerWaalsContact CE1-SG 3.52Å; F230-C234 PolarHBondContact O-N 2.88Å; F230-C234 PolarHBondContact O-SG 3.33Å; F230-C234 VanDerWaalsContact O-SG 3.35Å; L231-C234 PolarHBondContact O-N 2.97Å; C234-V236 VanDerWaalsContact C-N 3.34Å; C234-V236 PolarHBondContact O-N 3.34Å; C234-W238 WeakPolarHBondContact O-CA 3.41Å; C234-W238 WeakPolarHBondContact O-CB 3.22Å; C234-W238 PolarHBondContact O-N 3.14Å; C234-L239 PolarHBondContact O-N 3.4Å
235F98.3Very high97.7Very high82 Ų8245.7 Ų45.736%0.3625%0.254SS..Iπ-helixtrans-58.7-45.1177.1-179-97.3000112L161 A165 L231 E232 Y233 L239L161-F235 HydrophobicContact CB-CD1 4.02Å; L161-F235 HydrophobicContact CB-CE1 4.11Å; L161-F235 WeakPolarHBondContact O-CE1 3.27Å; A165-F235 HydrophobicContact CB-CD1 4.04Å; A165-F235 HydrophobicContact CB-CE1 3.65Å; A165-F235 HydrophobicContact CB-CZ 4.31Å; L231-F235 WeakPolarHBondContact O-CB 3.05Å; L231-F235 PolarHBondContact O-N 3.31Å; E232-F235 WeakPolarHBondContact O-CB 3.29Å; E232-F235 PolarHBondContact O-N 3.07Å; Y233-F235 VanDerWaalsContact C-N 3.34Å; F235-L239 HydrophobicContact CD2-CD2 3.84Å; F235-L239 HydrophobicContact CE2-CD2 3.62Å; F235-L239 HydrophobicContact CZ-CD2 4.44Å; F235-L239 VanDerWaalsContact O-CB 3.29Å; F235-L239 WeakPolarHBondContact O-CB 3.27Å
236V98.6Very high97.8Very high0 Ų048 Ų480%027%0.265CS..Iπ-helixtrans-76.5-51.9-178.9173.90000112.3I157 L161 A164 A165 E168 T209 E232 Y233 C234 P241I157-V236 HydrophobicContact CD1-CB 4.11Å; I157-V236 HydrophobicContact CD1-CG1 4.18Å; I157-V236 HydrophobicContact CD1-CG2 3.96Å; I157-V236 HydrophobicContact CG1-CG1 4.49Å; L161-V236 HydrophobicContact CD2-CG2 4.11Å; A164-V236 HydrophobicContact CB-CG1 3.88Å; A164-V236 HydrophobicContact CB-CG2 3.78Å; A165-V236 HydrophobicContact CB-CG2 4.49Å; E168-V236 HydrophobicContact CG-CG1 3.8Å; T209-V236 HydrophobicContact CG2-CG1 4.32Å; E232-V236 PolarHBondContact O-N 3.21Å; Y233-V236 PolarHBondContact O-N 2.92Å; C234-V236 VanDerWaalsContact C-N 3.34Å; C234-V236 PolarHBondContact O-N 3.34Å; V236-P241 VanDerWaalsContact O-CD 3.28Å; V236-P241 WeakPolarHBondContact O-CD 3.42Å
237Y98.6Very high97.9Very high0 Ų047 Ų470%026%0.258CS..Iπ-helixtrans-95.8-7.8-168-61.6-63.8000115.2I157 E168 T209 V212 P215 A218 Q222 F223 Y233 P241I157-Y237 HydrophobicContact CD1-CE2 4.02Å; I157-Y237 HydrophobicContact CG1-CE2 4.28Å; E168-Y237 HydrophobicContact CG-CD1 3.99Å; E168-Y237 HydrophobicContact CG-CE1 4.15Å; E168-Y237 WeakPolarHBondContact OE1-CE1 3.19Å; T209-Y237 WeakPolarHBondContact O-CE1 3.47Å; T209-Y237 PolarHBondContact O-OH 2.98Å; V212-Y237 HydrophobicContact CB-CD1 4.12Å; V212-Y237 HydrophobicContact CB-CE1 4.1Å; V212-Y237 HydrophobicContact CG2-CD1 4.33Å; V212-Y237 HydrophobicContact CG2-CE1 3.83Å; P215-Y237 WeakPolarHBondContact CG-O 3.03Å; A218-Y237 VanDerWaalsContact CB-CB 3.49Å; A218-Y237 HydrophobicContact CB-CD1 3.91Å; A218-Y237 HydrophobicContact CB-CD2 4.04Å; A218-Y237 HydrophobicContact CB-CG 3.56Å; Q222-Y237 HydrophobicContact CB-CD2 4.37Å; Q222-Y237 HydrophobicContact CB-CE2 3.74Å; Q222-Y237 HydrophobicContact CG-CE1 4.34Å; Q222-Y237 HydrophobicContact CG-CE2 3.87Å; F223-Y237 HydrophobicContact CE2-CD2 4.14Å; Y233-Y237 AromaticContact CD1-CD2 3.89Å; Y233-Y237 HydrophobicContact CD1-CD2 3.89Å; Y233-Y237 AromaticContact CD1-CE2 3.57Å; Y233-Y237 HydrophobicContact CD1-CE2 3.57Å; Y233-Y237 HydrophobicContact CE1-CE2 4.03Å; Y233-Y237 HydrophobicContact CG-CD2 4.47Å; Y233-Y237 WeakPolarHBondContact O-CB 3.15Å; Y233-Y237 PolarHBondContact O-N 3.45Å; Y237-P241 WeakPolarHBondContact O-CG 3.39Å
238W98Very high97.9Very high72 Ų7243.9 Ų43.927%0.27323%0.226SC..Iπ-helixtrans-104.4-57.6167.2-81.785.5000112.1P96 F121 P215 C234 L242P96-W238 HydrophobicContact CB-CH2 4.42Å; P96-W238 HydrophobicContact CB-CZ3 4.44Å; F121-W238 HydrophobicContact CE1-CZ2 4.23Å; F121-W238 AromaticContact CE2-CH2 3.79Å; F121-W238 HydrophobicContact CE2-CH2 3.79Å; F121-W238 AromaticContact CE2-CZ2 3.52Å; F121-W238 HydrophobicContact CE2-CZ2 3.52Å; F121-W238 AromaticContact CZ-CE2 3.92Å; F121-W238 AromaticContact CZ-CH2 3.91Å; F121-W238 HydrophobicContact CZ-CH2 3.91Å; F121-W238 AromaticContact CZ-CZ2 3.18Å; F121-W238 HydrophobicContact CZ-CZ2 3.18Å; P215-W238 HydrophobicContact CB-CD2 3.49Å; P215-W238 VanDerWaalsContact CB-CD2 3.49Å; P215-W238 VanDerWaalsContact CB-CE2 3.5Å; P215-W238 HydrophobicContact CB-CE3 3.93Å; P215-W238 HydrophobicContact CB-CG 3.84Å; P215-W238 HydrophobicContact CB-CH2 4.41Å; P215-W238 HydrophobicContact CB-CZ2 4.03Å; P215-W238 HydrophobicContact CB-CZ3 4.35Å; P215-W238 HydrophobicContact CG-CD2 3.89Å; P215-W238 HydrophobicContact CG-CE3 3.92Å; P215-W238 HydrophobicContact CG-CG 4.22Å; P215-W238 HydrophobicContact CG-CZ3 4.44Å; C234-W238 WeakPolarHBondContact O-CA 3.41Å; C234-W238 WeakPolarHBondContact O-CB 3.22Å; C234-W238 PolarHBondContact O-N 3.14Å; W238-L242 HydrophobicContact CE3-CD1 3.92Å; W238-L242 VanDerWaalsContact O-CB 3.31Å; W238-L242 WeakPolarHBondContact O-CB 3.43Å; W238-L242 WeakPolarHBondContact O-CG 3.45Å; W238-L242 PolarHBondContact O-N 3.5Å
239L98.1Very high97.8Very high75 Ų7542.1 Ų42.139%0.39322%0.217SC..Iπ-helixtrans-64.3-48.5-172.5-177.366.1000111.3C234 F235 L242 L243C234-L239 PolarHBondContact O-N 3.4Å; F235-L239 HydrophobicContact CD2-CD2 3.84Å; F235-L239 HydrophobicContact CE2-CD2 3.62Å; F235-L239 HydrophobicContact CZ-CD2 4.44Å; F235-L239 VanDerWaalsContact O-CB 3.29Å; F235-L239 WeakPolarHBondContact O-CB 3.27Å; L239-L242 PolarHBondContact O-N 2.04Å; L239-L243 HydrophobicContact CD1-CD1 3.85Å; L239-L243 HydrophobicContact CD1-CG 4Å; L239-L243 HydrophobicContact CG-CD1 3.82Å; L239-L243 HydrophobicContact CG-CG 4.31Å; L239-L243 WeakPolarHBondContact O-CB 3.22Å; L239-L243 VanDerWaalsContact O-CG 3.27Å; L239-L243 WeakPolarHBondContact O-CG 3.29Å; L239-L243 PolarHBondContact O-N 3.35Å
240G98.1Very high97.6Very high2 Ų243 Ų432%0.02122%0.216CC..Hα-helixtrans-53.2-60.3177.300000112.2A165 L169 L242 L243 G244A165-G240 WeakPolarHBondContact O-CA 3.34Å; L169-G240 VanDerWaalsContact CA-O 3.24Å; L169-G240 WeakPolarHBondContact CA-O 3.48Å; L169-G240 WeakPolarHBondContact CB-O 3.44Å; G240-L242 VanDerWaalsContact C-N 3.35Å; G240-L242 PolarHBondContact O-N 3.41Å; G240-L243 PolarHBondContact O-N 2.65Å; G240-G244 PolarHBondContact O-N 3.13Å
241P98.6Very high97.4Very high0 Ų040.9 Ų40.90%021%0.21CC..Hα-helixtrans-62-36.7-177.4-3040.2000114.6E168 A172 F213 V236 Y237 M245E168-P241 HydrophobicContact CB-CG 4.02Å; A172-P241 HydrophobicContact CB-CB 4.05Å; A172-P241 WeakPolarHBondContact CB-O 3.27Å; F213-P241 HydrophobicContact CB-CG 4.49Å; V236-P241 VanDerWaalsContact O-CD 3.28Å; V236-P241 WeakPolarHBondContact O-CD 3.42Å; Y237-P241 WeakPolarHBondContact O-CG 3.39Å; P241-M245 VanDerWaalsContact O-CB 3.29Å; P241-M245 WeakPolarHBondContact O-CB 3.36Å; P241-M245 PolarHBondContact O-N 3.46Å
242L98.3Very high97Very high45 Ų4536 Ų3624%0.23618%0.183CC..Hα-helixtrans-63.8-48.7175.6-75.5174.7000111.5C97 L100 W238 L239 G240 G244 M246C97-L242 HydrophobicContact CB-CD2 4.32Å; C97-L242 VanDerWaalsContact SG-CD2 3.6Å; L100-L242 HydrophobicContact CD1-CD2 3.45Å; L100-L242 VanDerWaalsContact CD1-CD2 3.45Å; W238-L242 HydrophobicContact CE3-CD1 3.92Å; W238-L242 VanDerWaalsContact O-CB 3.31Å; W238-L242 WeakPolarHBondContact O-CB 3.43Å; W238-L242 WeakPolarHBondContact O-CG 3.45Å; W238-L242 PolarHBondContact O-N 3.5Å; L239-L242 PolarHBondContact O-N 2.04Å; G240-L242 VanDerWaalsContact C-N 3.35Å; G240-L242 PolarHBondContact O-N 3.41Å; L242-G244 VanDerWaalsContact C-N 3.32Å; L242-G244 PolarHBondContact O-N 2.91Å; L242-M246 WeakPolarHBondContact O-CB 3.29Å; L242-M246 WeakPolarHBondContact O-CG 3.44Å; L242-M246 PolarHBondContact O-N 2.85Å
243L98.3Very high96.5Very high83 Ų8334.7 Ų34.744%0.43518%0.179SC..Hα-helixtrans-63.1-40.5178.7-70178.6000111.5L169 L239 G240 S247L169-L243 HydrophobicContact CD1-CB 3.74Å; L169-L243 HydrophobicContact CD1-CD1 4.35Å; L169-L243 HydrophobicContact CG-CB 4.26Å; L239-L243 HydrophobicContact CD1-CD1 3.85Å; L239-L243 HydrophobicContact CD1-CG 4Å; L239-L243 HydrophobicContact CG-CD1 3.82Å; L239-L243 HydrophobicContact CG-CG 4.31Å; L239-L243 WeakPolarHBondContact O-CB 3.22Å; L239-L243 VanDerWaalsContact O-CG 3.27Å; L239-L243 WeakPolarHBondContact O-CG 3.29Å; L239-L243 PolarHBondContact O-N 3.35Å; G240-L243 PolarHBondContact O-N 2.65Å; L243-S247 WeakPolarHBondContact O-CB 3.3Å; L243-S247 PolarHBondContact O-N 2.93Å; L243-S247 PolarHBondContact O-OG 2.81Å
244G98.3Very high96.1Very high0 Ų042.2 Ų42.20%021%0.211CC..Hα-helixtrans-64.1-49.4179.600000112L169 F173 G240 L242 S247 S248L169-G244 WeakPolarHBondContact O-CA 3.25Å; F173-G244 WeakPolarHBondContact CA-O 3.45Å; G240-G244 PolarHBondContact O-N 3.13Å; L242-G244 VanDerWaalsContact C-N 3.32Å; L242-G244 PolarHBondContact O-N 2.91Å; G244-S247 PolarHBondContact O-N 3.4Å; G244-S248 PolarHBondContact O-N 3.26Å; G244-S248 VanDerWaalsContact O-N 3.09Å
245M97.6Very high95.5Very high3 Ų344 Ų442%0.01522%0.219CC..Hα-helixtrans-59.3-51176.2178.8-76.3-6600111.2C97 E101 Q176 P241 S247 S248 V249C97-M245 HydrophobicContact CB-CB 4.2Å; C97-M245 HydrophobicContact CB-CE 4.25Å; C97-M245 HydrophobicContact CB-CG 4.2Å; C97-M245 VanDerWaalsContact O-CE 3.24Å; C97-M245 WeakPolarHBondContact O-CE 3.46Å; E101-M245 HydrophobicContact CB-CE 4.24Å; E101-M245 HydrophobicContact CB-CG 4.46Å; E101-M245 HydrophobicContact CB-SD 3.58Å; E101-M245 VanDerWaalsContact CB-SD 3.58Å; E101-M245 HydrophobicContact CG-SD 3.75Å; Q176-M245 HydrophobicContact CB-CG 4.38Å; Q176-M245 HydrophobicContact CG-CB 4.45Å; Q176-M245 HydrophobicContact CG-CG 3.87Å; P241-M245 VanDerWaalsContact O-CB 3.29Å; P241-M245 WeakPolarHBondContact O-CB 3.36Å; P241-M245 PolarHBondContact O-N 3.46Å; M245-S247 VanDerWaalsContact C-N 3.33Å; M245-S247 PolarHBondContact O-N 3.4Å; M245-S248 WeakPolarHBondContact O-CB 3.45Å; M245-S248 PolarHBondContact O-N 2.88Å; M245-V249 WeakPolarHBondContact O-CG2 3.49Å; M245-V249 PolarHBondContact O-N 2.62Å; M245-V249 HydrophobicContact SD-CG2 3.82Å
246M96.8Very high94.7Very high55 Ų5544.1 Ų44.127%0.27123%0.226SC..Hα-helixtrans-62.9-39.5-179.4-72.4-54.8-58.800112.1Y104 L242 S248 V249 L250Y104-M246 HydrophobicContact CD1-CE 4.5Å; Y104-M246 HydrophobicContact CD2-CE 4.16Å; Y104-M246 HydrophobicContact CE2-CE 4.35Å; Y104-M246 HydrophobicContact CG-CE 4.24Å; L242-M246 WeakPolarHBondContact O-CB 3.29Å; L242-M246 WeakPolarHBondContact O-CG 3.44Å; L242-M246 PolarHBondContact O-N 2.85Å; M246-S248 VanDerWaalsContact C-N 3.31Å; M246-S248 PolarHBondContact O-N 3.3Å; M246-V249 PolarHBondContact O-N 3.12Å; M246-L250 WeakPolarHBondContact O-CB 3.47Å; M246-L250 VanDerWaalsContact O-CG 3.26Å; M246-L250 WeakPolarHBondContact O-CG 3.44Å; M246-L250 PolarHBondContact O-N 3.04Å
247S97.5Very high93.8Very high56 Ų5648.7 Ų48.739%0.39225%0.254SS..Hα-helixtrans-61.2-41.2177.1-61.50000111.6L243 G244 M245 L251L243-S247 WeakPolarHBondContact O-CB 3.3Å; L243-S247 PolarHBondContact O-N 2.93Å; L243-S247 PolarHBondContact O-OG 2.81Å; G244-S247 PolarHBondContact O-N 3.4Å; M245-S247 VanDerWaalsContact C-N 3.33Å; M245-S247 PolarHBondContact O-N 3.4Å; S247-L251 VanDerWaalsContact O-CB 3.24Å; S247-L251 WeakPolarHBondContact O-CB 3.28Å; S247-L251 PolarHBondContact O-N 3.43Å
248S96.8Very high92.8Very high0 Ų051.1 Ų51.10%027%0.274CS..Hα-helixtrans-63-51.9175.2179.80000111T177 G244 M245 M246 L250 L251 F252T177-S248 VanDerWaalsContact CA-OG 3.31Å; T177-S248 WeakPolarHBondContact CA-OG 3.46Å; T177-S248 PolarHBondContact N-OG 3.43Å; T177-S248 PolarHBondContact OG1-OG 3.21Å; G244-S248 PolarHBondContact O-N 3.26Å; G244-S248 VanDerWaalsContact O-N 3.09Å; M245-S248 WeakPolarHBondContact O-CB 3.45Å; M245-S248 PolarHBondContact O-N 2.88Å; M246-S248 VanDerWaalsContact C-N 3.31Å; M246-S248 PolarHBondContact O-N 3.3Å; S248-L250 PolarHBondContact O-N 3.47Å; S248-L251 PolarHBondContact O-N 3.21Å; S248-F252 WeakPolarHBondContact O-CD2 3.37Å; S248-F252 PolarHBondContact O-N 2.95Å; S248-F252 VanDerWaalsContact O-N 3.07Å
249V94.3Very high91.8Very high0 Ų053.9 Ų53.90%029%0.288CS..Hα-helixtrans-55.3-51.8179.9169.10000111.6E101 Y104 Q176 M245 M246 L251 F252 D253E101-V249 HydrophobicContact CG-CG2 3.5Å; E101-V249 VanDerWaalsContact CG-CG2 3.5Å; Y104-V249 HydrophobicContact CD1-CG1 3.74Å; Y104-V249 HydrophobicContact CE1-CG1 3.52Å; Q176-V249 HydrophobicContact CG-CG2 4.18Å; M245-V249 WeakPolarHBondContact O-CG2 3.49Å; M245-V249 PolarHBondContact O-N 2.62Å; M245-V249 HydrophobicContact SD-CG2 3.82Å; M246-V249 PolarHBondContact O-N 3.12Å; V249-L251 PolarHBondContact O-N 2.96Å; V249-F252 PolarHBondContact O-N 3.38Å; V249-D253 WeakPolarHBondContact O-CB 3.15Å; V249-D253 PolarHBondContact O-N 2.82Å
250L93.9Very high90.6Very high77 Ų7754.3 Ų54.340%0.40330%0.297SS..Hα-helixtrans-65.5-37.6-177.4-68.1173.9000112.5Y104 M246 S248 K254Y104-L250 VanDerWaalsContact OH-CD2 3.31Å; Y104-L250 WeakPolarHBondContact OH-CD2 3.31Å; M246-L250 WeakPolarHBondContact O-CB 3.47Å; M246-L250 VanDerWaalsContact O-CG 3.26Å; M246-L250 WeakPolarHBondContact O-CG 3.44Å; M246-L250 PolarHBondContact O-N 3.04Å; S248-L250 PolarHBondContact O-N 3.47Å; L250-K254 WeakPolarHBondContact O-CB 3.33Å; L250-K254 WeakPolarHBondContact O-CG 3.39Å; L250-K254 PolarHBondContact O-N 2.98Å; L250-K254 VanDerWaalsContact O-N 3.12Å
251L93.9Very high89.1Confident78 Ų7864.5 Ų64.541%0.40834%0.335SS..Hα-helixtrans-61.7-49.9176.517861.7000110.7F173 S247 S248 V249 K254 L255F173-L251 HydrophobicContact CE2-CD2 4.22Å; F173-L251 HydrophobicContact CZ-CD2 3.92Å; S247-L251 VanDerWaalsContact O-CB 3.24Å; S247-L251 WeakPolarHBondContact O-CB 3.28Å; S247-L251 PolarHBondContact O-N 3.43Å; S248-L251 PolarHBondContact O-N 3.21Å; V249-L251 PolarHBondContact O-N 2.96Å; L251-K254 PolarHBondContact O-N 3.02Å; L251-L255 HydrophobicContact CD1-CD1 4.2Å; L251-L255 HydrophobicContact CD1-CG 4.41Å; L251-L255 HydrophobicContact CG-CD1 4.09Å; L251-L255 VanDerWaalsContact O-CG 3.29Å; L251-L255 WeakPolarHBondContact O-CG 3.3Å; L251-L255 PolarHBondContact O-N 3.2Å
252F89.5Confident87.2Confident31 Ų3173.1 Ų73.114%0.13637%0.373CS..Hα-helixtrans-74.3-30.2-177.1-72.5-68.1000113.7T177 T180 Q181 S248 V249 L255 T256T177-F252 HydrophobicContact CG2-CD2 4.49Å; T177-F252 HydrophobicContact CG2-CE2 3.36Å; T177-F252 HydrophobicContact CG2-CZ 3.47Å; T177-F252 VanDerWaalsContact CG2-CZ 3.47Å; T180-F252 HydrophobicContact CG2-CB 4.15Å; T180-F252 HydrophobicContact CG2-CG 4.48Å; Q181-F252 HydrophobicContact CG-CE1 4.36Å; Q181-F252 HydrophobicContact CG-CZ 4.43Å; S248-F252 WeakPolarHBondContact O-CD2 3.37Å; S248-F252 PolarHBondContact O-N 2.95Å; S248-F252 VanDerWaalsContact O-N 3.07Å; V249-F252 PolarHBondContact O-N 3.38Å; F252-L255 HydrophobicContact CD1-CD1 3.94Å; F252-L255 HydrophobicContact CE1-CD1 4.06Å; F252-L255 PolarHBondContact O-N 3.38Å; F252-T256 WeakPolarHBondContact O-CB 3.46Å; F252-T256 VanDerWaalsContact O-CG2 3.3Å; F252-T256 WeakPolarHBondContact O-CG2 3.49Å; F252-T256 PolarHBondContact O-N 2.91Å; F252-T256 PolarHBondContact O-OG1 3.41Å
253D88Confident85.2Confident37 Ų3775.5 Ų75.520%0.19839%0.393CS..Hα-helixtrans-64.2-41.4171.6-72.8-2.5000111.4R105 V249 T256 T257R105-D253 IonicContact CZ-OD1 2.87Å; R105-D253 IonicContact NH1-OD1 3.58Å; R105-D253 PolarHBondContact NH1-OD1 3.26Å; R105-D253 IonicContact NH1-OD2 3.67Å; R105-D253 IonicContact NH2-OD1 3.36Å; R105-D253 PolarHBondContact NH2-OD1 3.32Å; R105-D253 IonicContact NH2-OD2 3.43Å; V249-D253 WeakPolarHBondContact O-CB 3.15Å; V249-D253 PolarHBondContact O-N 2.82Å; D253-T256 WeakPolarHBondContact CA-OG1 3.46Å; D253-T256 PolarHBondContact O-OG1 3.35Å; D253-T257 WeakPolarHBondContact O-CB 3.47Å; D253-T257 PolarHBondContact O-N 3.02Å; D253-T257 VanDerWaalsContact O-N 3.14Å; D253-T257 PolarHBondContact O-OG1 3Å
254K88Confident82.5Confident161 Ų16176 Ų7670%0.740%0.404SS*.Hα-helixtrans-65.6-44.7173.9-75.7-172.3179.5-172.60112.2L250 L251 T257 A258L250-K254 WeakPolarHBondContact O-CB 3.33Å; L250-K254 WeakPolarHBondContact O-CG 3.39Å; L250-K254 PolarHBondContact O-N 2.98Å; L250-K254 VanDerWaalsContact O-N 3.12Å; L251-K254 PolarHBondContact O-N 3.02Å; K254-T257 PolarHBondContact O-N 3.41Å; K254-A258 WeakPolarHBondContact O-CB 3.5Å; K254-A258 PolarHBondContact O-N 3.24Å
255L86.2Confident80.1Confident68 Ų6881.6 Ų81.636%0.35644%0.44SS..Hα-helixtrans-62.5-47.4179.7-71.7172.9000111.5L251 F252 T257 A258 F259L251-L255 HydrophobicContact CD1-CD1 4.2Å; L251-L255 HydrophobicContact CD1-CG 4.41Å; L251-L255 HydrophobicContact CG-CD1 4.09Å; L251-L255 VanDerWaalsContact O-CG 3.29Å; L251-L255 WeakPolarHBondContact O-CG 3.3Å; L251-L255 PolarHBondContact O-N 3.2Å; F252-L255 HydrophobicContact CD1-CD1 3.94Å; F252-L255 HydrophobicContact CE1-CD1 4.06Å; F252-L255 PolarHBondContact O-N 3.38Å; L255-T257 PolarHBondContact O-N 2.65Å; L255-A258 PolarHBondContact O-N 2.86Å; L255-F259 HydrophobicContact CB-CD2 4.44Å; L255-F259 HydrophobicContact CB-CE2 4.29Å; L255-F259 HydrophobicContact CD2-CE2 4.46Å; L255-F259 WeakPolarHBondContact O-CD2 3.49Å; L255-F259 PolarHBondContact O-N 3.27Å
256T82.3Confident77.5Confident84 Ų8489.5 Ų89.552%0.51548%0.482SS..Hα-helixtrans-60.8-42.8178.5490000112.1F252 D253 F259 S260F252-T256 WeakPolarHBondContact O-CB 3.46Å; F252-T256 VanDerWaalsContact O-CG2 3.3Å; F252-T256 WeakPolarHBondContact O-CG2 3.49Å; F252-T256 PolarHBondContact O-N 2.91Å; F252-T256 PolarHBondContact O-OG1 3.41Å; D253-T256 WeakPolarHBondContact CA-OG1 3.46Å; D253-T256 PolarHBondContact O-OG1 3.35Å; T256-F259 PolarHBondContact O-N 2.95Å; T256-S260 WeakPolarHBondContact O-CB 3.32Å; T256-S260 PolarHBondContact O-N 2.93Å
257T79.6Confident75.1Confident96 Ų9695.8 Ų95.859%0.58951%0.51SS*.Hα-helixtrans-64.2-41.6175.1-60.40000111.7D253 K254 L255 S260 R261D253-T257 WeakPolarHBondContact O-CB 3.47Å; D253-T257 PolarHBondContact O-N 3.02Å; D253-T257 VanDerWaalsContact O-N 3.14Å; D253-T257 PolarHBondContact O-OG1 3Å; K254-T257 PolarHBondContact O-N 3.41Å; L255-T257 PolarHBondContact O-N 2.65Å; T257-S260 PolarHBondContact O-N 3.43Å; T257-R261 WeakPolarHBondContact O-CB 3.34Å; T257-R261 PolarHBondContact O-N 3.39Å
258A77.6Confident72.8Confident50 Ų50100.7 Ų100.741%0.41353%0.531SS..Hα-helixtrans-64.4-40.7178.200000112.6K254 L255 K262K254-A258 WeakPolarHBondContact O-CB 3.5Å; K254-A258 PolarHBondContact O-N 3.24Å; L255-A258 PolarHBondContact O-N 2.86Å; A258-K262 PolarHBondContact O-N 3.37Å
259F75.7Confident70.1Confident130 Ų130106 Ų10657%0.5757%0.565SS**Hα-helixtrans-68.4-43.9174.7-73.2-63.2000111.6L255 T256 R261 K262 S263L255-F259 HydrophobicContact CB-CD2 4.44Å; L255-F259 HydrophobicContact CB-CE2 4.29Å; L255-F259 HydrophobicContact CD2-CE2 4.46Å; L255-F259 WeakPolarHBondContact O-CD2 3.49Å; L255-F259 PolarHBondContact O-N 3.27Å; T256-F259 PolarHBondContact O-N 2.95Å; F259-R261 VanDerWaalsContact C-N 3.29Å; F259-R261 PolarHBondContact O-N 3.31Å; F259-K262 PolarHBondContact O-N 3.33Å; F259-K262 VanDerWaalsContact O-N 3.08Å; F259-S263 PolarHBondContact O-N 3.43Å; F259-S263 PolarHBondContact O-OG 3.38Å; F259-S263 VanDerWaalsContact O-OG 3.05Å
260S74.3Confident67.6Low84 Ų84115.2 Ų115.259%0.58761%0.608SS**Hα-helixtrans-62.1-35.1178.7-158.40000112.7T256 T257 K262 S263T256-S260 WeakPolarHBondContact O-CB 3.32Å; T256-S260 PolarHBondContact O-N 2.93Å; T257-S260 PolarHBondContact O-N 3.43Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 2.9Å; S260-S263 PolarHBondContact O-N 3.48Å
261R65.2Low65.1Low217 Ų217123 Ų12382%0.81963%0.632SS**Hα-helixtrans-69.3-28.3176.1-170.8175.2178.4178.30.2113.2T257 F259 S263T257-R261 WeakPolarHBondContact O-CB 3.34Å; T257-R261 PolarHBondContact O-N 3.39Å; F259-R261 VanDerWaalsContact C-N 3.29Å; F259-R261 PolarHBondContact O-N 3.31Å; R261-S263 VanDerWaalsContact C-N 3.33Å
262K60.1Low62.6Low180 Ų180125.8 Ų125.878%0.78365%0.653SS**Hα-helixtrans-78.5-17.1176-74.2-179179.2-1790113A258 F259 S260A258-K262 PolarHBondContact O-N 3.37Å; F259-K262 PolarHBondContact O-N 3.33Å; F259-K262 VanDerWaalsContact O-N 3.08Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 2.9Å
263S55.6Low60.3Low95 Ų95134 Ų13466%0.66469%0.688SS**THydrogen-bonded Turntrans-93.31.8-175.1-52.30000115.3F259 S260 R261F259-S263 PolarHBondContact O-N 3.43Å; F259-S263 PolarHBondContact O-OG 3.38Å; F259-S263 VanDerWaalsContact O-OG 3.05Å; S260-S263 PolarHBondContact O-N 3.48Å; R261-S263 VanDerWaalsContact C-N 3.33Å
264S40.3Very low58.2Low94 Ų94142 Ų14266%0.65772%0.721SS**SBendtrans-65.9133175-70.40000111.1
265P48.6Very low55.9Low117 Ų117143.7 Ų143.776%0.7673%0.732SS**  trans-74141.3-164.628.2-33.2000112.8H267P265-H267 PolarHBondContact O-N 3.25Å; P265-H267 VanDerWaalsContact O-N 3.12Å
266L43.8Very low54Low170 Ų170148.8 Ų148.889%0.8978%0.784SS**  trans-53.2115.5158.7-98.1104.5000108.3L268L266-L268 PolarHBondContact O-N 2.87Å
267H45.1Very low52.5Low187 Ų187152.1 Ų152.187%0.86680%0.797SS**  trans-56.6106.3163.5-102.7-75000108.4P265 P269P265-H267 PolarHBondContact O-N 3.25Å; P265-H267 VanDerWaalsContact O-N 3.12Å; H267-P269 WeakPolarHBondContact O-CD 3.18Å
268L49.7Very low51.1Low158 Ų158155 Ų15583%0.82781%0.808SS**  trans-77.5117.9165.6-155.679.3000107.1L266 Q270L266-L268 PolarHBondContact O-N 2.87Å; L268-Q270 PolarHBondContact O-N 2.91Å
269P40.5Very low49.6Very low112 Ų112160.8 Ų160.873%0.72783%0.83SS**  trans-65.4128.7-179.123.2-29.7000110.4H267 R271H267-P269 WeakPolarHBondContact O-CD 3.18Å; P269-R271 PolarHBondContact O-N 3.48Å
270Q41.4Very low48.1Very low193 Ų193162.6 Ų162.690%0.90285%0.845SS**  trans-57.2115.6173.7-118.2175.4-1800109.4L268 T272L268-Q270 PolarHBondContact O-N 2.91Å; Q270-T272 PolarHBondContact O-N 3.32Å; Q270-T272 VanDerWaalsContact O-N 3.16Å
271R41Very low46.5Very low242 Ų242167.6 Ų167.691%0.91386%0.861SS**  trans-73103.6175.1-153.4-179-169.8-170.13.2108.4P269 K273P269-R271 PolarHBondContact O-N 3.48Å; R271-K273 PolarHBondContact O-N 3.04Å; R271-K273 VanDerWaalsContact O-N 3.1Å
272T42.1Very low45.2Very low136 Ų136164.3 Ų164.383%0.83486%0.864SS**  trans-60.9107.2170.4100000109.4Q270 K274Q270-T272 PolarHBondContact O-N 3.32Å; Q270-T272 VanDerWaalsContact O-N 3.16Å; T272-K274 PolarHBondContact O-N 2.99Å
273K42.1Very low44.2Very low203 Ų203163.1 Ų163.188%0.88387%0.87SS**  trans-74.5109.4163.6-85.1-175.5174.9-178.90107.9R271 Q275R271-K273 PolarHBondContact O-N 3.04Å; R271-K273 VanDerWaalsContact O-N 3.1Å; K273-Q275 PolarHBondContact O-N 2.83Å
274K42.6Very low43.3Very low204 Ų204168.4 Ų168.489%0.88789%0.886SS**  trans-62.6125.4160.9-83.2-179.7172.1-179.40108.4T272T272-K274 PolarHBondContact O-N 2.99Å
275Q40.8Very low43.5Very low198 Ų198174.6 Ų174.693%0.92591%0.905SS**  trans-71.6133.4160.6-77.8172.4-42.700108.3K273K273-Q275 PolarHBondContact O-N 2.83Å
276A44.8Very low43.1Very low175 Ų175179.8 Ų179.8100%1.44692%0.918SS**  trans-119.9015900000106.5

Retrieved 276 of 276 residues in 929.8 ms (Link to these results)

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