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Coatomer subunit epsilon

The coatomer is a cytosolic protein complex that binds to dilysine motifs and reversibly associates with Golgi non-clathrin-coated vesicles, which further mediate biosynthetic protein transport from the ER, via the Golgi up to the trans Golgi network. The coatomer complex is required for budding from Golgi membranes, and is essential for the retrograde Golgi-to-ER transport of dilysine-tagged proteins.

AlphaFold DB , UniProt , Accession A0A077ZBE0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 302 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
1M41.2Very low44.6Very low211 Ų211103.1 Ų103.1100%1.03956%0.563SS**  0-32.10-74.7-174.9168.200112.7S3 S4 A5M1-S3 PolarHBondContact O-N 2.9Å; M1-S4 PolarHBondContact O-N 3.02Å; M1-S4 PolarHBondContact O-OG 3.39Å; M1-A5 PolarHBondContact O-N 2.52Å
2S40.1Very low46.6Very low94 Ų94102.3 Ų102.366%0.65756%0.558SS**Hα-helixtrans-55.9-46.1177.8-1530000114.2S4 A5 D6S2-S4 VanDerWaalsContact C-N 3.28Å; S2-S4 PolarHBondContact O-N 2.78Å; S2-A5 PolarHBondContact O-N 2.95Å; S2-D6 PolarHBondContact O-N 3.39Å; S2-D6 VanDerWaalsContact O-N 3.12Å
3S40.8Very low49.3Very low85 Ų8594.7 Ų94.759%0.59452%0.516SS*.Hα-helixtrans-68.3-23-175.569.40000114.9M1 K7M1-S3 PolarHBondContact O-N 2.9Å; S3-K7 WeakPolarHBondContact O-CG 3.24Å; S3-K7 PolarHBondContact O-N 3.44Å
4S38.9Very low51.8Low61 Ų6196.8 Ų96.843%0.42752%0.518SS..Hα-helixtrans-81.1-30.6178.2-150000111.4M1 S2 R8M1-S4 PolarHBondContact O-N 3.02Å; M1-S4 PolarHBondContact O-OG 3.39Å; S2-S4 VanDerWaalsContact C-N 3.28Å; S2-S4 PolarHBondContact O-N 2.78Å; S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.24Å
5A41.9Very low54.2Low45 Ų4592.1 Ų92.137%0.37250%0.502SS..Hα-helixtrans-74.2-47.1176.400000110.6M1 S2 K7 R8 T9M1-A5 PolarHBondContact O-N 2.52Å; S2-A5 PolarHBondContact O-N 2.95Å; A5-K7 VanDerWaalsContact C-N 3.32Å; A5-K7 PolarHBondContact O-N 3.21Å; A5-R8 PolarHBondContact O-N 3.1Å; A5-R8 VanDerWaalsContact O-N 3.14Å; A5-T9 PolarHBondContact O-N 3.27Å; A5-T9 PolarHBondContact O-OG1 3.35Å; A5-T9 VanDerWaalsContact O-OG1 3.11Å
6D39.3Very low56.5Low104 Ų10486.4 Ų86.456%0.55647%0.471SS*.Hα-helixtrans-59.4-39.8177.8-89.5-23.7000112.9S2 T9 S10S2-D6 PolarHBondContact O-N 3.39Å; S2-D6 VanDerWaalsContact O-N 3.12Å; D6-T9 VanDerWaalsContact CA-OG1 3.31Å; D6-T9 WeakPolarHBondContact CA-OG1 3.11Å; D6-T9 PolarHBondContact O-N 3.13Å; D6-T9 PolarHBondContact O-OG1 3.45Å; D6-S10 WeakPolarHBondContact O-CB 3.35Å; D6-S10 PolarHBondContact O-N 2.84Å
7K41.7Very low58.5Low153 Ų15385.2 Ų85.267%0.66546%0.46SS*.Hα-helixtrans-65.3-42.5176-77.8-172.7175.8-166.30112.2S3 A5 S10 D11S3-K7 WeakPolarHBondContact O-CG 3.24Å; S3-K7 PolarHBondContact O-N 3.44Å; A5-K7 VanDerWaalsContact C-N 3.32Å; A5-K7 PolarHBondContact O-N 3.21Å; K7-S10 PolarHBondContact O-N 2.73Å; K7-D11 PolarHBondContact O-N 3.3Å
8R42.2Very low60.4Low177 Ų17781.3 Ų81.367%0.66844%0.439SS*.Hα-helixtrans-66.1-40.7177.5-74.3179.3-165.9-177.63.3111.8S4 A5 D11 D12S4-R8 WeakPolarHBondContact O-CG 3.44Å; S4-R8 PolarHBondContact O-N 3.24Å; A5-R8 PolarHBondContact O-N 3.1Å; A5-R8 VanDerWaalsContact O-N 3.14Å; R8-D11 PolarHBondContact O-N 2.73Å; R8-D12 VanDerWaalsContact O-CB 3.3Å; R8-D12 WeakPolarHBondContact O-CB 3.31Å; R8-D12 PolarHBondContact O-N 2.95Å
9T48.7Very low62.1Low19 Ų1977.2 Ų77.212%0.11742%0.418CS..Hα-helixtrans-66.3-40176.2460000111.6A5 D6 D11 D12 L13 A42A5-T9 PolarHBondContact O-N 3.27Å; A5-T9 PolarHBondContact O-OG1 3.35Å; A5-T9 VanDerWaalsContact O-OG1 3.11Å; D6-T9 VanDerWaalsContact CA-OG1 3.31Å; D6-T9 WeakPolarHBondContact CA-OG1 3.11Å; D6-T9 PolarHBondContact O-N 3.13Å; D6-T9 PolarHBondContact O-OG1 3.45Å; T9-D11 VanDerWaalsContact C-N 3.33Å; T9-D11 PolarHBondContact O-N 3.5Å; T9-D12 PolarHBondContact O-N 3.39Å; T9-L13 WeakPolarHBondContact O-CB 3.49Å; T9-L13 WeakPolarHBondContact O-CD1 3.45Å; T9-L13 PolarHBondContact O-N 3.3Å; T9-A42 HydrophobicContact CG2-CB 3.95Å
10S55.3Low63.8Low67 Ų6774.6 Ų74.647%0.46940%0.402SS..Hα-helixtrans-59.4-43.6173.4-1760000112D6 K7 F14D6-S10 WeakPolarHBondContact O-CB 3.35Å; D6-S10 PolarHBondContact O-N 2.84Å; K7-S10 PolarHBondContact O-N 2.73Å; S10-F14 PolarHBondContact O-N 3.16Å
11D61Low65.3Low118 Ų11872 Ų7263%0.63139%0.388SS*.Hα-helixtrans-67.9-39.8175.9-72.5-11.7000111.7K7 R8 T9 L13 F14K7-D11 PolarHBondContact O-N 3.3Å; R8-D11 PolarHBondContact O-N 2.73Å; T9-D11 VanDerWaalsContact C-N 3.33Å; T9-D11 PolarHBondContact O-N 3.5Å; D11-L13 VanDerWaalsContact C-N 3.35Å; D11-L13 PolarHBondContact O-N 3.43Å; D11-F14 WeakPolarHBondContact O-CB 3.34Å; D11-F14 PolarHBondContact O-N 3.17Å
12D68.1Low67.8Low93 Ų9362.2 Ų62.250%0.49734%0.339SS..Hα-helixtrans-66.2-36.4-180-72.5-20000111.8R8 T9 F14 L35R8-D12 VanDerWaalsContact O-CB 3.3Å; R8-D12 WeakPolarHBondContact O-CB 3.31Å; R8-D12 PolarHBondContact O-N 2.95Å; T9-D12 PolarHBondContact O-N 3.39Å; D12-F14 VanDerWaalsContact C-N 3.31Å; D12-L35 HydrophobicContact CB-CD1 4.44Å; D12-L35 HydrophobicContact CB-CD2 3.91Å
13L81.4Confident70.3Confident4 Ų458.3 Ų58.32%0.02131%0.314CS..Hα-helixtrans-79.7-11.1177-85.5138.9000113.2T9 D11 G15 V16 K17 L35 E45 Y49T9-L13 WeakPolarHBondContact O-CB 3.49Å; T9-L13 WeakPolarHBondContact O-CD1 3.45Å; T9-L13 PolarHBondContact O-N 3.3Å; D11-L13 VanDerWaalsContact C-N 3.35Å; D11-L13 PolarHBondContact O-N 3.43Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 3.45Å; L13-V16 PolarHBondContact O-N 3.41Å; L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 VanDerWaalsContact O-CG 3.31Å; L13-K17 WeakPolarHBondContact O-CG 3.45Å; L13-K17 PolarHBondContact O-N 3.48Å; L13-L35 HydrophobicContact CG-CD1 4.32Å; L13-E45 HydrophobicContact CD1-CB 4.23Å; L13-E45 WeakPolarHBondContact CD1-OE2 3.48Å; L13-E45 HydrophobicContact CD2-CB 4.46Å; L13-Y49 HydrophobicContact CD2-CD2 4.25Å
14F85Confident72.9Confident124 Ų12455.6 Ų55.654%0.54430%0.295SS..Hα-helixtrans-58.4-45.3-179.7-177.4-103.5000112.1S10 D11 D12 K17 N18S10-F14 PolarHBondContact O-N 3.16Å; D11-F14 WeakPolarHBondContact O-CB 3.34Å; D11-F14 PolarHBondContact O-N 3.17Å; D12-F14 VanDerWaalsContact C-N 3.31Å; F14-K17 PolarHBondContact O-N 3.29Å; F14-N18 WeakPolarHBondContact CD1-ND2 3.41Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.39Å; F14-N18 WeakPolarHBondContact CZ-ND2 3.42Å; F14-N18 WeakPolarHBondContact O-CB 3.45Å; F14-N18 VanDerWaalsContact O-CG 3.32Å; F14-N18 PolarHBondContact O-N 3.36Å; F14-N18 PolarHBondContact O-ND2 3.06Å
15G86.9Confident75.6Confident27 Ų2755.7 Ų55.728%0.27829%0.287SS..Hα-helixtrans-60.7-45.8175.900000112.4L13 K17 N18 A19 E31L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 3.45Å; G15-K17 PolarHBondContact O-N 3.15Å; G15-N18 PolarHBondContact O-N 2.87Å; G15-A19 WeakPolarHBondContact O-CB 3.46Å; G15-A19 PolarHBondContact O-N 2.89Å; G15-E31 WeakPolarHBondContact CA-OE2 3.25Å
16V91.3Very high78.1Confident1 Ų158.4 Ų58.41%0.00629%0.292CS..Hα-helixtrans-60.1-47.5178.51790000111.6L13 A19 F20 E31 A32 L35 Y49L13-V16 PolarHBondContact O-N 3.41Å; V16-A19 PolarHBondContact O-N 3.46Å; V16-F20 WeakPolarHBondContact O-CB 3.41Å; V16-F20 PolarHBondContact O-N 2.96Å; V16-E31 HydrophobicContact CG2-CB 4.03Å; V16-A32 HydrophobicContact CG1-CB 3.88Å; V16-A32 HydrophobicContact CG2-CB 3.96Å; V16-L35 HydrophobicContact CG2-CD1 3.9Å; V16-Y49 HydrophobicContact CG1-CG 4.06Å
17K91.2Very high80.6Confident65 Ų6557.4 Ų57.428%0.28328%0.284SS..Hα-helixtrans-61.4-49.3178.7-72.5179.7179.8179.20111.1L13 F14 G15 A19 F20 H21 Y49L13-K17 WeakPolarHBondContact O-CB 3.28Å; L13-K17 VanDerWaalsContact O-CG 3.31Å; L13-K17 WeakPolarHBondContact O-CG 3.45Å; L13-K17 PolarHBondContact O-N 3.48Å; F14-K17 PolarHBondContact O-N 3.29Å; G15-K17 PolarHBondContact O-N 3.15Å; K17-A19 PolarHBondContact O-N 3.24Å; K17-F20 WeakPolarHBondContact O-CB 3.43Å; K17-F20 PolarHBondContact O-N 3.49Å; K17-F20 VanDerWaalsContact O-N 3.16Å; K17-H21 PolarHBondContact O-CD2 3.19Å; K17-H21 VanDerWaalsContact O-CG 3.3Å; K17-H21 PolarHBondContact O-N 2.71Å; K17-Y49 HydrophobicContact CG-CE1 4.07Å; K17-Y49 HydrophobicContact CG-CE2 3.93Å
18N91.6Very high83.2Confident15 Ų1550.1 Ų50.18%0.0825%0.252CS..Hα-helixtrans-60.8-47.9179.2-73.8-14.2000111.6F14 G15 F20 H21 I22 L175F14-N18 WeakPolarHBondContact CD1-ND2 3.41Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.39Å; F14-N18 WeakPolarHBondContact CZ-ND2 3.42Å; F14-N18 WeakPolarHBondContact O-CB 3.45Å; F14-N18 VanDerWaalsContact O-CG 3.32Å; F14-N18 PolarHBondContact O-N 3.36Å; F14-N18 PolarHBondContact O-ND2 3.06Å; G15-N18 PolarHBondContact O-N 2.87Å; N18-F20 VanDerWaalsContact C-N 3.25Å; N18-F20 PolarHBondContact O-N 2.92Å; N18-H21 PolarHBondContact O-N 3.46Å; N18-I22 VanDerWaalsContact O-CG1 3.32Å; N18-I22 WeakPolarHBondContact O-CG1 3.39Å; N18-I22 PolarHBondContact O-N 3.36Å; N18-I22 VanDerWaalsContact O-N 3.08Å; N18-L175 HydrophobicContact CB-CD1 3.71Å
19A93.7Very high85.7Confident4 Ų441.9 Ų41.93%0.03322%0.221CC..Hα-helixtrans-59.2-37.4176.600000112G15 V16 K17 S24 Q27 C28G15-A19 WeakPolarHBondContact O-CB 3.46Å; G15-A19 PolarHBondContact O-N 2.89Å; V16-A19 PolarHBondContact O-N 3.46Å; K17-A19 PolarHBondContact O-N 3.24Å; A19-S24 CarbonylContact O-C 3.59Å; A19-S24 VanDerWaalsContact O-CA 3.31Å; A19-S24 WeakPolarHBondContact O-CA 3.42Å; A19-S24 WeakPolarHBondContact O-CB 3.34Å; A19-S24 PolarHBondContact O-N 2.92Å; A19-Q27 HydrophobicContact CB-CB 4.34Å; A19-Q27 HydrophobicContact CB-CG 4.21Å; A19-C28 HydrophobicContact CB-CB 3.86Å
20F95.5Very high87.8Confident24 Ų2444.9 Ų44.911%0.10524%0.24CC..Hα-helixtrans-65.9-51.1175-176.2-96.3000112.3V16 K17 N18 I22 G23 Y25 C28 Y49 R52 A53V16-F20 WeakPolarHBondContact O-CB 3.41Å; V16-F20 PolarHBondContact O-N 2.96Å; K17-F20 WeakPolarHBondContact O-CB 3.43Å; K17-F20 PolarHBondContact O-N 3.49Å; K17-F20 VanDerWaalsContact O-N 3.16Å; N18-F20 VanDerWaalsContact C-N 3.25Å; N18-F20 PolarHBondContact O-N 2.92Å; F20-I22 VanDerWaalsContact C-N 3.34Å; F20-I22 PolarHBondContact O-N 3.26Å; F20-G23 PolarHBondContact O-N 3.39Å; F20-Y25 AromaticContact CD2-CD1 3.99Å; F20-Y25 HydrophobicContact CD2-CD1 3.99Å; F20-Y25 HydrophobicContact CD2-CE1 4.1Å; F20-Y25 HydrophobicContact CE2-CD1 4.13Å; F20-Y25 AromaticContact CE2-CE1 4Å; F20-Y25 HydrophobicContact CE2-CE1 4Å; F20-C28 HydrophobicContact CB-CB 4.38Å; F20-Y49 HydrophobicContact CB-CD1 3.86Å; F20-Y49 HydrophobicContact CB-CE1 4.25Å; F20-Y49 HydrophobicContact CD1-CD1 4.07Å; F20-Y49 HydrophobicContact CD1-CE1 4.02Å; F20-Y49 HydrophobicContact CD2-CD1 4.22Å; F20-Y49 AromaticContact CG-CD1 3.76Å; F20-Y49 HydrophobicContact CG-CD1 3.76Å; F20-Y49 HydrophobicContact CG-CE1 4.15Å; F20-R52 HydrophobicContact CE2-CB 3.65Å; F20-R52 HydrophobicContact CZ-CB 3.86Å; F20-A53 HydrophobicContact CD2-CB 4.22Å; F20-A53 HydrophobicContact CE2-CB 4.43Å
21H94.5Very high89.5Confident21 Ų2144.8 Ų44.810%0.09723%0.232CC..Hα-helixtrans-64.1-37-175-65.3-44.4000113K17 N18 G23 E142 M179 L212K17-H21 PolarHBondContact O-CD2 3.19Å; K17-H21 VanDerWaalsContact O-CG 3.3Å; K17-H21 PolarHBondContact O-N 2.71Å; N18-H21 PolarHBondContact O-N 3.46Å; H21-G23 PolarHBondContact O-N 3.08Å; H21-E142 IonicContact CE1-OE1 2.68Å; H21-E142 PolarHBondContact CE1-OE1 3.33Å; H21-E142 VanDerWaalsContact CE1-OE1 3.24Å; H21-E142 IonicContact ND1-OE1 3.54Å; H21-M179 WeakPolarHBondContact O-CE 3.46Å; H21-L212 WeakPolarHBondContact O-CD2 3.31Å
22I93.9Very high91Very high5 Ų539.2 Ų39.23%0.02620%0.202CC..THydrogen-bonded Turntrans-78.5-2.1176.770.3-177.3000113.2N18 F20 L175 Y207 T210 L213N18-I22 VanDerWaalsContact O-CG1 3.32Å; N18-I22 WeakPolarHBondContact O-CG1 3.39Å; N18-I22 PolarHBondContact O-N 3.36Å; N18-I22 VanDerWaalsContact O-N 3.08Å; F20-I22 VanDerWaalsContact C-N 3.34Å; F20-I22 PolarHBondContact O-N 3.26Å; I22-L175 HydrophobicContact CG2-CD1 3.74Å; I22-Y207 HydrophobicContact CD1-CG 4.33Å; I22-T210 HydrophobicContact CG1-CG2 4.4Å; I22-T210 VanDerWaalsContact O-CB 3.28Å; I22-T210 WeakPolarHBondContact O-CB 3.43Å; I22-T210 VanDerWaalsContact O-CG2 3.28Å; I22-T210 WeakPolarHBondContact O-CG2 3.35Å; I22-T210 PolarHBondContact O-OG1 2.88Å; I22-L213 HydrophobicContact CB-CD1 4.17Å
23G94.1Very high92Very high13 Ų1339.4 Ų39.413%0.13420%0.202CC..THydrogen-bonded Turntrans81.412.8-178.900000115F20 H21 Y25F20-G23 PolarHBondContact O-N 3.39Å; H21-G23 PolarHBondContact O-N 3.08Å; G23-Y25 WeakPolarHBondContact O-CD2 3.29Å; G23-Y25 PolarHBondContact O-N 3.23Å
24S94.3Very high92.4Very high27 Ų2742.9 Ų42.919%0.18923%0.232CC..  trans-80.860.7172.2-165.10000110.5A19 Q26 Q27 C28A19-S24 CarbonylContact O-C 3.59Å; A19-S24 VanDerWaalsContact O-CA 3.31Å; A19-S24 WeakPolarHBondContact O-CA 3.42Å; A19-S24 WeakPolarHBondContact O-CB 3.34Å; A19-S24 PolarHBondContact O-N 2.92Å; S24-Q26 VanDerWaalsContact C-N 3.29Å; S24-Q26 PolarHBondContact O-N 3.31Å; S24-Q27 WeakPolarHBondContact O-CB 3.41Å; S24-Q27 PolarHBondContact O-N 3.15Å; S24-Q27 VanDerWaalsContact O-N 3.13Å; S24-Q27 WeakPolarHBondContact OG-CB 3.4Å; S24-Q27 PolarHBondContact OG-OE1 3.3Å; S24-C28 PolarHBondContact O-N 2.63Å
25Y95.4Very high92.5Very high64 Ų6439 Ų3925%0.25122%0.216SC..Hα-helixtrans-61.6-34.7-170.1-56.2-56.2000113.5F20 G23 C28 I29 A53 A56 Q57F20-Y25 AromaticContact CD2-CD1 3.99Å; F20-Y25 HydrophobicContact CD2-CD1 3.99Å; F20-Y25 HydrophobicContact CD2-CE1 4.1Å; F20-Y25 HydrophobicContact CE2-CD1 4.13Å; F20-Y25 AromaticContact CE2-CE1 4Å; F20-Y25 HydrophobicContact CE2-CE1 4Å; G23-Y25 WeakPolarHBondContact O-CD2 3.29Å; G23-Y25 PolarHBondContact O-N 3.23Å; Y25-C28 WeakPolarHBondContact O-CB 3.44Å; Y25-C28 PolarHBondContact O-N 2.97Å; Y25-I29 WeakPolarHBondContact O-CD1 3.39Å; Y25-I29 VanDerWaalsContact O-CG1 3.3Å; Y25-I29 WeakPolarHBondContact O-CG1 3.29Å; Y25-I29 PolarHBondContact O-N 2.94Å; Y25-A53 HydrophobicContact CD1-CB 4.35Å; Y25-A56 HydrophobicContact CD1-CB 3.77Å; Y25-A56 HydrophobicContact CD2-CB 3.8Å; Y25-A56 HydrophobicContact CE1-CB 3.59Å; Y25-A56 HydrophobicContact CE2-CB 3.6Å; Y25-A56 HydrophobicContact CG-CB 3.88Å; Y25-A56 VanDerWaalsContact CZ-CB 3.5Å; Y25-Q57 HydrophobicContact CD2-CG 4.47Å
26Q94.3Very high92.4Very high101 Ų10147.1 Ų47.147%0.47224%0.244SC..Hα-helixtrans-69.1-37.8178.8-171.55741.700111.9S24 T30S24-Q26 VanDerWaalsContact C-N 3.29Å; S24-Q26 PolarHBondContact O-N 3.31Å; Q26-T30 WeakPolarHBondContact O-CB 3.36Å; Q26-T30 PolarHBondContact O-N 3.05Å; Q26-T30 PolarHBondContact O-OG1 2.92Å
27Q93.5Very high91.9Very high84 Ų8449.2 Ų49.239%0.39326%0.257SS..Hα-helixtrans-67.8-44.7174.2-177.2178.6-500110.5A19 S24 I29 T30 E31A19-Q27 HydrophobicContact CB-CB 4.34Å; A19-Q27 HydrophobicContact CB-CG 4.21Å; S24-Q27 WeakPolarHBondContact O-CB 3.41Å; S24-Q27 PolarHBondContact O-N 3.15Å; S24-Q27 VanDerWaalsContact O-N 3.13Å; S24-Q27 WeakPolarHBondContact OG-CB 3.4Å; S24-Q27 PolarHBondContact OG-OE1 3.3Å; Q27-I29 VanDerWaalsContact C-N 3.34Å; Q27-I29 PolarHBondContact O-N 3.36Å; Q27-T30 PolarHBondContact O-N 3.44Å; Q27-T30 VanDerWaalsContact O-N 3.08Å; Q27-E31 HydrophobicContact CG-CG 4.24Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.43Å; Q27-E31 PolarHBondContact NE2-OE1 3.3Å; Q27-E31 WeakPolarHBondContact O-CB 3.45Å; Q27-E31 WeakPolarHBondContact O-CG 3.33Å; Q27-E31 PolarHBondContact O-N 3.38Å
28C94.5Very high91.5Very high0 Ų050.8 Ų50.80%028%0.277CS..Hα-helixtrans-52.1-50.2174.2169.50000111.7A19 F20 S24 Y25 T30 A32A19-C28 HydrophobicContact CB-CB 3.86Å; F20-C28 HydrophobicContact CB-CB 4.38Å; S24-C28 PolarHBondContact O-N 2.63Å; Y25-C28 WeakPolarHBondContact O-CB 3.44Å; Y25-C28 PolarHBondContact O-N 2.97Å; C28-T30 PolarHBondContact O-N 3.49Å; C28-A32 WeakPolarHBondContact O-CB 3.45Å; C28-A32 PolarHBondContact O-N 3.39Å
29I94.8Very high91.2Very high4 Ų452.2 Ų52.22%0.02129%0.288CS..Hα-helixtrans-61.2-44.6177.3-66.4160.7000111.1Y25 Q27 A32 L33 A53 Y54Y25-I29 WeakPolarHBondContact O-CD1 3.39Å; Y25-I29 VanDerWaalsContact O-CG1 3.3Å; Y25-I29 WeakPolarHBondContact O-CG1 3.29Å; Y25-I29 PolarHBondContact O-N 2.94Å; Q27-I29 VanDerWaalsContact C-N 3.34Å; Q27-I29 PolarHBondContact O-N 3.36Å; I29-A32 PolarHBondContact O-N 3.14Å; I29-L33 HydrophobicContact CG2-CD1 3.72Å; I29-L33 HydrophobicContact CG2-CG 4.26Å; I29-L33 WeakPolarHBondContact O-CB 3.35Å; I29-L33 VanDerWaalsContact O-CG 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.39Å; I29-L33 PolarHBondContact O-N 2.99Å; I29-A53 HydrophobicContact CD1-CB 3.89Å; I29-A53 HydrophobicContact CG1-CB 3.59Å; I29-Y54 HydrophobicContact CD1-CD1 3.68Å; I29-Y54 HydrophobicContact CD1-CE1 3.67Å; I29-Y54 HydrophobicContact CD1-CG 4.15Å; I29-Y54 HydrophobicContact CG2-CE1 4.4Å; I29-Y54 HydrophobicContact CG2-CE2 4.48Å
30T93.8Very high90.8Very high82 Ų8260.7 Ų60.750%0.50332%0.324SS..Hα-helixtrans-64.5-47.4-177.2-56.10000111.5Q26 Q27 C28 A34Q26-T30 WeakPolarHBondContact O-CB 3.36Å; Q26-T30 PolarHBondContact O-N 3.05Å; Q26-T30 PolarHBondContact O-OG1 2.92Å; Q27-T30 PolarHBondContact O-N 3.44Å; Q27-T30 VanDerWaalsContact O-N 3.08Å; C28-T30 PolarHBondContact O-N 3.49Å; T30-A34 WeakPolarHBondContact O-CB 3.3Å; T30-A34 PolarHBondContact O-N 3.18Å; T30-A34 VanDerWaalsContact O-N 3.13Å
31E91.6Very high90.3Very high65 Ų6565.7 Ų65.730%0.30435%0.348SS..Hα-helixtrans-64.7-45.9177.3-71.2-177.6-16400110.9G15 V16 Q27 L33 A34 L35G15-E31 WeakPolarHBondContact CA-OE2 3.25Å; V16-E31 HydrophobicContact CG2-CB 4.03Å; Q27-E31 HydrophobicContact CG-CG 4.24Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.43Å; Q27-E31 PolarHBondContact NE2-OE1 3.3Å; Q27-E31 WeakPolarHBondContact O-CB 3.45Å; Q27-E31 WeakPolarHBondContact O-CG 3.33Å; Q27-E31 PolarHBondContact O-N 3.38Å; E31-L33 PolarHBondContact O-N 3.02Å; E31-A34 WeakPolarHBondContact O-CB 3.43Å; E31-A34 PolarHBondContact O-N 2.96Å; E31-A34 VanDerWaalsContact O-N 3.13Å; E31-L35 WeakPolarHBondContact O-CG 3.39Å; E31-L35 PolarHBondContact O-N 2.96Å
32A91.4Very high89.9Confident0 Ų065 Ų650%035%0.345CS..Hα-helixtrans-60.6-44.8179.100000112V16 C28 I29 A34 L35 R46 V50V16-A32 HydrophobicContact CG1-CB 3.88Å; V16-A32 HydrophobicContact CG2-CB 3.96Å; C28-A32 WeakPolarHBondContact O-CB 3.45Å; C28-A32 PolarHBondContact O-N 3.39Å; I29-A32 PolarHBondContact O-N 3.14Å; A32-A34 VanDerWaalsContact C-N 3.27Å; A32-A34 PolarHBondContact O-N 2.71Å; A32-L35 WeakPolarHBondContact O-CB 3.48Å; A32-L35 PolarHBondContact O-N 3.18Å; A32-L35 VanDerWaalsContact O-N 3.15Å; A32-R46 HydrophobicContact CB-CG 3.92Å; A32-R46 WeakPolarHBondContact O-CD 3.23Å; A32-R46 WeakPolarHBondContact O-CG 3.44Å; A32-V50 HydrophobicContact CB-CG2 3.45Å; A32-V50 VanDerWaalsContact CB-CG2 3.45Å
33L89.9Confident89.6Confident98 Ų9869.8 Ų69.851%0.51337%0.366SS..Hα-helixtrans-69.3-24.1178.4-68.7176.9000113.2I29 E31 L35 V50I29-L33 HydrophobicContact CG2-CD1 3.72Å; I29-L33 HydrophobicContact CG2-CG 4.26Å; I29-L33 WeakPolarHBondContact O-CB 3.35Å; I29-L33 VanDerWaalsContact O-CG 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.39Å; I29-L33 PolarHBondContact O-N 2.99Å; E31-L33 PolarHBondContact O-N 3.02Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L33-V50 HydrophobicContact CD2-CG2 4.48Å
34A89.5Confident89.4Confident77 Ų7771.3 Ų71.364%0.63637%0.371SS*.Hα-helixtrans-72.3-23.2172.900000112.5T30 E31 A32T30-A34 WeakPolarHBondContact O-CB 3.3Å; T30-A34 PolarHBondContact O-N 3.18Å; T30-A34 VanDerWaalsContact O-N 3.13Å; E31-A34 WeakPolarHBondContact O-CB 3.43Å; E31-A34 PolarHBondContact O-N 2.96Å; E31-A34 VanDerWaalsContact O-N 3.13Å; A32-A34 VanDerWaalsContact C-N 3.27Å; A32-A34 PolarHBondContact O-N 2.71Å
35L87.5Confident89.2Confident41 Ų4174.2 Ų74.222%0.21538%0.382CS..  trans-68.6136.5176.3-60.6179.5000111.6D12 L13 V16 E31 A32 L33 P37D12-L35 HydrophobicContact CB-CD1 4.44Å; D12-L35 HydrophobicContact CB-CD2 3.91Å; L13-L35 HydrophobicContact CG-CD1 4.32Å; V16-L35 HydrophobicContact CG2-CD1 3.9Å; E31-L35 WeakPolarHBondContact O-CG 3.39Å; E31-L35 PolarHBondContact O-N 2.96Å; A32-L35 WeakPolarHBondContact O-CB 3.48Å; A32-L35 PolarHBondContact O-N 3.18Å; A32-L35 VanDerWaalsContact O-N 3.15Å; L33-L35 VanDerWaalsContact C-N 3.28Å; L35-P37 WeakPolarHBondContact O-CD 3.46Å
36K84.7Confident89.1Confident199 Ų19973 Ų7387%0.86538%0.377SS*.  trans-105.288.6173-67.1-177.9-176.4176.70109.2S38K36-S38 PolarHBondContact O-N 3.37Å
37P81Confident88.9Confident44 Ų4469.4 Ų69.429%0.28636%0.361SS..  trans-63.8133.5-177.425.8-34000110.6L35 A42 K43L35-P37 WeakPolarHBondContact O-CD 3.46Å; P37-A42 HydrophobicContact CB-CB 3.99Å; P37-K43 HydrophobicContact CB-CB 3.91Å; P37-K43 HydrophobicContact CG-CB 3.76Å; P37-K43 HydrophobicContact CG-CG 4Å
38S82.6Confident89Confident98 Ų9865.9 Ų65.969%0.68535%0.345SS*.SBendtrans-88-22.4-179.656.50000113.1K36K36-S38 PolarHBondContact O-N 3.37Å
39S85.9Confident89Confident46 Ų4666.9 Ų66.932%0.32235%0.348SS..SBendtrans-122.2164.8-178.669.10000112E41 A42 K43S39-E41 VanDerWaalsContact C-N 3.29Å; S39-E41 WeakPolarHBondContact CB-OE2 3.43Å; S39-A42 VanDerWaalsContact OG-CB 3.26Å; S39-A42 WeakPolarHBondContact OG-CB 3.45Å; S39-A42 PolarHBondContact OG-N 3.44Å; S39-K43 WeakPolarHBondContact O-CB 3.3Å; S39-K43 PolarHBondContact O-N 3.28Å; S39-K43 VanDerWaalsContact O-N 3.14Å
40K84.4Confident89.1Confident181 Ų18167 Ų6779%0.78735%0.349SS*.Hα-helixtrans-69.1-34.4176.6-71.8-176.5178.5-179.10111K43 L44K40-K43 WeakPolarHBondContact O-CB 3.45Å; K40-K43 PolarHBondContact O-N 2.87Å; K40-L44 WeakPolarHBondContact O-CB 3.41Å; K40-L44 PolarHBondContact O-N 3.28Å
41E85Confident89.2Confident129 Ų12964.3 Ų64.360%0.60333%0.33SS*.Hα-helixtrans-66.8-49178.7-6171.5-156.100110.4S39 K43 L44 E45S39-E41 VanDerWaalsContact C-N 3.29Å; S39-E41 WeakPolarHBondContact CB-OE2 3.43Å; E41-K43 VanDerWaalsContact C-N 3.26Å; E41-K43 PolarHBondContact O-N 3.37Å; E41-L44 WeakPolarHBondContact O-CB 3.33Å; E41-L44 PolarHBondContact O-N 3.08Å; E41-L44 VanDerWaalsContact O-N 3.08Å; E41-E45 PolarHBondContact O-N 3.45Å
42A85.5Confident89.4Confident6 Ų662.2 Ų62.25%0.0532%0.319CS..Hα-helixtrans-63.8-33.9176.100000112T9 P37 S39 R46T9-A42 HydrophobicContact CG2-CB 3.95Å; P37-A42 HydrophobicContact CB-CB 3.99Å; S39-A42 VanDerWaalsContact OG-CB 3.26Å; S39-A42 WeakPolarHBondContact OG-CB 3.45Å; S39-A42 PolarHBondContact OG-N 3.44Å; A42-R46 WeakPolarHBondContact O-CB 3.25Å; A42-R46 PolarHBondContact O-N 2.97Å; A42-R46 VanDerWaalsContact O-N 3.07Å
43K88.5Confident89.7Confident106 Ų10662.2 Ų62.246%0.46132%0.319SS..Hα-helixtrans-65-44.1173.1-173.5-177174.3-173.30111.1P37 S39 K40 E41 R46 D47P37-K43 HydrophobicContact CB-CB 3.91Å; P37-K43 HydrophobicContact CG-CB 3.76Å; P37-K43 HydrophobicContact CG-CG 4Å; S39-K43 WeakPolarHBondContact O-CB 3.3Å; S39-K43 PolarHBondContact O-N 3.28Å; S39-K43 VanDerWaalsContact O-N 3.14Å; K40-K43 WeakPolarHBondContact O-CB 3.45Å; K40-K43 PolarHBondContact O-N 2.87Å; E41-K43 VanDerWaalsContact C-N 3.26Å; E41-K43 PolarHBondContact O-N 3.37Å; K43-R46 PolarHBondContact O-N 3.16Å; K43-D47 WeakPolarHBondContact O-CB 3.42Å; K43-D47 PolarHBondContact O-N 3.02Å
44L90.4Very high90Very high46 Ų4659.7 Ų59.724%0.24130%0.303CS..Hα-helixtrans-61.5-47177.2177.361.5000111.3K40 E41 R46 D47 I48 P74 L77K40-L44 WeakPolarHBondContact O-CB 3.41Å; K40-L44 PolarHBondContact O-N 3.28Å; E41-L44 WeakPolarHBondContact O-CB 3.33Å; E41-L44 PolarHBondContact O-N 3.08Å; E41-L44 VanDerWaalsContact O-N 3.08Å; L44-R46 PolarHBondContact O-N 2.98Å; L44-D47 PolarHBondContact O-N 3.36Å; L44-I48 HydrophobicContact CD1-CD1 4.23Å; L44-I48 HydrophobicContact CD1-CG1 4.38Å; L44-I48 HydrophobicContact CG-CD1 3.96Å; L44-I48 WeakPolarHBondContact O-CD1 3.48Å; L44-I48 VanDerWaalsContact O-CG1 3.26Å; L44-I48 WeakPolarHBondContact O-CG1 3.45Å; L44-I48 PolarHBondContact O-N 2.94Å; L44-P74 HydrophobicContact CD1-CB 3.82Å; L44-P74 HydrophobicContact CD1-CG 4.06Å; L44-P74 HydrophobicContact CD2-CB 4.01Å; L44-L77 HydrophobicContact CD1-CD1 3.87Å; L44-L77 HydrophobicContact CD1-CD2 4.23Å; L44-L77 HydrophobicContact CD1-CG 3.68Å
45E89.7Confident90.3Very high88 Ų8856.4 Ų56.441%0.41128%0.275SS..Hα-helixtrans-58.8-46.3177-73.4-173.1178.300112.5L13 E41 D47 I48 Y49L13-E45 HydrophobicContact CD1-CB 4.23Å; L13-E45 WeakPolarHBondContact CD1-OE2 3.48Å; L13-E45 HydrophobicContact CD2-CB 4.46Å; E41-E45 PolarHBondContact O-N 3.45Å; E45-D47 PolarHBondContact O-N 3.29Å; E45-I48 WeakPolarHBondContact O-CB 3.45Å; E45-I48 PolarHBondContact O-N 3.46Å; E45-Y49 WeakPolarHBondContact O-CD2 3.42Å; E45-Y49 PolarHBondContact O-N 3.34Å
46R91.9Very high90.6Very high38 Ų3856.4 Ų56.414%0.14328%0.281CS..Hα-helixtrans-58.4-48.6174178.9-157.465.6171.76.8111.4A32 A42 K43 L44 I48 Y49 V50A32-R46 HydrophobicContact CB-CG 3.92Å; A32-R46 WeakPolarHBondContact O-CD 3.23Å; A32-R46 WeakPolarHBondContact O-CG 3.44Å; A42-R46 WeakPolarHBondContact O-CB 3.25Å; A42-R46 PolarHBondContact O-N 2.97Å; A42-R46 VanDerWaalsContact O-N 3.07Å; K43-R46 PolarHBondContact O-N 3.16Å; L44-R46 PolarHBondContact O-N 2.98Å; R46-I48 VanDerWaalsContact C-N 3.29Å; R46-I48 PolarHBondContact O-N 2.98Å; R46-Y49 PolarHBondContact O-N 3.09Å; R46-V50 HydrophobicContact CG-CG2 4.46Å; R46-V50 WeakPolarHBondContact O-CG2 3.24Å; R46-V50 PolarHBondContact O-N 3.24Å
47D91.9Very high91Very high25 Ų2549.2 Ų49.213%0.13425%0.25CS..Hα-helixtrans-64.1-35.2-176.9-68.2-6.2000111.2K43 L44 E45 Y49 V50 Y51 L77K43-D47 WeakPolarHBondContact O-CB 3.42Å; K43-D47 PolarHBondContact O-N 3.02Å; L44-D47 PolarHBondContact O-N 3.36Å; E45-D47 PolarHBondContact O-N 3.29Å; D47-Y49 PolarHBondContact O-N 3.43Å; D47-V50 PolarHBondContact O-N 2.92Å; D47-Y51 HydrophobicContact CB-CD2 4.31Å; D47-Y51 HydrophobicContact CB-CE2 4.02Å; D47-Y51 WeakPolarHBondContact O-CD2 3.34Å; D47-Y51 PolarHBondContact O-N 2.65Å; D47-L77 HydrophobicContact CB-CD2 4.44Å
48I94.8Very high91.5Very high11 Ų1152.7 Ų52.76%0.05626%0.261CS..Hα-helixtrans-55-51.6173.2-75.8159.5000111.2L44 E45 R46 R52 P76 L77 I80 V112L44-I48 HydrophobicContact CD1-CD1 4.23Å; L44-I48 HydrophobicContact CD1-CG1 4.38Å; L44-I48 HydrophobicContact CG-CD1 3.96Å; L44-I48 WeakPolarHBondContact O-CD1 3.48Å; L44-I48 VanDerWaalsContact O-CG1 3.26Å; L44-I48 WeakPolarHBondContact O-CG1 3.45Å; L44-I48 PolarHBondContact O-N 2.94Å; E45-I48 WeakPolarHBondContact O-CB 3.45Å; E45-I48 PolarHBondContact O-N 3.46Å; R46-I48 VanDerWaalsContact C-N 3.29Å; R46-I48 PolarHBondContact O-N 2.98Å; I48-R52 WeakPolarHBondContact O-CB 3.48Å; I48-R52 WeakPolarHBondContact O-CD 3.28Å; I48-R52 WeakPolarHBondContact O-CG 3.4Å; I48-R52 PolarHBondContact O-N 3.37Å; I48-P76 HydrophobicContact CD1-CB 3.57Å; I48-P76 HydrophobicContact CD1-CG 4.18Å; I48-P76 HydrophobicContact CG1-CB 3.86Å; I48-L77 HydrophobicContact CG1-CD2 4.46Å; I48-I80 HydrophobicContact CB-CD1 4.04Å; I48-I80 HydrophobicContact CG1-CD1 3.9Å; I48-I80 HydrophobicContact CG2-CD1 3.96Å; I48-V112 HydrophobicContact CD1-CG2 4.28Å; I48-V112 HydrophobicContact CG2-CG1 4.18Å; I48-V112 HydrophobicContact CG2-CG2 4.18Å
49Y95.1Very high92Very high20 Ų2052.3 Ų52.38%0.07825%0.247CC..Hα-helixtrans-68.2-39.1179.8-78.1-78.7000112.5L13 V16 K17 F20 E45 R46 D47 R52 A53L13-Y49 HydrophobicContact CD2-CD2 4.25Å; V16-Y49 HydrophobicContact CG1-CG 4.06Å; K17-Y49 HydrophobicContact CG-CE1 4.07Å; K17-Y49 HydrophobicContact CG-CE2 3.93Å; F20-Y49 HydrophobicContact CB-CD1 3.86Å; F20-Y49 HydrophobicContact CB-CE1 4.25Å; F20-Y49 HydrophobicContact CD1-CD1 4.07Å; F20-Y49 HydrophobicContact CD1-CE1 4.02Å; F20-Y49 HydrophobicContact CD2-CD1 4.22Å; F20-Y49 AromaticContact CG-CD1 3.76Å; F20-Y49 HydrophobicContact CG-CD1 3.76Å; F20-Y49 HydrophobicContact CG-CE1 4.15Å; E45-Y49 WeakPolarHBondContact O-CD2 3.42Å; E45-Y49 PolarHBondContact O-N 3.34Å; R46-Y49 PolarHBondContact O-N 3.09Å; D47-Y49 PolarHBondContact O-N 3.43Å; Y49-R52 PolarHBondContact O-N 2.88Å; Y49-A53 VanDerWaalsContact O-CB 3.22Å; Y49-A53 WeakPolarHBondContact O-CB 3.03Å; Y49-A53 PolarHBondContact O-N 3.07Å
50V95.3Very high92.4Very high7 Ų752.1 Ų52.14%0.04224%0.24CC..Hα-helixtrans-59.3-50.9177.7170.40000111A32 L33 R46 D47 A53 Y54A32-V50 HydrophobicContact CB-CG2 3.45Å; A32-V50 VanDerWaalsContact CB-CG2 3.45Å; L33-V50 HydrophobicContact CD2-CG2 4.48Å; R46-V50 HydrophobicContact CG-CG2 4.46Å; R46-V50 WeakPolarHBondContact O-CG2 3.24Å; R46-V50 PolarHBondContact O-N 3.24Å; D47-V50 PolarHBondContact O-N 2.92Å; V50-A53 PolarHBondContact O-N 3.38Å; V50-Y54 HydrophobicContact CG1-CD2 3.77Å; V50-Y54 HydrophobicContact CG1-CE2 3.42Å; V50-Y54 VanDerWaalsContact CG1-CE2 3.42Å; V50-Y54 VanDerWaalsContact O-CD2 3.23Å; V50-Y54 WeakPolarHBondContact O-CD2 3.28Å; V50-Y54 PolarHBondContact O-N 2.91Å
51Y96.5Very high92.8Very high26 Ų2647.7 Ų47.710%0.10223%0.229CC..Hα-helixtrans-69.3-38.6-178.9-67.9-56.8000112.5D47 A53 Y54 I55 A63 E66 I67 L77D47-Y51 HydrophobicContact CB-CD2 4.31Å; D47-Y51 HydrophobicContact CB-CE2 4.02Å; D47-Y51 WeakPolarHBondContact O-CD2 3.34Å; D47-Y51 PolarHBondContact O-N 2.65Å; Y51-A53 VanDerWaalsContact C-N 3.3Å; Y51-A53 PolarHBondContact O-N 3.19Å; Y51-Y54 HydrophobicContact CD1-CD2 4.41Å; Y51-Y54 PolarHBondContact O-N 2.92Å; Y51-I55 WeakPolarHBondContact O-CG1 3.36Å; Y51-I55 PolarHBondContact O-N 3.11Å; Y51-A63 HydrophobicContact CD1-CB 4.3Å; Y51-E66 HydrophobicContact CE1-CB 3.87Å; Y51-E66 WeakPolarHBondContact CE1-OE2 3.41Å; Y51-E66 PolarHBondContact OH-OE2 2.99Å; Y51-I67 HydrophobicContact CD1-CD1 4.29Å; Y51-I67 HydrophobicContact CD1-CG1 4.34Å; Y51-I67 HydrophobicContact CD2-CD1 3.88Å; Y51-I67 HydrophobicContact CD2-CG1 4.04Å; Y51-I67 HydrophobicContact CE1-CG1 4.18Å; Y51-I67 HydrophobicContact CE2-CD1 4.24Å; Y51-I67 HydrophobicContact CE2-CG1 3.87Å; Y51-I67 HydrophobicContact CG-CD1 3.92Å; Y51-I67 HydrophobicContact CG-CG1 4.28Å; Y51-L77 HydrophobicContact CD2-CD2 3.72Å; Y51-L77 HydrophobicContact CE2-CD2 3.94Å
52R97Very high93.1Very high20 Ų2043 Ų438%0.07521%0.208CC..Hα-helixtrans-61.7-40173.7-72.1170.965.1-162.40.2111.6F20 I48 Y49 I55 A56 I80 M116 E142F20-R52 HydrophobicContact CE2-CB 3.65Å; F20-R52 HydrophobicContact CZ-CB 3.86Å; I48-R52 WeakPolarHBondContact O-CB 3.48Å; I48-R52 WeakPolarHBondContact O-CD 3.28Å; I48-R52 WeakPolarHBondContact O-CG 3.4Å; I48-R52 PolarHBondContact O-N 3.37Å; Y49-R52 PolarHBondContact O-N 2.88Å; R52-I55 PolarHBondContact O-N 3.29Å; R52-A56 WeakPolarHBondContact O-CB 3.44Å; R52-A56 PolarHBondContact O-N 2.98Å; R52-I80 HydrophobicContact CG-CD1 4Å; R52-I80 HydrophobicContact CG-CG1 4Å; R52-M116 HydrophobicContact CG-SD 4.28Å; R52-E142 IonicContact CZ-OE1 2.96Å; R52-E142 VanDerWaalsContact CZ-OE1 3.28Å; R52-E142 IonicContact CZ-OE2 3.8Å; R52-E142 VanDerWaalsContact NH1-CD 3.29Å; R52-E142 IonicContact NH1-OE1 2.69Å; R52-E142 PolarHBondContact NH1-OE1 2.89Å; R52-E142 IonicContact NH1-OE2 3.58Å; R52-E142 PolarHBondContact NH1-OE2 3.47Å; R52-E142 IonicContact NH2-OE1 2.73Å; R52-E142 PolarHBondContact NH2-OE1 2.78Å; R52-E142 IonicContact NH2-OE2 2.58Å
53A96.5Very high93.4Very high0 Ų042.7 Ų42.70%021%0.206CC..Hα-helixtrans-65.5-39.3175.300000112F20 Y25 I29 Y49 V50 Y51 A56 Q57F20-A53 HydrophobicContact CD2-CB 4.22Å; F20-A53 HydrophobicContact CE2-CB 4.43Å; Y25-A53 HydrophobicContact CD1-CB 4.35Å; I29-A53 HydrophobicContact CD1-CB 3.89Å; I29-A53 HydrophobicContact CG1-CB 3.59Å; Y49-A53 VanDerWaalsContact O-CB 3.22Å; Y49-A53 WeakPolarHBondContact O-CB 3.03Å; Y49-A53 PolarHBondContact O-N 3.07Å; V50-A53 PolarHBondContact O-N 3.38Å; Y51-A53 VanDerWaalsContact C-N 3.3Å; Y51-A53 PolarHBondContact O-N 3.19Å; A53-A56 PolarHBondContact O-N 2.9Å; A53-Q57 WeakPolarHBondContact O-CG 3.29Å; A53-Q57 PolarHBondContact O-N 3.49Å
54Y96.4Very high93.5Very high45 Ų4538.8 Ų38.818%0.17619%0.19CC..Hα-helixtrans-62.6-43.1172.6-78.2-54.2000112.5I29 V50 Y51 A56 Q57 K58 K59 V62I29-Y54 HydrophobicContact CD1-CD1 3.68Å; I29-Y54 HydrophobicContact CD1-CE1 3.67Å; I29-Y54 HydrophobicContact CD1-CG 4.15Å; I29-Y54 HydrophobicContact CG2-CE1 4.4Å; I29-Y54 HydrophobicContact CG2-CE2 4.48Å; V50-Y54 HydrophobicContact CG1-CD2 3.77Å; V50-Y54 HydrophobicContact CG1-CE2 3.42Å; V50-Y54 VanDerWaalsContact CG1-CE2 3.42Å; V50-Y54 VanDerWaalsContact O-CD2 3.23Å; V50-Y54 WeakPolarHBondContact O-CD2 3.28Å; V50-Y54 PolarHBondContact O-N 2.91Å; Y51-Y54 HydrophobicContact CD1-CD2 4.41Å; Y51-Y54 PolarHBondContact O-N 2.92Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; Y54-Q57 CarbonylContact O-C 3.48Å; Y54-Q57 PolarHBondContact O-N 3.45Å; Y54-K58 PolarHBondContact O-N 3.1Å; Y54-K59 HydrophobicContact CD1-CB 4.34Å; Y54-K59 HydrophobicContact CD1-CD 3.98Å; Y54-K59 HydrophobicContact CE1-CD 4.45Å; Y54-K59 WeakPolarHBondContact O-CA 3.5Å; Y54-K59 WeakPolarHBondContact O-CB 3.45Å; Y54-K59 PolarHBondContact O-N 3.46Å; Y54-V62 HydrophobicContact CD2-CB 4.42Å; Y54-V62 HydrophobicContact CD2-CG1 3.75Å; Y54-V62 HydrophobicContact CE2-CG1 3.85Å; Y54-V62 HydrophobicContact CG-CB 4.33Å; Y54-V62 HydrophobicContact CG-CG1 4.13Å
55I96.4Very high93.5Very high9 Ų943.9 Ų43.95%0.04621%0.213CC..Hα-helixtrans-60.9-44.5175.1-68.7168.9000110.4Y51 R52 Q57 K58 F60 A63 I80 L83 A84 L87Y51-I55 WeakPolarHBondContact O-CG1 3.36Å; Y51-I55 PolarHBondContact O-N 3.11Å; R52-I55 PolarHBondContact O-N 3.29Å; I55-Q57 PolarHBondContact O-N 2.89Å; I55-K58 WeakPolarHBondContact O-CA 3.14Å; I55-K58 PolarHBondContact O-N 3.37Å; I55-F60 HydrophobicContact CB-CD1 4.46Å; I55-F60 HydrophobicContact CG1-CD1 4.49Å; I55-F60 HydrophobicContact CG2-CD1 4.07Å; I55-F60 HydrophobicContact CG2-CE1 3.94Å; I55-F60 WeakPolarHBondContact O-CE1 3.41Å; I55-A63 HydrophobicContact CD1-CB 4.3Å; I55-A63 HydrophobicContact CG1-CB 4.16Å; I55-I80 HydrophobicContact CD1-CG2 3.53Å; I55-I80 WeakPolarHBondContact CD1-O 3.29Å; I55-L83 HydrophobicContact CG2-CD2 4.3Å; I55-L83 HydrophobicContact CG2-CG 4.4Å; I55-A84 HydrophobicContact CD1-CB 3.76Å; I55-A84 HydrophobicContact CG1-CB 3.92Å; I55-L87 HydrophobicContact CG2-CD1 3.74Å
56A93.9Very high93.5Very high40 Ų4045 Ų4533%0.33122%0.218SC..Hα-helixtrans-62.5-31.6177.500000112.7Y25 R52 A53 Y54 K58Y25-A56 HydrophobicContact CD1-CB 3.77Å; Y25-A56 HydrophobicContact CD2-CB 3.8Å; Y25-A56 HydrophobicContact CE1-CB 3.59Å; Y25-A56 HydrophobicContact CE2-CB 3.6Å; Y25-A56 HydrophobicContact CG-CB 3.88Å; Y25-A56 VanDerWaalsContact CZ-CB 3.5Å; R52-A56 WeakPolarHBondContact O-CB 3.44Å; R52-A56 PolarHBondContact O-N 2.98Å; A53-A56 PolarHBondContact O-N 2.9Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; A56-K58 PolarHBondContact O-N 3.35Å
57Q92.7Very high93.4Very high49 Ų4943.5 Ų43.523%0.22921%0.213CC..THydrogen-bonded Turntrans-789.8170.2-68-174.6-1.300114.1Y25 A53 Y54 I55 K59Y25-Q57 HydrophobicContact CD2-CG 4.47Å; A53-Q57 WeakPolarHBondContact O-CG 3.29Å; A53-Q57 PolarHBondContact O-N 3.49Å; Y54-Q57 CarbonylContact O-C 3.48Å; Y54-Q57 PolarHBondContact O-N 3.45Å; I55-Q57 PolarHBondContact O-N 2.89Å; Q57-K59 HydrophobicContact CB-CD 4.25Å; Q57-K59 HydrophobicContact CB-CG 4.26Å; Q57-K59 PolarHBondContact O-N 2.95Å
58K92.1Very high92.9Very high117 Ų11749.3 Ų49.351%0.50924%0.237SC..THydrogen-bonded Turntrans60.418.3-174.7-54.6175.5179.1171.50114.2Y54 I55 A56 F60 Y276Y54-K58 PolarHBondContact O-N 3.1Å; I55-K58 WeakPolarHBondContact O-CA 3.14Å; I55-K58 PolarHBondContact O-N 3.37Å; A56-K58 PolarHBondContact O-N 3.35Å; K58-F60 VanDerWaalsContact C-N 3.28Å; K58-F60 HydrophobicContact CB-CE2 4.07Å; K58-F60 HydrophobicContact CB-CZ 3.97Å; K58-F60 HydrophobicContact CG-CZ 4.21Å; K58-F60 WeakPolarHBondContact O-CD2 3.36Å; K58-F60 PolarHBondContact O-N 3.1Å; K58-Y276 PolarHBondContact NZ-OH 2.93Å; K58-Y276 VanDerWaalsContact NZ-OH 3.15Å
59K92.5Very high92Very high89 Ų8953.8 Ų53.839%0.38727%0.265SS..  trans-90.258.1177.5-65.1174.6-178.7164.80110.9Y54 Q57 T61 V62Y54-K59 HydrophobicContact CD1-CB 4.34Å; Y54-K59 HydrophobicContact CD1-CD 3.98Å; Y54-K59 HydrophobicContact CE1-CD 4.45Å; Y54-K59 WeakPolarHBondContact O-CA 3.5Å; Y54-K59 WeakPolarHBondContact O-CB 3.45Å; Y54-K59 PolarHBondContact O-N 3.46Å; Q57-K59 HydrophobicContact CB-CD 4.25Å; Q57-K59 HydrophobicContact CB-CG 4.26Å; Q57-K59 PolarHBondContact O-N 2.95Å; K59-T61 VanDerWaalsContact C-N 3.26Å; K59-T61 PolarHBondContact O-N 3.05Å; K59-V62 HydrophobicContact CB-CG2 4.28Å; K59-V62 PolarHBondContact O-N 3.09Å
60F93.8Very high91.2Very high42 Ų4257.8 Ų57.818%0.18429%0.287CS..Hα-helixtrans-62.8-31.2-173.9-47.3-60.9000113.4I55 K58 V62 A63 L64 L87 G88I55-F60 HydrophobicContact CB-CD1 4.46Å; I55-F60 HydrophobicContact CG1-CD1 4.49Å; I55-F60 HydrophobicContact CG2-CD1 4.07Å; I55-F60 HydrophobicContact CG2-CE1 3.94Å; I55-F60 WeakPolarHBondContact O-CE1 3.41Å; K58-F60 VanDerWaalsContact C-N 3.28Å; K58-F60 HydrophobicContact CB-CE2 4.07Å; K58-F60 HydrophobicContact CB-CZ 3.97Å; K58-F60 HydrophobicContact CG-CZ 4.21Å; K58-F60 WeakPolarHBondContact O-CD2 3.36Å; K58-F60 PolarHBondContact O-N 3.1Å; F60-V62 VanDerWaalsContact C-N 3.25Å; F60-V62 PolarHBondContact O-N 3.36Å; F60-A63 PolarHBondContact O-N 3.41Å; F60-L64 HydrophobicContact CB-CD1 4.44Å; F60-L64 VanDerWaalsContact O-CG 3.31Å; F60-L64 WeakPolarHBondContact O-CG 3.46Å; F60-L64 PolarHBondContact O-N 3.2Å; F60-L87 HydrophobicContact CD1-CB 4.09Å; F60-L87 HydrophobicContact CE1-CB 3.55Å; F60-L87 HydrophobicContact CE1-CD1 4.01Å; F60-L87 HydrophobicContact CE1-CG 4.45Å; F60-L87 HydrophobicContact CE2-CB 4.5Å; F60-L87 HydrophobicContact CZ-CB 3.77Å; F60-G88 VanDerWaalsContact CD2-CA 3.44Å
61T92.5Very high90Very high88 Ų8863.2 Ų63.254%0.5433%0.325SS..Hα-helixtrans-57.8-38-17951.70000112.3K59 A63 L64 E65K59-T61 VanDerWaalsContact C-N 3.26Å; K59-T61 PolarHBondContact O-N 3.05Å; T61-A63 PolarHBondContact O-N 2.91Å; T61-L64 CarbonylContact O-C 3.1Å; T61-L64 PolarHBondContact O-N 3.14Å; T61-E65 WeakPolarHBondContact O-CB 3.26Å; T61-E65 WeakPolarHBondContact O-CG 3.26Å; T61-E65 PolarHBondContact O-N 3.04Å
62V92.1Very high89.1Confident30 Ų3068.9 Ų68.918%0.18236%0.358CS..Hα-helixtrans-60-50.7179.2-178.20000110.5Y54 K59 F60 L64 E65 E66Y54-V62 HydrophobicContact CD2-CB 4.42Å; Y54-V62 HydrophobicContact CD2-CG1 3.75Å; Y54-V62 HydrophobicContact CE2-CG1 3.85Å; Y54-V62 HydrophobicContact CG-CB 4.33Å; Y54-V62 HydrophobicContact CG-CG1 4.13Å; K59-V62 HydrophobicContact CB-CG2 4.28Å; K59-V62 PolarHBondContact O-N 3.09Å; F60-V62 VanDerWaalsContact C-N 3.25Å; F60-V62 PolarHBondContact O-N 3.36Å; V62-L64 VanDerWaalsContact C-N 3.33Å; V62-L64 PolarHBondContact O-N 3.37Å; V62-E65 PolarHBondContact O-N 3.37Å; V62-E66 HydrophobicContact CG1-CG 4.38Å; V62-E66 VanDerWaalsContact O-CB 3.31Å; V62-E66 WeakPolarHBondContact O-CB 3.17Å; V62-E66 WeakPolarHBondContact O-CG 3.41Å; V62-E66 PolarHBondContact O-N 2.7Å
63A90.6Very high88.5Confident0 Ų069.5 Ų69.50%036%0.363CS..Hα-helixtrans-65.1-37177.300000112.2Y51 I55 F60 T61 I67 A84Y51-A63 HydrophobicContact CD1-CB 4.3Å; I55-A63 HydrophobicContact CD1-CB 4.3Å; I55-A63 HydrophobicContact CG1-CB 4.16Å; F60-A63 PolarHBondContact O-N 3.41Å; T61-A63 PolarHBondContact O-N 2.91Å; A63-I67 HydrophobicContact CB-CD1 4.14Å; A63-I67 VanDerWaalsContact O-CB 3.23Å; A63-I67 WeakPolarHBondContact O-CB 3.28Å; A63-I67 VanDerWaalsContact O-CG1 3.29Å; A63-I67 WeakPolarHBondContact O-CG1 3.5Å; A63-I67 PolarHBondContact O-N 3.47Å; A63-A84 HydrophobicContact CB-CB 3.84Å
64L91.5Very high88.1Confident24 Ų2472 Ų7213%0.12638%0.38CS..Hα-helixtrans-75-20-179.8-68.7174.7000114.4F60 T61 V62 R81 A84 E85F60-L64 HydrophobicContact CB-CD1 4.44Å; F60-L64 VanDerWaalsContact O-CG 3.31Å; F60-L64 WeakPolarHBondContact O-CG 3.46Å; F60-L64 PolarHBondContact O-N 3.2Å; T61-L64 CarbonylContact O-C 3.1Å; T61-L64 PolarHBondContact O-N 3.14Å; V62-L64 VanDerWaalsContact C-N 3.33Å; V62-L64 PolarHBondContact O-N 3.37Å; L64-R81 HydrophobicContact CD2-CG 4.04Å; L64-R81 PolarHBondContact O-NH1 2.89Å; L64-A84 HydrophobicContact CD2-CB 4.07Å; L64-A84 HydrophobicContact CG-CB 4.05Å; L64-E85 HydrophobicContact CD2-CB 3.98Å
65E90.8Very high87.8Confident153 Ų15370.2 Ų70.272%0.71538%0.375SS*.Hα-helixtrans-99.7-39.2178.5-71.3177.6-177.100111.8T61 V62T61-E65 WeakPolarHBondContact O-CB 3.26Å; T61-E65 WeakPolarHBondContact O-CG 3.26Å; T61-E65 PolarHBondContact O-N 3.04Å; V62-E65 PolarHBondContact O-N 3.37Å
66E89.6Confident87.7Confident113 Ų11370.1 Ų70.153%0.52838%0.375SS..Hα-helixtrans-82.4-32.5-175.8-63.9-173-176.800113.1Y51 V62 K68Y51-E66 HydrophobicContact CE1-CB 3.87Å; Y51-E66 WeakPolarHBondContact CE1-OE2 3.41Å; Y51-E66 PolarHBondContact OH-OE2 2.99Å; V62-E66 HydrophobicContact CG1-CG 4.38Å; V62-E66 VanDerWaalsContact O-CB 3.31Å; V62-E66 WeakPolarHBondContact O-CB 3.17Å; V62-E66 WeakPolarHBondContact O-CG 3.41Å; V62-E66 PolarHBondContact O-N 2.7Å; E66-K68 PolarHBondContact O-N 3.36Å
67I88.9Confident87.6Confident5 Ų569.3 Ų69.33%0.02637%0.365CS..SBendtrans-83.7100.7176.3-54.2172.4000109Y51 A63 T73 L77 I80 R81Y51-I67 HydrophobicContact CD1-CD1 4.29Å; Y51-I67 HydrophobicContact CD1-CG1 4.34Å; Y51-I67 HydrophobicContact CD2-CD1 3.88Å; Y51-I67 HydrophobicContact CD2-CG1 4.04Å; Y51-I67 HydrophobicContact CE1-CG1 4.18Å; Y51-I67 HydrophobicContact CE2-CD1 4.24Å; Y51-I67 HydrophobicContact CE2-CG1 3.87Å; Y51-I67 HydrophobicContact CG-CD1 3.92Å; Y51-I67 HydrophobicContact CG-CG1 4.28Å; A63-I67 HydrophobicContact CB-CD1 4.14Å; A63-I67 VanDerWaalsContact O-CB 3.23Å; A63-I67 WeakPolarHBondContact O-CB 3.28Å; A63-I67 VanDerWaalsContact O-CG1 3.29Å; A63-I67 WeakPolarHBondContact O-CG1 3.5Å; A63-I67 PolarHBondContact O-N 3.47Å; I67-T73 HydrophobicContact CG2-CG2 4.16Å; I67-L77 HydrophobicContact CG2-CB 3.95Å; I67-I80 HydrophobicContact CD1-CB 4.46Å; I67-I80 HydrophobicContact CD1-CG2 4.05Å; I67-R81 HydrophobicContact CB-CB 4.24Å; I67-R81 HydrophobicContact CB-CG 4.42Å; I67-R81 HydrophobicContact CD1-CB 4.1Å; I67-R81 HydrophobicContact CG2-CB 4Å; I67-R81 HydrophobicContact CG2-CG 4.48Å; I67-R81 PolarHBondContact O-NH1 2.95Å
68K81.1Confident87.6Confident148 Ų14868.7 Ų68.764%0.64337%0.368SS*.  trans-67.6147.3175.5-62.2-175.1-179.7-177.80111.3E66 T73E66-K68 PolarHBondContact O-N 3.36Å; K68-T73 WeakPolarHBondContact O-CG2 3.39Å; K68-T73 PolarHBondContact O-OG1 3Å
69V76.8Confident87.7Confident105 Ų10563.1 Ų63.164%0.63634%0.344SS*.  trans-101.575.2175.7-171.50000108.4R81V69-R81 VanDerWaalsContact CG2-CD 3.42Å; V69-R81 VanDerWaalsContact CG2-CZ 3.44Å
70D77.7Confident87.9Confident103 Ų10358.9 Ų58.955%0.55133%0.325SS*.  trans-114162.9176.1-59.2-31.6000109.8D72 T73D70-D72 PolarHBondContact O-N 3.18Å; D70-D72 VanDerWaalsContact O-N 3.07Å; D70-T73 PolarHBondContact N-OG1 3.48Å; D70-T73 WeakPolarHBondContact O-CB 3.35Å; D70-T73 PolarHBondContact O-N 2.89Å; D70-T73 PolarHBondContact O-OG1 3.07Å
71S70.4Confident88Confident121 Ų12159 Ų5985%0.84633%0.325SS*.THydrogen-bonded Turntrans-57.6-23.1177.854.90000113.9
72D77.6Confident88.1Confident146 Ų14655.9 Ų55.978%0.78130%0.304SS*.THydrogen-bonded Turntrans-93.64.8-176.8-61.9-10.8000112.7D70 P74D70-D72 PolarHBondContact O-N 3.18Å; D70-D72 VanDerWaalsContact O-N 3.07Å; D72-P74 WeakPolarHBondContact O-CD 3.21Å
73T84.6Confident88.3Confident32 Ų3255 Ų5520%0.19630%0.299CS..  trans-68.1123.3-178.9-48.30000109.6I67 K68 D70 G75 L77 A78I67-T73 HydrophobicContact CG2-CG2 4.16Å; K68-T73 WeakPolarHBondContact O-CG2 3.39Å; K68-T73 PolarHBondContact O-OG1 3Å; D70-T73 PolarHBondContact N-OG1 3.48Å; D70-T73 WeakPolarHBondContact O-CB 3.35Å; D70-T73 PolarHBondContact O-N 2.89Å; D70-T73 PolarHBondContact O-OG1 3.07Å; T73-G75 PolarHBondContact O-N 3.21Å; T73-L77 HydrophobicContact CG2-CB 4.14Å; T73-A78 HydrophobicContact CG2-CB 4.25Å
74P88.7Confident88.5Confident53 Ų5355 Ų5534%0.34430%0.299SS..  trans-56.2136.9175.1-25.134.4000111.3L44 D72 P76 L77 A78L44-P74 HydrophobicContact CD1-CB 3.82Å; L44-P74 HydrophobicContact CD1-CG 4.06Å; L44-P74 HydrophobicContact CD2-CB 4.01Å; D72-P74 WeakPolarHBondContact O-CD 3.21Å; P74-P76 VanDerWaalsContact C-N 3.32Å; P74-L77 HydrophobicContact CG-CD1 4.26Å; P74-L77 PolarHBondContact O-N 2.98Å; P74-A78 PolarHBondContact O-N 3.04Å
75G89.3Confident88.7Confident7 Ų755.3 Ų55.37%0.07230%0.299CS..Hα-helixtrans-45.2-49179.600000114T73 L77 A78 A79 C113T73-G75 PolarHBondContact O-N 3.21Å; G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.02Å; G75-A78 WeakPolarHBondContact O-CB 3.21Å; G75-A78 PolarHBondContact O-N 3.43Å; G75-A78 VanDerWaalsContact O-N 3.16Å; G75-A79 PolarHBondContact O-N 2.95Å; G75-C113 PolarHBondContact O-SG 2.69Å; G75-C113 VanDerWaalsContact O-SG 3.39Å
76P93.5Very high89Confident8 Ų848.5 Ų48.55%0.05227%0.267CS..Hα-helixtrans-56.1-42.6177.4-30.737.9000114.2I48 P74 A79 I80 E110 V112I48-P76 HydrophobicContact CD1-CB 3.57Å; I48-P76 HydrophobicContact CD1-CG 4.18Å; I48-P76 HydrophobicContact CG1-CB 3.86Å; P74-P76 VanDerWaalsContact C-N 3.32Å; P76-A79 PolarHBondContact O-N 3.35Å; P76-I80 WeakPolarHBondContact O-CB 3.33Å; P76-I80 WeakPolarHBondContact O-CD1 3.42Å; P76-I80 WeakPolarHBondContact O-CG1 3.36Å; P76-I80 PolarHBondContact O-N 3.15Å; P76-E110 HydrophobicContact CG-CG 3.92Å; P76-E110 WeakPolarHBondContact CG-OE1 3.34Å; P76-V112 HydrophobicContact CB-CB 3.94Å; P76-V112 HydrophobicContact CB-CG1 3.87Å; P76-V112 HydrophobicContact CG-CB 4.35Å
77L93.4Very high89.1Confident22 Ų2245.2 Ų45.212%0.11525%0.253CS..Hα-helixtrans-70.5-38.5178.8-66.1-177.9000111.4L44 D47 I48 Y51 I67 T73 P74 G75 A79 I80 R81L44-L77 HydrophobicContact CD1-CD1 3.87Å; L44-L77 HydrophobicContact CD1-CD2 4.23Å; L44-L77 HydrophobicContact CD1-CG 3.68Å; D47-L77 HydrophobicContact CB-CD2 4.44Å; I48-L77 HydrophobicContact CG1-CD2 4.46Å; Y51-L77 HydrophobicContact CD2-CD2 3.72Å; Y51-L77 HydrophobicContact CE2-CD2 3.94Å; I67-L77 HydrophobicContact CG2-CB 3.95Å; T73-L77 HydrophobicContact CG2-CB 4.14Å; P74-L77 HydrophobicContact CG-CD1 4.26Å; P74-L77 PolarHBondContact O-N 2.98Å; G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.02Å; L77-A79 VanDerWaalsContact C-N 3.34Å; L77-A79 PolarHBondContact O-N 3.5Å; L77-I80 HydrophobicContact CD2-CD1 4.44Å; L77-I80 PolarHBondContact O-N 3.4Å; L77-R81 WeakPolarHBondContact O-CB 3.47Å; L77-R81 PolarHBondContact O-N 3.27Å
78A92.6Very high89.3Confident36 Ų3646.4 Ų46.430%0.29827%0.266SS..Hα-helixtrans-60.8-43.3174.500000111.6T73 P74 G75 R81 M82T73-A78 HydrophobicContact CG2-CB 4.25Å; P74-A78 PolarHBondContact O-N 3.04Å; G75-A78 WeakPolarHBondContact O-CB 3.21Å; G75-A78 PolarHBondContact O-N 3.43Å; G75-A78 VanDerWaalsContact O-N 3.16Å; A78-R81 PolarHBondContact O-N 3.35Å; A78-M82 PolarHBondContact O-N 3.12Å
79A94.5Very high89.8Confident0 Ų042.4 Ų42.40%025%0.249CC..Hα-helixtrans-67.2-40.2177.500000112.9G75 P76 L77 R81 M82 L83 L103 C113 M116G75-A79 PolarHBondContact O-N 2.95Å; P76-A79 PolarHBondContact O-N 3.35Å; L77-A79 VanDerWaalsContact C-N 3.34Å; L77-A79 PolarHBondContact O-N 3.5Å; A79-R81 VanDerWaalsContact C-N 3.34Å; A79-R81 PolarHBondContact O-N 3.33Å; A79-M82 WeakPolarHBondContact O-CB 3.37Å; A79-M82 PolarHBondContact O-N 2.99Å; A79-L83 PolarHBondContact O-N 2.9Å; A79-L103 HydrophobicContact CB-CD1 4.39Å; A79-L103 HydrophobicContact CB-CD2 3.94Å; A79-C113 HydrophobicContact CB-CB 4.18Å; A79-M116 HydrophobicContact CB-CB 3.97Å; A79-M116 HydrophobicContact CB-CG 4.07Å
80I96.4Very high90.3Very high0 Ų040.6 Ų40.60%024%0.24CC..Hα-helixtrans-63.2-42.1174.8-71.1164.6000110.9I48 R52 I55 I67 P76 L77 M82 L83 A84 V112 M116I48-I80 HydrophobicContact CB-CD1 4.04Å; I48-I80 HydrophobicContact CG1-CD1 3.9Å; I48-I80 HydrophobicContact CG2-CD1 3.96Å; R52-I80 HydrophobicContact CG-CD1 4Å; R52-I80 HydrophobicContact CG-CG1 4Å; I55-I80 HydrophobicContact CD1-CG2 3.53Å; I55-I80 WeakPolarHBondContact CD1-O 3.29Å; I67-I80 HydrophobicContact CD1-CB 4.46Å; I67-I80 HydrophobicContact CD1-CG2 4.05Å; P76-I80 WeakPolarHBondContact O-CB 3.33Å; P76-I80 WeakPolarHBondContact O-CD1 3.42Å; P76-I80 WeakPolarHBondContact O-CG1 3.36Å; P76-I80 PolarHBondContact O-N 3.15Å; L77-I80 HydrophobicContact CD2-CD1 4.44Å; L77-I80 PolarHBondContact O-N 3.4Å; I80-M82 VanDerWaalsContact C-N 3.31Å; I80-M82 PolarHBondContact O-N 2.85Å; I80-L83 PolarHBondContact O-N 3.38Å; I80-A84 PolarHBondContact O-N 2.9Å; I80-V112 HydrophobicContact CD1-CG1 4.14Å; I80-V112 HydrophobicContact CG1-CG1 4.2Å; I80-M116 HydrophobicContact CG1-CG 3.99Å; I80-M116 HydrophobicContact CG1-SD 3.88Å
81R94.8Very high91Very high46 Ų4642.7 Ų42.717%0.17425%0.251CS..Hα-helixtrans-61.7-41.9174.9-174.3-166.2165.1858.4111.3L64 I67 V69 L77 A78 A79 L83 A84 E85L64-R81 HydrophobicContact CD2-CG 4.04Å; L64-R81 PolarHBondContact O-NH1 2.89Å; I67-R81 HydrophobicContact CB-CB 4.24Å; I67-R81 HydrophobicContact CB-CG 4.42Å; I67-R81 HydrophobicContact CD1-CB 4.1Å; I67-R81 HydrophobicContact CG2-CB 4Å; I67-R81 HydrophobicContact CG2-CG 4.48Å; I67-R81 PolarHBondContact O-NH1 2.95Å; V69-R81 VanDerWaalsContact CG2-CD 3.42Å; V69-R81 VanDerWaalsContact CG2-CZ 3.44Å; L77-R81 WeakPolarHBondContact O-CB 3.47Å; L77-R81 PolarHBondContact O-N 3.27Å; A78-R81 PolarHBondContact O-N 3.35Å; A79-R81 VanDerWaalsContact C-N 3.34Å; A79-R81 PolarHBondContact O-N 3.33Å; R81-L83 VanDerWaalsContact C-N 3.33Å; R81-L83 PolarHBondContact O-N 3.33Å; R81-A84 WeakPolarHBondContact O-CB 3.4Å; R81-A84 PolarHBondContact O-N 3.47Å; R81-A84 VanDerWaalsContact O-N 3.16Å; R81-E85 PolarHBondContact O-N 3.22Å
82M94.7Very high92.1Very high22 Ų2242 Ų4211%0.10823%0.23CC..Hα-helixtrans-59.7-43.2176.4-175.7177.8-77.700111.5A78 A79 I80 E85 Y86 V96 E99 L100 L103 I120A78-M82 PolarHBondContact O-N 3.12Å; A79-M82 WeakPolarHBondContact O-CB 3.37Å; A79-M82 PolarHBondContact O-N 2.99Å; I80-M82 VanDerWaalsContact C-N 3.31Å; I80-M82 PolarHBondContact O-N 2.85Å; M82-E85 PolarHBondContact O-N 3.34Å; M82-Y86 PolarHBondContact O-N 3.28Å; M82-V96 HydrophobicContact CG-CB 4.48Å; M82-V96 HydrophobicContact CG-CG1 3.32Å; M82-V96 HydrophobicContact SD-CG1 4.12Å; M82-E99 HydrophobicContact CE-CB 3.83Å; M82-L100 HydrophobicContact SD-CD2 3.73Å; M82-L103 HydrophobicContact CE-CB 4.5Å; M82-L103 HydrophobicContact SD-CD2 3.94Å; M82-I120 HydrophobicContact CG-CD1 4.03Å; M82-I120 HydrophobicContact SD-CD1 4.49Å
83L96.3Very high92.8Very high11 Ų1138.2 Ų38.26%0.05820%0.204CC..Hα-helixtrans-61.6-43.4172.5178.765.1000112.1I55 A79 I80 R81 E85 Y86 L87 M116 T119 I120I55-L83 HydrophobicContact CG2-CD2 4.3Å; I55-L83 HydrophobicContact CG2-CG 4.4Å; A79-L83 PolarHBondContact O-N 2.9Å; I80-L83 PolarHBondContact O-N 3.38Å; R81-L83 VanDerWaalsContact C-N 3.33Å; R81-L83 PolarHBondContact O-N 3.33Å; L83-E85 VanDerWaalsContact C-N 3.26Å; L83-E85 PolarHBondContact O-N 2.91Å; L83-Y86 PolarHBondContact O-N 3.42Å; L83-L87 HydrophobicContact CD1-CD1 3.85Å; L83-L87 HydrophobicContact CD1-CG 4.04Å; L83-L87 HydrophobicContact CG-CD1 4.01Å; L83-L87 HydrophobicContact CG-CG 4.5Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 3.33Å; L83-M116 HydrophobicContact CB-CB 4.47Å; L83-M116 HydrophobicContact CB-SD 4.27Å; L83-M116 HydrophobicContact CD2-CE 4.27Å; L83-M116 HydrophobicContact CD2-SD 3.44Å; L83-M116 WeakPolarHBondContact CD2-SD 3.33Å; L83-M116 HydrophobicContact CG-SD 4.49Å; L83-T119 HydrophobicContact CD1-CG2 3.88Å; L83-T119 HydrophobicContact CD2-CG2 4.28Å; L83-I120 HydrophobicContact CB-CD1 4.41Å; L83-I120 HydrophobicContact CD1-CD1 4.46Å; L83-I120 HydrophobicContact CD1-CG1 3.69Å
84A96.2Very high93.2Very high0 Ų044.1 Ų44.10%023%0.23CC..Hα-helixtrans-61.5-35.9176.100000112.2I55 A63 L64 I80 R81 G88I55-A84 HydrophobicContact CD1-CB 3.76Å; I55-A84 HydrophobicContact CG1-CB 3.92Å; A63-A84 HydrophobicContact CB-CB 3.84Å; L64-A84 HydrophobicContact CD2-CB 4.07Å; L64-A84 HydrophobicContact CG-CB 4.05Å; I80-A84 PolarHBondContact O-N 2.9Å; R81-A84 WeakPolarHBondContact O-CB 3.4Å; R81-A84 PolarHBondContact O-N 3.47Å; R81-A84 VanDerWaalsContact O-N 3.16Å; A84-G88 WeakPolarHBondContact O-CA 3.28Å; A84-G88 PolarHBondContact O-N 2.81Å
85E95.3Very high93.5Very high30 Ų3048.3 Ų48.314%0.1424%0.242CC..Hα-helixtrans-69-45.4176.6-174.6156-160.900111.6L64 R81 M82 L83 K89 R92 V96L64-E85 HydrophobicContact CD2-CB 3.98Å; R81-E85 PolarHBondContact O-N 3.22Å; M82-E85 PolarHBondContact O-N 3.34Å; L83-E85 VanDerWaalsContact C-N 3.26Å; L83-E85 PolarHBondContact O-N 2.91Å; E85-K89 HydrophobicContact CG-CD 4.48Å; E85-K89 WeakPolarHBondContact O-CB 3.28Å; E85-K89 PolarHBondContact O-N 3.06Å; E85-R92 HydrophobicContact CG-CB 4.31Å; E85-R92 WeakPolarHBondContact OE1-CD 3.32Å; E85-R92 IonicContact OE1-CZ 2.91Å; E85-R92 IonicContact OE1-NE 2.99Å; E85-R92 IonicContact OE1-NH1 3.91Å; E85-R92 PolarHBondContact OE1-NH1 3.31Å; E85-V96 HydrophobicContact CB-CG2 4.18Å; E85-V96 HydrophobicContact CG-CG2 3.84Å
86Y95.9Very high93.7Very high10 Ų1048.1 Ų48.14%0.03924%0.24CC..Hα-helixtrans-59-47.9176.3177.2-95.2000112.5M82 L83 R93 V96 V97 I120 H123 E124M82-Y86 PolarHBondContact O-N 3.28Å; L83-Y86 PolarHBondContact O-N 3.42Å; Y86-R93 HydrophobicContact CD2-CB 3.88Å; Y86-R93 HydrophobicContact CD2-CG 3.72Å; Y86-R93 HydrophobicContact CE2-CB 3.73Å; Y86-R93 HydrophobicContact CE2-CG 3.67Å; Y86-R93 HydrophobicContact CG-CG 4.33Å; Y86-R93 VanDerWaalsContact O-CG 3.31Å; Y86-R93 WeakPolarHBondContact O-CG 3.38Å; Y86-R93 PolarHBondContact O-NE 3.13Å; Y86-V96 HydrophobicContact CD2-CB 4.46Å; Y86-V96 HydrophobicContact CD2-CG1 4.33Å; Y86-V97 HydrophobicContact CD2-CG2 4.3Å; Y86-V97 HydrophobicContact CE2-CG2 3.95Å; Y86-I120 HydrophobicContact CD1-CG1 4.22Å; Y86-I120 HydrophobicContact CD1-CG2 4.24Å; Y86-I120 HydrophobicContact CD2-CG2 3.63Å; Y86-I120 HydrophobicContact CE1-CG2 4.4Å; Y86-I120 HydrophobicContact CE2-CG2 3.79Å; Y86-I120 HydrophobicContact CG-CG1 4.12Å; Y86-I120 HydrophobicContact CG-CG2 3.88Å; Y86-H123 HydrophobicContact CE1-CB 3.51Å; Y86-H123 AromaticContact CE1-CG 3.94Å; Y86-H123 VanDerWaalsContact OH-CB 3.27Å; Y86-H123 WeakPolarHBondContact OH-CB 3.43Å; Y86-E124 HydrophobicContact CE2-CG 4.29Å; Y86-E124 WeakPolarHBondContact CE2-OE1 3.4Å; Y86-E124 VanDerWaalsContact CZ-OE1 3.26Å; Y86-E124 PolarHBondContact OH-OE1 3.43Å
87L93.3Very high93.8Very high44 Ų4449.5 Ų49.523%0.2325%0.248CC..Hα-helixtrans-76-37.3-178.1-66.9177.1000112.7I55 F60 L83I55-L87 HydrophobicContact CG2-CD1 3.74Å; F60-L87 HydrophobicContact CD1-CB 4.09Å; F60-L87 HydrophobicContact CE1-CB 3.55Å; F60-L87 HydrophobicContact CE1-CD1 4.01Å; F60-L87 HydrophobicContact CE1-CG 4.45Å; F60-L87 HydrophobicContact CE2-CB 4.5Å; F60-L87 HydrophobicContact CZ-CB 3.77Å; L83-L87 HydrophobicContact CD1-CD1 3.85Å; L83-L87 HydrophobicContact CD1-CG 4.04Å; L83-L87 HydrophobicContact CG-CD1 4.01Å; L83-L87 HydrophobicContact CG-CG 4.5Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 3.33Å
88G91.8Very high93.9Very high30 Ų3054 Ų5431%0.30927%0.272SS..Hα-helixtrans-86.8-18.8-174.400000115.2F60 A84F60-G88 VanDerWaalsContact CD2-CA 3.44Å; A84-G88 WeakPolarHBondContact O-CA 3.28Å; A84-G88 PolarHBondContact O-N 2.81Å
89K92.2Very high94Very high65 Ų6556.8 Ų56.828%0.28328%0.279SS..  trans-13289.1-177-62.5-177.5-178.1171.40111.4E85 D91 R92E85-K89 HydrophobicContact CG-CD 4.48Å; E85-K89 WeakPolarHBondContact O-CB 3.28Å; E85-K89 PolarHBondContact O-N 3.06Å; K89-D91 PolarHBondContact O-N 3.26Å; K89-D91 VanDerWaalsContact O-N 3.16Å; K89-R92 HydrophobicContact CB-CB 4.12Å; K89-R92 HydrophobicContact CB-CG 4.15Å; K89-R92 HydrophobicContact CD-CG 4.42Å; K89-R92 PolarHBondContact O-N 3.34Å
90P88.2Confident93.9Very high67 Ų6756.9 Ų56.944%0.43528%0.28SS..G310 helixtrans-51.5-40.9-179.2-28.736.4000113.4R92 R93P90-R92 PolarHBondContact O-N 2.9Å; P90-R92 VanDerWaalsContact O-N 3.12Å; P90-R93 WeakPolarHBondContact O-CB 3.16Å; P90-R93 WeakPolarHBondContact O-CG 3.12Å; P90-R93 PolarHBondContact O-N 3.46Å
91D91.8Very high93.8Very high147 Ų14759.8 Ų59.879%0.78630%0.298SS*.G310 helixtrans-67.3-7.5178.715.9-64.5000114.9K89K89-D91 PolarHBondContact O-N 3.26Å; K89-D91 VanDerWaalsContact O-N 3.16Å
92R92.4Very high93.6Very high107 Ų10759.8 Ų59.840%0.40431%0.306SS..G310 helixtrans-110.8-2.1175.4-63.2-165.2179.7-167.9-8.1114.1E85 K89 P90 E94 K95 V96E85-R92 HydrophobicContact CG-CB 4.31Å; E85-R92 WeakPolarHBondContact OE1-CD 3.32Å; E85-R92 IonicContact OE1-CZ 2.91Å; E85-R92 IonicContact OE1-NE 2.99Å; E85-R92 IonicContact OE1-NH1 3.91Å; E85-R92 PolarHBondContact OE1-NH1 3.31Å; K89-R92 HydrophobicContact CB-CB 4.12Å; K89-R92 HydrophobicContact CB-CG 4.15Å; K89-R92 HydrophobicContact CD-CG 4.42Å; K89-R92 PolarHBondContact O-N 3.34Å; P90-R92 PolarHBondContact O-N 2.9Å; P90-R92 VanDerWaalsContact O-N 3.12Å; R92-E94 PolarHBondContact O-N 3.35Å; R92-K95 PolarHBondContact O-N 2.89Å; R92-V96 WeakPolarHBondContact O-CG2 3.33Å; R92-V96 PolarHBondContact O-N 2.94Å
93R93.4Very high93.4Very high66 Ų6659.4 Ų59.425%0.24930%0.304CS..Hα-helixtrans-53.3-50.3-176.4-73.9178.6-178.2158.82.3112.7Y86 P90 K95 V96 V97 D278Y86-R93 HydrophobicContact CD2-CB 3.88Å; Y86-R93 HydrophobicContact CD2-CG 3.72Å; Y86-R93 HydrophobicContact CE2-CB 3.73Å; Y86-R93 HydrophobicContact CE2-CG 3.67Å; Y86-R93 HydrophobicContact CG-CG 4.33Å; Y86-R93 VanDerWaalsContact O-CG 3.31Å; Y86-R93 WeakPolarHBondContact O-CG 3.38Å; Y86-R93 PolarHBondContact O-NE 3.13Å; P90-R93 WeakPolarHBondContact O-CB 3.16Å; P90-R93 WeakPolarHBondContact O-CG 3.12Å; P90-R93 PolarHBondContact O-N 3.46Å; R93-K95 VanDerWaalsContact C-N 3.35Å; R93-K95 PolarHBondContact O-N 2.86Å; R93-V96 PolarHBondContact O-N 3.41Å; R93-V96 VanDerWaalsContact O-N 3.14Å; R93-V97 WeakPolarHBondContact O-CG2 3.35Å; R93-V97 PolarHBondContact O-N 3.33Å; R93-D278 IonicContact CZ-OD2 3.64Å; R93-D278 IonicContact NH1-OD2 3.54Å; R93-D278 PolarHBondContact NH1-OD2 3.32Å; R93-D278 IonicContact NH2-OD2 3.67Å
94E93.3Very high93.1Very high155 Ų15560.2 Ų60.272%0.72431%0.307SS*.Hα-helixtrans-56.4-47.1180-172.7177.9-168.200111.9R92 V96 V97 D98R92-E94 PolarHBondContact O-N 3.35Å; E94-V96 VanDerWaalsContact C-N 3.34Å; E94-V96 PolarHBondContact O-N 3.44Å; E94-V97 PolarHBondContact O-N 3.33Å; E94-D98 PolarHBondContact O-N 3.07Å
95K94.3Very high92.8Very high141 Ų14167.8 Ų67.861%0.61334%0.342SS*.Hα-helixtrans-62.6-40.8177.8-67.1-178.3178.2178.70112.7R92 R93 V97 D98 E99R92-K95 PolarHBondContact O-N 2.89Å; R93-K95 VanDerWaalsContact C-N 3.35Å; R93-K95 PolarHBondContact O-N 2.86Å; K95-V97 VanDerWaalsContact C-N 3.33Å; K95-D98 PolarHBondContact O-N 3.24Å; K95-E99 WeakPolarHBondContact O-CG 3.49Å; K95-E99 PolarHBondContact O-N 3.4Å; K95-E99 VanDerWaalsContact O-N 3.14Å
96V94.6Very high92.5Very high3 Ų375.6 Ų75.62%0.01837%0.371CS..Hα-helixtrans-64.6-42178169.50000110.6M82 E85 Y86 R92 R93 E94 D98 E99 L100 I120M82-V96 HydrophobicContact CG-CB 4.48Å; M82-V96 HydrophobicContact CG-CG1 3.32Å; M82-V96 HydrophobicContact SD-CG1 4.12Å; E85-V96 HydrophobicContact CB-CG2 4.18Å; E85-V96 HydrophobicContact CG-CG2 3.84Å; Y86-V96 HydrophobicContact CD2-CB 4.46Å; Y86-V96 HydrophobicContact CD2-CG1 4.33Å; R92-V96 WeakPolarHBondContact O-CG2 3.33Å; R92-V96 PolarHBondContact O-N 2.94Å; R93-V96 PolarHBondContact O-N 3.41Å; R93-V96 VanDerWaalsContact O-N 3.14Å; E94-V96 VanDerWaalsContact C-N 3.34Å; E94-V96 PolarHBondContact O-N 3.44Å; V96-D98 VanDerWaalsContact C-N 3.34Å; V96-D98 PolarHBondContact O-N 3.19Å; V96-E99 PolarHBondContact O-N 3.44Å; V96-L100 PolarHBondContact O-N 2.93Å; V96-I120 HydrophobicContact CG1-CD1 3.99Å
97V95.2Very high92.1Very high37 Ų3778.1 Ų78.122%0.22438%0.382CS..Hα-helixtrans-62.5-42.2176.51740000110.9Y86 R93 E94 K95 E99 L100 I120 E124Y86-V97 HydrophobicContact CD2-CG2 4.3Å; Y86-V97 HydrophobicContact CE2-CG2 3.95Å; R93-V97 WeakPolarHBondContact O-CG2 3.35Å; R93-V97 PolarHBondContact O-N 3.33Å; E94-V97 PolarHBondContact O-N 3.33Å; K95-V97 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 3.48Å; V97-L100 WeakPolarHBondContact O-CB 3.44Å; V97-L100 WeakPolarHBondContact O-CG 3.36Å; V97-L100 PolarHBondContact O-N 3.02Å; V97-I120 HydrophobicContact CG2-CG2 3.99Å; V97-E124 HydrophobicContact CG2-CG 3.78Å
98D95Very high91.7Very high116 Ų11678 Ų7862%0.6239%0.386SS*.Hα-helixtrans-63.8-25176.2-71.9-19.9000113.5E94 K95 V96 P101E94-D98 PolarHBondContact O-N 3.07Å; K95-D98 PolarHBondContact O-N 3.24Å; V96-D98 VanDerWaalsContact C-N 3.34Å; V96-D98 PolarHBondContact O-N 3.19Å; D98-P101 WeakPolarHBondContact O-CD 3.34Å
99E94.2Very high91.5Very high96 Ų9681.7 Ų81.745%0.44940%0.402SS..Hα-helixtrans-83.1-17.2177.7-74.2176.9-168.900113.2M82 K95 V96 V97 S102 L103M82-E99 HydrophobicContact CE-CB 3.83Å; K95-E99 WeakPolarHBondContact O-CG 3.49Å; K95-E99 PolarHBondContact O-N 3.4Å; K95-E99 VanDerWaalsContact O-N 3.14Å; V96-E99 PolarHBondContact O-N 3.44Å; V97-E99 PolarHBondContact O-N 3.48Å; E99-S102 WeakPolarHBondContact O-CB 3.03Å; E99-S102 PolarHBondContact O-N 3.41Å; E99-S102 PolarHBondContact O-OG 3.2Å; E99-L103 PolarHBondContact O-N 3.06Å; E99-L103 VanDerWaalsContact O-N 3.11Å
100L93.6Very high91.6Very high2 Ų281.9 Ų81.91%0.0140%0.404CS..Hα-helixtrans-56.4-42.8-177.3-67.5178.1000114.5M82 V96 V97 S102 L103 F104 A117 I120 L121 Y133M82-L100 HydrophobicContact SD-CD2 3.73Å; V96-L100 PolarHBondContact O-N 2.93Å; V97-L100 WeakPolarHBondContact O-CB 3.44Å; V97-L100 WeakPolarHBondContact O-CG 3.36Å; V97-L100 PolarHBondContact O-N 3.02Å; L100-S102 PolarHBondContact O-N 3.26Å; L100-L103 WeakPolarHBondContact O-CB 3.47Å; L100-L103 PolarHBondContact O-N 3.45Å; L100-L103 VanDerWaalsContact O-N 3.17Å; L100-F104 PolarHBondContact O-N 2.79Å; L100-A117 HydrophobicContact CD2-CB 3.9Å; L100-I120 HydrophobicContact CD1-CB 4.26Å; L100-I120 HydrophobicContact CD1-CG2 3.88Å; L100-I120 HydrophobicContact CD2-CD1 3.89Å; L100-L121 HydrophobicContact CD1-CD1 4.37Å; L100-L121 HydrophobicContact CD1-CD2 3.83Å; L100-L121 HydrophobicContact CD1-CG 3.75Å; L100-Y133 HydrophobicContact CB-CE1 4.45Å
101P93Very high91.8Very high60 Ų6080.5 Ų80.539%0.3940%0.395SS..Hα-helixtrans-59.1-37.5176.2-24.835.9000112.3D98 F104 E105D98-P101 WeakPolarHBondContact O-CD 3.34Å; P101-F104 PolarHBondContact O-N 2.76Å; P101-E105 WeakPolarHBondContact O-CG 3.41Å; P101-E105 PolarHBondContact O-N 2.46Å
102S91.9Very high92Very high47 Ų4774.3 Ų74.333%0.32936%0.362SS..Hα-helixtrans-70.8-34178.779.50000112.7E99 L100 R106E99-S102 WeakPolarHBondContact O-CB 3.03Å; E99-S102 PolarHBondContact O-N 3.41Å; E99-S102 PolarHBondContact O-OG 3.2Å; L100-S102 PolarHBondContact O-N 3.26Å; S102-R106 WeakPolarHBondContact O-CG 3.33Å; S102-R106 PolarHBondContact O-N 3.15Å
103L90Very high92.1Very high13 Ų1369.3 Ų69.37%0.06834%0.344CS..Hα-helixtrans-65.4-45.2172.2-178.272.7000110.2A79 M82 E99 L100 R106 H107 A117A79-L103 HydrophobicContact CB-CD1 4.39Å; A79-L103 HydrophobicContact CB-CD2 3.94Å; M82-L103 HydrophobicContact CE-CB 4.5Å; M82-L103 HydrophobicContact SD-CD2 3.94Å; E99-L103 PolarHBondContact O-N 3.06Å; E99-L103 VanDerWaalsContact O-N 3.11Å; L100-L103 WeakPolarHBondContact O-CB 3.47Å; L100-L103 PolarHBondContact O-N 3.45Å; L100-L103 VanDerWaalsContact O-N 3.17Å; L103-R106 PolarHBondContact O-N 3.34Å; L103-H107 PolarHBondContact O-N 3.41Å; L103-A117 HydrophobicContact CD2-CB 4.46Å
104F89.4Confident92.2Very high28 Ų2866.2 Ų66.212%0.12333%0.332CS..Hα-helixtrans-62.2-43.6178.7-179.7-102000112.2L100 P101 R106 H107 S108 L114 Y133 H136L100-F104 PolarHBondContact O-N 2.79Å; P101-F104 PolarHBondContact O-N 2.76Å; F104-R106 VanDerWaalsContact C-N 3.26Å; F104-R106 PolarHBondContact O-N 2.81Å; F104-H107 CarbonylContact O-C 3.57Å; F104-H107 PolarHBondContact O-N 2.97Å; F104-S108 WeakPolarHBondContact O-CA 3.31Å; F104-S108 VanDerWaalsContact O-CB 3.29Å; F104-S108 WeakPolarHBondContact O-CB 3.33Å; F104-S108 PolarHBondContact O-N 2.93Å; F104-L114 HydrophobicContact CD2-CD2 3.56Å; F104-L114 HydrophobicContact CE2-CD2 3.63Å; F104-Y133 HydrophobicContact CB-CD1 4.2Å; F104-Y133 HydrophobicContact CB-CE1 3.66Å; F104-Y133 HydrophobicContact CB-CE2 4.39Å; F104-Y133 HydrophobicContact CD1-CE2 4.32Å; F104-Y133 AromaticContact CD2-CD1 3.75Å; F104-Y133 HydrophobicContact CD2-CD1 3.75Å; F104-Y133 AromaticContact CD2-CD2 3.87Å; F104-Y133 HydrophobicContact CD2-CD2 3.87Å; F104-Y133 HydrophobicContact CD2-CE1 4.04Å; F104-Y133 HydrophobicContact CD2-CE2 4.16Å; F104-Y133 AromaticContact CD2-CG 3.68Å; F104-Y133 HydrophobicContact CD2-CG 3.68Å; F104-Y133 HydrophobicContact CE2-CD2 4.06Å; F104-Y133 HydrophobicContact CE2-CG 4.04Å; F104-Y133 HydrophobicContact CG-CD1 4.19Å; F104-Y133 HydrophobicContact CG-CD2 4.2Å; F104-Y133 AromaticContact CG-CE1 3.98Å; F104-Y133 HydrophobicContact CG-CE1 3.98Å; F104-Y133 HydrophobicContact CG-CE2 4.01Å; F104-Y133 HydrophobicContact CG-CG 4.31Å; F104-Y133 AromaticContact CG-CZ 3.91Å; F104-H136 AromaticContact CE2-ND1 3.84Å; F104-H136 AromaticContact CZ-CE1 3.52Å; F104-H136 AromaticContact CZ-ND1 3.7Å; F104-H136 AromaticContact CZ-NE2 3.8Å
105E90Very high92.4Very high159 Ų15959.2 Ų59.274%0.74330%0.3SS*.Hα-helixtrans-59.8-35.1175.9-76.6177.3-179.600113P101P101-E105 WeakPolarHBondContact O-CG 3.41Å; P101-E105 PolarHBondContact O-N 2.46Å
106R88.2Confident92.5Very high195 Ų19552.7 Ų52.774%0.73627%0.271SS*.Hα-helixtrans-82.2-31.1-179.4-68.7176.8-171.4-177.36.1113.4S102 L103 F104S102-R106 WeakPolarHBondContact O-CG 3.33Å; S102-R106 PolarHBondContact O-N 3.15Å; L103-R106 PolarHBondContact O-N 3.34Å; F104-R106 VanDerWaalsContact C-N 3.26Å; F104-R106 PolarHBondContact O-N 2.81Å
107H87.9Confident92.6Very high62 Ų6252.7 Ų52.729%0.28727%0.272SS..  trans-135.444.3-168.8-61.3-63.1000112.4L103 F104 T109 E110 C113L103-H107 PolarHBondContact O-N 3.41Å; F104-H107 CarbonylContact O-C 3.57Å; F104-H107 PolarHBondContact O-N 2.97Å; H107-T109 PolarHBondContact O-N 3.4Å; H107-T109 VanDerWaalsContact O-N 3.12Å; H107-E110 HydrophobicContact CB-CB 4.03Å; H107-E110 PolarHBondContact O-N 3.4Å; H107-C113 HydrophobicContact CB-CB 3.82Å
108S85.8Confident92.7Very high43 Ų4350.9 Ų50.930%0.30126%0.261SS..THydrogen-bonded Turntrans-63.9-18.1-172.1580000115.3F104 H136F104-S108 WeakPolarHBondContact O-CA 3.31Å; F104-S108 VanDerWaalsContact O-CB 3.29Å; F104-S108 WeakPolarHBondContact O-CB 3.33Å; F104-S108 PolarHBondContact O-N 2.93Å; S108-H136 WeakPolarHBondContact O-CB 3.27Å
109T87.2Confident92.8Very high106 Ų10646.8 Ų46.865%0.6524%0.24SC*.THydrogen-bonded Turntrans-113.9-0.3179.261.90000113.4H107 P111H107-T109 PolarHBondContact O-N 3.4Å; H107-T109 VanDerWaalsContact O-N 3.12Å; T109-P111 WeakPolarHBondContact O-CD 3.37Å
110E93.5Very high93Very high70 Ų7042.3 Ų42.333%0.32722%0.219SC..  trans-85.4111.5-175.3-176.656.5-145.300110.2P76 H107 V112 C113 L114P76-E110 HydrophobicContact CG-CG 3.92Å; P76-E110 WeakPolarHBondContact CG-OE1 3.34Å; H107-E110 HydrophobicContact CB-CB 4.03Å; H107-E110 PolarHBondContact O-N 3.4Å; E110-V112 VanDerWaalsContact C-N 3.32Å; E110-V112 PolarHBondContact O-N 3.15Å; E110-C113 HydrophobicContact CB-CB 4.07Å; E110-C113 HydrophobicContact CG-CB 4.23Å; E110-C113 WeakPolarHBondContact O-CB 3.4Å; E110-C113 PolarHBondContact O-N 3.1Å; E110-C113 VanDerWaalsContact O-N 3.08Å; E110-L114 WeakPolarHBondContact O-CG 3.33Å; E110-L114 PolarHBondContact O-N 2.99Å; E110-L114 VanDerWaalsContact O-N 3.1Å
111P94Very high93.1Very high38 Ų3842.5 Ų42.525%0.24722%0.22CC..Hα-helixtrans-58.8-40.6-168.1-24.533.6000113.5T109 L114 L115 S137 C140T109-P111 WeakPolarHBondContact O-CD 3.37Å; P111-L114 PolarHBondContact O-N 3.02Å; P111-L115 VanDerWaalsContact O-CB 3.27Å; P111-L115 WeakPolarHBondContact O-CB 3.39Å; P111-L115 PolarHBondContact O-N 3.48Å; P111-S137 WeakPolarHBondContact CB-OG 3.45Å; P111-S137 WeakPolarHBondContact CG-OG 3.31Å; P111-C140 HydrophobicContact CB-CB 3.95Å; P111-C140 HydrophobicContact CG-CB 4.38Å
112V94.9Very high93.2Very high16 Ų1640.1 Ų40.110%0.09721%0.205CC..Hα-helixtrans-67.6-39.4-179.4-1800000111I48 P76 I80 E110 L115 M116I48-V112 HydrophobicContact CD1-CG2 4.28Å; I48-V112 HydrophobicContact CG2-CG1 4.18Å; I48-V112 HydrophobicContact CG2-CG2 4.18Å; P76-V112 HydrophobicContact CB-CB 3.94Å; P76-V112 HydrophobicContact CB-CG1 3.87Å; P76-V112 HydrophobicContact CG-CB 4.35Å; I80-V112 HydrophobicContact CD1-CG1 4.14Å; I80-V112 HydrophobicContact CG1-CG1 4.2Å; E110-V112 VanDerWaalsContact C-N 3.32Å; E110-V112 PolarHBondContact O-N 3.15Å; V112-L115 PolarHBondContact O-N 3.38Å; V112-M116 HydrophobicContact CG1-CG 4.27Å; V112-M116 VanDerWaalsContact O-CG 3.24Å; V112-M116 WeakPolarHBondContact O-CG 3.21Å; V112-M116 PolarHBondContact O-N 2.89Å
113C95.3Very high93.3Very high2 Ų242.9 Ų42.91%0.01421%0.212CC..Hα-helixtrans-62-46.3176.1-65.60000111.2G75 A79 H107 E110 M116 A117G75-C113 PolarHBondContact O-SG 2.69Å; G75-C113 VanDerWaalsContact O-SG 3.39Å; A79-C113 HydrophobicContact CB-CB 4.18Å; H107-C113 HydrophobicContact CB-CB 3.82Å; E110-C113 HydrophobicContact CB-CB 4.07Å; E110-C113 HydrophobicContact CG-CB 4.23Å; E110-C113 WeakPolarHBondContact O-CB 3.4Å; E110-C113 PolarHBondContact O-N 3.1Å; E110-C113 VanDerWaalsContact O-N 3.08Å; C113-M116 PolarHBondContact O-N 3.5Å; C113-A117 WeakPolarHBondContact O-CB 3.21Å; C113-A117 PolarHBondContact O-N 2.97Å
114L96Very high93.4Very high2 Ų246.5 Ų46.51%0.0123%0.229CC..Hα-helixtrans-63.3-42.3177.9-61.1174.6000111.6F104 E110 P111 A117 A118 H136F104-L114 HydrophobicContact CD2-CD2 3.56Å; F104-L114 HydrophobicContact CE2-CD2 3.63Å; E110-L114 WeakPolarHBondContact O-CG 3.33Å; E110-L114 PolarHBondContact O-N 2.99Å; E110-L114 VanDerWaalsContact O-N 3.1Å; P111-L114 PolarHBondContact O-N 3.02Å; L114-A117 PolarHBondContact O-N 2.98Å; L114-A118 VanDerWaalsContact O-CB 3.24Å; L114-A118 WeakPolarHBondContact O-CB 3.45Å; L114-A118 PolarHBondContact O-N 3.46Å; L114-H136 HydrophobicContact CD1-CB 3.98Å
115L96.6Very high93.6Very high7 Ų750 Ų504%0.03725%0.248CC..Hα-helixtrans-63.2-46.1178.2-178.364.3000112.1P111 V112 A118 T119 E142 M146P111-L115 VanDerWaalsContact O-CB 3.27Å; P111-L115 WeakPolarHBondContact O-CB 3.39Å; P111-L115 PolarHBondContact O-N 3.48Å; V112-L115 PolarHBondContact O-N 3.38Å; L115-A118 PolarHBondContact O-N 3.21Å; L115-T119 WeakPolarHBondContact O-CB 3.48Å; L115-T119 PolarHBondContact O-N 3.16Å; L115-T119 PolarHBondContact O-OG1 2.62Å; L115-E142 HydrophobicContact CD1-CB 4.41Å; L115-E142 HydrophobicContact CD2-CB 3.7Å; L115-E142 HydrophobicContact CD2-CG 4.47Å; L115-M146 HydrophobicContact CD1-CB 3.65Å; L115-M146 HydrophobicContact CD1-CG 3.95Å; L115-M146 HydrophobicContact CD1-SD 4.47Å
116M96.8Very high93.9Very high4 Ų445.9 Ų45.92%0.0223%0.232CC..Hα-helixtrans-65.8-42.2178.3-62.7-58.286.800111.2R52 A79 I80 L83 V112 C113 T119 I120R52-M116 HydrophobicContact CG-SD 4.28Å; A79-M116 HydrophobicContact CB-CB 3.97Å; A79-M116 HydrophobicContact CB-CG 4.07Å; I80-M116 HydrophobicContact CG1-CG 3.99Å; I80-M116 HydrophobicContact CG1-SD 3.88Å; L83-M116 HydrophobicContact CB-CB 4.47Å; L83-M116 HydrophobicContact CB-SD 4.27Å; L83-M116 HydrophobicContact CD2-CE 4.27Å; L83-M116 HydrophobicContact CD2-SD 3.44Å; L83-M116 WeakPolarHBondContact CD2-SD 3.33Å; L83-M116 HydrophobicContact CG-SD 4.49Å; V112-M116 HydrophobicContact CG1-CG 4.27Å; V112-M116 VanDerWaalsContact O-CG 3.24Å; V112-M116 WeakPolarHBondContact O-CG 3.21Å; V112-M116 PolarHBondContact O-N 2.89Å; C113-M116 PolarHBondContact O-N 3.5Å; M116-T119 WeakPolarHBondContact O-CB 3.46Å; M116-T119 PolarHBondContact O-N 2.94Å; M116-I120 WeakPolarHBondContact O-CG1 3.31Å; M116-I120 PolarHBondContact O-N 3.21Å; M116-I120 VanDerWaalsContact O-N 3.08Å
117A96.6Very high94.3Very high3 Ų338 Ų383%0.02520%0.203CC..Hα-helixtrans-61.9-45.9175.500000112L100 L103 C113 L114 T119 I120 L121 Y133L100-A117 HydrophobicContact CD2-CB 3.9Å; L103-A117 HydrophobicContact CD2-CB 4.46Å; C113-A117 WeakPolarHBondContact O-CB 3.21Å; C113-A117 PolarHBondContact O-N 2.97Å; L114-A117 PolarHBondContact O-N 2.98Å; A117-T119 VanDerWaalsContact C-N 3.32Å; A117-T119 PolarHBondContact O-N 3.12Å; A117-I120 PolarHBondContact O-N 3.34Å; A117-L121 WeakPolarHBondContact O-CG 3.43Å; A117-L121 PolarHBondContact O-N 2.85Å; A117-Y133 HydrophobicContact CB-CD1 3.73Å; A117-Y133 HydrophobicContact CB-CE1 4.05Å
118A97.2Very high94.7Very high0 Ų042 Ų420%022%0.221CC..Hα-helixtrans-61.6-39.7175.600000112L114 L115 I120 L121 S122 A130 L134 M146L114-A118 VanDerWaalsContact O-CB 3.24Å; L114-A118 WeakPolarHBondContact O-CB 3.45Å; L114-A118 PolarHBondContact O-N 3.46Å; L115-A118 PolarHBondContact O-N 3.21Å; A118-I120 VanDerWaalsContact C-N 3.34Å; A118-I120 PolarHBondContact O-N 3.08Å; A118-L121 PolarHBondContact O-N 3.36Å; A118-S122 WeakPolarHBondContact O-CB 3.32Å; A118-S122 PolarHBondContact O-N 3.22Å; A118-S122 PolarHBondContact O-OG 3Å; A118-S122 VanDerWaalsContact O-OG 3.05Å; A118-A130 HydrophobicContact CB-CB 4.09Å; A118-L134 HydrophobicContact CB-CD1 3.81Å; A118-L134 HydrophobicContact CB-CD2 3.75Å; A118-L134 HydrophobicContact CB-CG 3.71Å; A118-M146 HydrophobicContact CB-CG 4.01Å
119T97.3Very high95.1Very high30 Ų3042.1 Ų42.118%0.18422%0.217CC..Hα-helixtrans-59.5-44.5175.7-55.50000111.2L83 L115 M116 A117 S122 H123L83-T119 HydrophobicContact CD1-CG2 3.88Å; L83-T119 HydrophobicContact CD2-CG2 4.28Å; L115-T119 WeakPolarHBondContact O-CB 3.48Å; L115-T119 PolarHBondContact O-N 3.16Å; L115-T119 PolarHBondContact O-OG1 2.62Å; M116-T119 WeakPolarHBondContact O-CB 3.46Å; M116-T119 PolarHBondContact O-N 2.94Å; A117-T119 VanDerWaalsContact C-N 3.32Å; A117-T119 PolarHBondContact O-N 3.12Å; T119-S122 PolarHBondContact O-N 2.87Å; T119-H123 PolarHBondContact O-CD2 3.06Å; T119-H123 PolarHBondContact O-N 2.95Å
120I97.4Very high95.5Very high1 Ų137 Ų371%0.00519%0.186CC..Hα-helixtrans-62.6-48.1176.3-65.9163.4000110.6M82 L83 Y86 V96 V97 L100 M116 A117 A118 S122 H123 E124M82-I120 HydrophobicContact CG-CD1 4.03Å; M82-I120 HydrophobicContact SD-CD1 4.49Å; L83-I120 HydrophobicContact CB-CD1 4.41Å; L83-I120 HydrophobicContact CD1-CD1 4.46Å; L83-I120 HydrophobicContact CD1-CG1 3.69Å; Y86-I120 HydrophobicContact CD1-CG1 4.22Å; Y86-I120 HydrophobicContact CD1-CG2 4.24Å; Y86-I120 HydrophobicContact CD2-CG2 3.63Å; Y86-I120 HydrophobicContact CE1-CG2 4.4Å; Y86-I120 HydrophobicContact CE2-CG2 3.79Å; Y86-I120 HydrophobicContact CG-CG1 4.12Å; Y86-I120 HydrophobicContact CG-CG2 3.88Å; V96-I120 HydrophobicContact CG1-CD1 3.99Å; V97-I120 HydrophobicContact CG2-CG2 3.99Å; L100-I120 HydrophobicContact CD1-CB 4.26Å; L100-I120 HydrophobicContact CD1-CG2 3.88Å; L100-I120 HydrophobicContact CD2-CD1 3.89Å; M116-I120 WeakPolarHBondContact O-CG1 3.31Å; M116-I120 PolarHBondContact O-N 3.21Å; M116-I120 VanDerWaalsContact O-N 3.08Å; A117-I120 PolarHBondContact O-N 3.34Å; A118-I120 VanDerWaalsContact C-N 3.34Å; A118-I120 PolarHBondContact O-N 3.08Å; I120-S122 VanDerWaalsContact C-N 3.29Å; I120-S122 PolarHBondContact O-N 3.29Å; I120-H123 WeakPolarHBondContact O-CB 3.45Å; I120-H123 PolarHBondContact O-N 2.9Å; I120-H123 VanDerWaalsContact O-N 3.11Å; I120-E124 PolarHBondContact O-N 3.27Å; I120-E124 VanDerWaalsContact O-N 3.16Å
121L96.7Very high95.6Very high7 Ų735.4 Ų35.44%0.03718%0.179CC..Hα-helixtrans-62.2-35.6179.2-71.9165.9000112.7L100 A117 A118 H123 E124 L125 N126 E129 A130 Y133L100-L121 HydrophobicContact CD1-CD1 4.37Å; L100-L121 HydrophobicContact CD1-CD2 3.83Å; L100-L121 HydrophobicContact CD1-CG 3.75Å; A117-L121 WeakPolarHBondContact O-CG 3.43Å; A117-L121 PolarHBondContact O-N 2.85Å; A118-L121 PolarHBondContact O-N 3.36Å; L121-H123 VanDerWaalsContact C-N 3.35Å; L121-E124 CarbonylContact O-C 3.43Å; L121-E124 WeakPolarHBondContact O-CA 3.44Å; L121-E124 PolarHBondContact O-N 3.45Å; L121-L125 PolarHBondContact O-N 3.44Å; L121-L125 VanDerWaalsContact O-N 3.15Å; L121-N126 HydrophobicContact CD2-CB 4.32Å; L121-N126 PolarHBondContact O-N 3.43Å; L121-E129 HydrophobicContact CD1-CB 4.17Å; L121-E129 HydrophobicContact CD1-CG 3.75Å; L121-E129 HydrophobicContact CD2-CB 4.31Å; L121-E129 HydrophobicContact CD2-CG 4.03Å; L121-A130 HydrophobicContact CB-CB 3.88Å; L121-A130 HydrophobicContact CD1-CB 4.32Å; L121-Y133 HydrophobicContact CD1-CD1 4.26Å; L121-Y133 HydrophobicContact CD1-CE1 4.25Å
122S95.4Very high95.6Very high10 Ų1039.5 Ų39.57%0.0719%0.19CC..Hα-helixtrans-66.2-35.1174.3-660000112.7A118 T119 I120 E124 L125 M146 C150A118-S122 WeakPolarHBondContact O-CB 3.32Å; A118-S122 PolarHBondContact O-N 3.22Å; A118-S122 PolarHBondContact O-OG 3Å; A118-S122 VanDerWaalsContact O-OG 3.05Å; T119-S122 PolarHBondContact O-N 2.87Å; I120-S122 VanDerWaalsContact C-N 3.29Å; I120-S122 PolarHBondContact O-N 3.29Å; S122-E124 VanDerWaalsContact C-N 3.29Å; S122-E124 PolarHBondContact O-N 3.08Å; S122-L125 WeakPolarHBondContact O-CA 3.48Å; S122-L125 PolarHBondContact O-N 2.88Å; S122-M146 WeakPolarHBondContact OG-CE 3.16Å; S122-C150 PolarHBondContact OG-SG 3.41Å; S122-C150 VanDerWaalsContact OG-SG 3.41Å
123H92.8Very high95.6Very high104 Ų10438.9 Ų38.948%0.48119%0.186SC..Hα-helixtrans-66.5-31.4171.3-79.3-70.1000112.7Y86 T119 I120 L121 L125Y86-H123 HydrophobicContact CE1-CB 3.51Å; Y86-H123 AromaticContact CE1-CG 3.94Å; Y86-H123 VanDerWaalsContact OH-CB 3.27Å; Y86-H123 WeakPolarHBondContact OH-CB 3.43Å; T119-H123 PolarHBondContact O-CD2 3.06Å; T119-H123 PolarHBondContact O-N 2.95Å; I120-H123 WeakPolarHBondContact O-CB 3.45Å; I120-H123 PolarHBondContact O-N 2.9Å; I120-H123 VanDerWaalsContact O-N 3.11Å; L121-H123 VanDerWaalsContact C-N 3.35Å; H123-L125 PolarHBondContact O-N 3.35Å
124E93.5Very high95.5Very high90 Ų9038.9 Ų38.942%0.42119%0.186SC..THydrogen-bonded Turntrans-78.62.5170.5-65.1-58.8142.900113.5Y86 V97 I120 L121 S122 N126Y86-E124 HydrophobicContact CE2-CG 4.29Å; Y86-E124 WeakPolarHBondContact CE2-OE1 3.4Å; Y86-E124 VanDerWaalsContact CZ-OE1 3.26Å; Y86-E124 PolarHBondContact OH-OE1 3.43Å; V97-E124 HydrophobicContact CG2-CG 3.78Å; I120-E124 PolarHBondContact O-N 3.27Å; I120-E124 VanDerWaalsContact O-N 3.16Å; L121-E124 CarbonylContact O-C 3.43Å; L121-E124 WeakPolarHBondContact O-CA 3.44Å; L121-E124 PolarHBondContact O-N 3.45Å; S122-E124 VanDerWaalsContact C-N 3.29Å; S122-E124 PolarHBondContact O-N 3.08Å; E124-N126 PolarHBondContact O-N 3.46Å; E124-N126 VanDerWaalsContact O-N 3.15Å
125L92.8Very high95.3Very high100 Ų10045.7 Ų45.752%0.52422%0.217SC..THydrogen-bonded Turntrans58.319.4-174.8-51.3176.4000113.8L121 S122 H123 F127L121-L125 PolarHBondContact O-N 3.44Å; L121-L125 VanDerWaalsContact O-N 3.15Å; S122-L125 WeakPolarHBondContact O-CA 3.48Å; S122-L125 PolarHBondContact O-N 2.88Å; H123-L125 PolarHBondContact O-N 3.35Å; L125-F127 HydrophobicContact CB-CE2 4.08Å; L125-F127 HydrophobicContact CB-CZ 4.5Å; L125-F127 HydrophobicContact CD2-CE2 4.06Å; L125-F127 HydrophobicContact CD2-CZ 3.84Å; L125-F127 WeakPolarHBondContact O-CD2 3.36Å; L125-F127 PolarHBondContact O-N 3.29Å
126N95.5Very high95Very high73 Ų7349.7 Ų49.739%0.3924%0.236SC..  trans-92.967.9177.1-169.1-5.1000110.7L121 E124 E128 E129 A130L121-N126 HydrophobicContact CD2-CB 4.32Å; L121-N126 PolarHBondContact O-N 3.43Å; E124-N126 PolarHBondContact O-N 3.46Å; E124-N126 VanDerWaalsContact O-N 3.15Å; N126-E128 VanDerWaalsContact C-N 3.35Å; N126-E128 PolarHBondContact O-N 3.24Å; N126-E129 WeakPolarHBondContact OD1-CB 3.43Å; N126-E129 PolarHBondContact OD1-N 3.45Å; N126-A130 PolarHBondContact O-N 3.31Å
127F96.9Very high94.6Very high30 Ų3050.1 Ų50.113%0.13224%0.239CC..Hα-helixtrans-68.3-31.1-175.3-58.1-69.3000113.5L125 A130 L131 C150 A153 M154L125-F127 HydrophobicContact CB-CE2 4.08Å; L125-F127 HydrophobicContact CB-CZ 4.5Å; L125-F127 HydrophobicContact CD2-CE2 4.06Å; L125-F127 HydrophobicContact CD2-CZ 3.84Å; L125-F127 WeakPolarHBondContact O-CD2 3.36Å; L125-F127 PolarHBondContact O-N 3.29Å; F127-A130 PolarHBondContact O-N 3.46Å; F127-L131 VanDerWaalsContact O-CG 3.28Å; F127-L131 WeakPolarHBondContact O-CG 3.47Å; F127-L131 PolarHBondContact O-N 2.88Å; F127-C150 HydrophobicContact CB-CB 4.21Å; F127-C150 HydrophobicContact CD1-CB 4.12Å; F127-A153 HydrophobicContact CD1-CB 3.96Å; F127-A153 HydrophobicContact CD2-CB 4.03Å; F127-A153 HydrophobicContact CE1-CB 3.6Å; F127-A153 HydrophobicContact CE2-CB 3.68Å; F127-A153 HydrophobicContact CG-CB 4.16Å; F127-A153 HydrophobicContact CZ-CB 3.46Å; F127-A153 VanDerWaalsContact CZ-CB 3.46Å; F127-M154 HydrophobicContact CB-CG 3.62Å; F127-M154 HydrophobicContact CB-SD 3.6Å; F127-M154 HydrophobicContact CD2-CG 4.25Å; F127-M154 HydrophobicContact CG-CG 4.19Å
128E95.7Very high94Very high145 Ų14553 Ų5368%0.67826%0.256SS*.Hα-helixtrans-62.6-45.9178.8-68.3-176.8178.400111.5N126 L131 R132 M154N126-E128 VanDerWaalsContact C-N 3.35Å; N126-E128 PolarHBondContact O-N 3.24Å; E128-L131 PolarHBondContact O-N 3.02Å; E128-R132 PolarHBondContact O-N 2.9Å; E128-R132 VanDerWaalsContact O-N 3.12Å; E128-M154 HydrophobicContact CG-CE 3.56Å; E128-M154 HydrophobicContact CG-SD 4.27Å
129E94.9Very high93.6Very high46 Ų4659.5 Ų59.522%0.21529%0.291CS..Hα-helixtrans-68.8-37.5177.3-17468.1173.800111.6L121 N126 L131 R132 Y133L121-E129 HydrophobicContact CD1-CB 4.17Å; L121-E129 HydrophobicContact CD1-CG 3.75Å; L121-E129 HydrophobicContact CD2-CB 4.31Å; L121-E129 HydrophobicContact CD2-CG 4.03Å; N126-E129 WeakPolarHBondContact OD1-CB 3.43Å; N126-E129 PolarHBondContact OD1-N 3.45Å; E129-L131 VanDerWaalsContact C-N 3.33Å; E129-L131 PolarHBondContact O-N 3.16Å; E129-R132 WeakPolarHBondContact O-CB 3.48Å; E129-R132 PolarHBondContact O-N 3.29Å; E129-R132 IonicContact OE1-CZ 3.4Å; E129-R132 IonicContact OE1-NE 2.69Å; E129-R132 PolarHBondContact OE1-NE 2.97Å; E129-R132 IonicContact OE1-NH2 2.99Å; E129-R132 PolarHBondContact OE1-NH2 3.41Å; E129-R132 IonicContact OE2-CZ 3.53Å; E129-R132 IonicContact OE2-NE 3.28Å; E129-R132 PolarHBondContact OE2-NE 2.91Å; E129-R132 IonicContact OE2-NH2 2.77Å; E129-R132 PolarHBondContact OE2-NH2 2.86Å; E129-Y133 HydrophobicContact CG-CE2 4.15Å; E129-Y133 WeakPolarHBondContact O-CD2 3.43Å; E129-Y133 PolarHBondContact O-N 3.47Å; E129-Y133 VanDerWaalsContact OE1-CE2 3.26Å; E129-Y133 WeakPolarHBondContact OE1-CE2 3.39Å; E129-Y133 PolarHBondContact OE1-OH 3.23Å
130A96.1Very high93.4Very high0 Ų059.4 Ų59.40%029%0.291CS..Hα-helixtrans-58.8-45.5174.600000111.3A118 L121 N126 F127 R132 Y133 L134A118-A130 HydrophobicContact CB-CB 4.09Å; L121-A130 HydrophobicContact CB-CB 3.88Å; L121-A130 HydrophobicContact CD1-CB 4.32Å; N126-A130 PolarHBondContact O-N 3.31Å; F127-A130 PolarHBondContact O-N 3.46Å; A130-R132 VanDerWaalsContact C-N 3.32Å; A130-R132 PolarHBondContact O-N 3.27Å; A130-Y133 PolarHBondContact O-N 3.43Å; A130-L134 VanDerWaalsContact O-CG 3.29Å; A130-L134 WeakPolarHBondContact O-CG 3.45Å; A130-L134 PolarHBondContact O-N 2.58Å
131L96Very high93.3Very high35 Ų3561 Ų6118%0.18330%0.3CS..Hα-helixtrans-62.3-37.5176.5-71.4171.5000112.3F127 E128 E129 Y133 L134 H135 T147 C150 L151 M154F127-L131 VanDerWaalsContact O-CG 3.28Å; F127-L131 WeakPolarHBondContact O-CG 3.47Å; F127-L131 PolarHBondContact O-N 2.88Å; E128-L131 PolarHBondContact O-N 3.02Å; E129-L131 VanDerWaalsContact C-N 3.33Å; E129-L131 PolarHBondContact O-N 3.16Å; L131-Y133 VanDerWaalsContact C-N 3.25Å; L131-Y133 PolarHBondContact O-N 3.28Å; L131-L134 PolarHBondContact O-N 3.13Å; L131-H135 PolarHBondContact O-N 3.16Å; L131-T147 HydrophobicContact CD2-CG2 3.7Å; L131-C150 HydrophobicContact CD1-CB 4.36Å; L131-C150 HydrophobicContact CD2-CB 3.73Å; L131-C150 HydrophobicContact CG-CB 3.84Å; L131-L151 HydrophobicContact CD1-CD2 3.95Å; L131-L151 HydrophobicContact CD1-CG 4.48Å; L131-L151 HydrophobicContact CD2-CD2 4.38Å; L131-L151 HydrophobicContact CD2-CG 4.16Å; L131-M154 HydrophobicContact CD1-SD 3.59Å; L131-M154 VanDerWaalsContact CD1-SD 3.59Å
132R94.1Very high93.3Very high125 Ų12561.8 Ų61.847%0.47230%0.303SS..Hα-helixtrans-58.7-38.8175.2-172.6172.876.398.5-9.1111.7E128 E129 A130 H136E128-R132 PolarHBondContact O-N 2.9Å; E128-R132 VanDerWaalsContact O-N 3.12Å; E129-R132 WeakPolarHBondContact O-CB 3.48Å; E129-R132 PolarHBondContact O-N 3.29Å; E129-R132 IonicContact OE1-CZ 3.4Å; E129-R132 IonicContact OE1-NE 2.69Å; E129-R132 PolarHBondContact OE1-NE 2.97Å; E129-R132 IonicContact OE1-NH2 2.99Å; E129-R132 PolarHBondContact OE1-NH2 3.41Å; E129-R132 IonicContact OE2-CZ 3.53Å; E129-R132 IonicContact OE2-NE 3.28Å; E129-R132 PolarHBondContact OE2-NE 2.91Å; E129-R132 IonicContact OE2-NH2 2.77Å; E129-R132 PolarHBondContact OE2-NH2 2.86Å; A130-R132 VanDerWaalsContact C-N 3.32Å; A130-R132 PolarHBondContact O-N 3.27Å; R132-H136 PolarHBondContact O-CE1 3.41Å; R132-H136 VanDerWaalsContact O-CE1 3.24Å; R132-H136 PolarHBondContact O-ND1 3.33Å
133Y93.4Very high93.3Very high3 Ų361.3 Ų61.31%0.01230%0.3CS..Hα-helixtrans-74.1-47.9179.8-75.5-155.7000110.2L100 F104 A117 L121 E129 A130 L131 H135 H136L100-Y133 HydrophobicContact CB-CE1 4.45Å; F104-Y133 HydrophobicContact CB-CD1 4.2Å; F104-Y133 HydrophobicContact CB-CE1 3.66Å; F104-Y133 HydrophobicContact CB-CE2 4.39Å; F104-Y133 HydrophobicContact CD1-CE2 4.32Å; F104-Y133 AromaticContact CD2-CD1 3.75Å; F104-Y133 HydrophobicContact CD2-CD1 3.75Å; F104-Y133 AromaticContact CD2-CD2 3.87Å; F104-Y133 HydrophobicContact CD2-CD2 3.87Å; F104-Y133 HydrophobicContact CD2-CE1 4.04Å; F104-Y133 HydrophobicContact CD2-CE2 4.16Å; F104-Y133 AromaticContact CD2-CG 3.68Å; F104-Y133 HydrophobicContact CD2-CG 3.68Å; F104-Y133 HydrophobicContact CE2-CD2 4.06Å; F104-Y133 HydrophobicContact CE2-CG 4.04Å; F104-Y133 HydrophobicContact CG-CD1 4.19Å; F104-Y133 HydrophobicContact CG-CD2 4.2Å; F104-Y133 AromaticContact CG-CE1 3.98Å; F104-Y133 HydrophobicContact CG-CE1 3.98Å; F104-Y133 HydrophobicContact CG-CE2 4.01Å; F104-Y133 HydrophobicContact CG-CG 4.31Å; F104-Y133 AromaticContact CG-CZ 3.91Å; A117-Y133 HydrophobicContact CB-CD1 3.73Å; A117-Y133 HydrophobicContact CB-CE1 4.05Å; L121-Y133 HydrophobicContact CD1-CD1 4.26Å; L121-Y133 HydrophobicContact CD1-CE1 4.25Å; E129-Y133 HydrophobicContact CG-CE2 4.15Å; E129-Y133 WeakPolarHBondContact O-CD2 3.43Å; E129-Y133 PolarHBondContact O-N 3.47Å; E129-Y133 VanDerWaalsContact OE1-CE2 3.26Å; E129-Y133 WeakPolarHBondContact OE1-CE2 3.39Å; E129-Y133 PolarHBondContact OE1-OH 3.23Å; A130-Y133 PolarHBondContact O-N 3.43Å; L131-Y133 VanDerWaalsContact C-N 3.25Å; L131-Y133 PolarHBondContact O-N 3.28Å; Y133-H135 PolarHBondContact O-N 2.99Å; Y133-H136 PolarHBondContact O-N 2.75Å; Y133-H136 PolarHBondContact O-ND1 3.07Å
134L94.6Very high93.6Very high2 Ų256.6 Ų56.61%0.0128%0.278CS..Hα-helixtrans-62.3-28.8-177.5-67.2167.5000113.6A118 A130 L131 H136 S137 C143 M146 T147A118-L134 HydrophobicContact CB-CD1 3.81Å; A118-L134 HydrophobicContact CB-CD2 3.75Å; A118-L134 HydrophobicContact CB-CG 3.71Å; A130-L134 VanDerWaalsContact O-CG 3.29Å; A130-L134 WeakPolarHBondContact O-CG 3.45Å; A130-L134 PolarHBondContact O-N 2.58Å; L131-L134 PolarHBondContact O-N 3.13Å; L134-H136 PolarHBondContact O-N 2.97Å; L134-S137 PolarHBondContact O-N 2.99Å; L134-C143 HydrophobicContact CD2-CB 3.99Å; L134-M146 HydrophobicContact CD1-CB 3.93Å; L134-M146 HydrophobicContact CD1-CG 3.75Å; L134-M146 HydrophobicContact CD2-CB 4.1Å; L134-M146 HydrophobicContact CD2-CG 4.24Å; L134-T147 WeakPolarHBondContact CB-OG1 3.48Å
135H91.9Very high93.8Very high144 Ų14452.7 Ų52.767%0.66726%0.261SS*.THydrogen-bonded Turntrans-57.8-20.5177.3-170.365.5000114L131 Y133 S137L131-H135 PolarHBondContact O-N 3.16Å; Y133-H135 PolarHBondContact O-N 2.99Å; H135-S137 VanDerWaalsContact C-N 3.28Å; H135-S137 PolarHBondContact O-N 2.93Å
136H89.6Confident94Very high92 Ų9249 Ų4943%0.42624%0.241SC..THydrogen-bonded Turntrans-81.3-4.5178.7-61.875.6000113.5F104 S108 L114 R132 Y133 L134F104-H136 AromaticContact CE2-ND1 3.84Å; F104-H136 AromaticContact CZ-CE1 3.52Å; F104-H136 AromaticContact CZ-ND1 3.7Å; F104-H136 AromaticContact CZ-NE2 3.8Å; S108-H136 WeakPolarHBondContact O-CB 3.27Å; L114-H136 HydrophobicContact CD1-CB 3.98Å; R132-H136 PolarHBondContact O-CE1 3.41Å; R132-H136 VanDerWaalsContact O-CE1 3.24Å; R132-H136 PolarHBondContact O-ND1 3.33Å; Y133-H136 PolarHBondContact O-N 2.75Å; Y133-H136 PolarHBondContact O-ND1 3.07Å; L134-H136 PolarHBondContact O-N 2.97Å
137S88.4Confident94.1Very high12 Ų1246.5 Ų46.58%0.08423%0.229CC..  trans-138.973.7-179.9-174.40000111.4P111 L134 H135 D139 C143P111-S137 WeakPolarHBondContact CB-OG 3.45Å; P111-S137 WeakPolarHBondContact CG-OG 3.31Å; L134-S137 PolarHBondContact O-N 2.99Å; H135-S137 VanDerWaalsContact C-N 3.28Å; H135-S137 PolarHBondContact O-N 2.93Å; S137-D139 VanDerWaalsContact C-N 3.34Å; S137-C143 VanDerWaalsContact O-CB 3.28Å; S137-C143 WeakPolarHBondContact O-CB 3.27Å
138T84Confident94.2Very high63 Ų6345.1 Ų45.139%0.38722%0.223SC..THydrogen-bonded Turntrans-79.6-14.8178.455.60000113.9C140 L144T138-C140 VanDerWaalsContact C-N 3.33Å; T138-L144 WeakPolarHBondContact O-CD1 3.3Å
139D88.9Confident94.3Very high138 Ų13842.1 Ų42.174%0.73821%0.209SC*.THydrogen-bonded Turntrans-91.34-176.4-56.5-22.9000112.9S137S137-D139 VanDerWaalsContact C-N 3.34Å
140C93.3Very high94.4Very high27 Ų2740 Ų4018%0.18220%0.198CC..  trans-110.5118-178.6-179.90000110.9P111 T138 E142 C143 L144P111-C140 HydrophobicContact CB-CB 3.95Å; P111-C140 HydrophobicContact CG-CB 4.38Å; T138-C140 VanDerWaalsContact C-N 3.33Å; C140-E142 PolarHBondContact O-N 3.04Å; C140-C143 HydrophobicContact CB-CB 3.99Å; C140-C143 WeakPolarHBondContact O-CB 3.23Å; C140-C143 PolarHBondContact O-N 3.08Å; C140-L144 PolarHBondContact O-N 3.49Å
141L94.9Very high94.5Very high36 Ų3640.4 Ų40.419%0.18820%0.201CC..Hα-helixtrans-56.6-36.6178.9-68.8173.3000112.9L144 A145 M167 L170 D171 L176L141-L144 PolarHBondContact O-N 2.82Å; L141-A145 WeakPolarHBondContact O-CB 3.48Å; L141-A145 PolarHBondContact O-N 3.19Å; L141-M167 HydrophobicContact CD2-CB 4.19Å; L141-M167 HydrophobicContact CD2-CE 4.38Å; L141-M167 HydrophobicContact CD2-CG 4.44Å; L141-L170 HydrophobicContact CD2-CB 3.89Å; L141-L170 HydrophobicContact CD2-CD1 4.13Å; L141-D171 HydrophobicContact CD1-CB 3.85Å; L141-L176 HydrophobicContact CB-CD2 4.08Å
142E96.1Very high94.6Very high23 Ų2340.7 Ų40.711%0.10720%0.202CC..Hα-helixtrans-67.2-38.2177.6-59.5-165.1108.600112.3H21 R52 L115 C140 A145 M146 L176H21-E142 IonicContact CE1-OE1 2.68Å; H21-E142 PolarHBondContact CE1-OE1 3.33Å; H21-E142 VanDerWaalsContact CE1-OE1 3.24Å; H21-E142 IonicContact ND1-OE1 3.54Å; R52-E142 IonicContact CZ-OE1 2.96Å; R52-E142 VanDerWaalsContact CZ-OE1 3.28Å; R52-E142 IonicContact CZ-OE2 3.8Å; R52-E142 VanDerWaalsContact NH1-CD 3.29Å; R52-E142 IonicContact NH1-OE1 2.69Å; R52-E142 PolarHBondContact NH1-OE1 2.89Å; R52-E142 IonicContact NH1-OE2 3.58Å; R52-E142 PolarHBondContact NH1-OE2 3.47Å; R52-E142 IonicContact NH2-OE1 2.73Å; R52-E142 PolarHBondContact NH2-OE1 2.78Å; R52-E142 IonicContact NH2-OE2 2.58Å; L115-E142 HydrophobicContact CD1-CB 4.41Å; L115-E142 HydrophobicContact CD2-CB 3.7Å; L115-E142 HydrophobicContact CD2-CG 4.47Å; C140-E142 PolarHBondContact O-N 3.04Å; E142-A145 PolarHBondContact O-N 2.95Å; E142-M146 WeakPolarHBondContact O-CB 3.44Å; E142-M146 PolarHBondContact O-N 3.03Å; E142-L176 HydrophobicContact CB-CD2 4.4Å; E142-L176 HydrophobicContact CG-CD2 3.94Å
143C97Very high94.6Very high0 Ų037.3 Ų37.30%020%0.201CC..Hα-helixtrans-67.8-39.9175.7-650000111.3L134 S137 C140 M146 T147L134-C143 HydrophobicContact CD2-CB 3.99Å; S137-C143 VanDerWaalsContact O-CB 3.28Å; S137-C143 WeakPolarHBondContact O-CB 3.27Å; C140-C143 HydrophobicContact CB-CB 3.99Å; C140-C143 WeakPolarHBondContact O-CB 3.23Å; C140-C143 PolarHBondContact O-N 3.08Å; C143-M146 PolarHBondContact O-N 3.33Å; C143-T147 WeakPolarHBondContact O-CB 3.36Å; C143-T147 PolarHBondContact O-N 3.49Å; C143-T147 PolarHBondContact O-OG1 2.9Å
144L97.7Very high94.8Very high5 Ų540.2 Ų40.23%0.02622%0.215CC..Hα-helixtrans-67.5-41175.5-66.1178.2000111.9T138 C140 L141 M146 T147 V148 T163 E166 M167 L170T138-L144 WeakPolarHBondContact O-CD1 3.3Å; C140-L144 PolarHBondContact O-N 3.49Å; L141-L144 PolarHBondContact O-N 2.82Å; L144-M146 VanDerWaalsContact C-N 3.32Å; L144-M146 PolarHBondContact O-N 3.27Å; L144-T147 WeakPolarHBondContact O-CA 3.5Å; L144-T147 VanDerWaalsContact O-CB 3.27Å; L144-T147 WeakPolarHBondContact O-CB 3.22Å; L144-T147 PolarHBondContact O-N 3.22Å; L144-T147 VanDerWaalsContact O-N 3.12Å; L144-V148 WeakPolarHBondContact O-CG2 3.47Å; L144-V148 PolarHBondContact O-N 3.08Å; L144-T163 HydrophobicContact CB-CG2 4.2Å; L144-T163 HydrophobicContact CD2-CG2 4.03Å; L144-E166 HydrophobicContact CD1-CB 4.31Å; L144-M167 HydrophobicContact CB-CE 4.45Å; L144-M167 HydrophobicContact CB-CG 3.47Å; L144-M167 VanDerWaalsContact CB-CG 3.47Å; L144-M167 HydrophobicContact CB-SD 3.91Å; L144-M167 HydrophobicContact CD1-CB 4.45Å; L144-M167 HydrophobicContact CD1-CG 3.62Å; L144-M167 HydrophobicContact CG-CG 4.21Å; L144-L170 HydrophobicContact CD1-CD1 3.56Å
145A97.6Very high94.8Very high7 Ų746 Ų466%0.05825%0.246CC..Hα-helixtrans-61.4-42.5174.200000111.5L141 E142 T147 V148 H149 M167 L176 T180L141-A145 WeakPolarHBondContact O-CB 3.48Å; L141-A145 PolarHBondContact O-N 3.19Å; E142-A145 PolarHBondContact O-N 2.95Å; A145-T147 VanDerWaalsContact C-N 3.3Å; A145-T147 PolarHBondContact O-N 3.48Å; A145-V148 PolarHBondContact O-N 3.47Å; A145-H149 PolarHBondContact O-N 2.93Å; A145-M167 HydrophobicContact CB-CE 3.9Å; A145-L176 HydrophobicContact CB-CD1 3.86Å; A145-L176 HydrophobicContact CB-CD2 3.93Å; A145-L176 HydrophobicContact CB-CG 3.88Å; A145-T180 HydrophobicContact CB-CG2 4.38Å
146M97.7Very high95.1Very high23 Ų2344.1 Ų44.111%0.11323%0.233CC..Hα-helixtrans-64.8-36.1174.1-166.766.5-158.700112L115 A118 S122 L134 E142 C143 L144 H149 C150L115-M146 HydrophobicContact CD1-CB 3.65Å; L115-M146 HydrophobicContact CD1-CG 3.95Å; L115-M146 HydrophobicContact CD1-SD 4.47Å; A118-M146 HydrophobicContact CB-CG 4.01Å; S122-M146 WeakPolarHBondContact OG-CE 3.16Å; L134-M146 HydrophobicContact CD1-CB 3.93Å; L134-M146 HydrophobicContact CD1-CG 3.75Å; L134-M146 HydrophobicContact CD2-CB 4.1Å; L134-M146 HydrophobicContact CD2-CG 4.24Å; E142-M146 WeakPolarHBondContact O-CB 3.44Å; E142-M146 PolarHBondContact O-N 3.03Å; C143-M146 PolarHBondContact O-N 3.33Å; L144-M146 VanDerWaalsContact C-N 3.32Å; L144-M146 PolarHBondContact O-N 3.27Å; M146-H149 WeakPolarHBondContact O-CB 3.47Å; M146-H149 PolarHBondContact O-N 2.92Å; M146-C150 PolarHBondContact O-N 3.35Å; M146-C150 PolarHBondContact O-SG 3.42Å; M146-C150 VanDerWaalsContact O-SG 3.36Å
147T98.3Very high95.4Very high21 Ų2141.3 Ų41.313%0.12922%0.221CC..Hα-helixtrans-61.5-46.9174.1-63.80000110.4L131 L134 C143 L144 A145 H149 C150 L151 T163L131-T147 HydrophobicContact CD2-CG2 3.7Å; L134-T147 WeakPolarHBondContact CB-OG1 3.48Å; C143-T147 WeakPolarHBondContact O-CB 3.36Å; C143-T147 PolarHBondContact O-N 3.49Å; C143-T147 PolarHBondContact O-OG1 2.9Å; L144-T147 WeakPolarHBondContact O-CA 3.5Å; L144-T147 VanDerWaalsContact O-CB 3.27Å; L144-T147 WeakPolarHBondContact O-CB 3.22Å; L144-T147 PolarHBondContact O-N 3.22Å; L144-T147 VanDerWaalsContact O-N 3.12Å; A145-T147 VanDerWaalsContact C-N 3.3Å; A145-T147 PolarHBondContact O-N 3.48Å; T147-H149 PolarHBondContact O-N 3.15Å; T147-C150 PolarHBondContact O-N 2.89Å; T147-L151 HydrophobicContact CG2-CD1 3.88Å; T147-L151 HydrophobicContact CG2-CG 4.42Å; T147-L151 VanDerWaalsContact O-CG 3.26Å; T147-L151 WeakPolarHBondContact O-CG 3.5Å; T147-L151 PolarHBondContact O-N 3.09Å; T147-T163 HydrophobicContact CG2-CG2 4.09Å
148V98.3Very high95.8Very high0 Ų045 Ų450%024%0.24CC..Hα-helixtrans-59.4-46.3174.6172.50000111.1L144 A145 C150 L151 L152 A160 T163 I164 M167 T180 V184L144-V148 WeakPolarHBondContact O-CG2 3.47Å; L144-V148 PolarHBondContact O-N 3.08Å; A145-V148 PolarHBondContact O-N 3.47Å; V148-C150 VanDerWaalsContact C-N 3.34Å; V148-C150 PolarHBondContact O-N 3.18Å; V148-L151 PolarHBondContact O-N 3.44Å; V148-L151 VanDerWaalsContact O-N 3.17Å; V148-L152 HydrophobicContact CG1-CD1 3.89Å; V148-L152 HydrophobicContact CG1-CG 4.04Å; V148-L152 WeakPolarHBondContact O-CG 3.42Å; V148-L152 PolarHBondContact O-N 3.25Å; V148-A160 HydrophobicContact CG1-CB 4.28Å; V148-T163 HydrophobicContact CG2-CG2 3.65Å; V148-I164 HydrophobicContact CG2-CD1 4.16Å; V148-M167 HydrophobicContact CG2-SD 4.37Å; V148-T180 HydrophobicContact CB-CG2 3.55Å; V148-T180 HydrophobicContact CG1-CG2 3.56Å; V148-T180 HydrophobicContact CG2-CG2 3.73Å; V148-V184 HydrophobicContact CG1-CG2 3.5Å
149H96.7Very high96.4Very high83 Ų8345 Ų4538%0.38424%0.237SC..Hα-helixtrans-53.6-50176.5170.878.1000111.9A145 M146 T147 L151 L152 A153A145-H149 PolarHBondContact O-N 2.93Å; M146-H149 WeakPolarHBondContact O-CB 3.47Å; M146-H149 PolarHBondContact O-N 2.92Å; T147-H149 PolarHBondContact O-N 3.15Å; H149-L151 PolarHBondContact O-N 3.27Å; H149-L152 PolarHBondContact O-N 3.18Å; H149-A153 PolarHBondContact O-N 3.34Å
150C98.1Very high96.8Very high0 Ų038.4 Ų38.40%020%0.202CC..Hα-helixtrans-61.1-43.9176.9-68.20000112.4S122 F127 L131 M146 T147 V148 L152 A153 M154S122-C150 PolarHBondContact OG-SG 3.41Å; S122-C150 VanDerWaalsContact OG-SG 3.41Å; F127-C150 HydrophobicContact CB-CB 4.21Å; F127-C150 HydrophobicContact CD1-CB 4.12Å; L131-C150 HydrophobicContact CD1-CB 4.36Å; L131-C150 HydrophobicContact CD2-CB 3.73Å; L131-C150 HydrophobicContact CG-CB 3.84Å; M146-C150 PolarHBondContact O-N 3.35Å; M146-C150 PolarHBondContact O-SG 3.42Å; M146-C150 VanDerWaalsContact O-SG 3.36Å; T147-C150 PolarHBondContact O-N 2.89Å; V148-C150 VanDerWaalsContact C-N 3.34Å; V148-C150 PolarHBondContact O-N 3.18Å; C150-L152 PolarHBondContact O-N 2.9Å; C150-A153 PolarHBondContact O-N 2.9Å; C150-M154 WeakPolarHBondContact O-CG 3.48Å; C150-M154 PolarHBondContact O-N 2.94Å
151L98.2Very high97Very high9 Ų941.5 Ų41.55%0.04721%0.212CC..Hα-helixtrans-64-40.3179.1-70.8169.4000112.2L131 T147 V148 H149 M154 N155 R156 I159 A160L131-L151 HydrophobicContact CD1-CD2 3.95Å; L131-L151 HydrophobicContact CD1-CG 4.48Å; L131-L151 HydrophobicContact CD2-CD2 4.38Å; L131-L151 HydrophobicContact CD2-CG 4.16Å; T147-L151 HydrophobicContact CG2-CD1 3.88Å; T147-L151 HydrophobicContact CG2-CG 4.42Å; T147-L151 VanDerWaalsContact O-CG 3.26Å; T147-L151 WeakPolarHBondContact O-CG 3.5Å; T147-L151 PolarHBondContact O-N 3.09Å; V148-L151 PolarHBondContact O-N 3.44Å; V148-L151 VanDerWaalsContact O-N 3.17Å; H149-L151 PolarHBondContact O-N 3.27Å; L151-M154 CarbonylContact O-C 3.43Å; L151-M154 PolarHBondContact O-N 3.34Å; L151-N155 PolarHBondContact O-N 3.21Å; L151-N155 VanDerWaalsContact O-N 3.14Å; L151-R156 HydrophobicContact CB-CB 4.45Å; L151-R156 HydrophobicContact CD2-CB 4.02Å; L151-R156 PolarHBondContact O-N 3.01Å; L151-I159 HydrophobicContact CD1-CB 4.04Å; L151-I159 HydrophobicContact CD1-CG2 3.6Å; L151-I159 HydrophobicContact CD2-CB 4.06Å; L151-I159 HydrophobicContact CD2-CD1 4.43Å; L151-I159 HydrophobicContact CD2-CG2 3.99Å; L151-I159 HydrophobicContact CG-CG2 4.47Å; L151-A160 HydrophobicContact CB-CB 4.05Å; L151-A160 HydrophobicContact CD1-CB 4.34Å
152L97.4Very high97.1Very high41 Ų4144.2 Ų44.222%0.21522%0.224CC..Hα-helixtrans-65.5-42.3175.4-68.3-177.6000111.4V148 H149 C150 M154 N155 I157 A160 W183 V184 A187V148-L152 HydrophobicContact CG1-CD1 3.89Å; V148-L152 HydrophobicContact CG1-CG 4.04Å; V148-L152 WeakPolarHBondContact O-CG 3.42Å; V148-L152 PolarHBondContact O-N 3.25Å; H149-L152 PolarHBondContact O-N 3.18Å; C150-L152 PolarHBondContact O-N 2.9Å; L152-M154 PolarHBondContact O-N 3.23Å; L152-N155 WeakPolarHBondContact O-CA 3.12Å; L152-N155 PolarHBondContact O-N 3.32Å; L152-I157 HydrophobicContact CD2-CG1 4.22Å; L152-A160 HydrophobicContact CD2-CB 4.04Å; L152-A160 HydrophobicContact CG-CB 4.48Å; L152-W183 HydrophobicContact CD1-CB 4.08Å; L152-V184 HydrophobicContact CD1-CG2 4.34Å; L152-V184 HydrophobicContact CD2-CG2 4.42Å; L152-A187 HydrophobicContact CD2-CB 3.58Å
153A95.4Very high97.1Very high54 Ų5443.5 Ų43.545%0.44622%0.221SC..Hα-helixtrans-62-32.117500000112.7F127 H149 C150 N155F127-A153 HydrophobicContact CD1-CB 3.96Å; F127-A153 HydrophobicContact CD2-CB 4.03Å; F127-A153 HydrophobicContact CE1-CB 3.6Å; F127-A153 HydrophobicContact CE2-CB 3.68Å; F127-A153 HydrophobicContact CG-CB 4.16Å; F127-A153 HydrophobicContact CZ-CB 3.46Å; F127-A153 VanDerWaalsContact CZ-CB 3.46Å; H149-A153 PolarHBondContact O-N 3.34Å; C150-A153 PolarHBondContact O-N 2.9Å; A153-N155 VanDerWaalsContact C-N 3.28Å
154M96.6Very high97.1Very high64 Ų6444 Ų4432%0.31522%0.223SC..THydrogen-bonded Turntrans-84.44.6173.2-66176.769.300113.9F127 E128 L131 C150 L151 L152 R156F127-M154 HydrophobicContact CB-CG 3.62Å; F127-M154 HydrophobicContact CB-SD 3.6Å; F127-M154 HydrophobicContact CD2-CG 4.25Å; F127-M154 HydrophobicContact CG-CG 4.19Å; E128-M154 HydrophobicContact CG-CE 3.56Å; E128-M154 HydrophobicContact CG-SD 4.27Å; L131-M154 HydrophobicContact CD1-SD 3.59Å; L131-M154 VanDerWaalsContact CD1-SD 3.59Å; C150-M154 WeakPolarHBondContact O-CG 3.48Å; C150-M154 PolarHBondContact O-N 2.94Å; L151-M154 CarbonylContact O-C 3.43Å; L151-M154 PolarHBondContact O-N 3.34Å; L152-M154 PolarHBondContact O-N 3.23Å; M154-R156 HydrophobicContact CB-CG 4.26Å; M154-R156 PolarHBondContact O-N 2.98Å
155N95.7Very high97.1Very high124 Ų12448.6 Ų48.666%0.66324%0.243SC*.THydrogen-bonded Turntrans56.232.3-176.2-164.441.1000113.9L151 L152 A153L151-N155 PolarHBondContact O-N 3.21Å; L151-N155 VanDerWaalsContact O-N 3.14Å; L152-N155 WeakPolarHBondContact O-CA 3.12Å; L152-N155 PolarHBondContact O-N 3.32Å; A153-N155 VanDerWaalsContact C-N 3.28Å
156R97.2Very high97.1Very high104 Ų10452.7 Ų52.739%0.39226%0.261SS..  trans-100.758.5176.4-68.2-56.5-52.7-81.55.5111.6L151 M154 D158 I159 A160L151-R156 HydrophobicContact CB-CB 4.45Å; L151-R156 HydrophobicContact CD2-CB 4.02Å; L151-R156 PolarHBondContact O-N 3.01Å; M154-R156 HydrophobicContact CB-CG 4.26Å; M154-R156 PolarHBondContact O-N 2.98Å; R156-D158 VanDerWaalsContact C-OD1 3.3Å; R156-D158 WeakPolarHBondContact CA-OD1 3.41Å; R156-D158 IonicContact CZ-OD1 2.62Å; R156-D158 IonicContact CZ-OD2 3.63Å; R156-D158 IonicContact NE-OD1 3.41Å; R156-D158 PolarHBondContact NE-OD1 3.48Å; R156-D158 IonicContact NE-OD2 3.47Å; R156-D158 IonicContact NH2-OD1 2.78Å; R156-D158 IonicContact NH2-OD2 2.67Å; R156-D158 PolarHBondContact NH2-OD2 3.01Å; R156-D158 PolarHBondContact O-N 3.19Å; R156-I159 VanDerWaalsContact CZ-CD1 3.43Å; R156-I159 PolarHBondContact O-N 3.38Å; R156-A160 PolarHBondContact O-N 3.45Å; R156-A160 VanDerWaalsContact O-N 3.11Å
157I96.1Very high97.1Very high33 Ų3351.6 Ų51.617%0.16926%0.256CS..Hα-helixtrans-62.7-30.3-176.5-49.3170.8000111.1L152 A160 K161 V184 A187 L188L152-I157 HydrophobicContact CD2-CG1 4.22Å; I157-A160 PolarHBondContact O-N 3.08Å; I157-K161 WeakPolarHBondContact O-CG 3.43Å; I157-K161 PolarHBondContact O-N 2.94Å; I157-V184 HydrophobicContact CG2-CG1 4.41Å; I157-A187 HydrophobicContact CD1-CB 4.01Å; I157-A187 WeakPolarHBondContact CD1-O 3.31Å; I157-A187 HydrophobicContact CG1-CB 4.19Å; I157-A187 HydrophobicContact CG2-CB 4.35Å; I157-L188 HydrophobicContact CG2-CD2 3.62Å; I157-L188 HydrophobicContact CG2-CG 3.9Å
158D96.2Very high97Very high89 Ų8954 Ų5448%0.47627%0.265SS..Hα-helixtrans-57.3-49.2175.860.2-47.8000112.3R156R156-D158 VanDerWaalsContact C-OD1 3.3Å; R156-D158 WeakPolarHBondContact CA-OD1 3.41Å; R156-D158 IonicContact CZ-OD1 2.62Å; R156-D158 IonicContact CZ-OD2 3.63Å; R156-D158 IonicContact NE-OD1 3.41Å; R156-D158 PolarHBondContact NE-OD1 3.48Å; R156-D158 IonicContact NE-OD2 3.47Å; R156-D158 IonicContact NH2-OD1 2.78Å; R156-D158 IonicContact NH2-OD2 2.67Å; R156-D158 PolarHBondContact NH2-OD2 3.01Å; R156-D158 PolarHBondContact O-N 3.19Å
159I96.8Very high97Very high63 Ų6359.8 Ų59.832%0.32330%0.301SS..Hα-helixtrans-72.9-39177.8-57.6-179.8000110.1L151 R156 K161 E162 T163L151-I159 HydrophobicContact CD1-CB 4.04Å; L151-I159 HydrophobicContact CD1-CG2 3.6Å; L151-I159 HydrophobicContact CD2-CB 4.06Å; L151-I159 HydrophobicContact CD2-CD1 4.43Å; L151-I159 HydrophobicContact CD2-CG2 3.99Å; L151-I159 HydrophobicContact CG-CG2 4.47Å; R156-I159 VanDerWaalsContact CZ-CD1 3.43Å; R156-I159 PolarHBondContact O-N 3.38Å; I159-K161 PolarHBondContact O-N 3.36Å; I159-E162 WeakPolarHBondContact O-CA 3.45Å; I159-E162 WeakPolarHBondContact O-CB 3.46Å; I159-E162 PolarHBondContact O-N 3.42Å; I159-T163 PolarHBondContact O-N 3.33Å; I159-T163 PolarHBondContact O-OG1 2.89Å
160A97.6Very high96.9Very high0 Ų059.7 Ų59.70%030%0.303CS..Hα-helixtrans-55.5-38.5179.400000111.8V148 L151 L152 R156 I157 E162 T163 I164 V184V148-A160 HydrophobicContact CG1-CB 4.28Å; L151-A160 HydrophobicContact CB-CB 4.05Å; L151-A160 HydrophobicContact CD1-CB 4.34Å; L152-A160 HydrophobicContact CD2-CB 4.04Å; L152-A160 HydrophobicContact CG-CB 4.48Å; R156-A160 PolarHBondContact O-N 3.45Å; R156-A160 VanDerWaalsContact O-N 3.11Å; I157-A160 PolarHBondContact O-N 3.08Å; A160-E162 PolarHBondContact O-N 2.87Å; A160-T163 PolarHBondContact O-N 3.13Å; A160-I164 WeakPolarHBondContact O-CG1 3.33Å; A160-I164 PolarHBondContact O-N 2.83Å; A160-V184 HydrophobicContact CB-CG2 4.11Å
161K96.8Very high96.7Very high92 Ų9262.8 Ų62.840%0.432%0.32SS..Hα-helixtrans-63.3-37.5174.1-7317972.3167.80113.7I157 I159 I164 K165 V184 L188I157-K161 WeakPolarHBondContact O-CG 3.43Å; I157-K161 PolarHBondContact O-N 2.94Å; I159-K161 PolarHBondContact O-N 3.36Å; K161-I164 PolarHBondContact O-N 3.48Å; K161-K165 PolarHBondContact O-N 3.32Å; K161-V184 HydrophobicContact CG-CG1 3.72Å; K161-L188 HydrophobicContact CD-CD1 4.03Å; K161-L188 HydrophobicContact CD-CD2 3.87Å; K161-L188 HydrophobicContact CD-CG 4.47Å; K161-L188 HydrophobicContact CG-CD1 4.35Å
162E97.1Very high96.5Very high94 Ų9468.5 Ų68.544%0.43935%0.346SS..Hα-helixtrans-68.3-40.6175.9-60-54129.700110.5I159 A160 I164 K165 E166I159-E162 WeakPolarHBondContact O-CA 3.45Å; I159-E162 WeakPolarHBondContact O-CB 3.46Å; I159-E162 PolarHBondContact O-N 3.42Å; A160-E162 PolarHBondContact O-N 2.87Å; E162-I164 VanDerWaalsContact C-N 3.29Å; E162-I164 PolarHBondContact O-N 2.94Å; E162-K165 WeakPolarHBondContact O-CB 3.44Å; E162-K165 PolarHBondContact O-N 3.16Å; E162-K165 IonicContact OE1-NZ 3.71Å; E162-K165 PolarHBondContact OE1-NZ 3.48Å; E162-K165 IonicContact OE2-NZ 3.78Å; E162-K165 PolarHBondContact OE2-NZ 3.37Å; E162-E166 PolarHBondContact O-N 2.99Å
163T96.6Very high96.3Very high7 Ų773.1 Ų73.14%0.04337%0.371CS..Hα-helixtrans-61-35.6173.5-51.50000112.4L144 T147 V148 I159 A160 K165 E166 M167L144-T163 HydrophobicContact CB-CG2 4.2Å; L144-T163 HydrophobicContact CD2-CG2 4.03Å; T147-T163 HydrophobicContact CG2-CG2 4.09Å; V148-T163 HydrophobicContact CG2-CG2 3.65Å; I159-T163 PolarHBondContact O-N 3.33Å; I159-T163 PolarHBondContact O-OG1 2.89Å; A160-T163 PolarHBondContact O-N 3.13Å; T163-K165 VanDerWaalsContact C-N 3.31Å; T163-K165 PolarHBondContact O-N 3.01Å; T163-E166 WeakPolarHBondContact O-CB 3.33Å; T163-E166 PolarHBondContact O-N 3.32Å; T163-M167 WeakPolarHBondContact O-CG 3.03Å; T163-M167 PolarHBondContact O-N 3.41Å
164I97.5Very high96.2Very high10 Ų1071.1 Ų71.15%0.05135%0.354CS..Hα-helixtrans-60.4-40172.6-69.4-59.6000111.9V148 A160 K161 E162 E166 M167 Q168 T180 T181 V184V148-I164 HydrophobicContact CG2-CD1 4.16Å; A160-I164 WeakPolarHBondContact O-CG1 3.33Å; A160-I164 PolarHBondContact O-N 2.83Å; K161-I164 PolarHBondContact O-N 3.48Å; E162-I164 VanDerWaalsContact C-N 3.29Å; E162-I164 PolarHBondContact O-N 2.94Å; I164-E166 VanDerWaalsContact C-N 3.27Å; I164-E166 PolarHBondContact O-N 3.4Å; I164-M167 HydrophobicContact CD1-SD 4.15Å; I164-M167 PolarHBondContact O-N 2.9Å; I164-Q168 HydrophobicContact CG2-CG 4.18Å; I164-Q168 WeakPolarHBondContact O-CB 3.5Å; I164-Q168 VanDerWaalsContact O-CG 3.29Å; I164-Q168 WeakPolarHBondContact O-CG 3.48Å; I164-Q168 PolarHBondContact O-N 3.02Å; I164-T180 HydrophobicContact CD1-CG2 3.69Å; I164-T181 HydrophobicContact CG2-CG2 4.23Å; I164-T181 WeakPolarHBondContact CG2-OG1 3.38Å; I164-V184 HydrophobicContact CD1-CG2 3.98Å; I164-V184 HydrophobicContact CG1-CB 4.22Å; I164-V184 HydrophobicContact CG1-CG2 3.69Å
165K97.6Very high96.1Very high103 Ų10368.5 Ų68.545%0.44834%0.341SS..Hα-helixtrans-64-35.6177.2-60.6175.6-165.6163.10111.7K161 E162 T163 T169K161-K165 PolarHBondContact O-N 3.32Å; E162-K165 WeakPolarHBondContact O-CB 3.44Å; E162-K165 PolarHBondContact O-N 3.16Å; E162-K165 IonicContact OE1-NZ 3.71Å; E162-K165 PolarHBondContact OE1-NZ 3.48Å; E162-K165 IonicContact OE2-NZ 3.78Å; E162-K165 PolarHBondContact OE2-NZ 3.37Å; T163-K165 VanDerWaalsContact C-N 3.31Å; T163-K165 PolarHBondContact O-N 3.01Å; K165-T169 WeakPolarHBondContact O-CB 3.45Å; K165-T169 PolarHBondContact O-N 3.47Å; K165-T169 PolarHBondContact O-OG1 3.3Å
166E96.6Very high96Very high93 Ų9363 Ų6344%0.43531%0.312SS..Hα-helixtrans-64.1-46.3173.4-63.5174-172.400110.6L144 E162 T163 I164 Q168 T169 L170L144-E166 HydrophobicContact CD1-CB 4.31Å; E162-E166 PolarHBondContact O-N 2.99Å; T163-E166 WeakPolarHBondContact O-CB 3.33Å; T163-E166 PolarHBondContact O-N 3.32Å; I164-E166 VanDerWaalsContact C-N 3.27Å; I164-E166 PolarHBondContact O-N 3.4Å; E166-Q168 PolarHBondContact O-N 3.23Å; E166-T169 WeakPolarHBondContact O-CB 3.13Å; E166-T169 PolarHBondContact O-N 3.29Å; E166-L170 PolarHBondContact O-N 3.45Å; E166-L170 VanDerWaalsContact O-N 3.1Å
167M97.5Very high96Very high0 Ų058.1 Ų58.10%029%0.294CS..Hα-helixtrans-60.5-43.9175.9-66-177.975.500112.5L141 L144 A145 V148 T163 I164 T169 L170 D171 L176 T177 T180L141-M167 HydrophobicContact CD2-CB 4.19Å; L141-M167 HydrophobicContact CD2-CE 4.38Å; L141-M167 HydrophobicContact CD2-CG 4.44Å; L144-M167 HydrophobicContact CB-CE 4.45Å; L144-M167 HydrophobicContact CB-CG 3.47Å; L144-M167 VanDerWaalsContact CB-CG 3.47Å; L144-M167 HydrophobicContact CB-SD 3.91Å; L144-M167 HydrophobicContact CD1-CB 4.45Å; L144-M167 HydrophobicContact CD1-CG 3.62Å; L144-M167 HydrophobicContact CG-CG 4.21Å; A145-M167 HydrophobicContact CB-CE 3.9Å; V148-M167 HydrophobicContact CG2-SD 4.37Å; T163-M167 WeakPolarHBondContact O-CG 3.03Å; T163-M167 PolarHBondContact O-N 3.41Å; I164-M167 HydrophobicContact CD1-SD 4.15Å; I164-M167 PolarHBondContact O-N 2.9Å; M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 3.47Å; M167-L170 PolarHBondContact O-N 3.37Å; M167-D171 CarbonylContact O-C 3.53Å; M167-D171 PolarHBondContact O-N 3.47Å; M167-L176 HydrophobicContact CE-CG 4.31Å; M167-T177 HydrophobicContact CB-CG2 3.9Å; M167-T180 HydrophobicContact CE-CG2 4.29Å; M167-T180 HydrophobicContact SD-CG2 3.85Å
168Q97.4Very high96.1Very high70 Ų7059.4 Ų59.433%0.32730%0.299SS..Hα-helixtrans-64-34.4176.7-71.3171.1-22.400112.2I164 E166 L170 E172 T177I164-Q168 HydrophobicContact CG2-CG 4.18Å; I164-Q168 WeakPolarHBondContact O-CB 3.5Å; I164-Q168 VanDerWaalsContact O-CG 3.29Å; I164-Q168 WeakPolarHBondContact O-CG 3.48Å; I164-Q168 PolarHBondContact O-N 3.02Å; E166-Q168 PolarHBondContact O-N 3.23Å; Q168-L170 VanDerWaalsContact C-N 3.32Å; Q168-E172 HydrophobicContact CB-CB 4.46Å; Q168-E172 HydrophobicContact CG-CG 4.4Å; Q168-E172 PolarHBondContact O-N 3.03Å; Q168-T177 HydrophobicContact CG-CG2 3.81Å
169T97Very high96.1Very high123 Ų12355.5 Ų55.576%0.75528%0.278SS*.Hα-helixtrans-67.3-34.8175.2-58.10000111.7K165 E166 M167K165-T169 WeakPolarHBondContact O-CB 3.45Å; K165-T169 PolarHBondContact O-N 3.47Å; K165-T169 PolarHBondContact O-OG1 3.3Å; E166-T169 WeakPolarHBondContact O-CB 3.13Å; E166-T169 PolarHBondContact O-N 3.29Å; M167-T169 VanDerWaalsContact C-N 3.29Å; M167-T169 PolarHBondContact O-N 3.47Å
170L94.9Very high96.1Very high81 Ų8152.5 Ų52.542%0.42426%0.262SS..Hα-helixtrans-75-52.1176.7-69.6177.1000112L141 L144 E166 M167 Q168L141-L170 HydrophobicContact CD2-CB 3.89Å; L141-L170 HydrophobicContact CD2-CD1 4.13Å; L144-L170 HydrophobicContact CD1-CD1 3.56Å; E166-L170 PolarHBondContact O-N 3.45Å; E166-L170 VanDerWaalsContact O-N 3.1Å; M167-L170 PolarHBondContact O-N 3.37Å; Q168-L170 VanDerWaalsContact C-N 3.32Å
171D95.1Very high96.1Very high64 Ų6453.8 Ų53.834%0.34227%0.27SS..Hα-helixtrans-162.595.1-179.8-170-10.1000110.3L141 M167 D173 S174 T177L141-D171 HydrophobicContact CD1-CB 3.85Å; M167-D171 CarbonylContact O-C 3.53Å; M167-D171 PolarHBondContact O-N 3.47Å; D171-D173 VanDerWaalsContact C-N 3.3Å; D171-D173 PolarHBondContact OD1-N 3.25Å; D171-D173 VanDerWaalsContact OD1-N 3.13Å; D171-S174 PolarHBondContact OD1-N 2.9Å; D171-S174 WeakPolarHBondContact OD2-CB 3.26Å; D171-T177 WeakPolarHBondContact O-CB 3.42Å; D171-T177 PolarHBondContact O-OG1 3.25Å
172E93.8Very high96.2Very high129 Ų12949.4 Ų49.460%0.60325%0.251SS*.SBendtrans-65.9-32.9175.6-172.7176.1-179.100112.5Q168 S174Q168-E172 HydrophobicContact CB-CB 4.46Å; Q168-E172 HydrophobicContact CG-CG 4.4Å; Q168-E172 PolarHBondContact O-N 3.03Å; E172-S174 VanDerWaalsContact C-N 3.34Å
173D92.2Very high96.2Very high138 Ų13848 Ų4874%0.73824%0.242SC*.SBendtrans-81.2-14.3-175.4-71.1-40.7000112.7D171 L175 Q178D171-D173 VanDerWaalsContact C-N 3.3Å; D171-D173 PolarHBondContact OD1-N 3.25Å; D171-D173 VanDerWaalsContact OD1-N 3.13Å; D173-L175 PolarHBondContact O-N 3.47Å; D173-Q178 PolarHBondContact O-NE2 2.64Å
174S93.7Very high96.3Very high13 Ų1347.9 Ų47.99%0.09124%0.241CC..  trans-57.8134.9176.1178.30000112.2D171 E172 L176 T177 Q178D171-S174 PolarHBondContact OD1-N 2.9Å; D171-S174 WeakPolarHBondContact OD2-CB 3.26Å; E172-S174 VanDerWaalsContact C-N 3.34Å; S174-L176 PolarHBondContact O-N 2.95Å; S174-L176 PolarHBondContact OG-N 3.17Å; S174-T177 PolarHBondContact O-N 2.81Å; S174-T177 VanDerWaalsContact O-N 3.11Å; S174-Q178 PolarHBondContact O-N 3.45Å
175L93.9Very high96.2Very high8 Ų848.8 Ų48.84%0.04225%0.246CC..Hα-helixtrans-56.3-35.2172.9-62.8-176.4000111.9N18 I22 D173 M179 Y207N18-L175 HydrophobicContact CB-CD1 3.71Å; I22-L175 HydrophobicContact CG2-CD1 3.74Å; D173-L175 PolarHBondContact O-N 3.47Å; L175-M179 WeakPolarHBondContact O-CB 3.38Å; L175-M179 PolarHBondContact O-N 2.91Å; L175-Y207 HydrophobicContact CD1-CD2 4.29Å; L175-Y207 HydrophobicContact CD1-CE1 4.17Å; L175-Y207 HydrophobicContact CD1-CE2 3.96Å; L175-Y207 HydrophobicContact CD2-CD2 4.31Å; L175-Y207 HydrophobicContact CD2-CE2 3.47Å; L175-Y207 VanDerWaalsContact CD2-CE2 3.47Å; L175-Y207 HydrophobicContact CG-CE2 4.36Å
176L95Very high96.2Very high10 Ų1045 Ų455%0.05223%0.23CC..Hα-helixtrans-68.5-41.1-180-172.559.8000111.3L141 E142 A145 M167 S174 M179 T180L141-L176 HydrophobicContact CB-CD2 4.08Å; E142-L176 HydrophobicContact CB-CD2 4.4Å; E142-L176 HydrophobicContact CG-CD2 3.94Å; A145-L176 HydrophobicContact CB-CD1 3.86Å; A145-L176 HydrophobicContact CB-CD2 3.93Å; A145-L176 HydrophobicContact CB-CG 3.88Å; M167-L176 HydrophobicContact CE-CG 4.31Å; S174-L176 PolarHBondContact O-N 2.95Å; S174-L176 PolarHBondContact OG-N 3.17Å; L176-M179 HydrophobicContact CD1-CE 3.76Å; L176-T180 VanDerWaalsContact O-CB 3.26Å; L176-T180 WeakPolarHBondContact O-CB 3.32Å; L176-T180 PolarHBondContact O-N 2.86Å; L176-T180 PolarHBondContact O-OG1 2.94Å
177T97Very high96.1Very high1 Ų142.5 Ų42.51%0.00623%0.225CC..Hα-helixtrans-63.8-47.1176-59.10000111.1M167 Q168 D171 S174 M179 T180 T181M167-T177 HydrophobicContact CB-CG2 3.9Å; Q168-T177 HydrophobicContact CG-CG2 3.81Å; D171-T177 WeakPolarHBondContact O-CB 3.42Å; D171-T177 PolarHBondContact O-OG1 3.25Å; S174-T177 PolarHBondContact O-N 2.81Å; S174-T177 VanDerWaalsContact O-N 3.11Å; T177-M179 PolarHBondContact O-N 3.19Å; T177-T180 PolarHBondContact O-N 3.42Å; T177-T181 WeakPolarHBondContact O-CB 3.2Å; T177-T181 PolarHBondContact O-N 2.71Å; T177-T181 PolarHBondContact O-OG1 3.14Å
178Q97.3Very high96Very high60 Ų6045.2 Ų45.228%0.2824%0.24SC..Hα-helixtrans-62.2-45.1178.3-68.1178.544.300111.6D173 S174 T181 A182 T199 M203D173-Q178 PolarHBondContact O-NE2 2.64Å; S174-Q178 PolarHBondContact O-N 3.45Å; Q178-T181 WeakPolarHBondContact O-CB 3.45Å; Q178-T181 PolarHBondContact O-N 3.11Å; Q178-A182 PolarHBondContact O-N 3.34Å; Q178-T199 HydrophobicContact CB-CG2 4.14Å; Q178-M203 HydrophobicContact CB-CE 3.36Å
179M96.2Very high95.6Very high6 Ų643 Ų433%0.0324%0.235CC..Hα-helixtrans-64-44.8178.9-178.1169.567.600111.8H21 L175 L176 T177 T181 A182 W183 F200 M203 L212H21-M179 WeakPolarHBondContact O-CE 3.46Å; L175-M179 WeakPolarHBondContact O-CB 3.38Å; L175-M179 PolarHBondContact O-N 2.91Å; L176-M179 HydrophobicContact CD1-CE 3.76Å; T177-M179 PolarHBondContact O-N 3.19Å; M179-T181 VanDerWaalsContact C-N 3.31Å; M179-T181 PolarHBondContact O-N 3.23Å; M179-A182 WeakPolarHBondContact O-CB 3.41Å; M179-A182 PolarHBondContact O-N 3.07Å; M179-W183 HydrophobicContact CE-CH2 3.76Å; M179-W183 HydrophobicContact CE-CZ2 3.82Å; M179-W183 HydrophobicContact CG-CD2 4.49Å; M179-W183 HydrophobicContact CG-CH2 4.35Å; M179-W183 HydrophobicContact CG-CZ2 3.74Å; M179-W183 PolarHBondContact O-N 2.87Å; M179-W183 HydrophobicContact SD-CH2 4.34Å; M179-W183 HydrophobicContact SD-CZ2 3.77Å; M179-F200 HydrophobicContact CG-CE1 4.02Å; M179-M203 HydrophobicContact CB-CE 4.08Å; M179-M203 HydrophobicContact CB-SD 4.37Å; M179-L212 HydrophobicContact SD-CD2 4.18Å
180T97.7Very high95.2Very high0 Ų046.4 Ų46.40%023%0.234CC..Hα-helixtrans-66.7-37.3178.9-50.90000110.8A145 V148 I164 M167 L176 T177 A182 W183 V184A145-T180 HydrophobicContact CB-CG2 4.38Å; V148-T180 HydrophobicContact CB-CG2 3.55Å; V148-T180 HydrophobicContact CG1-CG2 3.56Å; V148-T180 HydrophobicContact CG2-CG2 3.73Å; I164-T180 HydrophobicContact CD1-CG2 3.69Å; M167-T180 HydrophobicContact CE-CG2 4.29Å; M167-T180 HydrophobicContact SD-CG2 3.85Å; L176-T180 VanDerWaalsContact O-CB 3.26Å; L176-T180 WeakPolarHBondContact O-CB 3.32Å; L176-T180 PolarHBondContact O-N 2.86Å; L176-T180 PolarHBondContact O-OG1 2.94Å; T177-T180 PolarHBondContact O-N 3.42Å; T180-A182 VanDerWaalsContact C-N 3.33Å; T180-A182 PolarHBondContact O-N 3.11Å; T180-W183 HydrophobicContact CG2-CE3 4.25Å; T180-W183 PolarHBondContact O-N 3.25Å; T180-V184 PolarHBondContact O-N 3Å; T180-V184 VanDerWaalsContact O-N 3.09Å
181T97.9Very high95.1Very high28 Ų2850.9 Ų50.917%0.17225%0.253CS..Hα-helixtrans-60-44.2172.5-58.20000110.9I164 T177 Q178 M179 W183 V184 N185I164-T181 HydrophobicContact CG2-CG2 4.23Å; I164-T181 WeakPolarHBondContact CG2-OG1 3.38Å; T177-T181 WeakPolarHBondContact O-CB 3.2Å; T177-T181 PolarHBondContact O-N 2.71Å; T177-T181 PolarHBondContact O-OG1 3.14Å; Q178-T181 WeakPolarHBondContact O-CB 3.45Å; Q178-T181 PolarHBondContact O-N 3.11Å; M179-T181 VanDerWaalsContact C-N 3.31Å; M179-T181 PolarHBondContact O-N 3.23Å; T181-W183 VanDerWaalsContact C-N 3.35Å; T181-W183 PolarHBondContact O-N 3.27Å; T181-V184 PolarHBondContact O-N 3.04Å; T181-N185 PolarHBondContact O-N 2.87Å
182A97.8Very high95.1Very high0 Ų050.8 Ų50.80%025%0.25CS..Hα-helixtrans-61.7-39.6176.400000112.3Q178 M179 T180 V184 N185 M186 A196 T199 F200Q178-A182 PolarHBondContact O-N 3.34Å; M179-A182 WeakPolarHBondContact O-CB 3.41Å; M179-A182 PolarHBondContact O-N 3.07Å; T180-A182 VanDerWaalsContact C-N 3.33Å; T180-A182 PolarHBondContact O-N 3.11Å; A182-V184 PolarHBondContact O-N 3.13Å; A182-N185 WeakPolarHBondContact O-CB 3.39Å; A182-N185 PolarHBondContact O-N 3.21Å; A182-M186 WeakPolarHBondContact O-CG 3.31Å; A182-M186 PolarHBondContact O-N 3.12Å; A182-A196 HydrophobicContact CB-CB 4.06Å; A182-A196 WeakPolarHBondContact O-CB 3.17Å; A182-T199 HydrophobicContact CB-CG2 4.09Å; A182-F200 HydrophobicContact CB-CD2 4.37Å; A182-F200 HydrophobicContact CB-CE1 4.2Å; A182-F200 HydrophobicContact CB-CE2 3.61Å; A182-F200 HydrophobicContact CB-CZ 3.49Å; A182-F200 VanDerWaalsContact CB-CZ 3.49Å
183W97.2Very high95.2Very high65 Ų6544.8 Ų44.825%0.24622%0.222CC..Hα-helixtrans-62-41.7173.6-63.6-25.3000113L152 M179 T180 T181 N185 M186 A187 F200L152-W183 HydrophobicContact CD1-CB 4.08Å; M179-W183 HydrophobicContact CE-CH2 3.76Å; M179-W183 HydrophobicContact CE-CZ2 3.82Å; M179-W183 HydrophobicContact CG-CD2 4.49Å; M179-W183 HydrophobicContact CG-CH2 4.35Å; M179-W183 HydrophobicContact CG-CZ2 3.74Å; M179-W183 PolarHBondContact O-N 2.87Å; M179-W183 HydrophobicContact SD-CH2 4.34Å; M179-W183 HydrophobicContact SD-CZ2 3.77Å; T180-W183 HydrophobicContact CG2-CE3 4.25Å; T180-W183 PolarHBondContact O-N 3.25Å; T181-W183 VanDerWaalsContact C-N 3.35Å; T181-W183 PolarHBondContact O-N 3.27Å; W183-N185 VanDerWaalsContact C-N 3.34Å; W183-M186 WeakPolarHBondContact O-CB 3.4Å; W183-M186 PolarHBondContact O-N 3.16Å; W183-A187 PolarHBondContact O-N 2.96Å; W183-A187 VanDerWaalsContact O-N 3.08Å; W183-F200 AromaticContact CD1-CZ 3.67Å; W183-F200 AromaticContact NE1-CZ 3.78Å
184V97.9Very high95.4Very high4 Ų441.6 Ų41.62%0.02420%0.203CC..Hα-helixtrans-65.3-40.3175.5175.30000110.9V148 L152 I157 A160 K161 I164 T180 T181 A182 M186 A187 L188V148-V184 HydrophobicContact CG1-CG2 3.5Å; L152-V184 HydrophobicContact CD1-CG2 4.34Å; L152-V184 HydrophobicContact CD2-CG2 4.42Å; I157-V184 HydrophobicContact CG2-CG1 4.41Å; A160-V184 HydrophobicContact CB-CG2 4.11Å; K161-V184 HydrophobicContact CG-CG1 3.72Å; I164-V184 HydrophobicContact CD1-CG2 3.98Å; I164-V184 HydrophobicContact CG1-CB 4.22Å; I164-V184 HydrophobicContact CG1-CG2 3.69Å; T180-V184 PolarHBondContact O-N 3Å; T180-V184 VanDerWaalsContact O-N 3.09Å; T181-V184 PolarHBondContact O-N 3.04Å; A182-V184 PolarHBondContact O-N 3.13Å; V184-M186 VanDerWaalsContact C-N 3.33Å; V184-M186 PolarHBondContact O-N 2.95Å; V184-A187 PolarHBondContact O-N 3.41Å; V184-A187 VanDerWaalsContact O-N 3.15Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 HydrophobicContact CG1-CG 4.43Å; V184-L188 WeakPolarHBondContact O-CG 3.47Å; V184-L188 PolarHBondContact O-N 2.96Å
185N97.3Very high95.5Very high28 Ų2845 Ų4515%0.1522%0.22CC..Hα-helixtrans-60.3-41.2174-79-11.2000112.1T181 A182 W183 A187 L188 G189 H192 A196T181-N185 PolarHBondContact O-N 2.87Å; A182-N185 WeakPolarHBondContact O-CB 3.39Å; A182-N185 PolarHBondContact O-N 3.21Å; W183-N185 VanDerWaalsContact C-N 3.34Å; N185-A187 VanDerWaalsContact C-N 3.32Å; N185-A187 PolarHBondContact O-N 3.49Å; N185-L188 PolarHBondContact O-N 2.9Å; N185-G189 PolarHBondContact O-N 3.43Å; N185-H192 HydrophobicContact CB-CB 3.84Å; N185-H192 VanDerWaalsContact O-CB 3.31Å; N185-H192 WeakPolarHBondContact O-CB 3.43Å; N185-A196 HydrophobicContact CB-CB 3.98Å
186M96.2Very high95.6Very high24 Ų2444.7 Ų44.712%0.11822%0.218CC..Hα-helixtrans-59.1-44.4173-67.7169.369.400111.8A182 W183 V184 L188 G189 L193 A196 F200 C219 C220 M223A182-M186 WeakPolarHBondContact O-CG 3.31Å; A182-M186 PolarHBondContact O-N 3.12Å; W183-M186 WeakPolarHBondContact O-CB 3.4Å; W183-M186 PolarHBondContact O-N 3.16Å; V184-M186 VanDerWaalsContact C-N 3.33Å; V184-M186 PolarHBondContact O-N 2.95Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.18Å; M186-G189 PolarHBondContact O-N 3.28Å; M186-L193 HydrophobicContact CB-CD2 4.3Å; M186-L193 HydrophobicContact CG-CD2 4.29Å; M186-A196 HydrophobicContact CG-CB 3.77Å; M186-F200 HydrophobicContact SD-CE2 3.71Å; M186-F200 HydrophobicContact SD-CZ 4.25Å; M186-C219 HydrophobicContact CE-CB 3.44Å; M186-C219 VanDerWaalsContact CE-CB 3.44Å; M186-C220 VanDerWaalsContact SD-SG 3.61Å; M186-M223 HydrophobicContact CB-SD 4.49Å; M186-M223 HydrophobicContact CE-SD 4.04Å; M186-M223 WeakPolarHBondContact O-CE 3.48Å
187A95.5Very high95.7Very high40 Ų4044.8 Ų44.833%0.33122%0.219SC..Hα-helixtrans-67.2-31.8179.100000113.3L152 I157 W183 V184 N185 G189L152-A187 HydrophobicContact CD2-CB 3.58Å; I157-A187 HydrophobicContact CD1-CB 4.01Å; I157-A187 WeakPolarHBondContact CD1-O 3.31Å; I157-A187 HydrophobicContact CG1-CB 4.19Å; I157-A187 HydrophobicContact CG2-CB 4.35Å; W183-A187 PolarHBondContact O-N 2.96Å; W183-A187 VanDerWaalsContact O-N 3.08Å; V184-A187 PolarHBondContact O-N 3.41Å; V184-A187 VanDerWaalsContact O-N 3.15Å; N185-A187 VanDerWaalsContact C-N 3.32Å; N185-A187 PolarHBondContact O-N 3.49Å; A187-G189 PolarHBondContact O-N 3.01Å
188L94.1Very high95.8Very high58 Ų5850.5 Ų50.530%0.30424%0.244SC..Hα-helixtrans-67.7-20.1177.4-74166.9000113.4I157 K161 V184 N185 M186 H192I157-L188 HydrophobicContact CG2-CD2 3.62Å; I157-L188 HydrophobicContact CG2-CG 3.9Å; K161-L188 HydrophobicContact CD-CD1 4.03Å; K161-L188 HydrophobicContact CD-CD2 3.87Å; K161-L188 HydrophobicContact CD-CG 4.47Å; K161-L188 HydrophobicContact CG-CD1 4.35Å; V184-L188 HydrophobicContact CG1-CD1 4.14Å; V184-L188 HydrophobicContact CG1-CG 4.43Å; V184-L188 WeakPolarHBondContact O-CG 3.47Å; V184-L188 PolarHBondContact O-N 2.96Å; N185-L188 PolarHBondContact O-N 2.9Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.18Å; L188-H192 HydrophobicContact CB-CB 4.37Å; L188-H192 VanDerWaalsContact CB-CD2 3.45Å; L188-H192 WeakPolarHBondContact CB-CD2 3.42Å
189G89.3Confident95.8Very high22 Ų2249.2 Ų49.223%0.22724%0.24CC..  trans100.7-163.717200000114N185 M186 A187 E191 H192 L193N185-G189 PolarHBondContact O-N 3.43Å; M186-G189 PolarHBondContact O-N 3.28Å; A187-G189 PolarHBondContact O-N 3.01Å; G189-E191 VanDerWaalsContact C-N 3.29Å; G189-E191 PolarHBondContact O-N 3.37Å; G189-H192 PolarHBondContact O-N 3.23Å; G189-L193 PolarHBondContact O-N 2.99Å
190R88.8Confident95.8Very high195 Ų19548.9 Ų48.974%0.73624%0.239SC*.Hα-helixtrans-54.8-36.6-157.5-176.1176.6-79.7-159.2-6.4115.3H192 L193R190-H192 PolarHBondContact O-N 3.25Å; R190-L193 HydrophobicContact CB-CD1 4.48Å; R190-L193 PolarHBondContact O-N 2.88Å
191E92.3Very high95.8Very high176 Ų17652 Ų5282%0.82225%0.254SS*.Hα-helixtrans-65.3-23.5-178-61.1-175.917300112.9G189G189-E191 VanDerWaalsContact C-N 3.29Å; G189-E191 PolarHBondContact O-N 3.37Å
192H95.7Very high95.8Very high61 Ų6155.1 Ų55.128%0.28227%0.266SS..Hα-helixtrans-108.5-6-175.6-62.3-70.8000113.6N185 L188 G189 R190 Q194 D195 A196N185-H192 HydrophobicContact CB-CB 3.84Å; N185-H192 VanDerWaalsContact O-CB 3.31Å; N185-H192 WeakPolarHBondContact O-CB 3.43Å; L188-H192 HydrophobicContact CB-CB 4.37Å; L188-H192 VanDerWaalsContact CB-CD2 3.45Å; L188-H192 WeakPolarHBondContact CB-CD2 3.42Å; G189-H192 PolarHBondContact O-N 3.23Å; R190-H192 PolarHBondContact O-N 3.25Å; H192-Q194 VanDerWaalsContact C-N 3.31Å; H192-Q194 PolarHBondContact O-N 2.54Å; H192-D195 PolarHBondContact O-N 3.44Å; H192-A196 PolarHBondContact O-N 2.97Å; H192-A196 VanDerWaalsContact O-N 3.16Å
193L96.1Very high95.6Very high3 Ų355.3 Ų55.32%0.01627%0.267CS..Hα-helixtrans-64-36.3-178.6-70.7174.3000112.7M186 G189 R190 D195 A196 L197 M223 M224M186-L193 HydrophobicContact CB-CD2 4.3Å; M186-L193 HydrophobicContact CG-CD2 4.29Å; G189-L193 PolarHBondContact O-N 2.99Å; R190-L193 HydrophobicContact CB-CD1 4.48Å; R190-L193 PolarHBondContact O-N 2.88Å; L193-D195 VanDerWaalsContact C-N 3.33Å; L193-D195 PolarHBondContact O-N 2.95Å; L193-A196 PolarHBondContact O-N 3.33Å; L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.37Å; L193-L197 PolarHBondContact O-N 3.16Å; L193-M223 HydrophobicContact CD1-CB 3.58Å; L193-M223 HydrophobicContact CD2-CB 3.91Å; L193-M223 HydrophobicContact CD2-CE 3.86Å; L193-M223 HydrophobicContact CD2-SD 3.93Å; L193-M223 HydrophobicContact CG-CB 4.43Å; L193-M224 HydrophobicContact CB-CG 3.61Å; L193-M224 HydrophobicContact CB-SD 4Å; L193-M224 HydrophobicContact CD1-CG 3.7Å; L193-M224 HydrophobicContact CG-CG 4.28Å
194Q96Very high95.6Very high71 Ų7153.1 Ų53.133%0.33226%0.26SS..Hα-helixtrans-63.9-40.9179.6-173.36454.600111.5H192 L197 F198 M224H192-Q194 VanDerWaalsContact C-N 3.31Å; H192-Q194 PolarHBondContact O-N 2.54Å; Q194-L197 PolarHBondContact O-N 3.15Å; Q194-F198 HydrophobicContact CG-CD2 4.05Å; Q194-F198 HydrophobicContact CG-CE2 3.57Å; Q194-F198 HydrophobicContact CG-CZ 4.08Å; Q194-F198 VanDerWaalsContact NE2-CE2 3.3Å; Q194-F198 VanDerWaalsContact O-CD2 3.28Å; Q194-F198 WeakPolarHBondContact O-CD2 3.31Å; Q194-F198 WeakPolarHBondContact O-CG 3.32Å; Q194-F198 PolarHBondContact O-N 3.17Å; Q194-M224 HydrophobicContact CB-CE 4.5Å
195D95.8Very high95.6Very high86 Ų8658.5 Ų58.546%0.4629%0.289SS..Hα-helixtrans-66.9-45.5178.3-64.6-19.6000110.6H192 L193 L197 F198 T199H192-D195 PolarHBondContact O-N 3.44Å; L193-D195 VanDerWaalsContact C-N 3.33Å; L193-D195 PolarHBondContact O-N 2.95Å; D195-L197 VanDerWaalsContact C-N 3.33Å; D195-L197 PolarHBondContact O-N 3.04Å; D195-F198 PolarHBondContact O-N 3.48Å; D195-T199 PolarHBondContact O-N 3.41Å; D195-T199 PolarHBondContact O-OG1 3.34Å
196A97.1Very high95.4Very high0 Ų063.3 Ų63.30%031%0.308CS..Hα-helixtrans-58.6-45.2175.100000111.9A182 N185 M186 H192 L193 F198 T199 F200A182-A196 HydrophobicContact CB-CB 4.06Å; A182-A196 WeakPolarHBondContact O-CB 3.17Å; N185-A196 HydrophobicContact CB-CB 3.98Å; M186-A196 HydrophobicContact CG-CB 3.77Å; H192-A196 PolarHBondContact O-N 2.97Å; H192-A196 VanDerWaalsContact O-N 3.16Å; L193-A196 PolarHBondContact O-N 3.33Å; A196-F198 VanDerWaalsContact C-N 3.33Å; A196-F198 PolarHBondContact O-N 3.11Å; A196-T199 WeakPolarHBondContact O-CB 3.23Å; A196-T199 PolarHBondContact O-N 3.36Å; A196-F200 HydrophobicContact CB-CE2 4.39Å; A196-F200 WeakPolarHBondContact O-CD2 3.5Å; A196-F200 PolarHBondContact O-N 3.07Å; A196-F200 VanDerWaalsContact O-N 3.08Å
197L97.4Very high95.2Very high13 Ų1366.9 Ų66.97%0.06832%0.321CS..Hα-helixtrans-57.9-45.7177-176.7150.6000111.5L193 Q194 D195 F200 Q201 L217 C220 Q221 M224L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.37Å; L193-L197 PolarHBondContact O-N 3.16Å; Q194-L197 PolarHBondContact O-N 3.15Å; D195-L197 VanDerWaalsContact C-N 3.33Å; D195-L197 PolarHBondContact O-N 3.04Å; L197-F200 PolarHBondContact O-N 3.15Å; L197-Q201 WeakPolarHBondContact O-CB 3.35Å; L197-Q201 PolarHBondContact O-N 3.48Å; L197-L217 HydrophobicContact CD1-CD1 4.47Å; L197-L217 HydrophobicContact CD2-CD1 4.35Å; L197-L217 HydrophobicContact CG-CD1 3.77Å; L197-C220 HydrophobicContact CB-CB 3.96Å; L197-C220 HydrophobicContact CD1-CB 4.19Å; L197-C220 HydrophobicContact CG-CB 4.36Å; L197-Q221 HydrophobicContact CD1-CG 4.05Å; L197-M224 HydrophobicContact CD1-SD 3.67Å
198F97.6Very high95.1Very high120 Ų12066.6 Ų66.653%0.52632%0.322SS..Hα-helixtrans-64.4-40.1178.1-72.6-39000112.6Q194 D195 A196 F200 Q201 E202Q194-F198 HydrophobicContact CG-CD2 4.05Å; Q194-F198 HydrophobicContact CG-CE2 3.57Å; Q194-F198 HydrophobicContact CG-CZ 4.08Å; Q194-F198 VanDerWaalsContact NE2-CE2 3.3Å; Q194-F198 VanDerWaalsContact O-CD2 3.28Å; Q194-F198 WeakPolarHBondContact O-CD2 3.31Å; Q194-F198 WeakPolarHBondContact O-CG 3.32Å; Q194-F198 PolarHBondContact O-N 3.17Å; D195-F198 PolarHBondContact O-N 3.48Å; A196-F198 VanDerWaalsContact C-N 3.33Å; A196-F198 PolarHBondContact O-N 3.11Å; F198-F200 PolarHBondContact O-N 3.46Å; F198-Q201 PolarHBondContact O-N 3.26Å; F198-E202 WeakPolarHBondContact O-CB 3.45Å; F198-E202 PolarHBondContact O-N 3.08Å
199T97.3Very high95.1Very high33 Ų3365.3 Ų65.320%0.20232%0.317CS..Hα-helixtrans-57.7-47.5174.2-57.40000111.5Q178 A182 D195 A196 E202 M203Q178-T199 HydrophobicContact CB-CG2 4.14Å; A182-T199 HydrophobicContact CB-CG2 4.09Å; D195-T199 PolarHBondContact O-N 3.41Å; D195-T199 PolarHBondContact O-OG1 3.34Å; A196-T199 WeakPolarHBondContact O-CB 3.23Å; A196-T199 PolarHBondContact O-N 3.36Å; T199-E202 PolarHBondContact O-N 2.97Å; T199-M203 HydrophobicContact CG2-CE 3.65Å; T199-M203 HydrophobicContact CG2-SD 4.42Å; T199-M203 WeakPolarHBondContact O-CG 3.44Å; T199-M203 PolarHBondContact O-N 3.44Å
200F97.5Very high95.4Very high0 Ų064.9 Ų64.90%031%0.311CS..Hα-helixtrans-66.4-41.2178.5-67-58.6000112.8M179 A182 W183 M186 A196 L197 F198 M203 I204 L213 S216 L217M179-F200 HydrophobicContact CG-CE1 4.02Å; A182-F200 HydrophobicContact CB-CD2 4.37Å; A182-F200 HydrophobicContact CB-CE1 4.2Å; A182-F200 HydrophobicContact CB-CE2 3.61Å; A182-F200 HydrophobicContact CB-CZ 3.49Å; A182-F200 VanDerWaalsContact CB-CZ 3.49Å; W183-F200 AromaticContact CD1-CZ 3.67Å; W183-F200 AromaticContact NE1-CZ 3.78Å; M186-F200 HydrophobicContact SD-CE2 3.71Å; M186-F200 HydrophobicContact SD-CZ 4.25Å; A196-F200 HydrophobicContact CB-CE2 4.39Å; A196-F200 WeakPolarHBondContact O-CD2 3.5Å; A196-F200 PolarHBondContact O-N 3.07Å; A196-F200 VanDerWaalsContact O-N 3.08Å; L197-F200 PolarHBondContact O-N 3.15Å; F198-F200 PolarHBondContact O-N 3.46Å; F200-M203 PolarHBondContact O-N 2.72Å; F200-I204 WeakPolarHBondContact O-CD1 3.47Å; F200-I204 VanDerWaalsContact O-CG1 3.29Å; F200-I204 WeakPolarHBondContact O-CG1 3.37Å; F200-I204 PolarHBondContact O-N 3.3Å; F200-L213 HydrophobicContact CD1-CD2 4.12Å; F200-S216 VanDerWaalsContact CE1-CB 3.41Å; F200-S216 VanDerWaalsContact CZ-CB 3.41Å; F200-L217 HydrophobicContact CB-CB 4.27Å; F200-L217 HydrophobicContact CB-CD1 4.36Å
201Q97.3Very high95.7Very high66 Ų6656.9 Ų56.931%0.30828%0.283SS..Hα-helixtrans-62.4-44.5177.2-172.56359.700111.3L197 F198 M203 I204 D205L197-Q201 WeakPolarHBondContact O-CB 3.35Å; L197-Q201 PolarHBondContact O-N 3.48Å; F198-Q201 PolarHBondContact O-N 3.26Å; Q201-M203 VanDerWaalsContact C-N 3.33Å; Q201-M203 PolarHBondContact O-N 3.38Å; Q201-I204 PolarHBondContact O-N 3.07Å; Q201-D205 PolarHBondContact NE2-OD1 3.05Å; Q201-D205 WeakPolarHBondContact O-CB 3.44Å; Q201-D205 PolarHBondContact O-N 3.43Å
202E96.9Very high95.8Very high92 Ų9251.1 Ų51.143%0.4326%0.258SS..Hα-helixtrans-62.6-40.2177.8-174.9178.9159.100111.9F198 T199 D205 K206F198-E202 WeakPolarHBondContact O-CB 3.45Å; F198-E202 PolarHBondContact O-N 3.08Å; T199-E202 PolarHBondContact O-N 2.97Å; E202-D205 PolarHBondContact O-N 3.17Å; E202-K206 HydrophobicContact CG-CD 4.05Å; E202-K206 WeakPolarHBondContact O-CB 2.92Å; E202-K206 WeakPolarHBondContact O-CG 3.45Å; E202-K206 PolarHBondContact O-N 3.41Å; E202-K206 VanDerWaalsContact OE1-CE 3.27Å; E202-K206 WeakPolarHBondContact OE1-CE 3.39Å; E202-K206 IonicContact OE1-NZ 2.77Å; E202-K206 PolarHBondContact OE1-NZ 3.24Å
203M95.3Very high95.9Very high4 Ų448.2 Ų48.22%0.0225%0.245CC..Hα-helixtrans-63.4-42.6173.8-72.1178.1-176.200111.9Q178 M179 T199 F200 Q201 K206 Y207 L213Q178-M203 HydrophobicContact CB-CE 3.36Å; M179-M203 HydrophobicContact CB-CE 4.08Å; M179-M203 HydrophobicContact CB-SD 4.37Å; T199-M203 HydrophobicContact CG2-CE 3.65Å; T199-M203 HydrophobicContact CG2-SD 4.42Å; T199-M203 WeakPolarHBondContact O-CG 3.44Å; T199-M203 PolarHBondContact O-N 3.44Å; F200-M203 PolarHBondContact O-N 2.72Å; Q201-M203 VanDerWaalsContact C-N 3.33Å; Q201-M203 PolarHBondContact O-N 3.38Å; M203-K206 PolarHBondContact O-N 3.41Å; M203-Y207 HydrophobicContact CB-CD2 4.49Å; M203-Y207 WeakPolarHBondContact O-CB 3.49Å; M203-Y207 WeakPolarHBondContact O-CD2 3.19Å; M203-Y207 PolarHBondContact O-N 2.86Å; M203-L213 HydrophobicContact CB-CD1 4.09Å; M203-L213 HydrophobicContact CB-CD2 4.17Å; M203-L213 HydrophobicContact SD-CD2 4.02Å
204I96.8Very high96Very high19 Ų1948.2 Ų48.210%0.09725%0.245CC..Hα-helixtrans-62.5-44.4176.6-71.9163.6000110.7F200 Q201 K206 G208 L213 L214 L217F200-I204 WeakPolarHBondContact O-CD1 3.47Å; F200-I204 VanDerWaalsContact O-CG1 3.29Å; F200-I204 WeakPolarHBondContact O-CG1 3.37Å; F200-I204 PolarHBondContact O-N 3.3Å; Q201-I204 PolarHBondContact O-N 3.07Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 2.9Å; I204-G208 CarbonylContact O-C 3.37Å; I204-G208 WeakPolarHBondContact O-CA 3.34Å; I204-G208 PolarHBondContact O-N 3.28Å; I204-L213 HydrophobicContact CD1-CB 4.03Å; I204-L213 HydrophobicContact CG1-CB 3.69Å; I204-L213 HydrophobicContact CG1-CD1 4.01Å; I204-L213 HydrophobicContact CG1-CG 4.47Å; I204-L214 HydrophobicContact CD1-CD2 4.09Å; I204-L217 HydrophobicContact CD1-CB 4.25Å; I204-L217 HydrophobicContact CD1-CD2 3.68Å
205D96.3Very high96Very high118 Ų11846 Ų4663%0.63124%0.235SC*.Hα-helixtrans-66-35.8-179.1-67.4-12.9000111.8Q201 E202Q201-D205 PolarHBondContact NE2-OD1 3.05Å; Q201-D205 WeakPolarHBondContact O-CB 3.44Å; Q201-D205 PolarHBondContact O-N 3.43Å; E202-D205 PolarHBondContact O-N 3.17Å
206K94.7Very high96.1Very high128 Ų12842.4 Ų42.456%0.55722%0.216SC*.Hα-helixtrans-82.6-41.1-178.8-74.4177.6175177.40114.1E202 M203 I204E202-K206 HydrophobicContact CG-CD 4.05Å; E202-K206 WeakPolarHBondContact O-CB 2.92Å; E202-K206 WeakPolarHBondContact O-CG 3.45Å; E202-K206 PolarHBondContact O-N 3.41Å; E202-K206 VanDerWaalsContact OE1-CE 3.27Å; E202-K206 WeakPolarHBondContact OE1-CE 3.39Å; E202-K206 IonicContact OE1-NZ 2.77Å; E202-K206 PolarHBondContact OE1-NZ 3.24Å; M203-K206 PolarHBondContact O-N 3.41Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 2.9Å
207Y91.8Very high96.1Very high100 Ų10042.6 Ų42.639%0.39222%0.217SC..Hα-helixtrans-115.9-6.1-168.9-56.2-77.6000113.8I22 L175 M203I22-Y207 HydrophobicContact CD1-CG 4.33Å; L175-Y207 HydrophobicContact CD1-CD2 4.29Å; L175-Y207 HydrophobicContact CD1-CE1 4.17Å; L175-Y207 HydrophobicContact CD1-CE2 3.96Å; L175-Y207 HydrophobicContact CD2-CD2 4.31Å; L175-Y207 HydrophobicContact CD2-CE2 3.47Å; L175-Y207 VanDerWaalsContact CD2-CE2 3.47Å; L175-Y207 HydrophobicContact CG-CE2 4.36Å; M203-Y207 HydrophobicContact CB-CD2 4.49Å; M203-Y207 WeakPolarHBondContact O-CB 3.49Å; M203-Y207 WeakPolarHBondContact O-CD2 3.19Å; M203-Y207 PolarHBondContact O-N 2.86Å
208G92.7Very high96.1Very high34 Ų3442 Ų4235%0.35122%0.215SC..  trans91.1158.9-176.400000113.2I204I204-G208 CarbonylContact O-C 3.37Å; I204-G208 WeakPolarHBondContact O-CA 3.34Å; I204-G208 PolarHBondContact O-N 3.28Å
209S94.1Very high96Very high30 Ų3037.7 Ų37.721%0.2120%0.199CC..  trans-78.3123.8-179.359.30000112.2E236 K240S209-E236 VanDerWaalsContact CB-OE1 3.25Å; S209-E236 WeakPolarHBondContact CB-OE1 3.04Å; S209-E236 PolarHBondContact OG-OE1 2.98Å; S209-K240 VanDerWaalsContact O-CE 3.28Å; S209-K240 WeakPolarHBondContact O-CE 3.4Å; S209-K240 PolarHBondContact O-NZ 3.34Å; S209-K240 WeakPolarHBondContact OG-CE 3.12Å; S209-K240 PolarHBondContact OG-NZ 3.04Å
210T95.4Very high96Very high14 Ų1436.1 Ų36.19%0.08619%0.189CC..  trans-113.6160169.768.90000109.7I22 L212 L213 L214I22-T210 HydrophobicContact CG1-CG2 4.4Å; I22-T210 VanDerWaalsContact O-CB 3.28Å; I22-T210 WeakPolarHBondContact O-CB 3.43Å; I22-T210 VanDerWaalsContact O-CG2 3.28Å; I22-T210 WeakPolarHBondContact O-CG2 3.35Å; I22-T210 PolarHBondContact O-OG1 2.88Å; T210-L212 PolarHBondContact O-N 3.28Å; T210-L213 PolarHBondContact O-N 2.99Å; T210-L213 WeakPolarHBondContact OG1-CG 3.38Å; T210-L213 PolarHBondContact OG1-N 3.15Å; T210-L214 WeakPolarHBondContact O-CB 3.49Å; T210-L214 VanDerWaalsContact O-CG 3.28Å; T210-L214 WeakPolarHBondContact O-CG 3.34Å; T210-L214 PolarHBondContact O-N 3.25Å
211V95.7Very high96Very high26 Ų2637.1 Ų37.116%0.15819%0.194CC..Hα-helixtrans-58.1-37.8177.2178.20000110.9N215 K240 D241 N244 V247V211-N215 WeakPolarHBondContact O-CB 3.32Å; V211-N215 PolarHBondContact O-N 2.99Å; V211-K240 HydrophobicContact CG2-CB 3.79Å; V211-D241 HydrophobicContact CG1-CB 4.49Å; V211-D241 HydrophobicContact CG2-CB 3.72Å; V211-N244 HydrophobicContact CG1-CB 3.89Å; V211-N244 WeakPolarHBondContact CG1-ND2 3.37Å; V211-V247 HydrophobicContact CG1-CG2 3.79Å
212L95.2Very high96Very high56 Ų5635 Ų3529%0.29319%0.185SC..Hα-helixtrans-61.4-53177-179.865.6000111.8H21 M179 T210 N215 S216H21-L212 WeakPolarHBondContact O-CD2 3.31Å; M179-L212 HydrophobicContact SD-CD2 4.18Å; T210-L212 PolarHBondContact O-N 3.28Å; L212-N215 PolarHBondContact O-N 2.69Å; L212-S216 PolarHBondContact O-N 3.39Å; L212-S216 VanDerWaalsContact O-N 3.08Å; L212-S216 PolarHBondContact O-OG 3.13Å
213L97.1Very high95.9Very high0 Ų034.9 Ų34.90%019%0.185CC..Hα-helixtrans-66.8-41.7-178.3-66.7177.1000111.8I22 F200 M203 I204 T210 N215 S216 L217I22-L213 HydrophobicContact CB-CD1 4.17Å; F200-L213 HydrophobicContact CD1-CD2 4.12Å; M203-L213 HydrophobicContact CB-CD1 4.09Å; M203-L213 HydrophobicContact CB-CD2 4.17Å; M203-L213 HydrophobicContact SD-CD2 4.02Å; I204-L213 HydrophobicContact CD1-CB 4.03Å; I204-L213 HydrophobicContact CG1-CB 3.69Å; I204-L213 HydrophobicContact CG1-CD1 4.01Å; I204-L213 HydrophobicContact CG1-CG 4.47Å; T210-L213 PolarHBondContact O-N 2.99Å; T210-L213 WeakPolarHBondContact OG1-CG 3.38Å; T210-L213 PolarHBondContact OG1-N 3.15Å; L213-N215 VanDerWaalsContact C-N 3.35Å; L213-S216 PolarHBondContact O-N 2.77Å; L213-L217 WeakPolarHBondContact O-CB 3.48Å; L213-L217 PolarHBondContact O-N 3.3Å
214L97.7Very high95.9Very high3 Ų336.6 Ų36.62%0.01619%0.194CC..Hα-helixtrans-64.5-39.4176.9-70.4171.3000111.6I204 T210 L217 A218 V233 E236 K240I204-L214 HydrophobicContact CD1-CD2 4.09Å; T210-L214 WeakPolarHBondContact O-CB 3.49Å; T210-L214 VanDerWaalsContact O-CG 3.28Å; T210-L214 WeakPolarHBondContact O-CG 3.34Å; T210-L214 PolarHBondContact O-N 3.25Å; L214-L217 PolarHBondContact O-N 3.48Å; L214-A218 VanDerWaalsContact O-CB 3.29Å; L214-A218 WeakPolarHBondContact O-CB 3.2Å; L214-A218 PolarHBondContact O-N 2.9Å; L214-V233 HydrophobicContact CB-CG1 4.1Å; L214-V233 HydrophobicContact CD2-CG1 3.88Å; L214-V233 WeakPolarHBondContact O-CG1 2.91Å; L214-E236 HydrophobicContact CD1-CB 4.29Å; L214-E236 HydrophobicContact CD1-CG 3.89Å; L214-K240 HydrophobicContact CD1-CD 3.86Å
215N96.3Very high95.8Very high25 Ų2537 Ų3713%0.13420%0.202CC..Hα-helixtrans-62.2-46.9175.5-168.577.7000111.1V211 L212 L213 L217 A218 C219 V247 D250V211-N215 WeakPolarHBondContact O-CB 3.32Å; V211-N215 PolarHBondContact O-N 2.99Å; L212-N215 PolarHBondContact O-N 2.69Å; L213-N215 VanDerWaalsContact C-N 3.35Å; N215-L217 VanDerWaalsContact C-N 3.33Å; N215-L217 PolarHBondContact O-N 3.24Å; N215-A218 PolarHBondContact O-N 3.36Å; N215-C219 WeakPolarHBondContact O-CB 3.26Å; N215-C219 PolarHBondContact O-N 3.01Å; N215-C219 PolarHBondContact O-SG 3.29Å; N215-C219 VanDerWaalsContact O-SG 3.33Å; N215-V247 HydrophobicContact CB-CG2 4.15Å; N215-V247 WeakPolarHBondContact OD1-CG2 3.18Å; N215-V247 PolarHBondContact OD1-N 3.5Å; N215-D250 PolarHBondContact OD1-OD2 2.93Å
216S97.2Very high95.8Very high9 Ų934.2 Ų34.26%0.06319%0.187CC..Hα-helixtrans-62.4-39.6175.9-61.50000112.7F200 L212 L213 C220F200-S216 VanDerWaalsContact CE1-CB 3.41Å; F200-S216 VanDerWaalsContact CZ-CB 3.41Å; L212-S216 PolarHBondContact O-N 3.39Å; L212-S216 VanDerWaalsContact O-N 3.08Å; L212-S216 PolarHBondContact O-OG 3.13Å; L213-S216 PolarHBondContact O-N 2.77Å; S216-C220 PolarHBondContact O-N 3.29Å; S216-C220 VanDerWaalsContact O-N 3.07Å; S216-C220 PolarHBondContact O-SG 3.38Å
217L97.6Very high96Very high5 Ų531.5 Ų31.53%0.02617%0.174CC..Hα-helixtrans-64-44.4174.9-178.465.1000111.9L197 F200 I204 L213 L214 N215 C220 Q221 V233L197-L217 HydrophobicContact CD1-CD1 4.47Å; L197-L217 HydrophobicContact CD2-CD1 4.35Å; L197-L217 HydrophobicContact CG-CD1 3.77Å; F200-L217 HydrophobicContact CB-CB 4.27Å; F200-L217 HydrophobicContact CB-CD1 4.36Å; I204-L217 HydrophobicContact CD1-CB 4.25Å; I204-L217 HydrophobicContact CD1-CD2 3.68Å; L213-L217 WeakPolarHBondContact O-CB 3.48Å; L213-L217 PolarHBondContact O-N 3.3Å; L214-L217 PolarHBondContact O-N 3.48Å; N215-L217 VanDerWaalsContact C-N 3.33Å; N215-L217 PolarHBondContact O-N 3.24Å; L217-C220 WeakPolarHBondContact O-CB 3.27Å; L217-C220 PolarHBondContact O-N 2.94Å; L217-Q221 WeakPolarHBondContact O-CG 3.48Å; L217-Q221 PolarHBondContact O-N 3.46Å; L217-V233 HydrophobicContact CB-CG1 4.1Å; L217-V233 HydrophobicContact CD2-CG1 3.98Å; L217-V233 HydrophobicContact CD2-CG2 3.91Å; L217-V233 HydrophobicContact CG-CG1 4.1Å; L217-V233 HydrophobicContact CG-CG2 4.22Å
218A97.3Very high96.2Very high1 Ų132.3 Ų32.31%0.00818%0.181CC..Hα-helixtrans-61-47.4176.700000111.5L214 N215 C220 Q221 I222 V233 V234L214-A218 VanDerWaalsContact O-CB 3.29Å; L214-A218 WeakPolarHBondContact O-CB 3.2Å; L214-A218 PolarHBondContact O-N 2.9Å; N215-A218 PolarHBondContact O-N 3.36Å; A218-C220 VanDerWaalsContact C-N 3.3Å; A218-C220 PolarHBondContact O-N 3.21Å; A218-Q221 PolarHBondContact O-N 3.22Å; A218-Q221 VanDerWaalsContact O-N 3.13Å; A218-I222 VanDerWaalsContact O-CG1 3.3Å; A218-I222 WeakPolarHBondContact O-CG1 3.41Å; A218-I222 PolarHBondContact O-N 3.47Å; A218-V233 HydrophobicContact CB-CB 4.24Å; A218-V233 HydrophobicContact CB-CG1 3.88Å; A218-V234 HydrophobicContact CB-CG2 3.52Å
219C96.5Very high96.4Very high29 Ų2933.3 Ų33.320%0.19618%0.179CC..Hα-helixtrans-54-46.1174-76.10000111.5M186 N215 Q221 I222 M223 D250M186-C219 HydrophobicContact CE-CB 3.44Å; M186-C219 VanDerWaalsContact CE-CB 3.44Å; N215-C219 WeakPolarHBondContact O-CB 3.26Å; N215-C219 PolarHBondContact O-N 3.01Å; N215-C219 PolarHBondContact O-SG 3.29Å; N215-C219 VanDerWaalsContact O-SG 3.33Å; C219-Q221 PolarHBondContact O-N 2.96Å; C219-I222 PolarHBondContact O-N 3.49Å; C219-M223 WeakPolarHBondContact O-CB 3.48Å; C219-M223 WeakPolarHBondContact O-CG 3.44Å; C219-M223 PolarHBondContact O-N 2.93Å; C219-D250 PolarHBondContact SG-OD2 3.4Å; C219-D250 VanDerWaalsContact SG-OD2 3.34Å
220C97.1Very high96.5Very high0 Ų031.9 Ų31.90%017%0.169CC..Hα-helixtrans-58.3-48.2176-66.40000111.8M186 L197 S216 L217 A218 I222 M223 M224M186-C220 VanDerWaalsContact SD-SG 3.61Å; L197-C220 HydrophobicContact CB-CB 3.96Å; L197-C220 HydrophobicContact CD1-CB 4.19Å; L197-C220 HydrophobicContact CG-CB 4.36Å; S216-C220 PolarHBondContact O-N 3.29Å; S216-C220 VanDerWaalsContact O-N 3.07Å; S216-C220 PolarHBondContact O-SG 3.38Å; L217-C220 WeakPolarHBondContact O-CB 3.27Å; L217-C220 PolarHBondContact O-N 2.94Å; A218-C220 VanDerWaalsContact C-N 3.3Å; A218-C220 PolarHBondContact O-N 3.21Å; C220-I222 PolarHBondContact O-N 2.86Å; C220-M223 PolarHBondContact O-N 3.12Å; C220-M224 WeakPolarHBondContact O-CB 3.49Å; C220-M224 VanDerWaalsContact O-CG 3.26Å; C220-M224 WeakPolarHBondContact O-CG 3.29Å; C220-M224 PolarHBondContact O-N 2.85Å
221Q97.3Very high96.6Very high20 Ų2033.4 Ų33.49%0.09318%0.175CC..Hα-helixtrans-61.1-44.2179.3-67.1-7319.100112.1L197 L217 A218 C219 M224 G225 N226 D229L197-Q221 HydrophobicContact CD1-CG 4.05Å; L217-Q221 WeakPolarHBondContact O-CG 3.48Å; L217-Q221 PolarHBondContact O-N 3.46Å; A218-Q221 PolarHBondContact O-N 3.22Å; A218-Q221 VanDerWaalsContact O-N 3.13Å; C219-Q221 PolarHBondContact O-N 2.96Å; Q221-M224 PolarHBondContact O-N 3.42Å; Q221-G225 PolarHBondContact O-N 3.45Å; Q221-G225 VanDerWaalsContact O-N 3.11Å; Q221-N226 HydrophobicContact CB-CB 4.41Å; Q221-N226 PolarHBondContact O-N 2.81Å; Q221-N226 PolarHBondContact OE1-ND2 3.3Å; Q221-D229 HydrophobicContact CG-CB 4.36Å
222I96.7Very high96.6Very high23 Ų2339.3 Ų39.312%0.11819%0.194CC..Hα-helixtrans-61.1-46.7177.3-68.4165.4000110.5A218 C219 C220 M224 G225 Y227 D250 V253 L254A218-I222 VanDerWaalsContact O-CG1 3.3Å; A218-I222 WeakPolarHBondContact O-CG1 3.41Å; A218-I222 PolarHBondContact O-N 3.47Å; C219-I222 PolarHBondContact O-N 3.49Å; C220-I222 PolarHBondContact O-N 2.86Å; I222-M224 VanDerWaalsContact C-N 3.27Å; I222-M224 PolarHBondContact O-N 3.4Å; I222-G225 PolarHBondContact O-N 2.89Å; I222-Y227 HydrophobicContact CG2-CE1 4.41Å; I222-Y227 WeakPolarHBondContact O-CE1 3.4Å; I222-D250 HydrophobicContact CD1-CB 3.92Å; I222-V253 HydrophobicContact CG2-CG1 3.83Å; I222-L254 HydrophobicContact CD1-CD1 3.98Å; I222-L254 HydrophobicContact CD1-CD2 4.2Å; I222-L254 HydrophobicContact CD1-CG 3.78Å; I222-L254 HydrophobicContact CG1-CD1 4.28Å; I222-L254 HydrophobicContact CG1-CD2 3.67Å; I222-L254 HydrophobicContact CG1-CG 3.85Å
223M95.5Very high96.7Very high89 Ų8937.4 Ų37.444%0.43819%0.185SC..Hα-helixtrans-66.4-29.3-179.9-68.5173.977.600112.7M186 L193 C219 C220 G225M186-M223 HydrophobicContact CB-SD 4.49Å; M186-M223 HydrophobicContact CE-SD 4.04Å; M186-M223 WeakPolarHBondContact O-CE 3.48Å; L193-M223 HydrophobicContact CD1-CB 3.58Å; L193-M223 HydrophobicContact CD2-CB 3.91Å; L193-M223 HydrophobicContact CD2-CE 3.86Å; L193-M223 HydrophobicContact CD2-SD 3.93Å; L193-M223 HydrophobicContact CG-CB 4.43Å; C219-M223 WeakPolarHBondContact O-CB 3.48Å; C219-M223 WeakPolarHBondContact O-CG 3.44Å; C219-M223 PolarHBondContact O-N 2.93Å; C220-M223 PolarHBondContact O-N 3.12Å; M223-G225 VanDerWaalsContact C-N 3.32Å
224M95.6Very high96.8Very high40 Ų4037.6 Ų37.620%0.19719%0.186CC..Hα-helixtrans-77.3-17.3173.7-70.9175.170.800113.3L193 Q194 L197 C220 Q221 I222L193-M224 HydrophobicContact CB-CG 3.61Å; L193-M224 HydrophobicContact CB-SD 4Å; L193-M224 HydrophobicContact CD1-CG 3.7Å; L193-M224 HydrophobicContact CG-CG 4.28Å; Q194-M224 HydrophobicContact CB-CE 4.5Å; L197-M224 HydrophobicContact CD1-SD 3.67Å; C220-M224 WeakPolarHBondContact O-CB 3.49Å; C220-M224 VanDerWaalsContact O-CG 3.26Å; C220-M224 WeakPolarHBondContact O-CG 3.29Å; C220-M224 PolarHBondContact O-N 2.85Å; Q221-M224 PolarHBondContact O-N 3.42Å; I222-M224 VanDerWaalsContact C-N 3.27Å; I222-M224 PolarHBondContact O-N 3.4Å
225G95.1Very high96.7Very high26 Ų2640.6 Ų40.627%0.26820%0.202SC..THydrogen-bonded Turntrans87.810.7-175.400000114.2Q221 I222 M223 Y227Q221-G225 PolarHBondContact O-N 3.45Å; Q221-G225 VanDerWaalsContact O-N 3.11Å; I222-G225 PolarHBondContact O-N 2.89Å; M223-G225 VanDerWaalsContact C-N 3.32Å; G225-Y227 WeakPolarHBondContact O-CD2 3.49Å; G225-Y227 PolarHBondContact O-N 2.98Å; G225-Y227 VanDerWaalsContact O-N 3.08Å
226N95.9Very high96.7Very high61 Ų6143 Ų4333%0.32621%0.212SC..  trans-85.963.2177.8-60.5-19.4000109.7Q221 E228 D229 G230Q221-N226 HydrophobicContact CB-CB 4.41Å; Q221-N226 PolarHBondContact O-N 2.81Å; Q221-N226 PolarHBondContact OE1-ND2 3.3Å; N226-E228 VanDerWaalsContact C-N 3.35Å; N226-E228 PolarHBondContact O-N 3.49Å; N226-D229 HydrophobicContact CB-CB 4.25Å; N226-D229 PolarHBondContact O-N 2.92Å; N226-G230 PolarHBondContact O-N 3.28Å
227Y97.6Very high96.7Very high70 Ų7042.6 Ų42.628%0.27521%0.209SC..Hα-helixtrans-65.2-35-167.9-54.9-56.5000113.4I222 G225 D229 G230 E231 L254 M257I222-Y227 HydrophobicContact CG2-CE1 4.41Å; I222-Y227 WeakPolarHBondContact O-CE1 3.4Å; G225-Y227 WeakPolarHBondContact O-CD2 3.49Å; G225-Y227 PolarHBondContact O-N 2.98Å; G225-Y227 VanDerWaalsContact O-N 3.08Å; Y227-D229 VanDerWaalsContact C-N 3.31Å; Y227-D229 PolarHBondContact O-N 3.19Å; Y227-G230 PolarHBondContact O-N 3.3Å; Y227-E231 WeakPolarHBondContact O-CB 3.39Å; Y227-E231 PolarHBondContact O-N 2.77Å; Y227-L254 HydrophobicContact CD1-CD2 4.18Å; Y227-L254 VanDerWaalsContact O-CD2 3.29Å; Y227-L254 WeakPolarHBondContact O-CD2 3.46Å; Y227-M257 HydrophobicContact CD1-CB 3.85Å; Y227-M257 HydrophobicContact CD1-CG 4.14Å; Y227-M257 HydrophobicContact CD2-CB 4.07Å; Y227-M257 HydrophobicContact CE1-CB 3.92Å; Y227-M257 HydrophobicContact CE1-CG 3.78Å; Y227-M257 HydrophobicContact CE2-CB 4.12Å; Y227-M257 HydrophobicContact CG-CB 3.93Å
228E96.8Very high96.6Very high118 Ų11843.6 Ų43.655%0.55122%0.215SC*.Hα-helixtrans-66-35.5177.1-64.678.4-17400112N226 R232 L258N226-E228 VanDerWaalsContact C-N 3.35Å; N226-E228 PolarHBondContact O-N 3.49Å; E228-R232 PolarHBondContact O-N 3.18Å; E228-R232 PolarHBondContact O-NH1 3.45Å; E228-L258 HydrophobicContact CG-CD2 4.16Å
229D96.3Very high96.5Very high55 Ų5551.5 Ų51.529%0.29425%0.251SS..Hα-helixtrans-74.3-43.5175.9-67.4-6.4000110.4Q221 N226 Y227 E231 R232 V233Q221-D229 HydrophobicContact CG-CB 4.36Å; N226-D229 HydrophobicContact CB-CB 4.25Å; N226-D229 PolarHBondContact O-N 2.92Å; Y227-D229 VanDerWaalsContact C-N 3.31Å; Y227-D229 PolarHBondContact O-N 3.19Å; D229-E231 VanDerWaalsContact C-N 3.28Å; D229-E231 PolarHBondContact O-N 2.96Å; D229-R232 VanDerWaalsContact CG-NH2 3.27Å; D229-R232 PolarHBondContact O-N 3.43Å; D229-R232 VanDerWaalsContact O-N 3.15Å; D229-R232 IonicContact OD1-CZ 3.07Å; D229-R232 IonicContact OD1-NH1 2.71Å; D229-R232 PolarHBondContact OD1-NH1 3.19Å; D229-R232 IonicContact OD1-NH2 2.63Å; D229-R232 PolarHBondContact OD1-NH2 3Å; D229-R232 IonicContact OD2-NH2 3.94Å; D229-V233 WeakPolarHBondContact O-CG2 3.48Å; D229-V233 PolarHBondContact O-N 3.39Å
230G96.6Very high96.3Very high0 Ų055.2 Ų55.20%026%0.264CS..Hα-helixtrans-55.8-42.1173.400000112.3N226 Y227 R232 V233 V234N226-G230 PolarHBondContact O-N 3.28Å; Y227-G230 PolarHBondContact O-N 3.3Å; G230-R232 PolarHBondContact O-N 2.87Å; G230-V233 PolarHBondContact O-N 3Å; G230-V234 WeakPolarHBondContact O-CG2 3.23Å; G230-V234 PolarHBondContact O-N 3.19Å
231E97.2Very high96.1Very high46 Ų4657.7 Ų57.722%0.21528%0.278CS..Hα-helixtrans-62.2-39.7176.3172.4156.3-80.800113.6Y227 D229 V233 V234 N235 L254 L258 K260Y227-E231 WeakPolarHBondContact O-CB 3.39Å; Y227-E231 PolarHBondContact O-N 2.77Å; D229-E231 VanDerWaalsContact C-N 3.28Å; D229-E231 PolarHBondContact O-N 2.96Å; E231-V233 VanDerWaalsContact C-N 3.32Å; E231-V233 PolarHBondContact O-N 2.69Å; E231-V234 PolarHBondContact O-N 3.26Å; E231-N235 WeakPolarHBondContact CG-ND2 3.35Å; E231-N235 WeakPolarHBondContact O-CB 3.29Å; E231-N235 PolarHBondContact O-N 2.9Å; E231-N235 PolarHBondContact O-ND2 3.37Å; E231-L254 HydrophobicContact CB-CD1 4.31Å; E231-L258 HydrophobicContact CB-CD1 4.03Å; E231-L258 HydrophobicContact CG-CD1 4.45Å; E231-L258 WeakPolarHBondContact OE1-CD1 3.45Å; E231-K260 WeakPolarHBondContact OE1-CE 3.41Å; E231-K260 IonicContact OE1-NZ 2.52Å; E231-K260 PolarHBondContact OE1-NZ 3.44Å; E231-K260 WeakPolarHBondContact OE2-CE 3.47Å; E231-K260 IonicContact OE2-NZ 2.78Å; E231-K260 PolarHBondContact OE2-NZ 3.39Å
232R97Very high95.7Very high150 Ų15060 Ų6057%0.56630%0.296SS*.Hα-helixtrans-62.4-43.7175.8-66.4-167.1-53.4-85.37.3111.1E228 D229 G230 N235 E236E228-R232 PolarHBondContact O-N 3.18Å; E228-R232 PolarHBondContact O-NH1 3.45Å; D229-R232 VanDerWaalsContact CG-NH2 3.27Å; D229-R232 PolarHBondContact O-N 3.43Å; D229-R232 VanDerWaalsContact O-N 3.15Å; D229-R232 IonicContact OD1-CZ 3.07Å; D229-R232 IonicContact OD1-NH1 2.71Å; D229-R232 PolarHBondContact OD1-NH1 3.19Å; D229-R232 IonicContact OD1-NH2 2.63Å; D229-R232 PolarHBondContact OD1-NH2 3Å; D229-R232 IonicContact OD2-NH2 3.94Å; G230-R232 PolarHBondContact O-N 2.87Å; R232-N235 PolarHBondContact O-N 3.42Å; R232-E236 PolarHBondContact O-N 3.35Å; R232-E236 VanDerWaalsContact O-N 3.09Å
233V97.4Very high95.3Very high16 Ų1663 Ų6310%0.09731%0.312CS..Hα-helixtrans-65.8-43.6179.5-179.50000111.4L214 L217 A218 D229 G230 E231 E236 S237L214-V233 HydrophobicContact CB-CG1 4.1Å; L214-V233 HydrophobicContact CD2-CG1 3.88Å; L214-V233 WeakPolarHBondContact O-CG1 2.91Å; L217-V233 HydrophobicContact CB-CG1 4.1Å; L217-V233 HydrophobicContact CD2-CG1 3.98Å; L217-V233 HydrophobicContact CD2-CG2 3.91Å; L217-V233 HydrophobicContact CG-CG1 4.1Å; L217-V233 HydrophobicContact CG-CG2 4.22Å; A218-V233 HydrophobicContact CB-CB 4.24Å; A218-V233 HydrophobicContact CB-CG1 3.88Å; D229-V233 WeakPolarHBondContact O-CG2 3.48Å; D229-V233 PolarHBondContact O-N 3.39Å; G230-V233 PolarHBondContact O-N 3Å; E231-V233 VanDerWaalsContact C-N 3.32Å; E231-V233 PolarHBondContact O-N 2.69Å; V233-E236 PolarHBondContact O-N 3.41Å; V233-S237 PolarHBondContact O-N 2.75Å
234V97.4Very high95.2Very high3 Ų360.6 Ų60.62%0.01830%0.301CS..Hα-helixtrans-63.7-41.7177.3168.10000111.6A218 G230 E231 S237 L238 V247 D250 A251 L254A218-V234 HydrophobicContact CB-CG2 3.52Å; G230-V234 WeakPolarHBondContact O-CG2 3.23Å; G230-V234 PolarHBondContact O-N 3.19Å; E231-V234 PolarHBondContact O-N 3.26Å; V234-S237 WeakPolarHBondContact O-CB 3.4Å; V234-S237 PolarHBondContact O-N 3.25Å; V234-S237 VanDerWaalsContact O-N 3.16Å; V234-L238 HydrophobicContact CG1-CD1 4.03Å; V234-L238 HydrophobicContact CG1-CG 4.34Å; V234-L238 WeakPolarHBondContact O-CG 3.48Å; V234-L238 PolarHBondContact O-N 2.73Å; V234-V247 HydrophobicContact CG1-CG1 4.01Å; V234-D250 HydrophobicContact CG2-CB 3.8Å; V234-A251 HydrophobicContact CG1-CB 3.81Å; V234-L254 HydrophobicContact CB-CD1 3.9Å; V234-L254 HydrophobicContact CG1-CD1 4.41Å; V234-L254 HydrophobicContact CG2-CD1 3.48Å; V234-L254 VanDerWaalsContact CG2-CD1 3.48Å
235N96.3Very high95.2Very high66 Ų6659.3 Ų59.335%0.35330%0.297SS..Hα-helixtrans-62.7-43.5176.5-71.5-32.8000111.7E231 R232 S237 L238 E239E231-N235 WeakPolarHBondContact CG-ND2 3.35Å; E231-N235 WeakPolarHBondContact O-CB 3.29Å; E231-N235 PolarHBondContact O-N 2.9Å; E231-N235 PolarHBondContact O-ND2 3.37Å; R232-N235 PolarHBondContact O-N 3.42Å; N235-S237 VanDerWaalsContact C-N 3.26Å; N235-S237 PolarHBondContact O-N 3.04Å; N235-L238 PolarHBondContact O-N 2.68Å; N235-E239 WeakPolarHBondContact O-CG 3.39Å; N235-E239 PolarHBondContact O-N 3.39Å
236E96.8Very high95.2Very high75 Ų7562.2 Ų62.235%0.3530%0.303SS..Hα-helixtrans-59.1-40173.4-173.2-173.9153.800111.5S209 L214 R232 V233 E239 K240S209-E236 VanDerWaalsContact CB-OE1 3.25Å; S209-E236 WeakPolarHBondContact CB-OE1 3.04Å; S209-E236 PolarHBondContact OG-OE1 2.98Å; L214-E236 HydrophobicContact CD1-CB 4.29Å; L214-E236 HydrophobicContact CD1-CG 3.89Å; R232-E236 PolarHBondContact O-N 3.35Å; R232-E236 VanDerWaalsContact O-N 3.09Å; V233-E236 PolarHBondContact O-N 3.41Å; E236-E239 PolarHBondContact O-N 2.66Å; E236-K240 PolarHBondContact O-N 3.19Å
237S96.5Very high95.3Very high1 Ų159.3 Ų59.31%0.00729%0.288CS..Hα-helixtrans-66.4-42.4178.3-162.40000112.1V233 V234 N235 E239 K240 D241 V247V233-S237 PolarHBondContact O-N 2.75Å; V234-S237 WeakPolarHBondContact O-CB 3.4Å; V234-S237 PolarHBondContact O-N 3.25Å; V234-S237 VanDerWaalsContact O-N 3.16Å; N235-S237 VanDerWaalsContact C-N 3.26Å; N235-S237 PolarHBondContact O-N 3.04Å; S237-E239 VanDerWaalsContact C-N 3.32Å; S237-E239 PolarHBondContact O-N 2.67Å; S237-K240 PolarHBondContact O-N 3.37Å; S237-K240 VanDerWaalsContact O-N 3.15Å; S237-D241 PolarHBondContact O-N 3.22Å; S237-V247 VanDerWaalsContact OG-CG2 3.24Å; S237-V247 WeakPolarHBondContact OG-CG2 3.44Å
238L94.9Very high95.3Very high26 Ų2656 Ų5614%0.13628%0.275CS..Hα-helixtrans-67-28.9175.4-70.8173.8000113.1V234 N235 K240 D241 S242 V247 V248 A251 Y268V234-L238 HydrophobicContact CG1-CD1 4.03Å; V234-L238 HydrophobicContact CG1-CG 4.34Å; V234-L238 WeakPolarHBondContact O-CG 3.48Å; V234-L238 PolarHBondContact O-N 2.73Å; N235-L238 PolarHBondContact O-N 2.68Å; L238-K240 VanDerWaalsContact C-N 3.28Å; L238-D241 CarbonylContact O-C 3.41Å; L238-S242 VanDerWaalsContact O-CA 3.25Å; L238-S242 WeakPolarHBondContact O-CA 3.36Å; L238-S242 WeakPolarHBondContact O-CB 3.45Å; L238-S242 PolarHBondContact O-N 3.26Å; L238-V247 HydrophobicContact CD2-CB 4.28Å; L238-V247 HydrophobicContact CD2-CG1 3.63Å; L238-V247 HydrophobicContact CG-CG1 3.65Å; L238-V248 HydrophobicContact CD2-CG2 4.08Å; L238-A251 HydrophobicContact CD1-CB 4.3Å; L238-Y268 HydrophobicContact CD1-CE1 4.49Å
239E95.3Very high95.3Very high167 Ų16751.4 Ų51.478%0.7825%0.254SS*.Hα-helixtrans-66.6-31.6172.5-75.7177.4-174.700112N235 E236 S237N235-E239 WeakPolarHBondContact O-CG 3.39Å; N235-E239 PolarHBondContact O-N 3.39Å; E236-E239 PolarHBondContact O-N 2.66Å; S237-E239 VanDerWaalsContact C-N 3.32Å; S237-E239 PolarHBondContact O-N 2.67Å
240K93.7Very high95.3Very high107 Ų10749.6 Ų49.647%0.46524%0.244SC..Hα-helixtrans-80.8-44.2175.9-67.2176.1-170.7-87.10112.4S209 V211 L214 E236 S237 L238S209-K240 VanDerWaalsContact O-CE 3.28Å; S209-K240 WeakPolarHBondContact O-CE 3.4Å; S209-K240 PolarHBondContact O-NZ 3.34Å; S209-K240 WeakPolarHBondContact OG-CE 3.12Å; S209-K240 PolarHBondContact OG-NZ 3.04Å; V211-K240 HydrophobicContact CG2-CB 3.79Å; L214-K240 HydrophobicContact CD1-CD 3.86Å; E236-K240 PolarHBondContact O-N 3.19Å; S237-K240 PolarHBondContact O-N 3.37Å; S237-K240 VanDerWaalsContact O-N 3.15Å; L238-K240 VanDerWaalsContact C-N 3.28Å
241D91.8Very high95.3Very high53 Ų5349.9 Ų49.928%0.28325%0.246SC..  trans-144.993.3176.5-175.66.4000110.9V211 S237 L238 N243 N244V211-D241 HydrophobicContact CG1-CB 4.49Å; V211-D241 HydrophobicContact CG2-CB 3.72Å; S237-D241 PolarHBondContact O-N 3.22Å; L238-D241 CarbonylContact O-C 3.41Å; D241-N243 PolarHBondContact O-N 2.69Å; D241-N243 WeakPolarHBondContact OD1-CA 3.26Å; D241-N243 PolarHBondContact OD1-N 2.98Å; D241-N244 HydrophobicContact CB-CB 4.3Å; D241-N244 PolarHBondContact O-N 3.24Å; D241-N244 PolarHBondContact OD1-N 3.48Å
242S90.3Very high95.3Very high68 Ų6847.9 Ų47.948%0.47624%0.237SC..THydrogen-bonded Turntrans-66.5-9.7178.468.50000113.4L238 Q271L238-S242 VanDerWaalsContact O-CA 3.25Å; L238-S242 WeakPolarHBondContact O-CA 3.36Å; L238-S242 WeakPolarHBondContact O-CB 3.45Å; L238-S242 PolarHBondContact O-N 3.26Å; S242-Q271 PolarHBondContact O-NE2 3.28Å
243N88.4Confident95.3Very high85 Ų8542.9 Ų42.946%0.45522%0.223SC..THydrogen-bonded Turntrans-109.618.3-179.2-65.7-39000111.4D241 A245 Y276D241-N243 PolarHBondContact O-N 2.69Å; D241-N243 WeakPolarHBondContact OD1-CA 3.26Å; D241-N243 PolarHBondContact OD1-N 2.98Å; N243-A245 PolarHBondContact O-N 3.48Å; N243-Y276 VanDerWaalsContact O-CZ 3.27Å; N243-Y276 PolarHBondContact O-OH 3.08Å
244N93.3Very high95.3Very high40 Ų4042.2 Ų42.221%0.21422%0.219CC..  trans-80.1121.6174-167.9-69.4000111.4V211 D241 E246 V247 V248V211-N244 HydrophobicContact CG1-CB 3.89Å; V211-N244 WeakPolarHBondContact CG1-ND2 3.37Å; D241-N244 HydrophobicContact CB-CB 4.3Å; D241-N244 PolarHBondContact O-N 3.24Å; D241-N244 PolarHBondContact OD1-N 3.48Å; N244-E246 PolarHBondContact O-N 3.16Å; N244-E246 PolarHBondContact OD1-N 3.18Å; N244-E246 VanDerWaalsContact OD1-N 3.12Å; N244-V247 HydrophobicContact CB-CB 4.04Å; N244-V247 HydrophobicContact CB-CG2 3.78Å; N244-V247 PolarHBondContact O-N 3.23Å; N244-V247 PolarHBondContact OD1-N 3.36Å; N244-V248 VanDerWaalsContact O-CG2 3.23Å; N244-V248 WeakPolarHBondContact O-CG2 3.24Å; N244-V248 PolarHBondContact O-N 2.95Å
245A94.6Very high95.2Very high12 Ų1242.2 Ų42.210%0.09922%0.219CC..Hα-helixtrans-62-44.9-175.800000112.8N243 V247 V248 I249 M272 Y276N243-A245 PolarHBondContact O-N 3.48Å; A245-V247 PolarHBondContact O-N 3.4Å; A245-V248 PolarHBondContact O-N 2.95Å; A245-I249 WeakPolarHBondContact O-CG1 3.36Å; A245-I249 PolarHBondContact O-N 3.01Å; A245-M272 HydrophobicContact CB-CE 4.17Å; A245-M272 HydrophobicContact CB-SD 4.16Å; A245-Y276 HydrophobicContact CB-CD1 4.01Å; A245-Y276 HydrophobicContact CB-CD2 3.8Å; A245-Y276 HydrophobicContact CB-CE1 4.17Å; A245-Y276 HydrophobicContact CB-CE2 3.93Å; A245-Y276 HydrophobicContact CB-CG 3.86Å
246E95.9Very high95.2Very high87 Ų8744.3 Ų44.341%0.40723%0.227SC..Hα-helixtrans-63.2-43.8-179.4-52.3-49.5135.900111.1N244 V248 I249 D250 H279N244-E246 PolarHBondContact O-N 3.16Å; N244-E246 PolarHBondContact OD1-N 3.18Å; N244-E246 VanDerWaalsContact OD1-N 3.12Å; E246-V248 VanDerWaalsContact C-N 3.32Å; E246-V248 PolarHBondContact O-N 3.3Å; E246-I249 WeakPolarHBondContact O-CB 3.33Å; E246-I249 PolarHBondContact O-N 3.5Å; E246-I249 VanDerWaalsContact O-N 3.12Å; E246-D250 PolarHBondContact O-N 3.38Å; E246-H279 IonicContact OE1-CD2 3.1Å; E246-H279 IonicContact OE1-CE1 3.64Å; E246-H279 IonicContact OE1-NE2 3.31Å; E246-H279 PolarHBondContact OE1-NE2 3.08Å
247V96.9Very high95.1Very high1 Ų145.1 Ų45.11%0.00623%0.232CC..Hα-helixtrans-66.4-36.1179.1-177.10000111.4V211 N215 V234 S237 L238 N244 A245 I249 D250 A251V211-V247 HydrophobicContact CG1-CG2 3.79Å; N215-V247 HydrophobicContact CB-CG2 4.15Å; N215-V247 WeakPolarHBondContact OD1-CG2 3.18Å; N215-V247 PolarHBondContact OD1-N 3.5Å; V234-V247 HydrophobicContact CG1-CG1 4.01Å; S237-V247 VanDerWaalsContact OG-CG2 3.24Å; S237-V247 WeakPolarHBondContact OG-CG2 3.44Å; L238-V247 HydrophobicContact CD2-CB 4.28Å; L238-V247 HydrophobicContact CD2-CG1 3.63Å; L238-V247 HydrophobicContact CG-CG1 3.65Å; N244-V247 HydrophobicContact CB-CB 4.04Å; N244-V247 HydrophobicContact CB-CG2 3.78Å; N244-V247 PolarHBondContact O-N 3.23Å; N244-V247 PolarHBondContact OD1-N 3.36Å; A245-V247 PolarHBondContact O-N 3.4Å; V247-I249 VanDerWaalsContact C-N 3.33Å; V247-D250 PolarHBondContact O-N 3.14Å; V247-A251 PolarHBondContact O-N 2.99Å
248V96.9Very high95.1Very high0 Ų047.4 Ų47.40%024%0.244CC..Hα-helixtrans-66.9-36.6174.7173.70000110.9L238 N244 A245 E246 A251 I252 Y268 M272L238-V248 HydrophobicContact CD2-CG2 4.08Å; N244-V248 VanDerWaalsContact O-CG2 3.23Å; N244-V248 WeakPolarHBondContact O-CG2 3.24Å; N244-V248 PolarHBondContact O-N 2.95Å; A245-V248 PolarHBondContact O-N 2.95Å; E246-V248 VanDerWaalsContact C-N 3.32Å; E246-V248 PolarHBondContact O-N 3.3Å; V248-A251 WeakPolarHBondContact O-CB 3.17Å; V248-A251 PolarHBondContact O-N 3.45Å; V248-I252 HydrophobicContact CG1-CD1 4.45Å; V248-I252 WeakPolarHBondContact O-CG1 3.27Å; V248-I252 PolarHBondContact O-N 3.39Å; V248-Y268 HydrophobicContact CG1-CD1 4.25Å; V248-M272 HydrophobicContact CB-CG 4.48Å; V248-M272 HydrophobicContact CB-SD 4.11Å; V248-M272 HydrophobicContact CG1-CG 3.71Å; V248-M272 HydrophobicContact CG1-SD 3.97Å
249I97.4Very high95Very high21 Ų2149.3 Ų49.311%0.10827%0.27CS..Hα-helixtrans-63.2-45.1173.2-67.9163.6000110.4A245 E246 V247 A251 I252 V253 M272 H279 W281A245-I249 WeakPolarHBondContact O-CG1 3.36Å; A245-I249 PolarHBondContact O-N 3.01Å; E246-I249 WeakPolarHBondContact O-CB 3.33Å; E246-I249 PolarHBondContact O-N 3.5Å; E246-I249 VanDerWaalsContact O-N 3.12Å; V247-I249 VanDerWaalsContact C-N 3.33Å; I249-A251 VanDerWaalsContact C-N 3.28Å; I249-A251 PolarHBondContact O-N 2.93Å; I249-I252 WeakPolarHBondContact O-CB 3.4Å; I249-I252 PolarHBondContact O-N 2.89Å; I249-I252 VanDerWaalsContact O-N 3.08Å; I249-V253 WeakPolarHBondContact O-CG2 3.43Å; I249-V253 PolarHBondContact O-N 3.49Å; I249-M272 HydrophobicContact CD1-CE 3.78Å; I249-M272 HydrophobicContact CG1-CE 3.84Å; I249-M272 HydrophobicContact CG1-CG 4.5Å; I249-M272 HydrophobicContact CG1-SD 4.15Å; I249-H279 WeakPolarHBondContact CD1-CE1 3.48Å; I249-W281 HydrophobicContact CD1-CB 3.7Å; I249-W281 HydrophobicContact CD1-CD2 4.4Å; I249-W281 HydrophobicContact CD1-CG 3.85Å; I249-W281 HydrophobicContact CG1-CB 4.39Å; I249-W281 HydrophobicContact CG1-CD2 4.12Å; I249-W281 HydrophobicContact CG1-CG 4.02Å
250D97.4Very high95Very high18 Ų1844.4 Ų44.410%0.09625%0.246CC..Hα-helixtrans-59.6-39.9175-76.7-9.4000111.7N215 C219 I222 V234 E246 V247 I252 V253 L254N215-D250 PolarHBondContact OD1-OD2 2.93Å; C219-D250 PolarHBondContact SG-OD2 3.4Å; C219-D250 VanDerWaalsContact SG-OD2 3.34Å; I222-D250 HydrophobicContact CD1-CB 3.92Å; V234-D250 HydrophobicContact CG2-CB 3.8Å; E246-D250 PolarHBondContact O-N 3.38Å; V247-D250 PolarHBondContact O-N 3.14Å; D250-I252 VanDerWaalsContact C-N 3.34Å; D250-I252 PolarHBondContact O-N 3.38Å; D250-V253 PolarHBondContact O-N 3.46Å; D250-L254 WeakPolarHBondContact O-CB 3.24Å; D250-L254 WeakPolarHBondContact O-CG 3.29Å; D250-L254 PolarHBondContact O-N 3.38Å
251A96.8Very high95Very high5 Ų543 Ų434%0.04125%0.247CC..Hα-helixtrans-63.3-36.8174.200000112.9V234 L238 V247 V248 I249 S255 Y268V234-A251 HydrophobicContact CG1-CB 3.81Å; L238-A251 HydrophobicContact CD1-CB 4.3Å; V247-A251 PolarHBondContact O-N 2.99Å; V248-A251 WeakPolarHBondContact O-CB 3.17Å; V248-A251 PolarHBondContact O-N 3.45Å; I249-A251 VanDerWaalsContact C-N 3.28Å; I249-A251 PolarHBondContact O-N 2.93Å; A251-S255 VanDerWaalsContact O-CB 3.28Å; A251-S255 WeakPolarHBondContact O-CB 3.28Å; A251-S255 PolarHBondContact O-N 3.44Å; A251-S255 PolarHBondContact O-OG 2.84Å; A251-Y268 HydrophobicContact CB-CD1 4.38Å; A251-Y268 HydrophobicContact CB-CD2 4.04Å; A251-Y268 HydrophobicContact CB-CE1 4.23Å; A251-Y268 HydrophobicContact CB-CE2 3.84Å; A251-Y268 HydrophobicContact CB-CG 4.3Å
252I96.6Very high95Very high4 Ų445.8 Ų45.82%0.02127%0.266CS..Hα-helixtrans-61.3-51.7173.2-69.5163.1000109.5V248 I249 D250 L254 S255 Q256 T265 Y268 V269 M272 W281V248-I252 HydrophobicContact CG1-CD1 4.45Å; V248-I252 WeakPolarHBondContact O-CG1 3.27Å; V248-I252 PolarHBondContact O-N 3.39Å; I249-I252 WeakPolarHBondContact O-CB 3.4Å; I249-I252 PolarHBondContact O-N 2.89Å; I249-I252 VanDerWaalsContact O-N 3.08Å; D250-I252 VanDerWaalsContact C-N 3.34Å; D250-I252 PolarHBondContact O-N 3.38Å; I252-L254 PolarHBondContact O-N 3.2Å; I252-S255 PolarHBondContact O-N 3.46Å; I252-S255 PolarHBondContact O-OG 3.23Å; I252-Q256 WeakPolarHBondContact O-CG 3.36Å; I252-Q256 PolarHBondContact O-N 3.34Å; I252-Q256 VanDerWaalsContact O-N 3.16Å; I252-T265 HydrophobicContact CG2-CG2 4.09Å; I252-Y268 HydrophobicContact CG1-CG 4.39Å; I252-V269 HydrophobicContact CD1-CG2 4.07Å; I252-V269 HydrophobicContact CG1-CG2 4.26Å; I252-V269 HydrophobicContact CG2-CG2 4.29Å; I252-M272 HydrophobicContact CD1-CG 4Å; I252-W281 HydrophobicContact CD1-CH2 3.55Å; I252-W281 HydrophobicContact CD1-CZ2 3.82Å; I252-W281 HydrophobicContact CD1-CZ3 4.13Å; I252-W281 HydrophobicContact CG2-CZ2 4.22Å
253V96.4Very high95.2Very high46 Ų4648.6 Ų48.628%0.27927%0.272SS..Hα-helixtrans-58.4-50.1-179175.70000110.5I222 I249 D250 S255 Q256 M257I222-V253 HydrophobicContact CG2-CG1 3.83Å; I249-V253 WeakPolarHBondContact O-CG2 3.43Å; I249-V253 PolarHBondContact O-N 3.49Å; D250-V253 PolarHBondContact O-N 3.46Å; V253-S255 PolarHBondContact O-N 3.45Å; V253-Q256 PolarHBondContact O-N 3.39Å; V253-M257 HydrophobicContact CG1-CG 4.18Å; V253-M257 WeakPolarHBondContact O-CG 3.4Å; V253-M257 PolarHBondContact O-N 3.41Å
254L97.2Very high95.4Very high2 Ų247.4 Ų47.41%0.0127%0.265CS..Hα-helixtrans-61.8-42.1179.5-76166.2000112.9I222 Y227 E231 V234 D250 I252 Q256 M257 L258I222-L254 HydrophobicContact CD1-CD1 3.98Å; I222-L254 HydrophobicContact CD1-CD2 4.2Å; I222-L254 HydrophobicContact CD1-CG 3.78Å; I222-L254 HydrophobicContact CG1-CD1 4.28Å; I222-L254 HydrophobicContact CG1-CD2 3.67Å; I222-L254 HydrophobicContact CG1-CG 3.85Å; Y227-L254 HydrophobicContact CD1-CD2 4.18Å; Y227-L254 VanDerWaalsContact O-CD2 3.29Å; Y227-L254 WeakPolarHBondContact O-CD2 3.46Å; E231-L254 HydrophobicContact CB-CD1 4.31Å; V234-L254 HydrophobicContact CB-CD1 3.9Å; V234-L254 HydrophobicContact CG1-CD1 4.41Å; V234-L254 HydrophobicContact CG2-CD1 3.48Å; V234-L254 VanDerWaalsContact CG2-CD1 3.48Å; D250-L254 WeakPolarHBondContact O-CB 3.24Å; D250-L254 WeakPolarHBondContact O-CG 3.29Å; D250-L254 PolarHBondContact O-N 3.38Å; I252-L254 PolarHBondContact O-N 3.2Å; L254-Q256 PolarHBondContact O-N 3.47Å; L254-M257 PolarHBondContact O-N 2.96Å; L254-L258 WeakPolarHBondContact O-CB 3.41Å; L254-L258 WeakPolarHBondContact O-CG 3.3Å; L254-L258 PolarHBondContact O-N 2.99Å
255S96.2Very high95.4Very high2 Ų246.2 Ų46.21%0.01426%0.259CS..Hα-helixtrans-59.7-36.3177.673.20000112.1A251 I252 V253 K260 T265A251-S255 VanDerWaalsContact O-CB 3.28Å; A251-S255 WeakPolarHBondContact O-CB 3.28Å; A251-S255 PolarHBondContact O-N 3.44Å; A251-S255 PolarHBondContact O-OG 2.84Å; I252-S255 PolarHBondContact O-N 3.46Å; I252-S255 PolarHBondContact O-OG 3.23Å; V253-S255 PolarHBondContact O-N 3.45Å; S255-K260 WeakPolarHBondContact O-CB 3.44Å; S255-K260 PolarHBondContact O-N 3.17Å; S255-T265 WeakPolarHBondContact CB-OG1 3.44Å; S255-T265 WeakPolarHBondContact OG-CB 3.34Å; S255-T265 PolarHBondContact OG-OG1 2.8Å
256Q95.2Very high95.4Very high110 Ų11047.2 Ų47.251%0.51427%0.271SS..Hα-helixtrans-73.5-45176.1-68.1177-26.100111.7I252 V253 L254 L258 G259 T265I252-Q256 WeakPolarHBondContact O-CG 3.36Å; I252-Q256 PolarHBondContact O-N 3.34Å; I252-Q256 VanDerWaalsContact O-N 3.16Å; V253-Q256 PolarHBondContact O-N 3.39Å; L254-Q256 PolarHBondContact O-N 3.47Å; Q256-L258 PolarHBondContact O-N 3.07Å; Q256-G259 PolarHBondContact O-N 2.86Å; Q256-T265 HydrophobicContact CG-CG2 3.75Å
257M95.8Very high95.4Very high93 Ų9352.1 Ų52.146%0.45829%0.286SS..Hα-helixtrans-67.7-34.6-177.9-65.7-56.7103.800112.9Y227 V253 L254 G259Y227-M257 HydrophobicContact CD1-CB 3.85Å; Y227-M257 HydrophobicContact CD1-CG 4.14Å; Y227-M257 HydrophobicContact CD2-CB 4.07Å; Y227-M257 HydrophobicContact CE1-CB 3.92Å; Y227-M257 HydrophobicContact CE1-CG 3.78Å; Y227-M257 HydrophobicContact CE2-CB 4.12Å; Y227-M257 HydrophobicContact CG-CB 3.93Å; V253-M257 HydrophobicContact CG1-CG 4.18Å; V253-M257 WeakPolarHBondContact O-CG 3.4Å; V253-M257 PolarHBondContact O-N 3.41Å; L254-M257 PolarHBondContact O-N 2.96Å; M257-G259 VanDerWaalsContact C-N 3.26Å; M257-G259 PolarHBondContact O-N 3.02Å
258L96Very high95.3Very high49 Ų4954.8 Ų54.826%0.25730%0.296SS..THydrogen-bonded Turntrans-82.40.8176.5-68.8169.9000113.4E228 E231 L254 Q256 K260E228-L258 HydrophobicContact CG-CD2 4.16Å; E231-L258 HydrophobicContact CB-CD1 4.03Å; E231-L258 HydrophobicContact CG-CD1 4.45Å; E231-L258 WeakPolarHBondContact OE1-CD1 3.45Å; L254-L258 WeakPolarHBondContact O-CB 3.41Å; L254-L258 WeakPolarHBondContact O-CG 3.3Å; L254-L258 PolarHBondContact O-N 2.99Å; Q256-L258 PolarHBondContact O-N 3.07Å; L258-K260 VanDerWaalsContact C-N 3.31Å; L258-K260 HydrophobicContact CB-CG 4.18Å; L258-K260 PolarHBondContact O-N 3.43Å
259G93.2Very high95.2Very high66 Ų6656 Ų5668%0.6830%0.304SS*.THydrogen-bonded Turntrans64.233.8179.600000113.5Q256 M257Q256-G259 PolarHBondContact O-N 2.86Å; M257-G259 VanDerWaalsContact C-N 3.26Å; M257-G259 PolarHBondContact O-N 3.02Å
260K94.2Very high95.2Very high64 Ų6463.1 Ų63.128%0.27833%0.329SS..  trans-67.9157.5178.8-67.2-165.1169.7-171.40111.4E231 S255 L258 T262 I264E231-K260 WeakPolarHBondContact OE1-CE 3.41Å; E231-K260 IonicContact OE1-NZ 2.52Å; E231-K260 PolarHBondContact OE1-NZ 3.44Å; E231-K260 WeakPolarHBondContact OE2-CE 3.47Å; E231-K260 IonicContact OE2-NZ 2.78Å; E231-K260 PolarHBondContact OE2-NZ 3.39Å; S255-K260 WeakPolarHBondContact O-CB 3.44Å; S255-K260 PolarHBondContact O-N 3.17Å; L258-K260 VanDerWaalsContact C-N 3.31Å; L258-K260 HydrophobicContact CB-CG 4.18Å; L258-K260 PolarHBondContact O-N 3.43Å; K260-T262 PolarHBondContact O-N 3.21Å; K260-I264 HydrophobicContact CB-CD1 4.36Å; K260-I264 HydrophobicContact CD-CD1 4.38Å
261P94Very high95.1Very high76 Ų7664.8 Ų64.849%0.49434%0.336SS..  trans-51.9135.9174.6-26.733.8000112.1E263 I264P261-E263 VanDerWaalsContact CB-OE2 3.24Å; P261-E263 WeakPolarHBondContact CB-OE2 3.38Å; P261-E263 PolarHBondContact O-N 2.96Å; P261-I264 HydrophobicContact CB-CG1 4.49Å; P261-I264 HydrophobicContact CG-CD1 4.44Å; P261-I264 WeakPolarHBondContact O-CB 3.28Å; P261-I264 PolarHBondContact O-N 3.18Å
262T92Very high95.1Very high112 Ų11264.6 Ų64.669%0.68734%0.335SS*.Hα-helixtrans-57.5-24.2-175.5530000113.5K260 I264 T265 G266K260-T262 PolarHBondContact O-N 3.21Å; T262-I264 VanDerWaalsContact C-N 3.3Å; T262-I264 PolarHBondContact O-N 3.12Å; T262-T265 PolarHBondContact O-N 3Å; T262-G266 PolarHBondContact O-N 3.05Å
263E94.6Very high95Very high127 Ų12767.1 Ų67.159%0.59335%0.345SS*.Hα-helixtrans-64.1-33.9175.5-61.681.3178.800112.1P261 R267P261-E263 VanDerWaalsContact CB-OE2 3.24Å; P261-E263 WeakPolarHBondContact CB-OE2 3.38Å; P261-E263 PolarHBondContact O-N 2.96Å; E263-R267 VanDerWaalsContact O-CG 3.31Å; E263-R267 WeakPolarHBondContact O-CG 3.37Å; E263-R267 PolarHBondContact O-N 3.33Å; E263-R267 VanDerWaalsContact O-N 3.1Å
264I92.3Very high94.9Very high60 Ų6070.8 Ų70.831%0.30836%0.364SS..Hα-helixtrans-69.6-52.3178-58.1-175.7000109.3K260 P261 T262 G266 R267 Y268K260-I264 HydrophobicContact CB-CD1 4.36Å; K260-I264 HydrophobicContact CD-CD1 4.38Å; P261-I264 HydrophobicContact CB-CG1 4.49Å; P261-I264 HydrophobicContact CG-CD1 4.44Å; P261-I264 WeakPolarHBondContact O-CB 3.28Å; P261-I264 PolarHBondContact O-N 3.18Å; T262-I264 VanDerWaalsContact C-N 3.3Å; T262-I264 PolarHBondContact O-N 3.12Å; I264-G266 VanDerWaalsContact C-N 3.27Å; I264-G266 PolarHBondContact O-N 3.47Å; I264-R267 WeakPolarHBondContact O-CB 3.46Å; I264-R267 PolarHBondContact O-N 2.97Å; I264-R267 VanDerWaalsContact O-N 3.13Å; I264-Y268 HydrophobicContact CG2-CD2 4.38Å; I264-Y268 HydrophobicContact CG2-CE2 3.84Å; I264-Y268 PolarHBondContact O-N 3.28Å
265T93.7Very high94.7Very high15 Ų1573.1 Ų73.19%0.09238%0.383CS..Hα-helixtrans-56.1-45.3174.9-49.20000110.8I252 S255 Q256 T262 R267 Y268 V269I252-T265 HydrophobicContact CG2-CG2 4.09Å; S255-T265 WeakPolarHBondContact CB-OG1 3.44Å; S255-T265 WeakPolarHBondContact OG-CB 3.34Å; S255-T265 PolarHBondContact OG-OG1 2.8Å; Q256-T265 HydrophobicContact CG-CG2 3.75Å; T262-T265 PolarHBondContact O-N 3Å; T265-R267 VanDerWaalsContact C-N 3.27Å; T265-R267 PolarHBondContact O-N 3.39Å; T265-Y268 PolarHBondContact O-N 2.93Å; T265-V269 HydrophobicContact CG2-CG2 4.27Å; T265-V269 VanDerWaalsContact O-CG2 3.29Å; T265-V269 WeakPolarHBondContact O-CG2 3.47Å; T265-V269 PolarHBondContact O-N 2.93Å
266G94.8Very high94.6Very high34 Ų3475 Ų7535%0.35139%0.39SS..Hα-helixtrans-60.9-30.7179.200000114.1T262 I264 R270T262-G266 PolarHBondContact O-N 3.05Å; I264-G266 VanDerWaalsContact C-N 3.27Å; I264-G266 PolarHBondContact O-N 3.47Å; G266-R270 WeakPolarHBondContact O-CB 3.49Å; G266-R270 PolarHBondContact O-N 3.14Å
267R95.4Very high94.4Very high190 Ų19073 Ų7372%0.71739%0.387SS*.Hα-helixtrans-66.9-47.5173.8-76172.6-174-161.82.7111.7E263 I264 T265 R270 Q271E263-R267 VanDerWaalsContact O-CG 3.31Å; E263-R267 WeakPolarHBondContact O-CG 3.37Å; E263-R267 PolarHBondContact O-N 3.33Å; E263-R267 VanDerWaalsContact O-N 3.1Å; I264-R267 WeakPolarHBondContact O-CB 3.46Å; I264-R267 PolarHBondContact O-N 2.97Å; I264-R267 VanDerWaalsContact O-N 3.13Å; T265-R267 VanDerWaalsContact C-N 3.27Å; T265-R267 PolarHBondContact O-N 3.39Å; R267-R270 PolarHBondContact O-N 3.38Å; R267-Q271 PolarHBondContact O-N 3.18Å
268Y95Very high94Very high56 Ų5673 Ų7322%0.2239%0.389CS..Hα-helixtrans-66.5-40.9178.3-63.9-53000112.1L238 V248 A251 I252 I264 T265 R270 Q271 M272L238-Y268 HydrophobicContact CD1-CE1 4.49Å; V248-Y268 HydrophobicContact CG1-CD1 4.25Å; A251-Y268 HydrophobicContact CB-CD1 4.38Å; A251-Y268 HydrophobicContact CB-CD2 4.04Å; A251-Y268 HydrophobicContact CB-CE1 4.23Å; A251-Y268 HydrophobicContact CB-CE2 3.84Å; A251-Y268 HydrophobicContact CB-CG 4.3Å; I252-Y268 HydrophobicContact CG1-CG 4.39Å; I264-Y268 HydrophobicContact CG2-CD2 4.38Å; I264-Y268 HydrophobicContact CG2-CE2 3.84Å; I264-Y268 PolarHBondContact O-N 3.28Å; T265-Y268 PolarHBondContact O-N 2.93Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 3.1Å; Y268-Q271 WeakPolarHBondContact O-CB 3.48Å; Y268-Q271 PolarHBondContact O-N 2.96Å; Y268-M272 PolarHBondContact O-N 3.5Å
269V96Very high93.8Very high27 Ų2772.5 Ų72.516%0.16439%0.385CS..Hα-helixtrans-59-42.5174.1173.90000110.9I252 T265 M272 K273 W281 L285I252-V269 HydrophobicContact CD1-CG2 4.07Å; I252-V269 HydrophobicContact CG1-CG2 4.26Å; I252-V269 HydrophobicContact CG2-CG2 4.29Å; T265-V269 HydrophobicContact CG2-CG2 4.27Å; T265-V269 VanDerWaalsContact O-CG2 3.29Å; T265-V269 WeakPolarHBondContact O-CG2 3.47Å; T265-V269 PolarHBondContact O-N 2.93Å; V269-M272 PolarHBondContact O-N 3.14Å; V269-K273 HydrophobicContact CG1-CD 4.35Å; V269-K273 WeakPolarHBondContact O-CG 3.42Å; V269-K273 PolarHBondContact O-N 3.06Å; V269-W281 HydrophobicContact CG1-CH2 4.33Å; V269-W281 HydrophobicContact CG2-CH2 4.13Å; V269-L285 HydrophobicContact CG1-CD2 3.66Å
270R95.9Very high93.7Very high170 Ų17072.8 Ų72.864%0.64237%0.374SS*.Hα-helixtrans-65.1-43176-174177.8-60.6168.22.3111.7G266 R267 Y268 M272 K273 D274G266-R270 WeakPolarHBondContact O-CB 3.49Å; G266-R270 PolarHBondContact O-N 3.14Å; R267-R270 PolarHBondContact O-N 3.38Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 3.1Å; R270-M272 VanDerWaalsContact C-N 3.28Å; R270-M272 PolarHBondContact O-N 3.37Å; R270-K273 PolarHBondContact O-N 3.16Å; R270-K273 VanDerWaalsContact O-N 3.14Å; R270-D274 WeakPolarHBondContact CG-OD2 3.37Å; R270-D274 WeakPolarHBondContact O-CB 3.44Å; R270-D274 VanDerWaalsContact O-CG 3.3Å; R270-D274 PolarHBondContact O-N 2.97Å
271Q95.4Very high93.7Very high53 Ų5373.1 Ų73.125%0.24837%0.374CS..Hα-helixtrans-56.6-43.2175.1-177.1179.8-5.800111.6S242 R267 Y268 D274 A275S242-Q271 PolarHBondContact O-NE2 3.28Å; R267-Q271 PolarHBondContact O-N 3.18Å; Y268-Q271 WeakPolarHBondContact O-CB 3.48Å; Y268-Q271 PolarHBondContact O-N 2.96Å; Q271-D274 PolarHBondContact O-N 2.93Å; Q271-A275 VanDerWaalsContact O-CB 3.3Å; Q271-A275 WeakPolarHBondContact O-CB 3.47Å; Q271-A275 PolarHBondContact O-N 3.3Å
272M96.3Very high93.8Very high0 Ų069.5 Ų69.50%035%0.351CS..Hα-helixtrans-63.4-43.3174.7-75.8-59.4-6400112.7A245 V248 I249 I252 Y268 V269 R270 D274 Y276 H279 W281 T282A245-M272 HydrophobicContact CB-CE 4.17Å; A245-M272 HydrophobicContact CB-SD 4.16Å; V248-M272 HydrophobicContact CB-CG 4.48Å; V248-M272 HydrophobicContact CB-SD 4.11Å; V248-M272 HydrophobicContact CG1-CG 3.71Å; V248-M272 HydrophobicContact CG1-SD 3.97Å; I249-M272 HydrophobicContact CD1-CE 3.78Å; I249-M272 HydrophobicContact CG1-CE 3.84Å; I249-M272 HydrophobicContact CG1-CG 4.5Å; I249-M272 HydrophobicContact CG1-SD 4.15Å; I252-M272 HydrophobicContact CD1-CG 4Å; Y268-M272 PolarHBondContact O-N 3.5Å; V269-M272 PolarHBondContact O-N 3.14Å; R270-M272 VanDerWaalsContact C-N 3.28Å; R270-M272 PolarHBondContact O-N 3.37Å; M272-D274 PolarHBondContact O-N 3.44Å; M272-Y276 HydrophobicContact CE-CD2 4.42Å; M272-Y276 HydrophobicContact CE-CG 4.4Å; M272-Y276 CarbonylContact O-C 3.54Å; M272-Y276 WeakPolarHBondContact O-CA 3.49Å; M272-Y276 WeakPolarHBondContact O-CB 3.47Å; M272-Y276 PolarHBondContact O-N 3.17Å; M272-Y276 HydrophobicContact SD-CD2 3.76Å; M272-Y276 HydrophobicContact SD-CG 4.33Å; M272-H279 HydrophobicContact CE-CB 4.16Å; M272-W281 HydrophobicContact CB-CE3 4.01Å; M272-W281 HydrophobicContact CB-CZ3 3.62Å; M272-W281 HydrophobicContact CE-CE3 4.07Å; M272-W281 HydrophobicContact CG-CE3 4.15Å; M272-W281 HydrophobicContact CG-CZ3 3.96Å; M272-T282 PolarHBondContact O-OG1 3.18Å
273K95.3Very high93.9Very high57 Ų5771.8 Ų71.825%0.24835%0.347CS..Hα-helixtrans-63.7-39.6177.4-73.2178.3177.1-173.20112.8V269 R270 T282 L286 E289V269-K273 HydrophobicContact CG1-CD 4.35Å; V269-K273 WeakPolarHBondContact O-CG 3.42Å; V269-K273 PolarHBondContact O-N 3.06Å; R270-K273 PolarHBondContact O-N 3.16Å; R270-K273 VanDerWaalsContact O-N 3.14Å; K273-T282 HydrophobicContact CG-CG2 4.1Å; K273-L286 HydrophobicContact CD-CD2 4.16Å; K273-L286 HydrophobicContact CG-CD2 4.47Å; K273-E289 IonicContact NZ-OE1 3.24Å; K273-E289 PolarHBondContact NZ-OE1 3.02Å; K273-E289 IonicContact NZ-OE2 2.71Å; K273-E289 PolarHBondContact NZ-OE2 3.49Å
274D94.1Very high94Very high124 Ų12470 Ų7066%0.66334%0.341SS*.Hα-helixtrans-81.7-46.7-175-66.3-15.5000112.2R270 Q271 M272R270-D274 WeakPolarHBondContact CG-OD2 3.37Å; R270-D274 WeakPolarHBondContact O-CB 3.44Å; R270-D274 VanDerWaalsContact O-CG 3.3Å; R270-D274 PolarHBondContact O-N 2.97Å; Q271-D274 PolarHBondContact O-N 2.93Å; M272-D274 PolarHBondContact O-N 3.44Å
275A93.1Very high94.1Very high51 Ų5169.2 Ų69.242%0.42134%0.338SS..Hα-helixtrans-90-25.4-174.800000113.4Q271 P277Q271-A275 VanDerWaalsContact O-CB 3.3Å; Q271-A275 WeakPolarHBondContact O-CB 3.47Å; Q271-A275 PolarHBondContact O-N 3.3Å; A275-P277 VanDerWaalsContact C-CD 3.42Å
276Y93.4Very high94.2Very high42 Ų4272 Ų7217%0.16535%0.351CS..  trans-131.653.9-171.4-63-63.6000113.1K58 N243 A245 M272 D278 H279 T282K58-Y276 PolarHBondContact NZ-OH 2.93Å; K58-Y276 VanDerWaalsContact NZ-OH 3.15Å; N243-Y276 VanDerWaalsContact O-CZ 3.27Å; N243-Y276 PolarHBondContact O-OH 3.08Å; A245-Y276 HydrophobicContact CB-CD1 4.01Å; A245-Y276 HydrophobicContact CB-CD2 3.8Å; A245-Y276 HydrophobicContact CB-CE1 4.17Å; A245-Y276 HydrophobicContact CB-CE2 3.93Å; A245-Y276 HydrophobicContact CB-CG 3.86Å; M272-Y276 HydrophobicContact CE-CD2 4.42Å; M272-Y276 HydrophobicContact CE-CG 4.4Å; M272-Y276 CarbonylContact O-C 3.54Å; M272-Y276 WeakPolarHBondContact O-CA 3.49Å; M272-Y276 WeakPolarHBondContact O-CB 3.47Å; M272-Y276 PolarHBondContact O-N 3.17Å; M272-Y276 HydrophobicContact SD-CD2 3.76Å; M272-Y276 HydrophobicContact SD-CG 4.33Å; Y276-D278 VanDerWaalsContact C-N 3.3Å; Y276-D278 PolarHBondContact O-N 2.93Å; Y276-H279 WeakPolarHBondContact O-CB 3.4Å; Y276-H279 PolarHBondContact O-N 3.04Å; Y276-T282 WeakPolarHBondContact O-CB 3.47Å; Y276-T282 PolarHBondContact O-OG1 3.11Å
277P91.1Very high94.2Very high68 Ų6873 Ų7344%0.44236%0.356SS..THydrogen-bonded Turntrans-63.4-34-17726.4-35.2000113.4A275 H279A275-P277 VanDerWaalsContact C-CD 3.42Å; P277-H279 VanDerWaalsContact C-N 3.32Å
278D88.2Confident94.2Very high92 Ų9270 Ų7049%0.49235%0.349SS..THydrogen-bonded Turntrans-81.3-10.2-179.2-73.2-12.2000113.4R93 Y276 R283R93-D278 IonicContact CZ-OD2 3.64Å; R93-D278 IonicContact NH1-OD2 3.54Å; R93-D278 PolarHBondContact NH1-OD2 3.32Å; R93-D278 IonicContact NH2-OD2 3.67Å; Y276-D278 VanDerWaalsContact C-N 3.3Å; Y276-D278 PolarHBondContact O-N 2.93Å; D278-R283 VanDerWaalsContact O-CD 3.31Å; D278-R283 WeakPolarHBondContact O-CD 3.26Å
279H92.1Very high94.2Very high39 Ų3970.9 Ų70.918%0.18136%0.355CS..SBendtrans-65138.5-175.3-171.1-91.4000111.1E246 I249 M272 Y276 P277 W281 T282 R283E246-H279 IonicContact OE1-CD2 3.1Å; E246-H279 IonicContact OE1-CE1 3.64Å; E246-H279 IonicContact OE1-NE2 3.31Å; E246-H279 PolarHBondContact OE1-NE2 3.08Å; I249-H279 WeakPolarHBondContact CD1-CE1 3.48Å; M272-H279 HydrophobicContact CE-CB 4.16Å; Y276-H279 WeakPolarHBondContact O-CB 3.4Å; Y276-H279 PolarHBondContact O-N 3.04Å; P277-H279 VanDerWaalsContact C-N 3.32Å; H279-W281 VanDerWaalsContact C-N 3.25Å; H279-W281 VanDerWaalsContact ND1-CB 3.33Å; H279-W281 WeakPolarHBondContact ND1-CB 3.45Å; H279-W281 PolarHBondContact ND1-N 3.39Å; H279-W281 PolarHBondContact O-N 3.47Å; H279-W281 VanDerWaalsContact O-N 3.16Å; H279-T282 PolarHBondContact O-N 3.41Å; H279-R283 PolarHBondContact O-N 3.06Å
280P91.4Very high94.1Very high71 Ų7173.4 Ų73.446%0.46137%0.374SS..Hα-helixtrans-51.4-42.7-177.7-30.136000113.8T282 R283 D284P280-T282 PolarHBondContact O-N 3.41Å; P280-R283 PolarHBondContact O-N 2.91Å; P280-D284 PolarHBondContact O-N 3.44Å
281W94.3Very high94.1Very high72 Ų7268.9 Ų68.927%0.27336%0.36SS..Hα-helixtrans-60.7-44.9176.6-175.994.4000112.7I249 I252 V269 M272 H279 D284 L285I249-W281 HydrophobicContact CD1-CB 3.7Å; I249-W281 HydrophobicContact CD1-CD2 4.4Å; I249-W281 HydrophobicContact CD1-CG 3.85Å; I249-W281 HydrophobicContact CG1-CB 4.39Å; I249-W281 HydrophobicContact CG1-CD2 4.12Å; I249-W281 HydrophobicContact CG1-CG 4.02Å; I252-W281 HydrophobicContact CD1-CH2 3.55Å; I252-W281 HydrophobicContact CD1-CZ2 3.82Å; I252-W281 HydrophobicContact CD1-CZ3 4.13Å; I252-W281 HydrophobicContact CG2-CZ2 4.22Å; V269-W281 HydrophobicContact CG1-CH2 4.33Å; V269-W281 HydrophobicContact CG2-CH2 4.13Å; M272-W281 HydrophobicContact CB-CE3 4.01Å; M272-W281 HydrophobicContact CB-CZ3 3.62Å; M272-W281 HydrophobicContact CE-CE3 4.07Å; M272-W281 HydrophobicContact CG-CE3 4.15Å; M272-W281 HydrophobicContact CG-CZ3 3.96Å; H279-W281 VanDerWaalsContact C-N 3.25Å; H279-W281 VanDerWaalsContact ND1-CB 3.33Å; H279-W281 WeakPolarHBondContact ND1-CB 3.45Å; H279-W281 PolarHBondContact ND1-N 3.39Å; H279-W281 PolarHBondContact O-N 3.47Å; H279-W281 VanDerWaalsContact O-N 3.16Å; W281-D284 PolarHBondContact O-N 2.62Å; W281-L285 HydrophobicContact CH2-CD2 3.52Å; W281-L285 HydrophobicContact CZ2-CD2 4.28Å; W281-L285 HydrophobicContact CZ3-CD2 3.75Å; W281-L285 WeakPolarHBondContact O-CB 3.31Å; W281-L285 PolarHBondContact O-N 2.78Å
282T95.6Very high94Very high0 Ų072.7 Ų72.70%038%0.376CS..Hα-helixtrans-66.6-42.6180-54.90000110.9M272 K273 Y276 H279 P280 L285 L286M272-T282 PolarHBondContact O-OG1 3.18Å; K273-T282 HydrophobicContact CG-CG2 4.1Å; Y276-T282 WeakPolarHBondContact O-CB 3.47Å; Y276-T282 PolarHBondContact O-OG1 3.11Å; H279-T282 PolarHBondContact O-N 3.41Å; P280-T282 PolarHBondContact O-N 3.41Å; T282-L285 PolarHBondContact O-N 3.14Å; T282-L286 HydrophobicContact CG2-CD1 4.09Å; T282-L286 HydrophobicContact CG2-CG 4.48Å; T282-L286 WeakPolarHBondContact O-CG 3.26Å; T282-L286 PolarHBondContact O-N 3.32Å
283R94.5Very high93.9Very high159 Ų15977.6 Ų77.660%0.640%0.402SS*.Hα-helixtrans-62.3-45.1177.5-69.7178.762.4-169.8-0.7111.7D278 H279 P280 A287D278-R283 VanDerWaalsContact O-CD 3.31Å; D278-R283 WeakPolarHBondContact O-CD 3.26Å; H279-R283 PolarHBondContact O-N 3.06Å; P280-R283 PolarHBondContact O-N 2.91Å; R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.33Å
284D95.3Very high93.8Very high91 Ų9182.2 Ų82.249%0.48742%0.418SS..Hα-helixtrans-63.4-46.8176.9-173.560.4000110.8P280 W281 L286 A287 K288P280-D284 PolarHBondContact O-N 3.44Å; W281-D284 PolarHBondContact O-N 2.62Å; D284-L286 PolarHBondContact O-N 3.37Å; D284-A287 WeakPolarHBondContact O-CB 3.45Å; D284-A287 PolarHBondContact O-N 3.19Å; D284-A287 VanDerWaalsContact O-N 3.15Å; D284-K288 WeakPolarHBondContact O-CG 3.32Å; D284-K288 PolarHBondContact O-N 3.24Å; D284-K288 WeakPolarHBondContact OD1-CE 3.43Å
285L95.5Very high93.8Very high43 Ų4380.3 Ų80.323%0.22541%0.407CS..Hα-helixtrans-56.1-50177.7178.964.6000112.3V269 W281 T282 A287 K288 E289V269-L285 HydrophobicContact CG1-CD2 3.66Å; W281-L285 HydrophobicContact CH2-CD2 3.52Å; W281-L285 HydrophobicContact CZ2-CD2 4.28Å; W281-L285 HydrophobicContact CZ3-CD2 3.75Å; W281-L285 WeakPolarHBondContact O-CB 3.31Å; W281-L285 PolarHBondContact O-N 2.78Å; T282-L285 PolarHBondContact O-N 3.14Å; L285-A287 VanDerWaalsContact C-N 3.3Å; L285-A287 PolarHBondContact O-N 3.21Å; L285-K288 PolarHBondContact O-N 3.37Å; L285-E289 HydrophobicContact CD1-CG 4.4Å; L285-E289 WeakPolarHBondContact O-CG 3.36Å; L285-E289 PolarHBondContact O-N 3.1Å
286L95.2Very high93.7Very high72 Ų7281.1 Ų81.138%0.37741%0.407SS..Hα-helixtrans-63.5-36.2179.5-69.7174.2000112.2K273 T282 D284 S290K273-L286 HydrophobicContact CD-CD2 4.16Å; K273-L286 HydrophobicContact CG-CD2 4.47Å; T282-L286 HydrophobicContact CG2-CD1 4.09Å; T282-L286 HydrophobicContact CG2-CG 4.48Å; T282-L286 WeakPolarHBondContact O-CG 3.26Å; T282-L286 PolarHBondContact O-N 3.32Å; D284-L286 PolarHBondContact O-N 3.37Å; L286-S290 WeakPolarHBondContact O-CB 3.37Å; L286-S290 PolarHBondContact O-N 3.04Å; L286-S290 PolarHBondContact O-OG 3.11Å
287A95.3Very high93.6Very high56 Ų5681.5 Ų81.546%0.46342%0.418SS..Hα-helixtrans-65.6-41.7174.600000111.6R283 D284 L285 S290 E291R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.33Å; D284-A287 WeakPolarHBondContact O-CB 3.45Å; D284-A287 PolarHBondContact O-N 3.19Å; D284-A287 VanDerWaalsContact O-N 3.15Å; L285-A287 VanDerWaalsContact C-N 3.3Å; L285-A287 PolarHBondContact O-N 3.21Å; A287-S290 PolarHBondContact O-N 2.92Å; A287-E291 WeakPolarHBondContact O-CB 3.46Å; A287-E291 PolarHBondContact O-N 3.45Å
288K96.1Very high93.4Very high128 Ų12883.4 Ų83.456%0.55743%0.425SS*.Hα-helixtrans-67.6-40.5176.3-63.4-58.7177.7-174.50112.6D284 L285 E291 F292D284-K288 WeakPolarHBondContact O-CG 3.32Å; D284-K288 PolarHBondContact O-N 3.24Å; D284-K288 WeakPolarHBondContact OD1-CE 3.43Å; L285-K288 PolarHBondContact O-N 3.37Å; K288-E291 PolarHBondContact O-N 3Å; K288-F292 WeakPolarHBondContact O-CB 3.41Å; K288-F292 PolarHBondContact O-N 3.35Å
289E94Very high92.9Very high73 Ų7389 Ų8934%0.34144%0.438SS..Hα-helixtrans-60-47.9173.7-74.3177168.500111K273 L285 E291 F292 D293K273-E289 IonicContact NZ-OE1 3.24Å; K273-E289 PolarHBondContact NZ-OE1 3.02Å; K273-E289 IonicContact NZ-OE2 2.71Å; K273-E289 PolarHBondContact NZ-OE2 3.49Å; L285-E289 HydrophobicContact CD1-CG 4.4Å; L285-E289 WeakPolarHBondContact O-CG 3.36Å; L285-E289 PolarHBondContact O-N 3.1Å; E289-E291 VanDerWaalsContact C-N 3.31Å; E289-E291 PolarHBondContact O-N 3.02Å; E289-F292 PolarHBondContact O-N 3.24Å; E289-D293 PolarHBondContact O-N 3.36Å
290S94.6Very high92.1Very high81 Ų8191.8 Ų91.857%0.56646%0.463SS*.Hα-helixtrans-60.8-40.1178-58.50000112.3L286 A287 R294L286-S290 WeakPolarHBondContact O-CB 3.37Å; L286-S290 PolarHBondContact O-N 3.04Å; L286-S290 PolarHBondContact O-OG 3.11Å; A287-S290 PolarHBondContact O-N 2.92Å; S290-R294 WeakPolarHBondContact O-CB 3.38Å; S290-R294 PolarHBondContact O-N 3.12Å; S290-R294 VanDerWaalsContact O-N 3.1Å
291E94.6Very high90.7Very high75 Ų7598.9 Ų98.935%0.3548%0.48SS..Hα-helixtrans-67.9-40.7176.2178.958.3-168.200112A287 K288 E289 R294 L295A287-E291 WeakPolarHBondContact O-CB 3.46Å; A287-E291 PolarHBondContact O-N 3.45Å; K288-E291 PolarHBondContact O-N 3Å; E289-E291 VanDerWaalsContact C-N 3.31Å; E289-E291 PolarHBondContact O-N 3.02Å; E291-R294 VanDerWaalsContact CD-NH2 3.31Å; E291-R294 WeakPolarHBondContact O-CB 3.29Å; E291-R294 PolarHBondContact O-N 2.69Å; E291-R294 IonicContact OE1-CZ 3.56Å; E291-R294 IonicContact OE1-NE 2.76Å; E291-R294 IonicContact OE1-NH2 3.63Å; E291-R294 PolarHBondContact OE1-NH2 3.47Å; E291-R294 IonicContact OE2-CZ 3.9Å; E291-R294 VanDerWaalsContact OE2-CZ 3.31Å; E291-R294 IonicContact OE2-NE 2.7Å; E291-R294 PolarHBondContact OE2-NE 3.07Å; E291-R294 IonicContact OE2-NH2 3.6Å; E291-R294 PolarHBondContact OE2-NH2 3.2Å; E291-R294 VanDerWaalsContact OE2-NH2 3.1Å; E291-L295 HydrophobicContact CG-CD1 4.36Å; E291-L295 WeakPolarHBondContact O-CG 3.35Å; E291-L295 PolarHBondContact O-N 3.07Å
292F94.3Very high88.9Confident133 Ų133103.2 Ų103.258%0.58352%0.515SS*.Hα-helixtrans-61.4-47.6176-177.9-95.8000111.6K288 E289 R294 L295 V296K288-F292 WeakPolarHBondContact O-CB 3.41Å; K288-F292 PolarHBondContact O-N 3.35Å; E289-F292 PolarHBondContact O-N 3.24Å; F292-R294 VanDerWaalsContact C-N 3.29Å; F292-R294 PolarHBondContact O-N 3.03Å; F292-L295 PolarHBondContact O-N 2.65Å; F292-L295 VanDerWaalsContact O-N 3.1Å; F292-V296 HydrophobicContact CD1-CG2 4.02Å; F292-V296 HydrophobicContact CE1-CG2 3.61Å; F292-V296 HydrophobicContact CE2-CG2 4.44Å; F292-V296 HydrophobicContact CZ-CG2 3.84Å; F292-V296 WeakPolarHBondContact O-CG2 3.21Å; F292-V296 PolarHBondContact O-N 2.93Å
293D94.6Very high88.6Confident103 Ų103108.4 Ų108.455%0.55154%0.541SS*.Hα-helixtrans-60.5-40.1178-73.5-16.9000111.7E289 L295 V296 A297E289-D293 PolarHBondContact O-N 3.36Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.41Å; D293-V296 PolarHBondContact O-N 3.34Å; D293-A297 WeakPolarHBondContact O-CB 3.38Å; D293-A297 PolarHBondContact O-N 2.99Å
294R93.1Very high88.3Confident154 Ų154105.7 Ų105.758%0.58154%0.538SS*.Hα-helixtrans-59.6-43.5174.3-171.4-178.175.9104.21.1111.8S290 E291 F292 L298S290-R294 WeakPolarHBondContact O-CB 3.38Å; S290-R294 PolarHBondContact O-N 3.12Å; S290-R294 VanDerWaalsContact O-N 3.1Å; E291-R294 VanDerWaalsContact CD-NH2 3.31Å; E291-R294 WeakPolarHBondContact O-CB 3.29Å; E291-R294 PolarHBondContact O-N 2.69Å; E291-R294 IonicContact OE1-CZ 3.56Å; E291-R294 IonicContact OE1-NE 2.76Å; E291-R294 IonicContact OE1-NH2 3.63Å; E291-R294 PolarHBondContact OE1-NH2 3.47Å; E291-R294 IonicContact OE2-CZ 3.9Å; E291-R294 VanDerWaalsContact OE2-CZ 3.31Å; E291-R294 IonicContact OE2-NE 2.7Å; E291-R294 PolarHBondContact OE2-NE 3.07Å; E291-R294 IonicContact OE2-NH2 3.6Å; E291-R294 PolarHBondContact OE2-NH2 3.2Å; E291-R294 VanDerWaalsContact OE2-NH2 3.1Å; F292-R294 VanDerWaalsContact C-N 3.29Å; F292-R294 PolarHBondContact O-N 3.03Å; R294-L298 PolarHBondContact O-N 3.25Å; R294-L298 VanDerWaalsContact O-N 3.09Å
295L93Very high87.9Confident84 Ų84106.6 Ų106.644%0.4454%0.541SS..Hα-helixtrans-69.6-38.8179.5-69.2172.5000112.5E291 F292 D293 L298 R299E291-L295 HydrophobicContact CG-CD1 4.36Å; E291-L295 WeakPolarHBondContact O-CG 3.35Å; E291-L295 PolarHBondContact O-N 3.07Å; F292-L295 PolarHBondContact O-N 2.65Å; F292-L295 VanDerWaalsContact O-N 3.1Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.41Å; L295-L298 PolarHBondContact O-N 3.42Å; L295-R299 PolarHBondContact O-N 3.33Å; L295-R299 VanDerWaalsContact O-N 3.14Å
296V91.8Very high87.4Confident68 Ų68110.3 Ų110.341%0.41256%0.559SS.*Hα-helixtrans-62.8-47.4174.5172.40000110.4F292 D293 L298 R299 S300F292-V296 HydrophobicContact CD1-CG2 4.02Å; F292-V296 HydrophobicContact CE1-CG2 3.61Å; F292-V296 HydrophobicContact CE2-CG2 4.44Å; F292-V296 HydrophobicContact CZ-CG2 3.84Å; F292-V296 WeakPolarHBondContact O-CG2 3.21Å; F292-V296 PolarHBondContact O-N 2.93Å; D293-V296 PolarHBondContact O-N 3.34Å; V296-L298 VanDerWaalsContact C-N 3.26Å; V296-L298 PolarHBondContact O-N 3.36Å; V296-R299 PolarHBondContact O-N 2.98Å; V296-R299 VanDerWaalsContact O-N 3.15Å; V296-S300 PolarHBondContact O-N 3.31Å; V296-S300 PolarHBondContact O-OG 3.12Å
297A90Very high86.9Confident49 Ų49112.7 Ų112.741%0.40557%0.57SS.*Hα-helixtrans-62.2-32.5178.300000112.9D293 R301D293-A297 WeakPolarHBondContact O-CB 3.38Å; D293-A297 PolarHBondContact O-N 2.99Å; A297-R301 WeakPolarHBondContact O-CG 3.17Å
298L88Confident86.4Confident109 Ų109116.5 Ų116.557%0.57158%0.578SS**Hα-helixtrans-67.3-43.7174.6-17368000111.6R294 L295 V296 S300 R301R294-L298 PolarHBondContact O-N 3.25Å; R294-L298 VanDerWaalsContact O-N 3.09Å; L295-L298 PolarHBondContact O-N 3.42Å; V296-L298 VanDerWaalsContact C-N 3.26Å; V296-L298 PolarHBondContact O-N 3.36Å; L298-S300 PolarHBondContact O-N 3.19Å; L298-R301 PolarHBondContact O-N 3.44Å
299R78.2Confident85.7Confident208 Ų208115.6 Ų115.679%0.78558%0.579SS**Hα-helixtrans-67.2-31.5177.5-86.7-170.4172-173.3-0.5113.6L295 V296 R301 T302L295-R299 PolarHBondContact O-N 3.33Å; L295-R299 VanDerWaalsContact O-N 3.14Å; V296-R299 PolarHBondContact O-N 2.98Å; V296-R299 VanDerWaalsContact O-N 3.15Å; R299-R301 PolarHBondContact O-N 3.38Å; R299-T302 PolarHBondContact O-N 3.42Å; R299-T302 PolarHBondContact O-OG1 3.24Å
300S74Confident85Confident99 Ų99118.9 Ų118.969%0.69260%0.597SS**THydrogen-bonded Turntrans-71.7-11.1176.2-56.10000113.6V296 L298V296-S300 PolarHBondContact O-N 3.31Å; V296-S300 PolarHBondContact O-OG 3.12Å; L298-S300 PolarHBondContact O-N 3.19Å
301R63.5Low84.2Confident220 Ų220122.1 Ų122.183%0.8360%0.6SS**THydrogen-bonded Turntrans-97-13177.4-68.5178.2-177.8-173.41.8113.8A297 L298 R299A297-R301 WeakPolarHBondContact O-CG 3.17Å; L298-R301 PolarHBondContact O-N 3.44Å; R299-R301 PolarHBondContact O-N 3.38Å
302T55.8Low83.3Confident163 Ų163126.4 Ų126.4100%162%0.623SS**  trans-98.50176.2540000110.7R299R299-T302 PolarHBondContact O-N 3.42Å; R299-T302 PolarHBondContact O-OG1 3.24Å

Retrieved 302 of 302 residues in 293.1 ms (Link to these results)

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