A0A087XNZ2_POEFO Loading...

V-type proton ATPase 21 kDa proteolipid subunit c''

Proton-conducting pore forming of the V0 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment. Proton-conducting pore forming subunit of the V0 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment.

AlphaFold DB , UniProt , Accession A0A087XNZ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 211 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
1M50.5Low63.8Low178 Ų178125 Ų12588%0.87764%0.638SS**  0-69.30-134.5169.978.400114.3E4 W5M1-E4 VanDerWaalsContact CA-OE2 3.26Å; M1-E4 WeakPolarHBondContact CA-OE2 3.26Å; M1-E4 PolarHBondContact N-OE2 2.77Å; M1-E4 PolarHBondContact O-N 3.43Å; M1-W5 PolarHBondContact O-N 3.48Å
2L49.9Very low65.9Low156 Ų156122.8 Ų122.882%0.81763%0.627SS**Hα-helixtrans-66.6-38.6179.1-87160.7000113.9W5 M6L2-W5 PolarHBondContact O-N 3.49Å; L2-M6 PolarHBondContact O-N 3.3Å
3L48.7Very low67.9Low133 Ų133121.2 Ų121.270%0.69662%0.62SS**Hα-helixtrans-68.7-30.5176.2-96137.9000113.7M6L3-M6 PolarHBondContact O-N 3.31Å
4E53.7Low69.6Low134 Ų134123.6 Ų123.663%0.62662%0.619SS**Hα-helixtrans-72.2-33.2177.3-74.6159.513900111.9M1 M7M1-E4 VanDerWaalsContact CA-OE2 3.26Å; M1-E4 WeakPolarHBondContact CA-OE2 3.26Å; M1-E4 PolarHBondContact N-OE2 2.77Å; M1-E4 PolarHBondContact O-N 3.43Å; E4-M7 PolarHBondContact O-N 3.47Å
5W52.7Low71Confident184 Ų184121.1 Ų121.170%0.69761%0.613SS**Hα-helixtrans-68-35.8174.1-89.681.7000112.9M1 L2 M7 N8 A11M1-W5 PolarHBondContact O-N 3.48Å; L2-W5 PolarHBondContact O-N 3.49Å; W5-M7 PolarHBondContact O-N 3.41Å; W5-N8 PolarHBondContact O-N 3.39Å; W5-A11 WeakPolarHBondContact O-CB 3.49Å
6M52.4Low72.3Confident142 Ų142115.9 Ų115.970%0.760%0.599SS**Hα-helixtrans-66.7-19175.5-75.6179.762.800113.3L2 L3 I12L2-M6 PolarHBondContact O-N 3.3Å; L3-M6 PolarHBondContact O-N 3.31Å; M6-I12 WeakPolarHBondContact O-CG1 2.93Å
7M56.1Low73.7Confident142 Ų142114.3 Ų114.370%0.760%0.596SS**THydrogen-bonded Turntrans-101.44.3-177.1-67.3-17963.700114.1E4 W5 G9E4-M7 PolarHBondContact O-N 3.47Å; W5-M7 PolarHBondContact O-N 3.41Å; M7-G9 PolarHBondContact O-N 3.47Å
8N78Confident74.8Confident83 Ų83112.1 Ų112.144%0.44459%0.588SS.*SBendtrans-68.9129.2170.4-82.8-31.7000109.9W5 H10 A11 I12W5-N8 PolarHBondContact O-N 3.39Å; N8-H10 PolarHBondContact O-N 3.47Å; N8-H10 VanDerWaalsContact O-N 3.08Å; N8-A11 HydrophobicContact CB-CB 4.12Å; N8-A11 WeakPolarHBondContact O-CA 3.41Å; N8-A11 WeakPolarHBondContact O-CB 3.47Å; N8-A11 PolarHBondContact O-N 3.13Å; N8-I12 PolarHBondContact O-N 3.41Å
9G86.1Confident75.8Confident58 Ų58112.4 Ų112.460%0.59859%0.589SS**Hα-helixtrans-53.2-34.8-177.600000114M7 L13M7-G9 PolarHBondContact O-N 3.47Å; G9-L13 PolarHBondContact O-N 3.48Å; G9-L13 VanDerWaalsContact O-N 3.13Å
10H85.5Confident76.8Confident138 Ų138109.4 Ų109.464%0.63958%0.581SS**Hα-helixtrans-68.6-42173.2-63.5-62000113.2N8 I12 L13 Y14N8-H10 PolarHBondContact O-N 3.47Å; N8-H10 VanDerWaalsContact O-N 3.08Å; H10-I12 VanDerWaalsContact C-N 3.34Å; H10-I12 PolarHBondContact O-N 3.21Å; H10-L13 WeakPolarHBondContact O-CB 3.43Å; H10-L13 PolarHBondContact O-N 3.04Å; H10-Y14 HydrophobicContact CB-CE2 4.01Å; H10-Y14 WeakPolarHBondContact O-CD2 3.37Å; H10-Y14 PolarHBondContact O-N 3.41Å
11A88.1Confident77.8Confident27 Ų27109.5 Ų109.522%0.22358%0.577CS.*Hα-helixtrans-62.6-43.3177.900000110.9W5 N8 L13 Y14 T15W5-A11 WeakPolarHBondContact O-CB 3.49Å; N8-A11 HydrophobicContact CB-CB 4.12Å; N8-A11 WeakPolarHBondContact O-CA 3.41Å; N8-A11 WeakPolarHBondContact O-CB 3.47Å; N8-A11 PolarHBondContact O-N 3.13Å; A11-L13 VanDerWaalsContact C-N 3.31Å; A11-L13 PolarHBondContact O-N 2.87Å; A11-Y14 PolarHBondContact O-N 3Å; A11-T15 WeakPolarHBondContact O-CB 3.34Å; A11-T15 PolarHBondContact O-N 3.34Å; A11-T15 PolarHBondContact O-OG1 3.48Å
12I89.8Confident79.9Confident99 Ų99108.7 Ų108.751%0.50857%0.565SS.*Hα-helixtrans-59.6-42.7175-63.6170.9000110.9M6 N8 H10 G16M6-I12 WeakPolarHBondContact O-CG1 2.93Å; N8-I12 PolarHBondContact O-N 3.41Å; H10-I12 VanDerWaalsContact C-N 3.34Å; H10-I12 PolarHBondContact O-N 3.21Å; I12-G16 PolarHBondContact O-N 2.84Å
13L91.3Very high82.1Confident102 Ų102103.9 Ų103.953%0.53454%0.544SS..Hα-helixtrans-60.3-50.6176.217965.4000111.7G9 H10 A11 G16 V17G9-L13 PolarHBondContact O-N 3.48Å; G9-L13 VanDerWaalsContact O-N 3.13Å; H10-L13 WeakPolarHBondContact O-CB 3.43Å; H10-L13 PolarHBondContact O-N 3.04Å; A11-L13 VanDerWaalsContact C-N 3.31Å; A11-L13 PolarHBondContact O-N 2.87Å; L13-G16 PolarHBondContact O-N 3.13Å; L13-V17 HydrophobicContact CD1-CG2 4.1Å; L13-V17 WeakPolarHBondContact O-CB 3.44Å; L13-V17 VanDerWaalsContact O-CG2 3.3Å; L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L13-V17 PolarHBondContact O-N 3Å
14Y91.7Very high84.3Confident154 Ų154101.4 Ų101.460%0.60453%0.534SS*.Hα-helixtrans-62.8-46.3179.8-63.2-57.5000111.6H10 A11 G16 V17 T18H10-Y14 HydrophobicContact CB-CE2 4.01Å; H10-Y14 WeakPolarHBondContact O-CD2 3.37Å; H10-Y14 PolarHBondContact O-N 3.41Å; A11-Y14 PolarHBondContact O-N 3Å; Y14-G16 VanDerWaalsContact C-N 3.33Å; Y14-G16 PolarHBondContact O-N 3.37Å; Y14-V17 PolarHBondContact O-N 3.28Å; Y14-T18 WeakPolarHBondContact O-CB 3.41Å; Y14-T18 PolarHBondContact O-N 3.08Å; Y14-T18 PolarHBondContact O-OG1 3.12Å
15T90.3Very high86.3Confident86 Ų8698.5 Ų98.553%0.52852%0.522SS..Hα-helixtrans-60.5-43.9177.2-560000111.3A11 T18 L19A11-T15 WeakPolarHBondContact O-CB 3.34Å; A11-T15 PolarHBondContact O-N 3.34Å; A11-T15 PolarHBondContact O-OG1 3.48Å; T15-T18 PolarHBondContact O-N 2.92Å; T15-L19 HydrophobicContact CG2-CD1 4.1Å; T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 PolarHBondContact O-N 2.87Å
16G92.9Very high88.3Confident39 Ų3995.2 Ų95.240%0.40252%0.518SS..Hα-helixtrans-62.9-46.9177.900000113I12 L13 Y14 L19 A20I12-G16 PolarHBondContact O-N 2.84Å; L13-G16 PolarHBondContact O-N 3.13Å; Y14-G16 VanDerWaalsContact C-N 3.33Å; Y14-G16 PolarHBondContact O-N 3.37Å; G16-L19 PolarHBondContact O-N 3.22Å; G16-A20 WeakPolarHBondContact O-CB 3.26Å; G16-A20 PolarHBondContact O-N 3.4Å
17V94.9Very high90.4Very high88 Ų8893.4 Ų93.453%0.53351%0.51SS..Hα-helixtrans-63.2-44.3177.61720000111L13 Y14 A20 F21L13-V17 HydrophobicContact CD1-CG2 4.1Å; L13-V17 WeakPolarHBondContact O-CB 3.44Å; L13-V17 VanDerWaalsContact O-CG2 3.3Å; L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L13-V17 PolarHBondContact O-N 3Å; Y14-V17 PolarHBondContact O-N 3.28Å; V17-A20 PolarHBondContact O-N 2.91Å; V17-F21 VanDerWaalsContact O-CB 3.31Å; V17-F21 WeakPolarHBondContact O-CB 3.31Å; V17-F21 PolarHBondContact O-N 2.89Å
18T93.6Very high92.2Very high75 Ų7589.8 Ų89.846%0.4650%0.495SS..Hα-helixtrans-62.5-44.7177.8-60.90000111.7Y14 T15 F21 W22Y14-T18 WeakPolarHBondContact O-CB 3.41Å; Y14-T18 PolarHBondContact O-N 3.08Å; Y14-T18 PolarHBondContact O-OG1 3.12Å; T15-T18 PolarHBondContact O-N 2.92Å; T18-F21 PolarHBondContact O-N 2.85Å; T18-W22 PolarHBondContact O-N 2.98Å; T18-W22 VanDerWaalsContact O-N 3.09Å
19L94.8Very high92.9Very high117 Ų11787.6 Ų87.661%0.61349%0.492SS*.Hα-helixtrans-61.8-48177-111.1140.4000111.8T15 G16 F21 W22 S23T15-L19 HydrophobicContact CG2-CD1 4.1Å; T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 PolarHBondContact O-N 2.87Å; G16-L19 PolarHBondContact O-N 3.22Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 2.97Å; L19-W22 PolarHBondContact O-N 3.48Å; L19-S23 WeakPolarHBondContact O-CB 3.42Å; L19-S23 PolarHBondContact O-N 2.98Å; L19-S23 PolarHBondContact O-OG 3.29Å; L19-S23 VanDerWaalsContact O-OG 3.11Å
20A95.6Very high93.3Very high52 Ų5288.7 Ų88.743%0.4348%0.484SS..Hα-helixtrans-62.1-39.9179.600000112.2G16 V17 S23 T24G16-A20 WeakPolarHBondContact O-CB 3.26Å; G16-A20 PolarHBondContact O-N 3.4Å; V17-A20 PolarHBondContact O-N 2.91Å; A20-S23 WeakPolarHBondContact CA-OG 3.43Å; A20-S23 PolarHBondContact O-OG 2.68Å; A20-T24 VanDerWaalsContact O-CB 3.3Å; A20-T24 WeakPolarHBondContact O-CB 3.18Å; A20-T24 PolarHBondContact O-N 3.44Å; A20-T24 PolarHBondContact O-OG1 3.35Å
21F96.4Very high93.7Very high113 Ų11384.5 Ų84.550%0.49647%0.469SS..Hα-helixtrans-62.1-52176.4176.2-103.2000111.7V17 T18 L19 T24 I25V17-F21 VanDerWaalsContact O-CB 3.31Å; V17-F21 WeakPolarHBondContact O-CB 3.31Å; V17-F21 PolarHBondContact O-N 2.89Å; T18-F21 PolarHBondContact O-N 2.85Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 2.97Å; F21-T24 PolarHBondContact O-N 2.98Å; F21-I25 HydrophobicContact CD1-CD1 3.99Å; F21-I25 HydrophobicContact CD2-CD1 4.2Å; F21-I25 HydrophobicContact CE1-CD1 3.39Å; F21-I25 HydrophobicContact CE2-CD1 3.63Å; F21-I25 HydrophobicContact CE2-CG1 4.44Å; F21-I25 HydrophobicContact CG-CD1 4.37Å; F21-I25 HydrophobicContact CZ-CD1 3.2Å; F21-I25 HydrophobicContact CZ-CG1 4.41Å; F21-I25 PolarHBondContact O-N 3.48Å
22W95.6Very high93.9Very high161 Ų16186.9 Ų86.961%0.6147%0.473SS*.Hα-helixtrans-67.8-38.6-178.9-75.5115.2000113.2T18 L19 T24 I25 L26T18-W22 PolarHBondContact O-N 2.98Å; T18-W22 VanDerWaalsContact O-N 3.09Å; L19-W22 PolarHBondContact O-N 3.48Å; W22-T24 VanDerWaalsContact C-N 3.32Å; W22-T24 PolarHBondContact O-N 3.45Å; W22-I25 PolarHBondContact O-N 3.35Å; W22-L26 WeakPolarHBondContact O-CB 3.41Å; W22-L26 PolarHBondContact O-N 3Å
23S95.6Very high94.1Very high55 Ų5587.1 Ų87.139%0.38548%0.479SS..Hα-helixtrans-63.3-41.4175.564.20000111.4L19 A20 L26 I27L19-S23 WeakPolarHBondContact O-CB 3.42Å; L19-S23 PolarHBondContact O-N 2.98Å; L19-S23 PolarHBondContact O-OG 3.29Å; L19-S23 VanDerWaalsContact O-OG 3.11Å; A20-S23 WeakPolarHBondContact CA-OG 3.43Å; A20-S23 PolarHBondContact O-OG 2.68Å; S23-L26 PolarHBondContact O-N 2.94Å; S23-I27 WeakPolarHBondContact O-CD1 3.44Å; S23-I27 VanDerWaalsContact O-CG1 3.27Å; S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 3.47Å; S23-I27 VanDerWaalsContact O-N 3.08Å
24T95.9Very high94.2Very high80 Ų8088.1 Ų88.149%0.49148%0.484SS..Hα-helixtrans-66.4-45.3178.2-55.20000111.1A20 F21 W22 L26 I27 V28A20-T24 VanDerWaalsContact O-CB 3.3Å; A20-T24 WeakPolarHBondContact O-CB 3.18Å; A20-T24 PolarHBondContact O-N 3.44Å; A20-T24 PolarHBondContact O-OG1 3.35Å; F21-T24 PolarHBondContact O-N 2.98Å; W22-T24 VanDerWaalsContact C-N 3.32Å; W22-T24 PolarHBondContact O-N 3.45Å; T24-L26 VanDerWaalsContact C-N 3.32Å; T24-L26 PolarHBondContact O-N 3.44Å; T24-I27 PolarHBondContact O-N 3.41Å; T24-V28 HydrophobicContact CG2-CG2 4.28Å; T24-V28 WeakPolarHBondContact O-CB 3.49Å; T24-V28 VanDerWaalsContact O-CG2 3.26Å; T24-V28 WeakPolarHBondContact O-CG2 3.36Å; T24-V28 PolarHBondContact O-N 3.13Å
25I95.5Very high94.3Very high74 Ų7487.5 Ų87.538%0.37949%0.485SS..Hα-helixtrans-59.5-42.7175.8-77.1179.9000111.6F21 W22 V28 G29F21-I25 HydrophobicContact CD1-CD1 3.99Å; F21-I25 HydrophobicContact CD2-CD1 4.2Å; F21-I25 HydrophobicContact CE1-CD1 3.39Å; F21-I25 HydrophobicContact CE2-CD1 3.63Å; F21-I25 HydrophobicContact CE2-CG1 4.44Å; F21-I25 HydrophobicContact CG-CD1 4.37Å; F21-I25 HydrophobicContact CZ-CD1 3.2Å; F21-I25 HydrophobicContact CZ-CG1 4.41Å; F21-I25 PolarHBondContact O-N 3.48Å; W22-I25 PolarHBondContact O-N 3.35Å; I25-V28 PolarHBondContact O-N 2.69Å; I25-G29 PolarHBondContact O-N 3.43Å
26L95.1Very high94.3Very high114 Ų11490.1 Ų90.160%0.59750%0.495SS*.Hα-helixtrans-61.5-47178.8-177.468.8000111.2W22 S23 T24 G29 I30W22-L26 WeakPolarHBondContact O-CB 3.41Å; W22-L26 PolarHBondContact O-N 3Å; S23-L26 PolarHBondContact O-N 2.94Å; T24-L26 VanDerWaalsContact C-N 3.32Å; T24-L26 PolarHBondContact O-N 3.44Å; L26-G29 PolarHBondContact O-N 2.92Å; L26-I30 HydrophobicContact CD1-CD1 4.22Å; L26-I30 HydrophobicContact CG-CD1 4Å; L26-I30 VanDerWaalsContact O-CG1 3.26Å; L26-I30 WeakPolarHBondContact O-CG1 3.35Å; L26-I30 PolarHBondContact O-N 3.28Å
27I95.3Very high94.3Very high105 Ų10591.1 Ų91.154%0.53849%0.491SS..Hα-helixtrans-62.2-48178.1-67164.5000110.3S23 T24 G29 I30 C31S23-I27 WeakPolarHBondContact O-CD1 3.44Å; S23-I27 VanDerWaalsContact O-CG1 3.27Å; S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 3.47Å; S23-I27 VanDerWaalsContact O-N 3.08Å; T24-I27 PolarHBondContact O-N 3.41Å; I27-G29 VanDerWaalsContact C-N 3.35Å; I27-G29 PolarHBondContact O-N 2.9Å; I27-I30 PolarHBondContact O-N 3.17Å; I27-C31 PolarHBondContact O-N 3.05Å; I27-C31 PolarHBondContact O-SG 2.92Å
28V94.9Very high94Very high65 Ų6588.8 Ų88.839%0.39449%0.485SS..Hα-helixtrans-60.4-45.7178.7170.60000110.7T24 I25 I30 C31 Y32T24-V28 HydrophobicContact CG2-CG2 4.28Å; T24-V28 WeakPolarHBondContact O-CB 3.49Å; T24-V28 VanDerWaalsContact O-CG2 3.26Å; T24-V28 WeakPolarHBondContact O-CG2 3.36Å; T24-V28 PolarHBondContact O-N 3.13Å; I25-V28 PolarHBondContact O-N 2.69Å; V28-I30 PolarHBondContact O-N 2.86Å; V28-C31 WeakPolarHBondContact O-CB 3.48Å; V28-C31 PolarHBondContact O-N 3.5Å; V28-Y32 HydrophobicContact CG1-CD2 3.59Å; V28-Y32 HydrophobicContact CG1-CE2 3.59Å; V28-Y32 VanDerWaalsContact O-CD2 3.31Å; V28-Y32 WeakPolarHBondContact O-CD2 3.44Å; V28-Y32 PolarHBondContact O-N 2.99Å
29G92.9Very high93.8Very high37 Ų3792.9 Ų92.938%0.38150%0.496SS..Hα-helixtrans-59.6-43.4177.600000112.9I25 L26 I27 Y32 T33I25-G29 PolarHBondContact O-N 3.43Å; L26-G29 PolarHBondContact O-N 2.92Å; I27-G29 VanDerWaalsContact C-N 3.35Å; I27-G29 PolarHBondContact O-N 2.9Å; G29-Y32 PolarHBondContact O-N 3.33Å; G29-T33 PolarHBondContact O-N 3.44Å; G29-T33 PolarHBondContact O-OG1 3.11Å
30I93.7Very high93.6Very high81 Ų8195 Ų9542%0.41550%0.496SS..Hα-helixtrans-65.4-40.6175.1-67.3166.5000111.1L26 I27 V28 T33 I34L26-I30 HydrophobicContact CD1-CD1 4.22Å; L26-I30 HydrophobicContact CG-CD1 4Å; L26-I30 VanDerWaalsContact O-CG1 3.26Å; L26-I30 WeakPolarHBondContact O-CG1 3.35Å; L26-I30 PolarHBondContact O-N 3.28Å; I27-I30 PolarHBondContact O-N 3.17Å; V28-I30 PolarHBondContact O-N 2.86Å; I30-T33 PolarHBondContact O-N 3.31Å; I30-T33 PolarHBondContact O-OG1 3.37Å; I30-I34 HydrophobicContact CG2-CD1 3.46Å; I30-I34 VanDerWaalsContact CG2-CD1 3.46Å; I30-I34 HydrophobicContact CG2-CG1 4.15Å; I30-I34 WeakPolarHBondContact O-CB 3.42Å; I30-I34 VanDerWaalsContact O-CG1 3.32Å; I30-I34 WeakPolarHBondContact O-CG1 3.42Å; I30-I34 PolarHBondContact O-N 2.91Å
31C93.7Very high93.4Very high50 Ų5099.8 Ų99.834%0.33851%0.508SS..Hα-helixtrans-63-44.3176.6-71.70000111.8I27 V28 T33 I34 F35I27-C31 PolarHBondContact O-N 3.05Å; I27-C31 PolarHBondContact O-SG 2.92Å; V28-C31 WeakPolarHBondContact O-CB 3.48Å; V28-C31 PolarHBondContact O-N 3.5Å; C31-T33 VanDerWaalsContact C-N 3.25Å; C31-T33 PolarHBondContact O-N 3.05Å; C31-I34 PolarHBondContact O-N 3.03Å; C31-F35 HydrophobicContact CB-CD2 4.05Å; C31-F35 HydrophobicContact CB-CE2 4.15Å; C31-F35 WeakPolarHBondContact O-CB 3.43Å; C31-F35 WeakPolarHBondContact O-CD2 3.41Å; C31-F35 PolarHBondContact O-N 3.4Å
32Y92.9Very high93.3Very high78 Ų7898.4 Ų98.431%0.30651%0.505SS..Hα-helixtrans-60.4-34.8178-91.9-79.2000112.6V28 G29 L37 G38 R40V28-Y32 HydrophobicContact CG1-CD2 3.59Å; V28-Y32 HydrophobicContact CG1-CE2 3.59Å; V28-Y32 VanDerWaalsContact O-CD2 3.31Å; V28-Y32 WeakPolarHBondContact O-CD2 3.44Å; V28-Y32 PolarHBondContact O-N 2.99Å; G29-Y32 PolarHBondContact O-N 3.33Å; Y32-L37 HydrophobicContact CD1-CB 3.89Å; Y32-L37 WeakPolarHBondContact CD1-O 3.46Å; Y32-L37 HydrophobicContact CE1-CB 4.32Å; Y32-L37 CarbonylContact O-C 3.59Å; Y32-L37 PolarHBondContact O-N 3.19Å; Y32-G38 PolarHBondContact O-N 3.39Å; Y32-G38 VanDerWaalsContact O-N 3.08Å; Y32-R40 HydrophobicContact CE1-CB 4.04Å
33T92.6Very high93.1Very high103 Ų10394.4 Ų94.463%0.63250%0.499SS*.Hα-helixtrans-79.6-38.2177.656.30000113.1G29 I30 C31G29-T33 PolarHBondContact O-N 3.44Å; G29-T33 PolarHBondContact O-OG1 3.11Å; I30-T33 PolarHBondContact O-N 3.31Å; I30-T33 PolarHBondContact O-OG1 3.37Å; C31-T33 VanDerWaalsContact C-N 3.25Å; C31-T33 PolarHBondContact O-N 3.05Å
34I94.8Very high93Very high123 Ų12394.6 Ų94.663%0.63150%0.504SS*.Hα-helixtrans-72.6-38.5-179-69.4177.1000112.3I30 C31 D36I30-I34 HydrophobicContact CG2-CD1 3.46Å; I30-I34 VanDerWaalsContact CG2-CD1 3.46Å; I30-I34 HydrophobicContact CG2-CG1 4.15Å; I30-I34 WeakPolarHBondContact O-CB 3.42Å; I30-I34 VanDerWaalsContact O-CG1 3.32Å; I30-I34 WeakPolarHBondContact O-CG1 3.42Å; I30-I34 PolarHBondContact O-N 2.91Å; C31-I34 PolarHBondContact O-N 3.03Å; I34-D36 PolarHBondContact O-N 2.77Å
35F94.3Very high92.8Very high142 Ų14298.1 Ų98.162%0.62351%0.508SS*.THydrogen-bonded Turntrans-85.813.4-177.3-68.5-65.3000114.1C31 L37C31-F35 HydrophobicContact CB-CD2 4.05Å; C31-F35 HydrophobicContact CB-CE2 4.15Å; C31-F35 WeakPolarHBondContact O-CB 3.43Å; C31-F35 WeakPolarHBondContact O-CD2 3.41Å; C31-F35 PolarHBondContact O-N 3.4Å; F35-L37 HydrophobicContact CB-CD1 3.8Å; F35-L37 HydrophobicContact CB-CG 4.46Å; F35-L37 PolarHBondContact O-N 3.45Å
36D89.8Confident92.7Very high140 Ų14099.5 Ų99.575%0.74951%0.512SS*.THydrogen-bonded Turntrans54.524.6-178-155.331.5000113.7I34 G38 F39I34-D36 PolarHBondContact O-N 2.77Å; D36-G38 VanDerWaalsContact C-N 3.3Å; D36-F39 WeakPolarHBondContact O-CD1 3.46Å; D36-F39 WeakPolarHBondContact O-CE1 3.27Å
37L92.8Very high92.7Very high61 Ų6197.1 Ų97.132%0.31950%0.499SS..  trans-92.19.3177.7-80.7153.6000112.1Y32 F35 F39 R40Y32-L37 HydrophobicContact CD1-CB 3.89Å; Y32-L37 WeakPolarHBondContact CD1-O 3.46Å; Y32-L37 HydrophobicContact CE1-CB 4.32Å; Y32-L37 CarbonylContact O-C 3.59Å; Y32-L37 PolarHBondContact O-N 3.19Å; F35-L37 HydrophobicContact CB-CD1 3.8Å; F35-L37 HydrophobicContact CB-CG 4.46Å; F35-L37 PolarHBondContact O-N 3.45Å; L37-F39 HydrophobicContact CD2-CE1 4.24Å; L37-F39 HydrophobicContact CD2-CZ 4.25Å; L37-F39 PolarHBondContact O-N 3.19Å; L37-F39 VanDerWaalsContact O-N 3.14Å; L37-R40 VanDerWaalsContact CD2-CD 3.49Å; L37-R40 HydrophobicContact CD2-CG 4.26Å; L37-R40 WeakPolarHBondContact O-CB 3.41Å; L37-R40 PolarHBondContact O-N 3.06Å
38G87.3Confident92.4Very high38 Ų3894.6 Ų94.639%0.39249%0.489SS..G310 helixtrans-57-29.7-176.800000113.4Y32 D36 R40 F41Y32-G38 PolarHBondContact O-N 3.39Å; Y32-G38 VanDerWaalsContact O-N 3.08Å; D36-G38 VanDerWaalsContact C-N 3.3Å; G38-R40 PolarHBondContact O-N 3.47Å; G38-R40 VanDerWaalsContact O-N 3.12Å; G38-F41 PolarHBondContact O-N 3.36Å
39F89.5Confident92.2Very high161 Ų16197.3 Ų97.371%0.70650%0.497SS*.G310 helixtrans-60.7-20.2175.470.8-91.1000113.8D36 L37D36-F39 WeakPolarHBondContact O-CD1 3.46Å; D36-F39 WeakPolarHBondContact O-CE1 3.27Å; L37-F39 HydrophobicContact CD2-CE1 4.24Å; L37-F39 HydrophobicContact CD2-CZ 4.25Å; L37-F39 PolarHBondContact O-N 3.19Å; L37-F39 VanDerWaalsContact O-N 3.14Å
40R91.1Very high92.2Very high163 Ų16396.8 Ų96.862%0.61549%0.486SS*.G310 helixtrans-81.8-18.2176.1-62.2-174.168.9-173.30.1113Y32 L37 G38 D42Y32-R40 HydrophobicContact CE1-CB 4.04Å; L37-R40 VanDerWaalsContact CD2-CD 3.49Å; L37-R40 HydrophobicContact CD2-CG 4.26Å; L37-R40 WeakPolarHBondContact O-CB 3.41Å; L37-R40 PolarHBondContact O-N 3.06Å; G38-R40 PolarHBondContact O-N 3.47Å; G38-R40 VanDerWaalsContact O-N 3.12Å; R40-D42 VanDerWaalsContact C-N 3.29Å; R40-D42 PolarHBondContact O-N 3.19Å; R40-D42 VanDerWaalsContact O-N 3.14Å
41F91.9Very high92.1Very high151 Ų15195.7 Ų95.766%0.66249%0.486SS*.  trans-86.175.6175.6-168.7-94.7000109.2G38 V43G38-F41 PolarHBondContact O-N 3.36Å; F41-V43 HydrophobicContact CD1-CG2 4.2Å; F41-V43 HydrophobicContact CE1-CG2 3.71Å; F41-V43 HydrophobicContact CZ-CG2 4.46Å
42D93.1Very high92.1Very high84 Ų8493.3 Ų93.345%0.44947%0.47SS..  trans-100.1101.6-176.5-169.8-8000111.6R40 A44 W45 F46R40-D42 VanDerWaalsContact C-N 3.29Å; R40-D42 PolarHBondContact O-N 3.19Å; R40-D42 VanDerWaalsContact O-N 3.14Å; D42-A44 VanDerWaalsContact C-N 3.31Å; D42-A44 WeakPolarHBondContact OD1-CA 3.24Å; D42-A44 VanDerWaalsContact OD1-CB 3.23Å; D42-A44 WeakPolarHBondContact OD1-CB 3.44Å; D42-A44 PolarHBondContact OD1-N 2.68Å; D42-W45 HydrophobicContact CB-CB 3.89Å; D42-W45 PolarHBondContact OD1-N 2.96Å; D42-F46 PolarHBondContact O-N 3.03Å
43V93Very high92.1Very high77 Ų7792.3 Ų92.347%0.46747%0.467SS..Hα-helixtrans-71.3-29.7175-176.80000111.2F41 F46 L47F41-V43 HydrophobicContact CD1-CG2 4.2Å; F41-V43 HydrophobicContact CE1-CG2 3.71Å; F41-V43 HydrophobicContact CZ-CG2 4.46Å; V43-F46 PolarHBondContact O-N 3.11Å; V43-L47 HydrophobicContact CG1-CD1 4.07Å; V43-L47 HydrophobicContact CG1-CG 4.33Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 WeakPolarHBondContact O-CG 3.3Å; V43-L47 PolarHBondContact O-N 3.05Å
44A92Very high92.3Very high60 Ų6091.4 Ų91.450%0.49646%0.457SS..Hα-helixtrans-65.8-47177.400000109.8D42 F46 L47 T48D42-A44 VanDerWaalsContact C-N 3.31Å; D42-A44 WeakPolarHBondContact OD1-CA 3.24Å; D42-A44 VanDerWaalsContact OD1-CB 3.23Å; D42-A44 WeakPolarHBondContact OD1-CB 3.44Å; D42-A44 PolarHBondContact OD1-N 2.68Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 3.09Å; A44-L47 PolarHBondContact O-N 2.94Å; A44-L47 VanDerWaalsContact O-N 3.15Å; A44-T48 WeakPolarHBondContact O-CG2 3.38Å; A44-T48 PolarHBondContact O-N 3.43Å; A44-T48 PolarHBondContact O-OG1 2.98Å
45W92.4Very high92.4Very high153 Ų15387.4 Ų87.458%0.5843%0.434SS*.Hα-helixtrans-55.3-46.9173.9177.875.9000112.1D42 L47 T48 E49D42-W45 HydrophobicContact CB-CB 3.89Å; D42-W45 PolarHBondContact OD1-N 2.96Å; W45-L47 VanDerWaalsContact C-N 3.33Å; W45-L47 PolarHBondContact O-N 2.92Å; W45-T48 PolarHBondContact O-N 3.39Å; W45-T48 PolarHBondContact O-OG1 3.43Å; W45-E49 HydrophobicContact CD2-CB 4.47Å; W45-E49 HydrophobicContact CZ2-CB 4.35Å; W45-E49 HydrophobicContact CZ2-CG 3.98Å; W45-E49 WeakPolarHBondContact O-CB 3.37Å; W45-E49 PolarHBondContact O-N 3.41Å
46F94.1Very high92.4Very high104 Ų10480.6 Ų80.646%0.45640%0.404SS..Hα-helixtrans-58.2-44.3177.3173.8-102.2000112.5D42 V43 A44 T50 W55D42-F46 PolarHBondContact O-N 3.03Å; V43-F46 PolarHBondContact O-N 3.11Å; A44-F46 VanDerWaalsContact C-N 3.33Å; A44-F46 PolarHBondContact O-N 3.09Å; F46-T50 WeakPolarHBondContact O-CB 3.24Å; F46-T50 PolarHBondContact O-N 3.44Å; F46-T50 PolarHBondContact O-OG1 3.09Å; F46-W55 HydrophobicContact CE1-CZ2 4.26Å
47L93.6Very high92.8Very high63 Ų6378.5 Ų78.533%0.3339%0.393SS..Hα-helixtrans-72.2-35.8-179-72.5178.4000112.7V43 A44 W45 W55 Y141V43-L47 HydrophobicContact CG1-CD1 4.07Å; V43-L47 HydrophobicContact CG1-CG 4.33Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 WeakPolarHBondContact O-CG 3.3Å; V43-L47 PolarHBondContact O-N 3.05Å; A44-L47 PolarHBondContact O-N 2.94Å; A44-L47 VanDerWaalsContact O-N 3.15Å; W45-L47 VanDerWaalsContact C-N 3.33Å; W45-L47 PolarHBondContact O-N 2.92Å; L47-W55 HydrophobicContact CD2-CZ2 4.42Å; L47-Y141 WeakPolarHBondContact CB-OH 3.48Å; L47-Y141 HydrophobicContact CD2-CE1 4.21Å; L47-Y141 PolarHBondContact O-OH 3.24Å
48T90.5Very high93Very high53 Ų5379.3 Ų79.333%0.32540%0.397SS..Hα-helixtrans-82.3-37.1-179.7550000112.8A44 W45 T50 Y137A44-T48 WeakPolarHBondContact O-CG2 3.38Å; A44-T48 PolarHBondContact O-N 3.43Å; A44-T48 PolarHBondContact O-OG1 2.98Å; W45-T48 PolarHBondContact O-N 3.39Å; W45-T48 PolarHBondContact O-OG1 3.43Å; T48-T50 VanDerWaalsContact C-N 3.34Å; T48-Y137 WeakPolarHBondContact O-CE1 3.32Å; T48-Y137 VanDerWaalsContact O-CZ 3.3Å; T48-Y137 PolarHBondContact O-OH 3.48Å
49E89.8Confident93.5Very high122 Ų12277.5 Ų77.557%0.5738%0.379SS*.Hα-helixtrans-73-32.7-179.3-16564.8-154.400111.3W45 S51W45-E49 HydrophobicContact CD2-CB 4.47Å; W45-E49 HydrophobicContact CZ2-CB 4.35Å; W45-E49 HydrophobicContact CZ2-CG 3.98Å; W45-E49 WeakPolarHBondContact O-CB 3.37Å; W45-E49 PolarHBondContact O-N 3.41Å; E49-S51 PolarHBondContact O-N 3.49Å
50T93Very high93.8Very high25 Ų2571 Ų7115%0.15335%0.351CS..SBendtrans-69.9128.3176.9-60.20000110.7F46 T48 M54F46-T50 WeakPolarHBondContact O-CB 3.24Å; F46-T50 PolarHBondContact O-N 3.44Å; F46-T50 PolarHBondContact O-OG1 3.09Å; T48-T50 VanDerWaalsContact C-N 3.34Å; T50-M54 HydrophobicContact CG2-CB 4.42Å; T50-M54 HydrophobicContact CG2-CE 3.21Å; T50-M54 HydrophobicContact CG2-SD 3.72Å
51S91.6Very high94.2Very high58 Ų5864.8 Ų64.841%0.40634%0.338SS..  trans-64.3136.9-175.571.80000112.6E49 F53 M54E49-S51 PolarHBondContact O-N 3.49Å; S51-F53 PolarHBondContact O-N 3.16Å; S51-M54 WeakPolarHBondContact O-CB 3.4Å; S51-M54 PolarHBondContact O-N 3.46Å; S51-M54 PolarHBondContact OG-N 2.84Å
52P93.3Very high94.4Very high1 Ų159.6 Ų59.61%0.00632%0.317CS..Hα-helixtrans-57.1-29.5172.9-27.434.4000113.7M54 W55 A56 F124 I132 Y137 M209P52-M54 VanDerWaalsContact C-N 3.31Å; P52-M54 PolarHBondContact O-N 3.39Å; P52-W55 PolarHBondContact O-N 3.12Å; P52-A56 PolarHBondContact O-N 3.08Å; P52-F124 HydrophobicContact CB-CE1 4.36Å; P52-F124 HydrophobicContact CB-CZ 4.38Å; P52-F124 HydrophobicContact CG-CE1 4.45Å; P52-F124 HydrophobicContact CG-CZ 4.07Å; P52-I132 HydrophobicContact CG-CG2 4.02Å; P52-Y137 HydrophobicContact CG-CD1 3.75Å; P52-Y137 HydrophobicContact CG-CE1 3.87Å; P52-Y137 HydrophobicContact CG-CG 4.26Å; P52-M209 HydrophobicContact CB-CE 4.05Å
53F94.3Very high94.7Very high56 Ų5655.6 Ų55.625%0.24630%0.295CS..Hα-helixtrans-61.8-35.6175.3-68.4-67.2000113S51 W55 A56 N57 F124 M209S51-F53 PolarHBondContact O-N 3.16Å; F53-W55 VanDerWaalsContact C-N 3.34Å; F53-W55 PolarHBondContact O-N 3.05Å; F53-A56 PolarHBondContact O-N 3.3Å; F53-N57 VanDerWaalsContact O-CB 3.27Å; F53-N57 WeakPolarHBondContact O-CB 3.46Å; F53-N57 VanDerWaalsContact O-CG 3.3Å; F53-N57 PolarHBondContact O-N 3.44Å; F53-N57 PolarHBondContact O-ND2 3.21Å; F53-F124 HydrophobicContact CD2-CE1 4.08Å; F53-F124 AromaticContact CD2-CZ 3.93Å; F53-F124 HydrophobicContact CD2-CZ 3.93Å; F53-F124 HydrophobicContact CE1-CD1 4.4Å; F53-F124 HydrophobicContact CE1-CE1 4.17Å; F53-F124 AromaticContact CE2-CD1 3.94Å; F53-F124 HydrophobicContact CE2-CD1 3.94Å; F53-F124 HydrophobicContact CE2-CD2 4.42Å; F53-F124 AromaticContact CE2-CE1 3.41Å; F53-F124 HydrophobicContact CE2-CE1 3.41Å; F53-F124 VanDerWaalsContact CE2-CE1 3.41Å; F53-F124 AromaticContact CE2-CE2 3.92Å; F53-F124 HydrophobicContact CE2-CE2 3.92Å; F53-F124 HydrophobicContact CE2-CG 4.42Å; F53-F124 AromaticContact CE2-CZ 3.39Å; F53-F124 HydrophobicContact CE2-CZ 3.39Å; F53-F124 AromaticContact CZ-CD1 3.61Å; F53-F124 HydrophobicContact CZ-CD1 3.61Å; F53-F124 AromaticContact CZ-CE1 3.46Å; F53-F124 HydrophobicContact CZ-CE1 3.46Å; F53-F124 VanDerWaalsContact CZ-CE1 3.46Å; F53-F124 HydrophobicContact CZ-CG 4.24Å; F53-F124 AromaticContact CZ-CZ 3.95Å; F53-F124 HydrophobicContact CZ-CZ 3.95Å; F53-M209 HydrophobicContact CD1-CE 3.4Å; F53-M209 HydrophobicContact CE1-CE 3.43Å; F53-M209 VanDerWaalsContact CE1-CE 3.43Å; F53-M209 HydrophobicContact CE1-SD 4.49Å; F53-M209 HydrophobicContact CG-CE 3.97Å; F53-M209 HydrophobicContact CZ-CE 4.03Å
54M95.9Very high94.9Very high85 Ų8554.9 Ų54.942%0.41929%0.288SS..Hα-helixtrans-59.8-48.4177-172.4-16878.800110.3T50 S51 P52 L58T50-M54 HydrophobicContact CG2-CB 4.42Å; T50-M54 HydrophobicContact CG2-CE 3.21Å; T50-M54 HydrophobicContact CG2-SD 3.72Å; S51-M54 WeakPolarHBondContact O-CB 3.4Å; S51-M54 PolarHBondContact O-N 3.46Å; S51-M54 PolarHBondContact OG-N 2.84Å; P52-M54 VanDerWaalsContact C-N 3.31Å; P52-M54 PolarHBondContact O-N 3.39Å; M54-L58 WeakPolarHBondContact O-CB 3.31Å; M54-L58 PolarHBondContact O-N 3.29Å
55W96.3Very high95.2Very high38 Ų3854.6 Ų54.614%0.14428%0.283CS..Hα-helixtrans-64.2-47.8179.1-64.2108.7000112F46 L47 P52 F53 G59 G140 Y141 F144F46-W55 HydrophobicContact CE1-CZ2 4.26Å; L47-W55 HydrophobicContact CD2-CZ2 4.42Å; P52-W55 PolarHBondContact O-N 3.12Å; F53-W55 VanDerWaalsContact C-N 3.34Å; F53-W55 PolarHBondContact O-N 3.05Å; W55-G59 PolarHBondContact O-N 3.44Å; W55-G140 WeakPolarHBondContact CB-O 3.31Å; W55-Y141 AromaticContact CD1-CE1 3.63Å; W55-Y141 HydrophobicContact CD2-CD1 4.26Å; W55-Y141 HydrophobicContact CD2-CE1 4.19Å; W55-Y141 AromaticContact CE2-CE1 3.9Å; W55-Y141 HydrophobicContact CG-CD1 4.03Å; W55-Y141 HydrophobicContact CG-CE1 4.02Å; W55-Y141 AromaticContact NE1-CE1 3.54Å; W55-F144 HydrophobicContact CB-CB 4Å; W55-F144 HydrophobicContact CE3-CB 4.3Å; W55-F144 AromaticContact CE3-CD1 3.57Å; W55-F144 HydrophobicContact CE3-CD1 3.57Å; W55-F144 AromaticContact CE3-CD2 3.91Å; W55-F144 HydrophobicContact CE3-CD2 3.91Å; W55-F144 AromaticContact CE3-CE1 3.72Å; W55-F144 HydrophobicContact CE3-CE1 3.72Å; W55-F144 HydrophobicContact CE3-CE2 4.07Å; W55-F144 AromaticContact CE3-CG 3.65Å; W55-F144 HydrophobicContact CE3-CG 3.65Å; W55-F144 AromaticContact CE3-CZ 3.96Å; W55-F144 HydrophobicContact CE3-CZ 3.96Å; W55-F144 AromaticContact CZ3-CD1 3.87Å; W55-F144 HydrophobicContact CZ3-CD1 3.87Å; W55-F144 AromaticContact CZ3-CE1 3.54Å; W55-F144 HydrophobicContact CZ3-CE1 3.54Å; W55-F144 HydrophobicContact CZ3-CE2 4.26Å; W55-F144 HydrophobicContact CZ3-CG 4.34Å; W55-F144 AromaticContact CZ3-CZ 3.75Å; W55-F144 HydrophobicContact CZ3-CZ 3.75Å; W55-F144 WeakPolarHBondContact O-CB 3.42Å
56A95.8Very high95.5Very high0 Ų048.8 Ų48.80%026%0.263CS..Hα-helixtrans-60-52.8179.200000112.3P52 F53 L58 G59 I60 M143 M209P52-A56 PolarHBondContact O-N 3.08Å; F53-A56 PolarHBondContact O-N 3.3Å; A56-L58 PolarHBondContact O-N 2.95Å; A56-G59 PolarHBondContact O-N 2.99Å; A56-I60 WeakPolarHBondContact O-CG1 3.45Å; A56-I60 PolarHBondContact O-N 2.91Å; A56-M143 HydrophobicContact CB-CB 4.12Å; A56-M143 HydrophobicContact CB-SD 3.6Å; A56-M143 VanDerWaalsContact CB-SD 3.6Å; A56-M209 HydrophobicContact CB-SD 4.31Å
57N96.8Very high95.7Very high95 Ų9543.9 Ų43.951%0.50824%0.241SC..Hα-helixtrans-67.8-37.5-177.1-69.3-37.6000112.3F53 G59 I60 G61F53-N57 VanDerWaalsContact O-CB 3.27Å; F53-N57 WeakPolarHBondContact O-CB 3.46Å; F53-N57 VanDerWaalsContact O-CG 3.3Å; F53-N57 PolarHBondContact O-N 3.44Å; F53-N57 PolarHBondContact O-ND2 3.21Å; N57-G59 VanDerWaalsContact C-N 3.32Å; N57-I60 PolarHBondContact O-N 3.41Å; N57-G61 PolarHBondContact O-N 3.21Å
58L97.9Very high95.9Very high79 Ų7944.2 Ų44.241%0.41425%0.246SC..Hα-helixtrans-64-40.8173.4-176.161.5000110.8M54 A56 G61 L62 F144M54-L58 WeakPolarHBondContact O-CB 3.31Å; M54-L58 PolarHBondContact O-N 3.29Å; A56-L58 PolarHBondContact O-N 2.95Å; L58-G61 PolarHBondContact O-N 3.29Å; L58-L62 HydrophobicContact CD1-CD1 3.98Å; L58-L62 HydrophobicContact CD1-CG 4.03Å; L58-L62 HydrophobicContact CD2-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 3.81Å; L58-L62 HydrophobicContact CG-CG 4.26Å; L58-L62 VanDerWaalsContact O-CB 3.31Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 WeakPolarHBondContact O-CG 3.29Å; L58-L62 PolarHBondContact O-N 3.46Å; L58-F144 HydrophobicContact CB-CD2 4.36Å; L58-F144 HydrophobicContact CB-CE2 4.4Å; L58-F144 HydrophobicContact CD2-CD2 4.32Å; L58-F144 HydrophobicContact CD2-CE2 3.62Å; L58-F144 HydrophobicContact CD2-CZ 4.41Å; L58-F144 HydrophobicContact CG-CD2 4.32Å; L58-F144 HydrophobicContact CG-CE2 3.88Å
59G97.1Very high96.3Very high0 Ų045.1 Ų45.10%025%0.251CS..Hα-helixtrans-57.7-50.6173.900000112.7W55 A56 N57 G61 L62 A63 G147W55-G59 PolarHBondContact O-N 3.44Å; A56-G59 PolarHBondContact O-N 2.99Å; N57-G59 VanDerWaalsContact C-N 3.32Å; G59-G61 PolarHBondContact O-N 2.8Å; G59-L62 PolarHBondContact O-N 2.74Å; G59-A63 WeakPolarHBondContact O-CB 3.35Å; G59-A63 PolarHBondContact O-N 2.81Å; G59-G147 WeakPolarHBondContact O-CA 3.27Å
60I97.5Very high96.7Very high24 Ų2439.3 Ų39.312%0.12322%0.224CC..Hα-helixtrans-59.7-46.5178.1-64.3159.5000110.7A56 N57 A63 I64 A114 I117A56-I60 WeakPolarHBondContact O-CG1 3.45Å; A56-I60 PolarHBondContact O-N 2.91Å; N57-I60 PolarHBondContact O-N 3.41Å; I60-A63 WeakPolarHBondContact O-CB 3.3Å; I60-A63 PolarHBondContact O-N 2.97Å; I60-I64 PolarHBondContact O-N 3.38Å; I60-A114 HydrophobicContact CG2-CB 4.28Å; I60-I117 HydrophobicContact CD1-CG2 4.24Å; I60-I117 HydrophobicContact CG1-CB 4.04Å; I60-I117 HydrophobicContact CG1-CG2 3.54Å
61G97.9Very high96.9Very high33 Ų3338.3 Ų38.334%0.3422%0.218SC..Hα-helixtrans-63.5-43178.500000113N57 L58 G59 I64 S65N57-G61 PolarHBondContact O-N 3.21Å; L58-G61 PolarHBondContact O-N 3.29Å; G59-G61 PolarHBondContact O-N 2.8Å; G61-I64 WeakPolarHBondContact O-CG2 3.36Å; G61-S65 VanDerWaalsContact O-CB 3.28Å; G61-S65 WeakPolarHBondContact O-CB 3.33Å; G61-S65 PolarHBondContact O-N 2.91Å; G61-S65 PolarHBondContact O-OG 3.49Å
62L97.8Very high97.2Very high42 Ų4238.2 Ų38.222%0.2222%0.221CC..Hα-helixtrans-68.9-34.2178.1-70.6176.9000112.4L58 G59 I64 S65 L66 F144 L148L58-L62 HydrophobicContact CD1-CD1 3.98Å; L58-L62 HydrophobicContact CD1-CG 4.03Å; L58-L62 HydrophobicContact CD2-CD1 4.47Å; L58-L62 HydrophobicContact CG-CD1 3.81Å; L58-L62 HydrophobicContact CG-CG 4.26Å; L58-L62 VanDerWaalsContact O-CB 3.31Å; L58-L62 WeakPolarHBondContact O-CB 3.38Å; L58-L62 WeakPolarHBondContact O-CG 3.29Å; L58-L62 PolarHBondContact O-N 3.46Å; G59-L62 PolarHBondContact O-N 2.74Å; L62-I64 PolarHBondContact O-N 3.01Å; L62-S65 WeakPolarHBondContact CA-OG 3.27Å; L62-L66 HydrophobicContact CB-CD1 4.24Å; L62-L66 HydrophobicContact CD2-CD1 4.29Å; L62-L66 HydrophobicContact CD2-CG 4.37Å; L62-L66 VanDerWaalsContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CB 3.36Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 2.78Å; L62-L66 VanDerWaalsContact O-N 3.1Å; L62-F144 HydrophobicContact CD1-CE2 4.16Å; L62-L148 HydrophobicContact CD1-CD2 3.57Å; L62-L148 HydrophobicContact CD1-CG 4.49Å
63A97.9Very high97.4Very high0 Ų044.8 Ų44.80%025%0.246CC..Hα-helixtrans-56.5-50.6176.500000111.8G59 I60 S67 A114 V150G59-A63 WeakPolarHBondContact O-CB 3.35Å; G59-A63 PolarHBondContact O-N 2.81Å; I60-A63 WeakPolarHBondContact O-CB 3.3Å; I60-A63 PolarHBondContact O-N 2.97Å; A63-S67 VanDerWaalsContact O-CB 3.3Å; A63-S67 WeakPolarHBondContact O-CB 3.29Å; A63-S67 PolarHBondContact O-OG 3.22Å; A63-A114 HydrophobicContact CB-CB 4.37Å; A63-V150 HydrophobicContact CB-CG1 3.61Å
64I98.3Very high97.6Very high62 Ų6242.1 Ų42.132%0.31823%0.234SC..Hα-helixtrans-77-47.4-179.1-171.2167.7000112.1I60 G61 L62 S67 V68 I111 A114I60-I64 PolarHBondContact O-N 3.38Å; G61-I64 WeakPolarHBondContact O-CG2 3.36Å; L62-I64 PolarHBondContact O-N 3.01Å; I64-S67 PolarHBondContact O-N 3.42Å; I64-V68 HydrophobicContact CG1-CG2 4.26Å; I64-V68 VanDerWaalsContact O-CG2 3.29Å; I64-V68 WeakPolarHBondContact O-CG2 3.48Å; I64-V68 PolarHBondContact O-N 3.31Å; I64-I111 HydrophobicContact CD1-CB 4.21Å; I64-I111 HydrophobicContact CD1-CD1 4.36Å; I64-I111 HydrophobicContact CD1-CG1 4.03Å; I64-A114 HydrophobicContact CB-CB 3.96Å; I64-A114 HydrophobicContact CG2-CB 4.49Å
65S98.2Very high97.7Very high54 Ų5441.1 Ų41.138%0.37823%0.229SC..Hα-helixtrans-63.8-48.5-173.756.70000112.3G61 L62 S67 V68 V69G61-S65 VanDerWaalsContact O-CB 3.28Å; G61-S65 WeakPolarHBondContact O-CB 3.33Å; G61-S65 PolarHBondContact O-N 2.91Å; G61-S65 PolarHBondContact O-OG 3.49Å; L62-S65 WeakPolarHBondContact CA-OG 3.27Å; S65-S67 PolarHBondContact O-N 2.98Å; S65-V68 PolarHBondContact O-N 3.08Å; S65-V69 VanDerWaalsContact O-CG2 3.3Å; S65-V69 WeakPolarHBondContact O-CG2 3.49Å; S65-V69 PolarHBondContact O-N 2.96Å
66L98.1Very high97.7Very high31 Ų3147.1 Ų47.116%0.16225%0.253CS..Hα-helixtrans-66.5-37.6179.9-64.2176.4000112.2L62 V69 G70 F152L62-L66 HydrophobicContact CB-CD1 4.24Å; L62-L66 HydrophobicContact CD2-CD1 4.29Å; L62-L66 HydrophobicContact CD2-CG 4.37Å; L62-L66 VanDerWaalsContact O-CB 3.29Å; L62-L66 WeakPolarHBondContact O-CB 3.36Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 2.78Å; L62-L66 VanDerWaalsContact O-N 3.1Å; L66-V69 PolarHBondContact O-N 3.44Å; L66-G70 PolarHBondContact O-N 2.91Å; L66-F152 HydrophobicContact CD1-CD1 4.42Å; L66-F152 HydrophobicContact CD1-CD2 4.16Å; L66-F152 HydrophobicContact CD1-CE1 4.31Å; L66-F152 HydrophobicContact CD1-CE2 4.07Å; L66-F152 HydrophobicContact CD1-CG 4.34Å; L66-F152 HydrophobicContact CD1-CZ 4.13Å
67S98.1Very high97.8Very high0 Ų048.7 Ų48.70%026%0.261CS..Hα-helixtrans-62.3-44.3175.7-61.60000111.7A63 I64 S65 G70 A71 G110 N154A63-S67 VanDerWaalsContact O-CB 3.3Å; A63-S67 WeakPolarHBondContact O-CB 3.29Å; A63-S67 PolarHBondContact O-OG 3.22Å; I64-S67 PolarHBondContact O-N 3.42Å; S65-S67 PolarHBondContact O-N 2.98Å; S67-G70 PolarHBondContact O-N 3.42Å; S67-A71 PolarHBondContact O-N 3.48Å; S67-G110 WeakPolarHBondContact OG-CA 3.19Å; S67-N154 VanDerWaalsContact OG-CB 3.31Å; S67-N154 WeakPolarHBondContact OG-CB 3.47Å; S67-N154 PolarHBondContact OG-ND2 3.22Å
68V98.3Very high97.8Very high70 Ų7044.2 Ų44.242%0.42424%0.237SC..Hα-helixtrans-68.7-37.4178.7173.90000111.5I64 S65 G70 A71 A72 A107I64-V68 HydrophobicContact CG1-CG2 4.26Å; I64-V68 VanDerWaalsContact O-CG2 3.29Å; I64-V68 WeakPolarHBondContact O-CG2 3.48Å; I64-V68 PolarHBondContact O-N 3.31Å; S65-V68 PolarHBondContact O-N 3.08Å; V68-G70 VanDerWaalsContact C-N 3.33Å; V68-G70 PolarHBondContact O-N 2.89Å; V68-A71 PolarHBondContact O-N 3.42Å; V68-A72 WeakPolarHBondContact O-CB 3.27Å; V68-A72 PolarHBondContact O-N 2.95Å; V68-A107 HydrophobicContact CG2-CB 4.29Å
69V98.4Very high97.8Very high73 Ų7341.1 Ų41.144%0.44223%0.225SC..Hα-helixtrans-59.3-44.8173.2170.20000110.7S65 L66 A72 W73 L155S65-V69 VanDerWaalsContact O-CG2 3.3Å; S65-V69 WeakPolarHBondContact O-CG2 3.49Å; S65-V69 PolarHBondContact O-N 2.96Å; L66-V69 PolarHBondContact O-N 3.44Å; V69-A72 PolarHBondContact O-N 3.49Å; V69-W73 WeakPolarHBondContact O-CB 3.39Å; V69-W73 PolarHBondContact O-N 3.38Å; V69-L155 HydrophobicContact CB-CD1 4.29Å; V69-L155 HydrophobicContact CG1-CD1 3.85Å
70G97.4Very high97.8Very high0 Ų043.9 Ų43.90%024%0.244CC..Hα-helixtrans-62.6-44.717600000113.8L66 S67 V68 W73 G74L66-G70 PolarHBondContact O-N 2.91Å; S67-G70 PolarHBondContact O-N 3.42Å; V68-G70 VanDerWaalsContact C-N 3.33Å; V68-G70 PolarHBondContact O-N 2.89Å; G70-W73 PolarHBondContact O-N 3.34Å; G70-G74 PolarHBondContact O-N 2.89Å
71A97.6Very high97.7Very high4 Ų443.6 Ų43.63%0.03324%0.244CC..Hα-helixtrans-61.2-49.6176.600000111.6S67 V68 W73 G74 I75 C103 A107S67-A71 PolarHBondContact O-N 3.48Å; V68-A71 PolarHBondContact O-N 3.42Å; A71-W73 VanDerWaalsContact C-N 3.31Å; A71-W73 PolarHBondContact O-N 3.2Å; A71-G74 PolarHBondContact O-N 3.12Å; A71-I75 WeakPolarHBondContact O-CB 3.26Å; A71-I75 WeakPolarHBondContact O-CD1 3.47Å; A71-I75 WeakPolarHBondContact O-CG1 3.24Å; A71-I75 PolarHBondContact O-N 3.14Å; A71-C103 WeakPolarHBondContact CB-O 3.45Å; A71-A107 HydrophobicContact CB-CB 3.78Å
72A98.2Very high97.6Very high56 Ų5642.7 Ų42.746%0.46323%0.231SC..Hα-helixtrans-60.2-41.2178.700000111.9V68 V69 I75 Y76V68-A72 WeakPolarHBondContact O-CB 3.27Å; V68-A72 PolarHBondContact O-N 2.95Å; V69-A72 PolarHBondContact O-N 3.49Å; A72-I75 PolarHBondContact O-N 2.92Å; A72-Y76 WeakPolarHBondContact O-CB 3.41Å; A72-Y76 PolarHBondContact O-N 2.9Å
73W98.1Very high97.6Very high139 Ų13946.7 Ų46.753%0.52725%0.252SS..Hα-helixtrans-62.9-47.5175.9-156.9-39.3000111.1V69 G70 A71 I75 Y76 I77 I159V69-W73 WeakPolarHBondContact O-CB 3.39Å; V69-W73 PolarHBondContact O-N 3.38Å; G70-W73 PolarHBondContact O-N 3.34Å; A71-W73 VanDerWaalsContact C-N 3.31Å; A71-W73 PolarHBondContact O-N 3.2Å; W73-I75 PolarHBondContact O-N 3.31Å; W73-Y76 PolarHBondContact O-N 3.41Å; W73-I77 WeakPolarHBondContact O-CG1 3.44Å; W73-I77 PolarHBondContact O-N 3.22Å; W73-I159 HydrophobicContact CB-CG1 4.17Å; W73-I159 HydrophobicContact CD2-CD1 4.36Å; W73-I159 HydrophobicContact CD2-CG1 4.34Å; W73-I159 HydrophobicContact CE3-CD1 4.34Å; W73-I159 HydrophobicContact CG-CG1 4.09Å
74G97.5Very high97.5Very high0 Ų049.2 Ų49.20%028%0.277CS..Hα-helixtrans-61.6-41.2178.600000113.4G70 A71 I77 T78 G158G70-G74 PolarHBondContact O-N 2.89Å; A71-G74 PolarHBondContact O-N 3.12Å; G74-I77 PolarHBondContact O-N 3.41Å; G74-T78 PolarHBondContact O-N 3.42Å; G74-T78 PolarHBondContact O-OG1 2.87Å; G74-G158 WeakPolarHBondContact CA-O 3.41Å
75I97.9Very high97.2Very high63 Ų6346.8 Ų46.832%0.32327%0.268SS..Hα-helixtrans-62.6-46.7175.7-67.8165.6000110.6A71 A72 W73 G79 I100 C103A71-I75 WeakPolarHBondContact O-CB 3.26Å; A71-I75 WeakPolarHBondContact O-CD1 3.47Å; A71-I75 WeakPolarHBondContact O-CG1 3.24Å; A71-I75 PolarHBondContact O-N 3.14Å; A72-I75 PolarHBondContact O-N 2.92Å; W73-I75 PolarHBondContact O-N 3.31Å; I75-G79 WeakPolarHBondContact O-CA 3.43Å; I75-G79 PolarHBondContact O-N 2.88Å; I75-I100 HydrophobicContact CG1-CG2 4.31Å; I75-C103 HydrophobicContact CG1-CB 3.83Å
76Y97.9Very high97.1Very high165 Ų16545 Ų4565%0.64726%0.257SS*.Hα-helixtrans-60.6-47.5178.9163.4-110.9000112A72 W73 S80A72-Y76 WeakPolarHBondContact O-CB 3.41Å; A72-Y76 PolarHBondContact O-N 2.9Å; W73-Y76 PolarHBondContact O-N 3.41Å; Y76-S80 WeakPolarHBondContact O-CB 3.34Å; Y76-S80 PolarHBondContact O-N 3.22Å; Y76-S80 PolarHBondContact O-OG 2.96Å
77I97.6Very high97Very high33 Ų3349.6 Ų49.617%0.16929%0.287CS..Hα-helixtrans-60-54.3179.6-67.7170.6000110.2W73 G74 S80 G162 I163W73-I77 WeakPolarHBondContact O-CG1 3.44Å; W73-I77 PolarHBondContact O-N 3.22Å; G74-I77 PolarHBondContact O-N 3.41Å; I77-S80 PolarHBondContact O-OG 3.33Å; I77-G162 WeakPolarHBondContact CG2-O 3.31Å; I77-I163 HydrophobicContact CD1-CG1 4.09Å
78T96.4Very high96.7Very high0 Ų059.1 Ų59.10%033%0.328CS..Hα-helixtrans-65.5-43.8-178.4-60.30000111.9G74 S80 S81 I82 I100 G162G74-T78 PolarHBondContact O-N 3.42Å; G74-T78 PolarHBondContact O-OG1 2.87Å; T78-S80 PolarHBondContact O-N 2.96Å; T78-S81 PolarHBondContact O-N 3.01Å; T78-I82 HydrophobicContact CG2-CD1 3.7Å; T78-I82 HydrophobicContact CG2-CG1 4.17Å; T78-I82 WeakPolarHBondContact O-CG1 3.49Å; T78-I82 PolarHBondContact O-N 3.49Å; T78-I100 HydrophobicContact CG2-CG1 4.38Å; T78-G162 WeakPolarHBondContact OG1-CA 3.48Å; T78-G162 PolarHBondContact OG1-O 3.35Å
79G96.6Very high96.4Very high15 Ų1556.5 Ų56.516%0.15531%0.314CS..Hα-helixtrans-62.1-41.5-177.100000112.6I75 S81 I82 I83I75-G79 WeakPolarHBondContact O-CA 3.43Å; I75-G79 PolarHBondContact O-N 2.88Å; G79-S81 VanDerWaalsContact C-N 3.3Å; G79-S81 PolarHBondContact O-N 3.05Å; G79-I82 PolarHBondContact O-N 2.87Å; G79-I83 WeakPolarHBondContact O-CG1 3.39Å; G79-I83 PolarHBondContact O-N 3.35Å
80S97.3Very high96.2Very high58 Ų5856.8 Ų56.841%0.40632%0.317SS..Hα-helixtrans-59.7-41175.770.50000112.1Y76 I77 T78 G84Y76-S80 WeakPolarHBondContact O-CB 3.34Å; Y76-S80 PolarHBondContact O-N 3.22Å; Y76-S80 PolarHBondContact O-OG 2.96Å; I77-S80 PolarHBondContact O-OG 3.33Å; T78-S80 PolarHBondContact O-N 2.96Å; S80-G84 PolarHBondContact O-N 3.39Å
81S96.7Very high95.9Very high17 Ų1763 Ų6312%0.11934%0.341CS..Hα-helixtrans-72.5-37.1177.6-67.90000113.6T78 G79 G84 G85 S166T78-S81 PolarHBondContact O-N 3.01Å; G79-S81 VanDerWaalsContact C-N 3.3Å; G79-S81 PolarHBondContact O-N 3.05Å; S81-G84 PolarHBondContact O-N 3.47Å; S81-G85 PolarHBondContact O-N 3.46Å; S81-S166 WeakPolarHBondContact CB-OG 3.43Å; S81-S166 PolarHBondContact OG-OG 3.5Å
82I96.3Very high95.6Very high14 Ų1462.8 Ų62.87%0.07234%0.339CS..Hα-helixtrans-62.4-46.1173.8-70.1172.8000110.2T78 G79 G86 N96 I100 A169T78-I82 HydrophobicContact CG2-CD1 3.7Å; T78-I82 HydrophobicContact CG2-CG1 4.17Å; T78-I82 WeakPolarHBondContact O-CG1 3.49Å; T78-I82 PolarHBondContact O-N 3.49Å; G79-I82 PolarHBondContact O-N 2.87Å; I82-G86 VanDerWaalsContact O-CA 3.31Å; I82-G86 WeakPolarHBondContact O-CA 3.45Å; I82-G86 PolarHBondContact O-N 2.93Å; I82-N96 HydrophobicContact CD1-CB 3.83Å; I82-N96 HydrophobicContact CG1-CB 4.01Å; I82-I100 HydrophobicContact CD1-CD1 4.05Å; I82-I100 HydrophobicContact CD1-CG1 4.32Å; I82-A169 HydrophobicContact CG1-CB 3.72Å
83I96.4Very high95.2Very high127 Ų12766.4 Ų66.465%0.65134%0.344SS*.Hα-helixtrans-66.3-46.1179.1-64.1169.2000109.9G79 G86 V87G79-I83 WeakPolarHBondContact O-CG1 3.39Å; G79-I83 PolarHBondContact O-N 3.35Å; I83-G86 PolarHBondContact O-N 3.28Å; I83-V87 PolarHBondContact O-N 3.11Å
84G96Very high94.9Very high52 Ų5264.3 Ų64.354%0.53635%0.347SS..Hα-helixtrans-60.1-50.217900000113.4S80 S81 G86S80-G84 PolarHBondContact O-N 3.39Å; S81-G84 PolarHBondContact O-N 3.47Å; G84-G86 VanDerWaalsContact C-N 3.31Å; G84-G86 PolarHBondContact O-N 3.01Å
85G93.2Very high94.5Very high12 Ų1267.5 Ų67.512%0.12436%0.361CS..Hα-helixtrans-70.2-28.2176.600000113.3S81 V87 A89 I92S81-G85 PolarHBondContact O-N 3.46Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.33Å; G85-A89 PolarHBondContact O-N 3.21Å; G85-A89 VanDerWaalsContact O-N 3.13Å; G85-I92 VanDerWaalsContact C-CD1 3.45Å
86G94.1Very high94.2Very high15 Ų1564.5 Ų64.516%0.15535%0.346CS..Hα-helixtrans-71.3-18.7-176.700000114.4I82 I83 G84 A89 P90I82-G86 VanDerWaalsContact O-CA 3.31Å; I82-G86 WeakPolarHBondContact O-CA 3.45Å; I82-G86 PolarHBondContact O-N 2.93Å; I83-G86 PolarHBondContact O-N 3.28Å; G84-G86 VanDerWaalsContact C-N 3.31Å; G84-G86 PolarHBondContact O-N 3.01Å; G86-A89 CarbonylContact O-C 3.58Å; G86-P90 VanDerWaalsContact O-CA 3.26Å; G86-P90 WeakPolarHBondContact O-CA 3.3Å
87V96.2Very high94Very high128 Ų12860.5 Ų60.578%0.77634%0.335SS*.THydrogen-bonded Turntrans-60.9-46.8175.8177.60000111I83 G85I83-V87 PolarHBondContact O-N 3.11Å; G85-V87 VanDerWaalsContact C-N 3.29Å; G85-V87 PolarHBondContact O-N 3.33Å
88K92.5Very high93.9Very high200 Ų20061.6 Ų61.687%0.8734%0.343SS*.THydrogen-bonded Turntrans-89.1-33.3179.7-169.4174.3-178.41800112.4P90K88-P90 WeakPolarHBondContact O-CD 3.45Å
89A93Very high93.7Very high16 Ų1661.6 Ų61.613%0.13234%0.343CS..  trans-123.875.8-177.300000111.4G85 G86 R91 I92 A173G85-A89 PolarHBondContact O-N 3.21Å; G85-A89 VanDerWaalsContact O-N 3.13Å; G86-A89 CarbonylContact O-C 3.58Å; A89-R91 PolarHBondContact O-N 3.49Å; A89-I92 HydrophobicContact CB-CG2 4.37Å; A89-I92 WeakPolarHBondContact O-CG1 3.35Å; A89-I92 PolarHBondContact O-N 3.27Å; A89-A173 HydrophobicContact CB-CB 4.24Å
90P92.9Very high93.7Very high78 Ų7862.9 Ų62.951%0.50635%0.346SS..THydrogen-bonded Turntrans-65.9-11.6-171.326.2-36.1000114.8G86 K88 I92 K93G86-P90 VanDerWaalsContact O-CA 3.26Å; G86-P90 WeakPolarHBondContact O-CA 3.3Å; K88-P90 WeakPolarHBondContact O-CD 3.45Å; P90-I92 PolarHBondContact O-N 3.4Å; P90-K93 VanDerWaalsContact O-CD 3.31Å; P90-K93 WeakPolarHBondContact O-CD 3.47Å; P90-K93 WeakPolarHBondContact O-CG 3.2Å; P90-K93 PolarHBondContact O-N 3.08Å
91R91.5Very high93.7Very high130 Ų13064.8 Ų64.849%0.49135%0.351SS..THydrogen-bonded Turntrans-64.5-23.3175.468.7-169.3-173.4128.113.6113.9A89 K93 D172 A176A89-R91 PolarHBondContact O-N 3.49Å; R91-K93 VanDerWaalsContact C-N 3.25Å; R91-K93 PolarHBondContact O-N 3.28Å; R91-D172 PolarHBondContact NH2-O 3.02Å; R91-A176 VanDerWaalsContact NH2-CB 3.33Å
92I92.1Very high93.6Very high0 Ų066.4 Ų66.40%036%0.356CS..Hα-helixtrans-73.3-19.4-177.974.8-179.5000112.4G85 A89 P90 T94 K95 N96 D172 A173G85-I92 VanDerWaalsContact C-CD1 3.45Å; A89-I92 HydrophobicContact CB-CG2 4.37Å; A89-I92 WeakPolarHBondContact O-CG1 3.35Å; A89-I92 PolarHBondContact O-N 3.27Å; P90-I92 PolarHBondContact O-N 3.4Å; I92-T94 VanDerWaalsContact C-N 3.26Å; I92-T94 PolarHBondContact O-N 3.02Å; I92-K95 PolarHBondContact O-N 3.19Å; I92-N96 WeakPolarHBondContact O-CB 3.44Å; I92-N96 PolarHBondContact O-N 3.08Å; I92-N96 PolarHBondContact O-OD1 3.42Å; I92-D172 HydrophobicContact CG2-CB 4.3Å; I92-D172 WeakPolarHBondContact CG2-OD2 3.36Å; I92-A173 HydrophobicContact CD1-CB 4.09Å; I92-A173 HydrophobicContact CG2-CB 4.32Å
93K89.4Confident93.5Very high132 Ų13265.7 Ų65.757%0.57435%0.352SS*.Hα-helixtrans-62.1-28.3-172.879-170.9178.1175.70114.4P90 R91 L97P90-K93 VanDerWaalsContact O-CD 3.31Å; P90-K93 WeakPolarHBondContact O-CD 3.47Å; P90-K93 WeakPolarHBondContact O-CG 3.2Å; P90-K93 PolarHBondContact O-N 3.08Å; R91-K93 VanDerWaalsContact C-N 3.25Å; R91-K93 PolarHBondContact O-N 3.28Å; K93-L97 VanDerWaalsContact O-CG 3.24Å; K93-L97 WeakPolarHBondContact O-CG 3.45Å
94T91.1Very high93.5Very high96 Ų9664.5 Ų64.559%0.58934%0.344SS*.Hα-helixtrans-99.1-39.6-179.447.90000111.7I92I92-T94 VanDerWaalsContact C-N 3.26Å; I92-T94 PolarHBondContact O-N 3.02Å
95K90.3Very high93.5Very high67 Ų6763 Ų6329%0.29133%0.326SS..Hα-helixtrans-68.9-40.1-177.1-169.1-178.5174.9-1630112.5I92 L97 D172 A176 F179I92-K95 PolarHBondContact O-N 3.19Å; K95-L97 VanDerWaalsContact C-N 3.3Å; K95-L97 PolarHBondContact O-N 2.98Å; K95-D172 IonicContact NZ-OD1 2.78Å; K95-D172 PolarHBondContact NZ-OD1 3.05Å; K95-D172 IonicContact NZ-OD2 3.84Å; K95-A176 PolarHBondContact NZ-O 2.93Å; K95-F179 HydrophobicContact CD-CD1 4.15Å; K95-F179 HydrophobicContact CD-CG 4.34Å; K95-F179 HydrophobicContact CG-CD1 4Å; K95-F179 HydrophobicContact CG-CE1 3.94Å; K95-F179 HydrophobicContact CG-CG 4.44Å; K95-F179 HydrophobicContact CG-CZ 4.38Å; K95-F179 WeakPolarHBondContact O-CZ 3.37Å
96N91.3Very high93.7Very high0 Ų062.5 Ų62.50%032%0.321CS..THydrogen-bonded Turntrans-84.82.4-177.5-66.174.4000114I82 I92 V98 S99 A169 D172 F179I82-N96 HydrophobicContact CD1-CB 3.83Å; I82-N96 HydrophobicContact CG1-CB 4.01Å; I92-N96 WeakPolarHBondContact O-CB 3.44Å; I92-N96 PolarHBondContact O-N 3.08Å; I92-N96 PolarHBondContact O-OD1 3.42Å; N96-V98 PolarHBondContact O-N 3.18Å; N96-S99 PolarHBondContact O-N 2.91Å; N96-A169 VanDerWaalsContact ND2-CA 3.27Å; N96-A169 WeakPolarHBondContact ND2-CA 3.49Å; N96-A169 PolarHBondContact ND2-N 3.07Å; N96-D172 PolarHBondContact OD1-OD2 3.18Å; N96-F179 HydrophobicContact CB-CE2 4.36Å; N96-F179 VanDerWaalsContact ND2-CD2 3.33Å; N96-F179 WeakPolarHBondContact ND2-CD2 3.44Å; N96-F179 VanDerWaalsContact ND2-CE2 3.29Å; N96-F179 WeakPolarHBondContact ND2-CE2 3.28Å
97L93.8Very high93.8Very high80 Ų8062.8 Ų62.842%0.41932%0.322SS..Hα-helixtrans-62.2-23.2172.2-69.3177.6000112.5K93 K95 S99 I100 I101K93-L97 VanDerWaalsContact O-CG 3.24Å; K93-L97 WeakPolarHBondContact O-CG 3.45Å; K95-L97 VanDerWaalsContact C-N 3.3Å; K95-L97 PolarHBondContact O-N 2.98Å; L97-S99 PolarHBondContact O-N 3.44Å; L97-I100 HydrophobicContact CD2-CD1 4.04Å; L97-I100 WeakPolarHBondContact O-CB 3.49Å; L97-I100 PolarHBondContact O-N 3.26Å; L97-I100 VanDerWaalsContact O-N 3.08Å; L97-I101 WeakPolarHBondContact O-CG1 3.29Å; L97-I101 PolarHBondContact O-N 3.41Å; L97-I101 VanDerWaalsContact O-N 3.08Å
98V94.2Very high93.9Very high57 Ų5760.5 Ų60.535%0.34530%0.304SS..Hα-helixtrans-56.2-39.2175.9-1780000111.4N96 I100 I101 F102 F179 L183N96-V98 PolarHBondContact O-N 3.18Å; V98-I100 VanDerWaalsContact C-N 3.33Å; V98-I100 PolarHBondContact O-N 2.92Å; V98-I101 PolarHBondContact O-N 3.46Å; V98-F102 HydrophobicContact CG1-CD2 4.08Å; V98-F102 HydrophobicContact CG1-CE2 3.59Å; V98-F102 HydrophobicContact CG1-CZ 4.09Å; V98-F102 WeakPolarHBondContact O-CD2 3.26Å; V98-F102 PolarHBondContact O-N 3.22Å; V98-F179 HydrophobicContact CB-CZ 4.45Å; V98-L183 HydrophobicContact CG1-CD1 4.02Å
99S93.1Very high94.1Very high0 Ų053.8 Ų53.80%027%0.274CS..Hα-helixtrans-66.5-33.2178.6-510000112.6N96 L97 C103 E186N96-S99 PolarHBondContact O-N 2.91Å; L97-S99 PolarHBondContact O-N 3.44Å; S99-C103 PolarHBondContact O-N 2.93Å; S99-C103 PolarHBondContact O-SG 3.32Å; S99-E186 WeakPolarHBondContact CA-OE2 3.25Å; S99-E186 VanDerWaalsContact CB-OE2 3.3Å; S99-E186 WeakPolarHBondContact CB-OE2 3.16Å; S99-E186 VanDerWaalsContact OG-CD 3.24Å; S99-E186 PolarHBondContact OG-OE1 3.31Å; S99-E186 PolarHBondContact OG-OE2 3.4Å
100I96.5Very high94.3Very high42 Ų4253 Ų5322%0.21527%0.267CS..Hα-helixtrans-67.8-42.7173.2-67.1177.1000110.2I75 T78 I82 L97 V98 F102 C103 E104I75-I100 HydrophobicContact CG1-CG2 4.31Å; T78-I100 HydrophobicContact CG2-CG1 4.38Å; I82-I100 HydrophobicContact CD1-CD1 4.05Å; I82-I100 HydrophobicContact CD1-CG1 4.32Å; L97-I100 HydrophobicContact CD2-CD1 4.04Å; L97-I100 WeakPolarHBondContact O-CB 3.49Å; L97-I100 PolarHBondContact O-N 3.26Å; L97-I100 VanDerWaalsContact O-N 3.08Å; V98-I100 VanDerWaalsContact C-N 3.33Å; V98-I100 PolarHBondContact O-N 2.92Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.34Å; I100-C103 WeakPolarHBondContact O-CB 3.14Å; I100-C103 PolarHBondContact O-N 3.42Å; I100-C103 VanDerWaalsContact O-N 3.11Å; I100-E104 PolarHBondContact O-N 3.19Å
101I96.8Very high94.5Very high98 Ų9853 Ų5350%0.50326%0.263SS..Hα-helixtrans-62.4-38.5178.7-63.9167.2000111L97 V98 C103 E104 A105L97-I101 WeakPolarHBondContact O-CG1 3.29Å; L97-I101 PolarHBondContact O-N 3.41Å; L97-I101 VanDerWaalsContact O-N 3.08Å; V98-I101 PolarHBondContact O-N 3.46Å; I101-C103 VanDerWaalsContact C-N 3.34Å; I101-C103 PolarHBondContact O-N 3.23Å; I101-E104 WeakPolarHBondContact O-CB 3.31Å; I101-E104 PolarHBondContact O-N 3.45Å; I101-A105 PolarHBondContact O-N 2.8Å
102F95.2Very high94.8Very high50 Ų5051.1 Ų51.122%0.21926%0.261CS..Hα-helixtrans-64.7-37.4174.1-72.3-48.1000112.8V98 I100 E104 A105 V161 L183 E186 I187V98-F102 HydrophobicContact CG1-CD2 4.08Å; V98-F102 HydrophobicContact CG1-CE2 3.59Å; V98-F102 HydrophobicContact CG1-CZ 4.09Å; V98-F102 WeakPolarHBondContact O-CD2 3.26Å; V98-F102 PolarHBondContact O-N 3.22Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.34Å; F102-E104 VanDerWaalsContact C-N 3.32Å; F102-A105 PolarHBondContact O-N 3.28Å; F102-V161 HydrophobicContact CB-CG1 3.81Å; F102-L183 HydrophobicContact CE2-CD1 3.84Å; F102-E186 HydrophobicContact CD2-CB 4.31Å; F102-I187 HydrophobicContact CE2-CG1 4.49Å; F102-I187 HydrophobicContact CZ-CG1 4.15Å
103C94.5Very high95.1Very high0 Ų051.1 Ų51.10%026%0.261CS..Hα-helixtrans-66.4-35.1173.3-62.20000111.7A71 I75 S99 I100 I101 V106A71-C103 WeakPolarHBondContact CB-O 3.45Å; I75-C103 HydrophobicContact CG1-CB 3.83Å; S99-C103 PolarHBondContact O-N 2.93Å; S99-C103 PolarHBondContact O-SG 3.32Å; I100-C103 WeakPolarHBondContact O-CB 3.14Å; I100-C103 PolarHBondContact O-N 3.42Å; I100-C103 VanDerWaalsContact O-N 3.11Å; I101-C103 VanDerWaalsContact C-N 3.34Å; I101-C103 PolarHBondContact O-N 3.23Å; C103-V106 WeakPolarHBondContact O-CB 3.49Å
104E97Very high95.4Very high102 Ų10245.2 Ų45.248%0.47724%0.237SC..Hα-helixtrans-69.2-39.7175.9-170.2-174.8171.400112.3I100 I101 F102 V106 A107 I108I100-E104 PolarHBondContact O-N 3.19Å; I101-E104 WeakPolarHBondContact O-CB 3.31Å; I101-E104 PolarHBondContact O-N 3.45Å; F102-E104 VanDerWaalsContact C-N 3.32Å; E104-V106 PolarHBondContact O-N 3.38Å; E104-V106 VanDerWaalsContact O-N 3.12Å; E104-A107 WeakPolarHBondContact O-CA 3.17Å; E104-A107 WeakPolarHBondContact O-CB 3.45Å; E104-A107 PolarHBondContact O-N 2.97Å; E104-I108 PolarHBondContact O-N 3.44Å
105A95.8Very high95.7Very high20 Ų2045 Ų4517%0.16523%0.231CC..Hα-helixtrans-55.6-32.6177.600000112.4I101 F102 A107 I108 Y109I101-A105 PolarHBondContact O-N 2.8Å; F102-A105 PolarHBondContact O-N 3.28Å; A105-A107 VanDerWaalsContact C-N 3.34Å; A105-A107 PolarHBondContact O-N 2.92Å; A105-I108 WeakPolarHBondContact O-CB 3.42Å; A105-I108 PolarHBondContact O-N 3.15Å; A105-Y109 WeakPolarHBondContact O-CD1 3.36Å; A105-Y109 WeakPolarHBondContact O-CD2 3.4Å; A105-Y109 VanDerWaalsContact O-CG 3.25Å; A105-Y109 PolarHBondContact O-N 3.32Å
106V95.8Very high96Very high1 Ų144.5 Ų44.51%0.00623%0.233CC..Hα-helixtrans-63.4-37.5175177.10000112.2C103 E104 Y109 G110 N154 C157C103-V106 WeakPolarHBondContact O-CB 3.49Å; E104-V106 PolarHBondContact O-N 3.38Å; E104-V106 VanDerWaalsContact O-N 3.12Å; V106-Y109 PolarHBondContact O-N 3.02Å; V106-G110 PolarHBondContact O-N 3.28Å; V106-N154 HydrophobicContact CG1-CB 3.44Å; V106-N154 VanDerWaalsContact CG1-CB 3.44Å; V106-N154 WeakPolarHBondContact CG1-O 3.4Å; V106-N154 PolarHBondContact O-ND2 3.42Å; V106-C157 HydrophobicContact CG2-CB 4.43Å
107A97.3Very high96.2Very high21 Ų2144.5 Ų44.517%0.17423%0.233CC..Hα-helixtrans-69.1-37.2173.400000111.6V68 A71 E104 A105 Y109 G110 I111V68-A107 HydrophobicContact CG2-CB 4.29Å; A71-A107 HydrophobicContact CB-CB 3.78Å; E104-A107 WeakPolarHBondContact O-CA 3.17Å; E104-A107 WeakPolarHBondContact O-CB 3.45Å; E104-A107 PolarHBondContact O-N 2.97Å; A105-A107 VanDerWaalsContact C-N 3.34Å; A105-A107 PolarHBondContact O-N 2.92Å; A107-Y109 VanDerWaalsContact C-N 3.31Å; A107-Y109 PolarHBondContact O-N 3.37Å; A107-G110 PolarHBondContact O-N 3.49Å; A107-G110 VanDerWaalsContact O-N 3.12Å; A107-I111 PolarHBondContact O-N 2.93Å
108I97.9Very high96.3Very high81 Ų8143.5 Ų43.542%0.41523%0.233SC..Hα-helixtrans-60.7-42.5175.7-62.5176.4000110.3E104 A105 G110 I111 I112E104-I108 PolarHBondContact O-N 3.44Å; A105-I108 WeakPolarHBondContact O-CB 3.42Å; A105-I108 PolarHBondContact O-N 3.15Å; I108-G110 VanDerWaalsContact C-N 3.3Å; I108-G110 PolarHBondContact O-N 2.73Å; I108-I111 VanDerWaalsContact O-CG2 3.28Å; I108-I111 WeakPolarHBondContact O-CG2 3.34Å; I108-I111 PolarHBondContact O-N 3.2Å; I108-I112 HydrophobicContact CG2-CD1 3.64Å; I108-I112 HydrophobicContact CG2-CG1 4.27Å; I108-I112 WeakPolarHBondContact O-CB 3.16Å; I108-I112 VanDerWaalsContact O-CG1 3.24Å; I108-I112 WeakPolarHBondContact O-CG1 3.2Å; I108-I112 PolarHBondContact O-N 3.46Å
109Y97.2Very high96.3Very high58 Ų5846.6 Ų46.623%0.22725%0.248CC..Hα-helixtrans-59.2-42174-59.1-24.4000112.2A105 V106 A107 M113 L194 V197A105-Y109 WeakPolarHBondContact O-CD1 3.36Å; A105-Y109 WeakPolarHBondContact O-CD2 3.4Å; A105-Y109 VanDerWaalsContact O-CG 3.25Å; A105-Y109 PolarHBondContact O-N 3.32Å; V106-Y109 PolarHBondContact O-N 3.02Å; A107-Y109 VanDerWaalsContact C-N 3.31Å; A107-Y109 PolarHBondContact O-N 3.37Å; Y109-M113 WeakPolarHBondContact O-CB 3.31Å; Y109-M113 WeakPolarHBondContact O-CG 3.14Å; Y109-M113 PolarHBondContact O-N 2.93Å; Y109-M113 VanDerWaalsContact O-N 3.1Å; Y109-L194 HydrophobicContact CD1-CD2 4.48Å; Y109-L194 HydrophobicContact CE1-CD2 3.87Å; Y109-L194 HydrophobicContact CE2-CD2 3.92Å; Y109-L194 HydrophobicContact CE2-CG 4.12Å; Y109-V197 HydrophobicContact CG-CG2 4.21Å
110G96.6Very high96.3Very high0 Ų048.8 Ų48.80%026%0.259CS..Hα-helixtrans-63.4-48.7177.300000113.8S67 V106 A107 I108 M113 A114 N154S67-G110 WeakPolarHBondContact OG-CA 3.19Å; V106-G110 PolarHBondContact O-N 3.28Å; A107-G110 PolarHBondContact O-N 3.49Å; A107-G110 VanDerWaalsContact O-N 3.12Å; I108-G110 VanDerWaalsContact C-N 3.3Å; I108-G110 PolarHBondContact O-N 2.73Å; G110-M113 PolarHBondContact O-N 2.88Å; G110-A114 WeakPolarHBondContact O-CB 3.42Å; G110-A114 PolarHBondContact O-N 2.86Å; G110-N154 PolarHBondContact N-ND2 3.39Å
111I97.9Very high96Very high79 Ų7948.4 Ų48.441%0.40526%0.262SS..Hα-helixtrans-67.9-38.9-180-171.3168.9000112.1I64 A107 I108 M113 A114 I115I64-I111 HydrophobicContact CD1-CB 4.21Å; I64-I111 HydrophobicContact CD1-CD1 4.36Å; I64-I111 HydrophobicContact CD1-CG1 4.03Å; A107-I111 PolarHBondContact O-N 2.93Å; I108-I111 VanDerWaalsContact O-CG2 3.28Å; I108-I111 WeakPolarHBondContact O-CG2 3.34Å; I108-I111 PolarHBondContact O-N 3.2Å; I111-M113 VanDerWaalsContact C-N 3.34Å; I111-M113 PolarHBondContact O-N 3.06Å; I111-A114 PolarHBondContact O-N 2.65Å; I111-I115 HydrophobicContact CG1-CD1 4.07Å; I111-I115 WeakPolarHBondContact O-CG1 3.49Å; I111-I115 PolarHBondContact O-N 2.68Å
112I97.7Very high95.8Very high89 Ų8947.8 Ų47.846%0.45626%0.257SS..Hα-helixtrans-59.5-48.7174.8-70.6171.1000109.7I108 A114 I115 V116I108-I112 HydrophobicContact CG2-CD1 3.64Å; I108-I112 HydrophobicContact CG2-CG1 4.27Å; I108-I112 WeakPolarHBondContact O-CB 3.16Å; I108-I112 VanDerWaalsContact O-CG1 3.24Å; I108-I112 WeakPolarHBondContact O-CG1 3.2Å; I108-I112 PolarHBondContact O-N 3.46Å; I112-A114 PolarHBondContact O-N 3.02Å; I112-I115 PolarHBondContact O-N 3.1Å; I112-V116 HydrophobicContact CG2-CG2 4.4Å; I112-V116 VanDerWaalsContact O-CG2 3.32Å; I112-V116 WeakPolarHBondContact O-CG2 3.43Å; I112-V116 PolarHBondContact O-N 2.91Å
113M97.3Very high95.5Very high1 Ų152.3 Ų52.31%0.00528%0.283CS..Hα-helixtrans-67.5-36.3-179.7-73.9-52.3-54.800113.1Y109 G110 I111 I115 V116 I117 V150 V197 A200 I201Y109-M113 WeakPolarHBondContact O-CB 3.31Å; Y109-M113 WeakPolarHBondContact O-CG 3.14Å; Y109-M113 PolarHBondContact O-N 2.93Å; Y109-M113 VanDerWaalsContact O-N 3.1Å; G110-M113 PolarHBondContact O-N 2.88Å; I111-M113 VanDerWaalsContact C-N 3.34Å; I111-M113 PolarHBondContact O-N 3.06Å; M113-I115 VanDerWaalsContact C-N 3.33Å; M113-I115 PolarHBondContact O-N 3.35Å; M113-V116 HydrophobicContact CE-CG1 4.45Å; M113-V116 PolarHBondContact O-N 3.47Å; M113-I117 HydrophobicContact CE-CD1 4.41Å; M113-I117 HydrophobicContact CE-CG1 4.35Å; M113-I117 WeakPolarHBondContact O-CB 3.21Å; M113-I117 VanDerWaalsContact O-CG1 3.22Å; M113-I117 WeakPolarHBondContact O-CG1 3.31Å; M113-I117 PolarHBondContact O-N 3.24Å; M113-V150 HydrophobicContact CB-CG1 4.18Å; M113-V150 HydrophobicContact CB-CG2 4.1Å; M113-V150 HydrophobicContact CG-CG2 3.94Å; M113-V197 HydrophobicContact CG-CG1 4.07Å; M113-V197 HydrophobicContact CG-CG2 4.18Å; M113-V197 HydrophobicContact SD-CG1 3.87Å; M113-A200 HydrophobicContact CE-CB 3.83Å; M113-I201 HydrophobicContact CE-CG1 3.76Å; M113-I201 HydrophobicContact SD-CD1 4.08Å; M113-I201 HydrophobicContact SD-CG1 3.67Å
114A97.3Very high95.2Very high7 Ų753.5 Ų53.56%0.05829%0.288CS..Hα-helixtrans-60.6-43.1173.800000111.8I60 A63 I64 G110 I111 I112 S118I60-A114 HydrophobicContact CG2-CB 4.28Å; A63-A114 HydrophobicContact CB-CB 4.37Å; I64-A114 HydrophobicContact CB-CB 3.96Å; I64-A114 HydrophobicContact CG2-CB 4.49Å; G110-A114 WeakPolarHBondContact O-CB 3.42Å; G110-A114 PolarHBondContact O-N 2.86Å; I111-A114 PolarHBondContact O-N 2.65Å; I112-A114 PolarHBondContact O-N 3.02Å; A114-S118 VanDerWaalsContact O-CB 3.22Å; A114-S118 WeakPolarHBondContact O-CB 3.38Å; A114-S118 PolarHBondContact O-N 3.18Å
115I97.3Very high94.6Very high93 Ų9354.5 Ų54.548%0.47730%0.301SS..Hα-helixtrans-64.7-45.5175.9-66.8166.3000110.9I111 I112 M113 I117 S118 N119I111-I115 HydrophobicContact CG1-CD1 4.07Å; I111-I115 WeakPolarHBondContact O-CG1 3.49Å; I111-I115 PolarHBondContact O-N 2.68Å; I112-I115 PolarHBondContact O-N 3.1Å; M113-I115 VanDerWaalsContact C-N 3.33Å; M113-I115 PolarHBondContact O-N 3.35Å; I115-I117 PolarHBondContact O-N 3.46Å; I115-S118 PolarHBondContact O-N 3.46Å; I115-N119 VanDerWaalsContact O-CG 3.27Å; I115-N119 PolarHBondContact O-N 3.45Å; I115-N119 PolarHBondContact O-ND2 3.4Å
116V95.9Very high93.8Very high55 Ų5554.2 Ų54.233%0.33330%0.301SS..Hα-helixtrans-59.6-47.1179.3169.30000111.2I112 M113 N119 M120I112-V116 HydrophobicContact CG2-CG2 4.4Å; I112-V116 VanDerWaalsContact O-CG2 3.32Å; I112-V116 WeakPolarHBondContact O-CG2 3.43Å; I112-V116 PolarHBondContact O-N 2.91Å; M113-V116 HydrophobicContact CE-CG1 4.45Å; M113-V116 PolarHBondContact O-N 3.47Å; V116-N119 PolarHBondContact O-N 3.39Å; V116-M120 WeakPolarHBondContact O-CG 3.36Å
117I95.4Very high93.1Very high0 Ų060.3 Ų60.30%034%0.338CS..Hα-helixtrans-67.8-39.9179.1-61.6167.2000110.4I60 M113 I115 N119 M120 M143 A146 T204I60-I117 HydrophobicContact CD1-CG2 4.24Å; I60-I117 HydrophobicContact CG1-CB 4.04Å; I60-I117 HydrophobicContact CG1-CG2 3.54Å; M113-I117 HydrophobicContact CE-CD1 4.41Å; M113-I117 HydrophobicContact CE-CG1 4.35Å; M113-I117 WeakPolarHBondContact O-CB 3.21Å; M113-I117 VanDerWaalsContact O-CG1 3.22Å; M113-I117 WeakPolarHBondContact O-CG1 3.31Å; M113-I117 PolarHBondContact O-N 3.24Å; I115-I117 PolarHBondContact O-N 3.46Å; I117-N119 VanDerWaalsContact C-N 3.3Å; I117-N119 PolarHBondContact O-N 3.12Å; I117-M120 WeakPolarHBondContact O-CB 3.29Å; I117-M120 PolarHBondContact O-N 2.99Å; I117-M120 VanDerWaalsContact O-N 3.11Å; I117-M143 HydrophobicContact CG2-CB 3.76Å; I117-M143 HydrophobicContact CG2-CG 3.8Å; I117-M143 HydrophobicContact CG2-SD 4.39Å; I117-A146 HydrophobicContact CD1-CB 4Å; I117-T204 HydrophobicContact CG1-CG2 4.48Å
118S95.5Very high92.3Very high59 Ų5962 Ų6241%0.41335%0.346SS..Hα-helixtrans-62-36.7177.7-1730000113A114 I115 M120 A121A114-S118 VanDerWaalsContact O-CB 3.22Å; A114-S118 WeakPolarHBondContact O-CB 3.38Å; A114-S118 PolarHBondContact O-N 3.18Å; I115-S118 PolarHBondContact O-N 3.46Å; S118-M120 PolarHBondContact O-N 2.89Å; S118-A121 PolarHBondContact O-N 3.01Å
119N94.6Very high91.5Very high122 Ų12260.3 Ų60.365%0.65234%0.341SS*.THydrogen-bonded Turntrans-69.9-14.1178.3-72.3-23.8000113.3I115 V116 I117I115-N119 VanDerWaalsContact O-CG 3.27Å; I115-N119 PolarHBondContact O-N 3.45Å; I115-N119 PolarHBondContact O-ND2 3.4Å; V116-N119 PolarHBondContact O-N 3.39Å; I117-N119 VanDerWaalsContact C-N 3.3Å; I117-N119 PolarHBondContact O-N 3.12Å
120M92.1Very high90.7Very high47 Ų4765.4 Ų65.423%0.23237%0.367CS..THydrogen-bonded Turntrans-90-12.4176.5-64.1170.3152.100112.8V116 I117 S118 E122 M143 T204 M209V116-M120 WeakPolarHBondContact O-CG 3.36Å; I117-M120 WeakPolarHBondContact O-CB 3.29Å; I117-M120 PolarHBondContact O-N 2.99Å; I117-M120 VanDerWaalsContact O-N 3.11Å; S118-M120 PolarHBondContact O-N 2.89Å; M120-E122 PolarHBondContact O-N 2.96Å; M120-M143 HydrophobicContact CB-CE 3.6Å; M120-M143 VanDerWaalsContact O-CE 3.29Å; M120-M143 WeakPolarHBondContact O-CE 3.38Å; M120-T204 WeakPolarHBondContact CE-O 3.39Å; M120-T204 HydrophobicContact SD-CG2 4.41Å; M120-M209 WeakPolarHBondContact O-CB 3.44Å
121A91.8Very high90.1Very high34 Ų3469.3 Ų69.328%0.28139%0.391SS..  trans-85.798.1-179.400000110.4S118 M143 M209S118-A121 PolarHBondContact O-N 3.01Å; A121-M143 HydrophobicContact CB-SD 4.31Å; A121-M209 HydrophobicContact CB-SD 4.3Å
122E92.5Very high89.5Confident85 Ų8566.3 Ų66.340%0.39738%0.375SS..  trans-100.7154.8171.8-51.5174.7179.700110.4M120 K208 M209M120-E122 PolarHBondContact O-N 2.96Å; E122-K208 WeakPolarHBondContact OE1-CE 3.32Å; E122-K208 IonicContact OE1-NZ 3.93Å; E122-K208 WeakPolarHBondContact OE2-CE 3.3Å; E122-K208 IonicContact OE2-NZ 3.87Å; E122-M209 VanDerWaalsContact CB-O 3.26Å; E122-M209 WeakPolarHBondContact CB-O 3.26Å; E122-M209 WeakPolarHBondContact CG-O 3.45Å
123N89Confident89Confident144 Ų14463.2 Ų63.277%0.7737%0.366SS*.  trans-75.2145.2176.2-66.3-39.3000110.7
124F87.5Confident88.6Confident25 Ų2567.2 Ų67.211%0.1140%0.398CS..  trans-129.1156171.760.3-102.2000110P52 F53 G126 I132 N136 M209 D211P52-F124 HydrophobicContact CB-CE1 4.36Å; P52-F124 HydrophobicContact CB-CZ 4.38Å; P52-F124 HydrophobicContact CG-CE1 4.45Å; P52-F124 HydrophobicContact CG-CZ 4.07Å; F53-F124 HydrophobicContact CD2-CE1 4.08Å; F53-F124 AromaticContact CD2-CZ 3.93Å; F53-F124 HydrophobicContact CD2-CZ 3.93Å; F53-F124 HydrophobicContact CE1-CD1 4.4Å; F53-F124 HydrophobicContact CE1-CE1 4.17Å; F53-F124 AromaticContact CE2-CD1 3.94Å; F53-F124 HydrophobicContact CE2-CD1 3.94Å; F53-F124 HydrophobicContact CE2-CD2 4.42Å; F53-F124 AromaticContact CE2-CE1 3.41Å; F53-F124 HydrophobicContact CE2-CE1 3.41Å; F53-F124 VanDerWaalsContact CE2-CE1 3.41Å; F53-F124 AromaticContact CE2-CE2 3.92Å; F53-F124 HydrophobicContact CE2-CE2 3.92Å; F53-F124 HydrophobicContact CE2-CG 4.42Å; F53-F124 AromaticContact CE2-CZ 3.39Å; F53-F124 HydrophobicContact CE2-CZ 3.39Å; F53-F124 AromaticContact CZ-CD1 3.61Å; F53-F124 HydrophobicContact CZ-CD1 3.61Å; F53-F124 AromaticContact CZ-CE1 3.46Å; F53-F124 HydrophobicContact CZ-CE1 3.46Å; F53-F124 VanDerWaalsContact CZ-CE1 3.46Å; F53-F124 HydrophobicContact CZ-CG 4.24Å; F53-F124 AromaticContact CZ-CZ 3.95Å; F53-F124 HydrophobicContact CZ-CZ 3.95Å; F124-G126 WeakPolarHBondContact CE2-O 3.42Å; F124-I132 HydrophobicContact CD2-CG1 4.29Å; F124-I132 HydrophobicContact CE2-CB 4.44Å; F124-I132 HydrophobicContact CE2-CD1 3.97Å; F124-I132 HydrophobicContact CE2-CG1 3.68Å; F124-I132 HydrophobicContact CE2-CG2 4.1Å; F124-I132 HydrophobicContact CZ-CD1 4.43Å; F124-I132 HydrophobicContact CZ-CG1 4.39Å; F124-I132 HydrophobicContact CZ-CG2 4.1Å; F124-N136 HydrophobicContact CD1-CB 4.33Å; F124-N136 HydrophobicContact CE1-CB 4.23Å; F124-M209 HydrophobicContact CD1-CE 4.12Å; F124-M209 HydrophobicContact CD1-CG 4.38Å; F124-M209 HydrophobicContact CE1-CE 3.53Å; F124-D211 WeakPolarHBondContact CB-OD1 3.38Å
125T83.9Confident88.2Confident123 Ų12372.7 Ų72.776%0.75542%0.418SS*.  trans-98-14.6-172.351.10000114.9D211T125-D211 PolarHBondContact N-OD2 3.45Å; T125-D211 VanDerWaalsContact N-OD2 3.09Å; T125-D211 PolarHBondContact OG1-OD2 3.17Å
126G79.3Confident88Confident15 Ų1568.5 Ų68.516%0.15540%0.396CS..  trans-66135.1179.500000113.6F124 T131 I132F124-G126 WeakPolarHBondContact CE2-O 3.42Å; G126-T131 WeakPolarHBondContact CA-OG1 3.37Å; G126-I132 WeakPolarHBondContact O-CG1 3.43Å
127T80.4Confident87.9Confident129 Ų12966.9 Ų66.979%0.79138%0.384SS*.  trans-113.1-21.5178.9530000113.5T131T127-T131 PolarHBondContact N-OG1 3.38Å
128T81.2Confident87.8Confident55 Ų5573 Ų7334%0.33741%0.413SS..SBendtrans-96150.4175.471.60000111E130 T131 I132T128-E130 PolarHBondContact O-N 3.33Å; T128-E130 VanDerWaalsContact O-N 3.13Å; T128-E130 PolarHBondContact OG1-OE2 2.96Å; T128-T131 PolarHBondContact N-OG1 3.34Å; T128-T131 PolarHBondContact O-N 3.36Å; T128-T131 PolarHBondContact O-OG1 3.04Å; T128-T131 VanDerWaalsContact OG1-CG2 3.29Å; T128-T131 WeakPolarHBondContact OG1-CG2 3.5Å; T128-T131 PolarHBondContact OG1-N 2.92Å; T128-T131 PolarHBondContact OG1-OG1 3.31Å; T128-T131 VanDerWaalsContact OG1-OG1 3.07Å; T128-I132 WeakPolarHBondContact O-CG1 3.41Å; T128-I132 PolarHBondContact O-N 3Å
129P82Confident87.7Confident46 Ų4670.3 Ų70.330%0.29939%0.394SS..Hα-helixtrans-55-33.7179.1-27.935.7000114.2G133 Y137P129-G133 PolarHBondContact O-N 3.08Å; P129-Y137 WeakPolarHBondContact CA-OH 3.44Å; P129-Y137 HydrophobicContact CB-CE2 4.44Å
130E80.6Confident87.7Confident166 Ų16664.5 Ų64.578%0.77636%0.363SS*.Hα-helixtrans-70-35.5176.5-52.4103.8178.300112.5T128T128-E130 PolarHBondContact O-N 3.33Å; T128-E130 VanDerWaalsContact O-N 3.13Å; T128-E130 PolarHBondContact OG1-OE2 2.96Å
131T83.7Confident87.9Confident82 Ų8265.8 Ų65.850%0.50337%0.366SS..Hα-helixtrans-77.7-34179.958.20000112.9G126 T127 T128 G133G126-T131 WeakPolarHBondContact CA-OG1 3.37Å; T127-T131 PolarHBondContact N-OG1 3.38Å; T128-T131 PolarHBondContact N-OG1 3.34Å; T128-T131 PolarHBondContact O-N 3.36Å; T128-T131 PolarHBondContact O-OG1 3.04Å; T128-T131 VanDerWaalsContact OG1-CG2 3.29Å; T128-T131 WeakPolarHBondContact OG1-CG2 3.5Å; T128-T131 PolarHBondContact OG1-N 2.92Å; T128-T131 PolarHBondContact OG1-OG1 3.31Å; T128-T131 VanDerWaalsContact OG1-OG1 3.07Å; T131-G133 VanDerWaalsContact C-N 3.33Å
132I84.8Confident88.2Confident15 Ų1565.2 Ų65.28%0.07736%0.36CS..Hα-helixtrans-65.9-40.7174.9-65.4173.3000110.1P52 F124 G126 T128 N136 Y137P52-I132 HydrophobicContact CG-CG2 4.02Å; F124-I132 HydrophobicContact CD2-CG1 4.29Å; F124-I132 HydrophobicContact CE2-CB 4.44Å; F124-I132 HydrophobicContact CE2-CD1 3.97Å; F124-I132 HydrophobicContact CE2-CG1 3.68Å; F124-I132 HydrophobicContact CE2-CG2 4.1Å; F124-I132 HydrophobicContact CZ-CD1 4.43Å; F124-I132 HydrophobicContact CZ-CG1 4.39Å; F124-I132 HydrophobicContact CZ-CG2 4.1Å; G126-I132 WeakPolarHBondContact O-CG1 3.43Å; T128-I132 WeakPolarHBondContact O-CG1 3.41Å; T128-I132 PolarHBondContact O-N 3Å; I132-N136 HydrophobicContact CG2-CB 3.57Å; I132-N136 WeakPolarHBondContact O-CB 3.39Å; I132-N136 PolarHBondContact O-ND2 3.25Å; I132-Y137 HydrophobicContact CB-CD2 4.5Å; I132-Y137 HydrophobicContact CB-CE2 3.81Å; I132-Y137 HydrophobicContact CG2-CD2 3.85Å; I132-Y137 HydrophobicContact CG2-CE2 3.53Å
133G86.4Confident88.4Confident25 Ų2561.2 Ų61.226%0.25834%0.341SS..Hα-helixtrans72.3159.4175.700000114.2P129 T131 R135 N136 Y137P129-G133 PolarHBondContact O-N 3.08Å; T131-G133 VanDerWaalsContact C-N 3.33Å; G133-R135 PolarHBondContact O-N 3.2Å; G133-R135 VanDerWaalsContact O-N 3.11Å; G133-N136 PolarHBondContact O-N 3.23Å; G133-Y137 WeakPolarHBondContact O-CD2 3.45Å; G133-Y137 PolarHBondContact O-N 3.47Å
134A88.6Confident88.8Confident84 Ų8456.3 Ų56.369%0.69431%0.313SS*.Hα-helixtrans-58.6-28.5-176.400000113.7Q138A134-Q138 VanDerWaalsContact O-CB 3.28Å; A134-Q138 WeakPolarHBondContact O-CB 3.4Å; A134-Q138 PolarHBondContact O-N 3.02Å
135R90.8Very high89.3Confident123 Ų12356.2 Ų56.246%0.46432%0.319SS..Hα-helixtrans-60.3-48.9178.7-173.7-177.571.9-170.8-3.9112G133 Q138 A139 G210 D211G133-R135 PolarHBondContact O-N 3.2Å; G133-R135 VanDerWaalsContact O-N 3.11Å; R135-Q138 PolarHBondContact O-N 3.35Å; R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 2.93Å; R135-G210 PolarHBondContact NH2-O 2.89Å; R135-D211 PolarHBondContact NH2-OXT 3.44Å
136N91.9Very high89.9Confident4 Ų450.4 Ų50.42%0.02128%0.283CS..Hα-helixtrans-74.5-34.9-175.8-75.4-43.2000112.2F124 I132 G133 A139 G140 G210F124-N136 HydrophobicContact CD1-CB 4.33Å; F124-N136 HydrophobicContact CE1-CB 4.23Å; I132-N136 HydrophobicContact CG2-CB 3.57Å; I132-N136 WeakPolarHBondContact O-CB 3.39Å; I132-N136 PolarHBondContact O-ND2 3.25Å; G133-N136 PolarHBondContact O-N 3.23Å; N136-A139 WeakPolarHBondContact O-CB 3.5Å; N136-A139 PolarHBondContact O-N 3.43Å; N136-G140 PolarHBondContact O-N 3.47Å; N136-G210 PolarHBondContact ND2-O 3.09Å; N136-G210 PolarHBondContact OD1-N 2.94Å; N136-G210 PolarHBondContact OD1-O 2.69Å; N136-G210 VanDerWaalsContact OD1-O 3.05Å
137Y93.2Very high90.8Very high22 Ų2249.7 Ų49.79%0.08628%0.276CS..Hα-helixtrans-63.9-47.2170.9-74.6-75.4000112.1T48 P52 P129 I132 G133 A139 G140 Y141T48-Y137 WeakPolarHBondContact O-CE1 3.32Å; T48-Y137 VanDerWaalsContact O-CZ 3.3Å; T48-Y137 PolarHBondContact O-OH 3.48Å; P52-Y137 HydrophobicContact CG-CD1 3.75Å; P52-Y137 HydrophobicContact CG-CE1 3.87Å; P52-Y137 HydrophobicContact CG-CG 4.26Å; P129-Y137 WeakPolarHBondContact CA-OH 3.44Å; P129-Y137 HydrophobicContact CB-CE2 4.44Å; I132-Y137 HydrophobicContact CB-CD2 4.5Å; I132-Y137 HydrophobicContact CB-CE2 3.81Å; I132-Y137 HydrophobicContact CG2-CD2 3.85Å; I132-Y137 HydrophobicContact CG2-CE2 3.53Å; G133-Y137 WeakPolarHBondContact O-CD2 3.45Å; G133-Y137 PolarHBondContact O-N 3.47Å; Y137-A139 PolarHBondContact O-N 3.05Å; Y137-G140 PolarHBondContact O-N 3.45Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.37Å; Y137-Y141 PolarHBondContact O-N 2.95Å
138Q93.8Very high91.7Very high129 Ų12945.8 Ų45.860%0.60325%0.25SC*.Hα-helixtrans-58.2-38.2175.2-177.4-179.70.800111.3A134 R135 S142A134-Q138 VanDerWaalsContact O-CB 3.28Å; A134-Q138 WeakPolarHBondContact O-CB 3.4Å; A134-Q138 PolarHBondContact O-N 3.02Å; R135-Q138 PolarHBondContact O-N 3.35Å; Q138-S142 WeakPolarHBondContact O-CB 3.11Å; Q138-S142 PolarHBondContact O-N 3.22Å
139A94.4Very high92.5Very high1 Ų145.3 Ų45.31%0.00825%0.247CC..Hα-helixtrans-63-50.1176.900000112.3R135 N136 Y137 Y141 S142 M143 V207 M209R135-A139 WeakPolarHBondContact O-CB 3.48Å; R135-A139 PolarHBondContact O-N 2.93Å; N136-A139 WeakPolarHBondContact O-CB 3.5Å; N136-A139 PolarHBondContact O-N 3.43Å; Y137-A139 PolarHBondContact O-N 3.05Å; A139-Y141 PolarHBondContact O-N 3.44Å; A139-S142 PolarHBondContact O-N 3.41Å; A139-M143 HydrophobicContact CB-CE 4.46Å; A139-M143 VanDerWaalsContact O-CG 3.25Å; A139-M143 WeakPolarHBondContact O-CG 3.1Å; A139-M143 PolarHBondContact O-N 3.13Å; A139-V207 HydrophobicContact CB-CG1 3.46Å; A139-V207 VanDerWaalsContact CB-CG1 3.46Å; A139-M209 HydrophobicContact CB-CB 3.89Å; A139-M209 HydrophobicContact CB-CG 4.29Å
140G94.8Very high93.2Very high0 Ų043.1 Ų43.10%023%0.233CC..Hα-helixtrans-57-45.6177.100000112.9W55 N136 Y137 M143 F144W55-G140 WeakPolarHBondContact CB-O 3.31Å; N136-G140 PolarHBondContact O-N 3.47Å; Y137-G140 PolarHBondContact O-N 3.45Å; G140-M143 PolarHBondContact O-N 3.19Å; G140-F144 WeakPolarHBondContact O-CB 3.35Å; G140-F144 PolarHBondContact O-N 3.18Å
141Y96.3Very high94Very high75 Ų7535.2 Ų35.229%0.29420%0.196SC..Hα-helixtrans-67.8-39.3179-60.6-39.8000113.4L47 W55 Y137 A139 F144 G145L47-Y141 WeakPolarHBondContact CB-OH 3.48Å; L47-Y141 HydrophobicContact CD2-CE1 4.21Å; L47-Y141 PolarHBondContact O-OH 3.24Å; W55-Y141 AromaticContact CD1-CE1 3.63Å; W55-Y141 HydrophobicContact CD2-CD1 4.26Å; W55-Y141 HydrophobicContact CD2-CE1 4.19Å; W55-Y141 AromaticContact CE2-CE1 3.9Å; W55-Y141 HydrophobicContact CG-CD1 4.03Å; W55-Y141 HydrophobicContact CG-CE1 4.02Å; W55-Y141 AromaticContact NE1-CE1 3.54Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.37Å; Y137-Y141 PolarHBondContact O-N 2.95Å; A139-Y141 PolarHBondContact O-N 3.44Å; Y141-F144 PolarHBondContact O-N 3Å; Y141-G145 PolarHBondContact O-N 3.47Å
142S96.6Very high94.7Very high22 Ų2235.7 Ų35.715%0.15419%0.191CC..Hα-helixtrans-67.8-40.8178-170.90000111.7Q138 A139 F144 G145 A146 Q203Q138-S142 WeakPolarHBondContact O-CB 3.11Å; Q138-S142 PolarHBondContact O-N 3.22Å; A139-S142 PolarHBondContact O-N 3.41Å; S142-F144 VanDerWaalsContact C-N 3.34Å; S142-F144 PolarHBondContact O-N 3.32Å; S142-G145 PolarHBondContact O-N 3.06Å; S142-A146 VanDerWaalsContact O-CB 3.24Å; S142-A146 WeakPolarHBondContact O-CB 3.46Å; S142-A146 PolarHBondContact O-N 3Å; S142-Q203 PolarHBondContact OG-O 3.39Å
143M96.9Very high95.4Very high0 Ų036.1 Ų36.10%020%0.195CC..Hα-helixtrans-62.1-41174.4-68.1178.8-172.200112.1A56 I117 M120 A121 A139 G140 G147 V207 M209A56-M143 HydrophobicContact CB-CB 4.12Å; A56-M143 HydrophobicContact CB-SD 3.6Å; A56-M143 VanDerWaalsContact CB-SD 3.6Å; I117-M143 HydrophobicContact CG2-CB 3.76Å; I117-M143 HydrophobicContact CG2-CG 3.8Å; I117-M143 HydrophobicContact CG2-SD 4.39Å; M120-M143 HydrophobicContact CB-CE 3.6Å; M120-M143 VanDerWaalsContact O-CE 3.29Å; M120-M143 WeakPolarHBondContact O-CE 3.38Å; A121-M143 HydrophobicContact CB-SD 4.31Å; A139-M143 HydrophobicContact CB-CE 4.46Å; A139-M143 VanDerWaalsContact O-CG 3.25Å; A139-M143 WeakPolarHBondContact O-CG 3.1Å; A139-M143 PolarHBondContact O-N 3.13Å; G140-M143 PolarHBondContact O-N 3.19Å; M143-G147 PolarHBondContact O-N 3.18Å; M143-V207 HydrophobicContact CE-CG1 4.23Å; M143-M209 HydrophobicContact CE-CB 3.75Å; M143-M209 HydrophobicContact CE-SD 4.11Å; M143-M209 HydrophobicContact SD-SD 4.1Å
144F97.8Very high95.9Very high42 Ų4234.9 Ų34.918%0.18418%0.183CC..Hα-helixtrans-62.4-49.8174-178.9-114000112.5W55 L58 L62 G140 Y141 S142 A146 G147 L148W55-F144 HydrophobicContact CB-CB 4Å; W55-F144 HydrophobicContact CE3-CB 4.3Å; W55-F144 AromaticContact CE3-CD1 3.57Å; W55-F144 HydrophobicContact CE3-CD1 3.57Å; W55-F144 AromaticContact CE3-CD2 3.91Å; W55-F144 HydrophobicContact CE3-CD2 3.91Å; W55-F144 AromaticContact CE3-CE1 3.72Å; W55-F144 HydrophobicContact CE3-CE1 3.72Å; W55-F144 HydrophobicContact CE3-CE2 4.07Å; W55-F144 AromaticContact CE3-CG 3.65Å; W55-F144 HydrophobicContact CE3-CG 3.65Å; W55-F144 AromaticContact CE3-CZ 3.96Å; W55-F144 HydrophobicContact CE3-CZ 3.96Å; W55-F144 AromaticContact CZ3-CD1 3.87Å; W55-F144 HydrophobicContact CZ3-CD1 3.87Å; W55-F144 AromaticContact CZ3-CE1 3.54Å; W55-F144 HydrophobicContact CZ3-CE1 3.54Å; W55-F144 HydrophobicContact CZ3-CE2 4.26Å; W55-F144 HydrophobicContact CZ3-CG 4.34Å; W55-F144 AromaticContact CZ3-CZ 3.75Å; W55-F144 HydrophobicContact CZ3-CZ 3.75Å; W55-F144 WeakPolarHBondContact O-CB 3.42Å; L58-F144 HydrophobicContact CB-CD2 4.36Å; L58-F144 HydrophobicContact CB-CE2 4.4Å; L58-F144 HydrophobicContact CD2-CD2 4.32Å; L58-F144 HydrophobicContact CD2-CE2 3.62Å; L58-F144 HydrophobicContact CD2-CZ 4.41Å; L58-F144 HydrophobicContact CG-CD2 4.32Å; L58-F144 HydrophobicContact CG-CE2 3.88Å; L62-F144 HydrophobicContact CD1-CE2 4.16Å; G140-F144 WeakPolarHBondContact O-CB 3.35Å; G140-F144 PolarHBondContact O-N 3.18Å; Y141-F144 PolarHBondContact O-N 3Å; S142-F144 VanDerWaalsContact C-N 3.34Å; S142-F144 PolarHBondContact O-N 3.32Å; F144-A146 PolarHBondContact O-N 2.92Å; F144-G147 PolarHBondContact O-N 3.22Å; F144-L148 HydrophobicContact CD1-CD1 3.97Å; F144-L148 HydrophobicContact CE1-CD1 3.36Å; F144-L148 HydrophobicContact CE1-CG 4.25Å; F144-L148 HydrophobicContact CE2-CD1 4.05Å; F144-L148 HydrophobicContact CE2-CD2 4.45Å; F144-L148 HydrophobicContact CE2-CG 4.12Å; F144-L148 HydrophobicContact CZ-CD1 3.42Å; F144-L148 VanDerWaalsContact CZ-CD1 3.42Å; F144-L148 HydrophobicContact CZ-CD2 4.39Å; F144-L148 HydrophobicContact CZ-CG 4Å; F144-L148 PolarHBondContact O-N 3.4Å
145G97.5Very high96.4Very high23 Ų2331.9 Ų31.924%0.23716%0.155CC..Hα-helixtrans-62.4-40.4179.600000113Y141 S142 L148 T149 Q203Y141-G145 PolarHBondContact O-N 3.47Å; S142-G145 PolarHBondContact O-N 3.06Å; G145-L148 PolarHBondContact O-N 2.91Å; G145-T149 WeakPolarHBondContact O-CB 3.42Å; G145-T149 PolarHBondContact O-N 3.4Å; G145-T149 PolarHBondContact O-OG1 3.16Å; G145-Q203 VanDerWaalsContact C-OE1 3.27Å; G145-Q203 PolarHBondContact O-OE1 2.95Å
146A97.6Very high96.7Very high0 Ų032 Ų320%016%0.159CC..Hα-helixtrans-65-44.1176.300000111.3I117 S142 F144 T149 V150 A200 Q203 T204I117-A146 HydrophobicContact CD1-CB 4Å; S142-A146 VanDerWaalsContact O-CB 3.24Å; S142-A146 WeakPolarHBondContact O-CB 3.46Å; S142-A146 PolarHBondContact O-N 3Å; F144-A146 PolarHBondContact O-N 2.92Å; A146-T149 PolarHBondContact O-N 3.46Å; A146-V150 WeakPolarHBondContact O-CG1 3.43Å; A146-V150 PolarHBondContact O-N 3.45Å; A146-A200 HydrophobicContact CB-CB 4.12Å; A146-Q203 HydrophobicContact CB-CB 4.36Å; A146-Q203 VanDerWaalsContact N-OE1 3.08Å; A146-T204 HydrophobicContact CB-CG2 3.51Å
147G97.7Very high97Very high0 Ų031.8 Ų31.80%016%0.158CC..Hα-helixtrans-62-43.7176.300000113.5G59 M143 F144 V150 G151G59-G147 WeakPolarHBondContact O-CA 3.27Å; M143-G147 PolarHBondContact O-N 3.18Å; F144-G147 PolarHBondContact O-N 3.22Å; G147-V150 WeakPolarHBondContact O-CG1 3.41Å; G147-G151 PolarHBondContact O-N 3.12Å
148L98.2Very high97.2Very high47 Ų4730.8 Ų30.825%0.24615%0.154CC..Hα-helixtrans-63.5-44.6174.4-77-178.5000112.4L62 F144 G145 G151 F152L62-L148 HydrophobicContact CD1-CD2 3.57Å; L62-L148 HydrophobicContact CD1-CG 4.49Å; F144-L148 HydrophobicContact CD1-CD1 3.97Å; F144-L148 HydrophobicContact CE1-CD1 3.36Å; F144-L148 HydrophobicContact CE1-CG 4.25Å; F144-L148 HydrophobicContact CE2-CD1 4.05Å; F144-L148 HydrophobicContact CE2-CD2 4.45Å; F144-L148 HydrophobicContact CE2-CG 4.12Å; F144-L148 HydrophobicContact CZ-CD1 3.42Å; F144-L148 VanDerWaalsContact CZ-CD1 3.42Å; F144-L148 HydrophobicContact CZ-CD2 4.39Å; F144-L148 HydrophobicContact CZ-CG 4Å; F144-L148 PolarHBondContact O-N 3.4Å; G145-L148 PolarHBondContact O-N 2.91Å; L148-G151 PolarHBondContact O-N 3.06Å; L148-F152 HydrophobicContact CD2-CD2 4.28Å; L148-F152 HydrophobicContact CD2-CE2 3.91Å; L148-F152 WeakPolarHBondContact O-CB 3.24Å; L148-F152 WeakPolarHBondContact O-CD2 3.42Å; L148-F152 PolarHBondContact O-N 2.95Å
149T97.9Very high97.4Very high46 Ų4626.5 Ų26.528%0.28214%0.135SC..Hα-helixtrans-61.3-51.3-178-63.40000110.7G145 A146 S153 V199G145-T149 WeakPolarHBondContact O-CB 3.42Å; G145-T149 PolarHBondContact O-N 3.4Å; G145-T149 PolarHBondContact O-OG1 3.16Å; A146-T149 PolarHBondContact O-N 3.46Å; T149-S153 WeakPolarHBondContact O-CB 3.32Å; T149-S153 PolarHBondContact O-N 2.91Å; T149-V199 HydrophobicContact CG2-CB 4.2Å; T149-V199 HydrophobicContact CG2-CG1 3.96Å
150V97.9Very high97.5Very high0 Ų028.7 Ų28.70%015%0.149CC..Hα-helixtrans-67.2-42.917970.80000111.3A63 M113 A146 G147 S153 N154 V197 A200A63-V150 HydrophobicContact CB-CG1 3.61Å; M113-V150 HydrophobicContact CB-CG1 4.18Å; M113-V150 HydrophobicContact CB-CG2 4.1Å; M113-V150 HydrophobicContact CG-CG2 3.94Å; A146-V150 WeakPolarHBondContact O-CG1 3.43Å; A146-V150 PolarHBondContact O-N 3.45Å; G147-V150 WeakPolarHBondContact O-CG1 3.41Å; V150-S153 PolarHBondContact O-N 3.49Å; V150-N154 WeakPolarHBondContact CG2-ND2 3.35Å; V150-N154 WeakPolarHBondContact O-CB 3.39Å; V150-N154 VanDerWaalsContact O-CG 3.28Å; V150-N154 PolarHBondContact O-N 3.48Å; V150-N154 PolarHBondContact O-ND2 3.4Å; V150-V197 HydrophobicContact CG2-CG2 4.07Å; V150-A200 HydrophobicContact CB-CB 4.17Å
151G98Very high97.6Very high0 Ų028.7 Ų28.70%015%0.149CC..Hα-helixtrans-60.7-51.2-177.700000112.6G147 L148 L155G147-G151 PolarHBondContact O-N 3.12Å; L148-G151 PolarHBondContact O-N 3.06Å; G151-L155 WeakPolarHBondContact O-CB 3.38Å; G151-L155 PolarHBondContact O-N 3.48Å
152F98.3Very high97.7Very high91 Ų9125.1 Ų25.140%0.39914%0.135SC..Hα-helixtrans-71.2-39178.4-81.2-65.5000113.1L66 L148 N154 L155 F156L66-F152 HydrophobicContact CD1-CD1 4.42Å; L66-F152 HydrophobicContact CD1-CD2 4.16Å; L66-F152 HydrophobicContact CD1-CE1 4.31Å; L66-F152 HydrophobicContact CD1-CE2 4.07Å; L66-F152 HydrophobicContact CD1-CG 4.34Å; L66-F152 HydrophobicContact CD1-CZ 4.13Å; L148-F152 HydrophobicContact CD2-CD2 4.28Å; L148-F152 HydrophobicContact CD2-CE2 3.91Å; L148-F152 WeakPolarHBondContact O-CB 3.24Å; L148-F152 WeakPolarHBondContact O-CD2 3.42Å; L148-F152 PolarHBondContact O-N 2.95Å; F152-N154 VanDerWaalsContact C-N 3.3Å; F152-N154 PolarHBondContact O-N 3.44Å; F152-L155 HydrophobicContact CD1-CD2 4.03Å; F152-L155 HydrophobicContact CE1-CD2 4.28Å; F152-L155 WeakPolarHBondContact O-CB 3.49Å; F152-L155 PolarHBondContact O-N 2.97Å; F152-F156 HydrophobicContact CB-CE2 4.15Å; F152-F156 HydrophobicContact CD1-CE2 4.21Å; F152-F156 HydrophobicContact CD1-CZ 4.05Å; F152-F156 WeakPolarHBondContact O-CD2 3.32Å; F152-F156 WeakPolarHBondContact O-CG 3.19Å; F152-F156 PolarHBondContact O-N 3.36Å
153S98Very high97.7Very high24 Ų2428.9 Ų28.917%0.16815%0.153CC..Hα-helixtrans-59.8-44.3176.7-169.20000111.1T149 V150 C157 I192T149-S153 WeakPolarHBondContact O-CB 3.32Å; T149-S153 PolarHBondContact O-N 2.91Å; V150-S153 PolarHBondContact O-N 3.49Å; S153-C157 WeakPolarHBondContact O-CB 3.28Å; S153-C157 PolarHBondContact O-N 3Å; S153-I192 PolarHBondContact OG-O 3.03Å
154N97.9Very high97.8Very high0 Ų030.4 Ų30.40%016%0.162CC..Hα-helixtrans-69.9-38.9176.7-76-11.3000112.3S67 V106 G110 V150 F152 F156 C157 G158 G193S67-N154 VanDerWaalsContact OG-CB 3.31Å; S67-N154 WeakPolarHBondContact OG-CB 3.47Å; S67-N154 PolarHBondContact OG-ND2 3.22Å; V106-N154 HydrophobicContact CG1-CB 3.44Å; V106-N154 VanDerWaalsContact CG1-CB 3.44Å; V106-N154 WeakPolarHBondContact CG1-O 3.4Å; V106-N154 PolarHBondContact O-ND2 3.42Å; G110-N154 PolarHBondContact N-ND2 3.39Å; V150-N154 WeakPolarHBondContact CG2-ND2 3.35Å; V150-N154 WeakPolarHBondContact O-CB 3.39Å; V150-N154 VanDerWaalsContact O-CG 3.28Å; V150-N154 PolarHBondContact O-N 3.48Å; V150-N154 PolarHBondContact O-ND2 3.4Å; F152-N154 VanDerWaalsContact C-N 3.3Å; F152-N154 PolarHBondContact O-N 3.44Å; N154-F156 PolarHBondContact O-N 3.02Å; N154-C157 PolarHBondContact O-N 3.12Å; N154-G158 PolarHBondContact O-N 3.14Å; N154-G193 WeakPolarHBondContact OD1-CA 3.48Å
155L98.3Very high97.7Very high20 Ų2028.4 Ų28.411%0.10515%0.154CC..Hα-helixtrans-53.9-53.1173.7176.962.7000111.3V69 G151 F152 I159V69-L155 HydrophobicContact CB-CD1 4.29Å; V69-L155 HydrophobicContact CG1-CD1 3.85Å; G151-L155 WeakPolarHBondContact O-CB 3.38Å; G151-L155 PolarHBondContact O-N 3.48Å; F152-L155 HydrophobicContact CD1-CD2 4.03Å; F152-L155 HydrophobicContact CE1-CD2 4.28Å; F152-L155 WeakPolarHBondContact O-CB 3.49Å; F152-L155 PolarHBondContact O-N 2.97Å; L155-I159 HydrophobicContact CD1-CD1 4.02Å; L155-I159 HydrophobicContact CG-CD1 4.24Å; L155-I159 WeakPolarHBondContact O-CG1 3.38Å; L155-I159 PolarHBondContact O-N 3.14Å
156F97.9Very high97.7Very high126 Ų12628.2 Ų28.255%0.55315%0.149SC*.Hα-helixtrans-71-36.6-178.6-59.4-41.9000112.6F152 N154 I159 C160F152-F156 HydrophobicContact CB-CE2 4.15Å; F152-F156 HydrophobicContact CD1-CE2 4.21Å; F152-F156 HydrophobicContact CD1-CZ 4.05Å; F152-F156 WeakPolarHBondContact O-CD2 3.32Å; F152-F156 WeakPolarHBondContact O-CG 3.19Å; F152-F156 PolarHBondContact O-N 3.36Å; N154-F156 PolarHBondContact O-N 3.02Å; F156-I159 PolarHBondContact O-N 3.45Å; F156-C160 VanDerWaalsContact O-CB 3.24Å; F156-C160 WeakPolarHBondContact O-CB 3.13Å; F156-C160 PolarHBondContact O-N 3.1Å
157C97.6Very high97.6Very high0 Ų030 Ų300%017%0.167CC..Hα-helixtrans-58.7-50.6173.5179.70000111.6V106 S153 N154 I159 C160 V161 G189 I192 G193V106-C157 HydrophobicContact CG2-CB 4.43Å; S153-C157 WeakPolarHBondContact O-CB 3.28Å; S153-C157 PolarHBondContact O-N 3Å; N154-C157 PolarHBondContact O-N 3.12Å; C157-I159 PolarHBondContact O-N 3.31Å; C157-C160 WeakPolarHBondContact O-CB 3.34Å; C157-C160 PolarHBondContact O-N 3.4Å; C157-V161 WeakPolarHBondContact O-CG2 3.4Å; C157-V161 PolarHBondContact O-N 3.32Å; C157-G189 PolarHBondContact SG-O 2.77Å; C157-G189 VanDerWaalsContact SG-O 3.34Å; C157-I192 HydrophobicContact CB-CB 4.26Å; C157-I192 HydrophobicContact CB-CG2 4.42Å; C157-G193 PolarHBondContact SG-N 2.96Å
158G97.2Very high97.5Very high0 Ų030 Ų300%017%0.167CC..Hα-helixtrans-61-41.3-179.800000112.9G74 N154 G162G74-G158 WeakPolarHBondContact CA-O 3.41Å; N154-G158 PolarHBondContact O-N 3.14Å; G158-G162 PolarHBondContact O-N 2.84Å
159I97.8Very high97.3Very high39 Ų3927.8 Ų27.820%0.216%0.156CC..Hα-helixtrans-65.2-45.7174.9-64.9166.7000110.8W73 L155 F156 C157 G162 I163W73-I159 HydrophobicContact CB-CG1 4.17Å; W73-I159 HydrophobicContact CD2-CD1 4.36Å; W73-I159 HydrophobicContact CD2-CG1 4.34Å; W73-I159 HydrophobicContact CE3-CD1 4.34Å; W73-I159 HydrophobicContact CG-CG1 4.09Å; L155-I159 HydrophobicContact CD1-CD1 4.02Å; L155-I159 HydrophobicContact CG-CD1 4.24Å; L155-I159 WeakPolarHBondContact O-CG1 3.38Å; L155-I159 PolarHBondContact O-N 3.14Å; F156-I159 PolarHBondContact O-N 3.45Å; C157-I159 PolarHBondContact O-N 3.31Å; I159-G162 PolarHBondContact O-N 3.04Å; I159-I163 HydrophobicContact CG2-CD1 3.82Å; I159-I163 HydrophobicContact CG2-CG1 4.47Å; I159-I163 VanDerWaalsContact O-CG1 3.31Å; I159-I163 WeakPolarHBondContact O-CG1 3.39Å; I159-I163 PolarHBondContact O-N 3.37Å
160C97.6Very high97.2Very high47 Ų4729.7 Ų29.732%0.31816%0.164SC..Hα-helixtrans-57.8-53.7178.5179.20000111.5F156 C157 G162 I163 V164F156-C160 VanDerWaalsContact O-CB 3.24Å; F156-C160 WeakPolarHBondContact O-CB 3.13Å; F156-C160 PolarHBondContact O-N 3.1Å; C157-C160 WeakPolarHBondContact O-CB 3.34Å; C157-C160 PolarHBondContact O-N 3.4Å; C160-G162 VanDerWaalsContact C-N 3.29Å; C160-G162 PolarHBondContact O-N 3.38Å; C160-I163 PolarHBondContact O-N 2.66Å; C160-V164 WeakPolarHBondContact O-CG2 3.48Å; C160-V164 PolarHBondContact O-N 3.41Å; C160-V164 VanDerWaalsContact O-N 3.08Å
161V97.2Very high97.1Very high0 Ų030.9 Ų30.90%017%0.173CC..Hα-helixtrans-61.8-38.9179176.40000110.9F102 C157 I163 V164 G165F102-V161 HydrophobicContact CB-CG1 3.81Å; C157-V161 WeakPolarHBondContact O-CG2 3.4Å; C157-V161 PolarHBondContact O-N 3.32Å; V161-I163 PolarHBondContact O-N 3.15Å; V161-V164 PolarHBondContact O-N 2.91Å; V161-G165 PolarHBondContact O-N 2.86Å
162G97.1Very high96.9Very high0 Ų031 Ų310%017%0.174CC..Hα-helixtrans-63.6-39.9176.700000114.1I77 T78 G158 I159 C160 S166I77-G162 WeakPolarHBondContact CG2-O 3.31Å; T78-G162 WeakPolarHBondContact OG1-CA 3.48Å; T78-G162 PolarHBondContact OG1-O 3.35Å; G158-G162 PolarHBondContact O-N 2.84Å; I159-G162 PolarHBondContact O-N 3.04Å; C160-G162 VanDerWaalsContact C-N 3.29Å; C160-G162 PolarHBondContact O-N 3.38Å; G162-S166 WeakPolarHBondContact O-CB 3.36Å; G162-S166 PolarHBondContact O-N 2.79Å
163I98.1Very high96.7Very high101 Ų10127.6 Ų27.652%0.51816%0.163SC..Hα-helixtrans-66.2-45.9176.3-68.2167.1000110.4I77 I159 C160 V161 S166 G167I77-I163 HydrophobicContact CD1-CG1 4.09Å; I159-I163 HydrophobicContact CG2-CD1 3.82Å; I159-I163 HydrophobicContact CG2-CG1 4.47Å; I159-I163 VanDerWaalsContact O-CG1 3.31Å; I159-I163 WeakPolarHBondContact O-CG1 3.39Å; I159-I163 PolarHBondContact O-N 3.37Å; C160-I163 PolarHBondContact O-N 2.66Å; V161-I163 PolarHBondContact O-N 3.15Å; I163-S166 PolarHBondContact O-N 3.25Å; I163-G167 PolarHBondContact O-N 3.26Å; I163-G167 VanDerWaalsContact O-N 3.16Å
164V97.4Very high96.6Very high33 Ų3334.5 Ų34.520%0.219%0.192CC..Hα-helixtrans-63.7-43.5177.8179.40000110.8C160 V161 S166 G167 A168 I182 V185 E186C160-V164 WeakPolarHBondContact O-CG2 3.48Å; C160-V164 PolarHBondContact O-N 3.41Å; C160-V164 VanDerWaalsContact O-N 3.08Å; V161-V164 PolarHBondContact O-N 2.91Å; V164-S166 PolarHBondContact O-N 3.45Å; V164-G167 CarbonylContact O-C 3.52Å; V164-G167 WeakPolarHBondContact O-CA 3.24Å; V164-G167 PolarHBondContact O-N 3Å; V164-G167 VanDerWaalsContact O-N 3.09Å; V164-A168 PolarHBondContact O-N 3.46Å; V164-I182 HydrophobicContact CG1-CG2 4.14Å; V164-V185 HydrophobicContact CG1-CB 4.04Å; V164-V185 HydrophobicContact CG1-CG1 3.95Å; V164-V185 HydrophobicContact CG2-CG1 4.21Å; V164-E186 HydrophobicContact CB-CG 4.14Å; V164-E186 HydrophobicContact CG1-CG 3.53Å
165G96.5Very high96.4Very high0 Ų038.1 Ų38.10%021%0.212CC..Hα-helixtrans-62.5-39.1178.200000113.4V161 A168 A169 E186V161-G165 PolarHBondContact O-N 2.86Å; G165-A168 PolarHBondContact O-N 3.47Å; G165-A169 WeakPolarHBondContact O-CB 3.22Å; G165-A169 PolarHBondContact O-N 3.41Å; G165-E186 WeakPolarHBondContact CA-OE1 3.49Å
166S97Very high96.1Very high19 Ų1938.7 Ų38.713%0.13322%0.219CC..Hα-helixtrans-59.6-45.7170.1166.20000111.9S81 G162 I163 V164 A168 A169 L170S81-S166 WeakPolarHBondContact CB-OG 3.43Å; S81-S166 PolarHBondContact OG-OG 3.5Å; G162-S166 WeakPolarHBondContact O-CB 3.36Å; G162-S166 PolarHBondContact O-N 2.79Å; I163-S166 PolarHBondContact O-N 3.25Å; V164-S166 PolarHBondContact O-N 3.45Å; S166-A168 PolarHBondContact O-N 3.34Å; S166-A169 PolarHBondContact O-N 3.29Å; S166-L170 WeakPolarHBondContact O-CG 3.32Å; S166-L170 PolarHBondContact O-N 3Å; S166-L170 VanDerWaalsContact O-N 3.13Å
167G95.8Very high95.9Very high38 Ų3836 Ų3639%0.39222%0.216SC..Hα-helixtrans-61.1-42.1174.400000112.8I163 V164 L170 A171I163-G167 PolarHBondContact O-N 3.26Å; I163-G167 VanDerWaalsContact O-N 3.16Å; V164-G167 CarbonylContact O-C 3.52Å; V164-G167 WeakPolarHBondContact O-CA 3.24Å; V164-G167 PolarHBondContact O-N 3Å; V164-G167 VanDerWaalsContact O-N 3.09Å; G167-L170 PolarHBondContact O-N 3.45Å; G167-A171 WeakPolarHBondContact O-CB 3.35Å; G167-A171 PolarHBondContact O-N 3.26Å
168A95.4Very high95.7Very high0 Ų039 Ų390%023%0.231CC..Hα-helixtrans-62.5-42177.100000112.2V164 G165 S166 A171 D172 F179 I182 E186V164-A168 PolarHBondContact O-N 3.46Å; G165-A168 PolarHBondContact O-N 3.47Å; S166-A168 PolarHBondContact O-N 3.34Å; A168-A171 PolarHBondContact O-N 3.46Å; A168-D172 WeakPolarHBondContact O-CB 3.23Å; A168-D172 PolarHBondContact O-N 3.49Å; A168-F179 HydrophobicContact CB-CD2 4.47Å; A168-I182 HydrophobicContact CB-CB 4.19Å; A168-I182 HydrophobicContact CB-CG2 3.63Å; A168-E186 VanDerWaalsContact CB-OE1 3.29Å; A168-E186 WeakPolarHBondContact CB-OE1 3.44Å
169A95.6Very high95.4Very high0 Ų039.4 Ų39.40%023%0.233CC..Hα-helixtrans-62.7-46.4177.300000112.3I82 N96 G165 S166 D172 A173I82-A169 HydrophobicContact CG1-CB 3.72Å; N96-A169 VanDerWaalsContact ND2-CA 3.27Å; N96-A169 WeakPolarHBondContact ND2-CA 3.49Å; N96-A169 PolarHBondContact ND2-N 3.07Å; G165-A169 WeakPolarHBondContact O-CB 3.22Å; G165-A169 PolarHBondContact O-N 3.41Å; S166-A169 PolarHBondContact O-N 3.29Å; A169-D172 PolarHBondContact O-N 3.43Å; A169-A173 PolarHBondContact O-N 3.33Å; A169-A173 VanDerWaalsContact O-N 3.11Å
170L95.8Very high95.1Very high86 Ų8642.1 Ų42.145%0.4525%0.252SS..Hα-helixtrans-68-36.7178.9-65.5175.2000112.1S166 G167 A173S166-L170 WeakPolarHBondContact O-CG 3.32Å; S166-L170 PolarHBondContact O-N 3Å; S166-L170 VanDerWaalsContact O-N 3.13Å; G167-L170 PolarHBondContact O-N 3.45Å; L170-A173 WeakPolarHBondContact O-CB 3.22Å
171A95.1Very high94.9Very high24 Ų2446.8 Ų46.820%0.19827%0.266CS..Hα-helixtrans-69-41.5175.900000112.6G167 A168 A173 Q174 N175 L178 I182G167-A171 WeakPolarHBondContact O-CB 3.35Å; G167-A171 PolarHBondContact O-N 3.26Å; A168-A171 PolarHBondContact O-N 3.46Å; A171-A173 VanDerWaalsContact C-N 3.27Å; A171-A173 PolarHBondContact O-N 3.43Å; A171-Q174 PolarHBondContact O-N 3.04Å; A171-Q174 VanDerWaalsContact O-N 3.12Å; A171-N175 PolarHBondContact O-N 3.32Å; A171-L178 HydrophobicContact CB-CD1 4.43Å; A171-I182 HydrophobicContact CB-CD1 3.57Å
172D94.6Very high94.8Very high2 Ų248.9 Ų48.91%0.01128%0.277CS..Hα-helixtrans-65.9-31.3177.7-165.964000112R91 I92 K95 N96 A168 A169 Q174 N175 A176 F179R91-D172 PolarHBondContact NH2-O 3.02Å; I92-D172 HydrophobicContact CG2-CB 4.3Å; I92-D172 WeakPolarHBondContact CG2-OD2 3.36Å; K95-D172 IonicContact NZ-OD1 2.78Å; K95-D172 PolarHBondContact NZ-OD1 3.05Å; K95-D172 IonicContact NZ-OD2 3.84Å; N96-D172 PolarHBondContact OD1-OD2 3.18Å; A168-D172 WeakPolarHBondContact O-CB 3.23Å; A168-D172 PolarHBondContact O-N 3.49Å; A169-D172 PolarHBondContact O-N 3.43Å; D172-Q174 PolarHBondContact O-N 3.46Å; D172-N175 CarbonylContact O-C 3.5Å; D172-A176 VanDerWaalsContact OD1-CA 3.24Å; D172-A176 WeakPolarHBondContact OD1-CA 3.35Å; D172-F179 HydrophobicContact CB-CB 4.15Å; D172-F179 VanDerWaalsContact OD1-CB 3.27Å; D172-F179 WeakPolarHBondContact OD1-CB 3.33Å
173A94.1Very high94.6Very high21 Ų2150.5 Ų50.517%0.17429%0.286CS..Hα-helixtrans-59.9-34.9172.900000112.1A89 I92 A169 L170 A171A89-A173 HydrophobicContact CB-CB 4.24Å; I92-A173 HydrophobicContact CD1-CB 4.09Å; I92-A173 HydrophobicContact CG2-CB 4.32Å; A169-A173 PolarHBondContact O-N 3.33Å; A169-A173 VanDerWaalsContact O-N 3.11Å; L170-A173 WeakPolarHBondContact O-CB 3.22Å; A171-A173 VanDerWaalsContact C-N 3.27Å; A171-A173 PolarHBondContact O-N 3.43Å
174Q95.1Very high94.5Very high169 Ų16950.1 Ų50.179%0.7928%0.284SS*.Hα-helixtrans-84.2-47.6176.3-58.2-58.3-34.200112.4A171 D172A171-Q174 PolarHBondContact O-N 3.04Å; A171-Q174 VanDerWaalsContact O-N 3.12Å; D172-Q174 PolarHBondContact O-N 3.46Å
175N94.3Very high94.4Very high76 Ų7652.3 Ų52.341%0.40630%0.297SS..  trans-144118.9-178.2-175-19.5000111.8A171 D172 S177 L178A171-N175 PolarHBondContact O-N 3.32Å; D172-N175 CarbonylContact O-C 3.5Å; N175-S177 PolarHBondContact ND2-OG 3.01Å; N175-S177 PolarHBondContact O-N 3.5Å; N175-S177 WeakPolarHBondContact OD1-CB 3.46Å; N175-S177 PolarHBondContact OD1-N 2.98Å; N175-S177 PolarHBondContact OD1-OG 3.41Å; N175-L178 HydrophobicContact CB-CD1 3.91Å; N175-L178 HydrophobicContact CB-CG 4.16Å; N175-L178 PolarHBondContact O-N 3.49Å
176A91.6Very high94.4Very high31 Ų3152.3 Ų52.326%0.25630%0.297SS..THydrogen-bonded Turntrans-65.1-23.2-175.200000114.9R91 K95 D172 L178R91-A176 VanDerWaalsContact NH2-CB 3.33Å; K95-A176 PolarHBondContact NZ-O 2.93Å; D172-A176 VanDerWaalsContact OD1-CA 3.24Å; D172-A176 WeakPolarHBondContact OD1-CA 3.35Å; A176-L178 PolarHBondContact O-N 3.3Å
177S93.4Very high94.3Very high69 Ų6955.4 Ų55.448%0.48331%0.311SS..THydrogen-bonded Turntrans-75.8-12.6-176.565.30000113N175N175-S177 PolarHBondContact ND2-OG 3.01Å; N175-S177 PolarHBondContact O-N 3.5Å; N175-S177 WeakPolarHBondContact OD1-CB 3.46Å; N175-S177 PolarHBondContact OD1-N 2.98Å; N175-S177 PolarHBondContact OD1-OG 3.41Å
178L92.6Very high94.3Very high63 Ų6360.8 Ų60.833%0.3332%0.324SS..SBendtrans-84.1-29.2-176-65.5175.4000113.3A171 N175 A176 V180 K181 I182A171-L178 HydrophobicContact CB-CD1 4.43Å; N175-L178 HydrophobicContact CB-CD1 3.91Å; N175-L178 HydrophobicContact CB-CG 4.16Å; N175-L178 PolarHBondContact O-N 3.49Å; A176-L178 PolarHBondContact O-N 3.3Å; L178-V180 PolarHBondContact O-N 2.91Å; L178-K181 WeakPolarHBondContact O-CB 3.14Å; L178-K181 PolarHBondContact O-N 3.11Å; L178-I182 HydrophobicContact CB-CD1 4.35Å; L178-I182 PolarHBondContact O-N 3.38Å; L178-I182 VanDerWaalsContact O-N 3.12Å
179F90.7Very high94.2Very high10 Ų1061.1 Ų61.14%0.04433%0.327CS..Hα-helixtrans-53.7-49.2-174.5176.2-100.4000113.6K95 N96 V98 A168 D172 K181 I182 L183K95-F179 HydrophobicContact CD-CD1 4.15Å; K95-F179 HydrophobicContact CD-CG 4.34Å; K95-F179 HydrophobicContact CG-CD1 4Å; K95-F179 HydrophobicContact CG-CE1 3.94Å; K95-F179 HydrophobicContact CG-CG 4.44Å; K95-F179 HydrophobicContact CG-CZ 4.38Å; K95-F179 WeakPolarHBondContact O-CZ 3.37Å; N96-F179 HydrophobicContact CB-CE2 4.36Å; N96-F179 VanDerWaalsContact ND2-CD2 3.33Å; N96-F179 WeakPolarHBondContact ND2-CD2 3.44Å; N96-F179 VanDerWaalsContact ND2-CE2 3.29Å; N96-F179 WeakPolarHBondContact ND2-CE2 3.28Å; V98-F179 HydrophobicContact CB-CZ 4.45Å; A168-F179 HydrophobicContact CB-CD2 4.47Å; D172-F179 HydrophobicContact CB-CB 4.15Å; D172-F179 VanDerWaalsContact OD1-CB 3.27Å; D172-F179 WeakPolarHBondContact OD1-CB 3.33Å; F179-K181 PolarHBondContact O-N 2.93Å; F179-I182 PolarHBondContact O-N 3.47Å; F179-I182 VanDerWaalsContact O-N 3.14Å; F179-L183 HydrophobicContact CE1-CD1 4.43Å; F179-L183 HydrophobicContact CE1-CD2 4.35Å; F179-L183 HydrophobicContact CZ-CD1 4.1Å; F179-L183 WeakPolarHBondContact O-CB 3.36Å; F179-L183 PolarHBondContact O-N 3.29Å
180V92.4Very high94.2Very high96 Ų9661.9 Ų61.958%0.58233%0.333SS*.Hα-helixtrans-62.9-30.9-177.4-178.20000111.6L178L178-V180 PolarHBondContact O-N 2.91Å
181K94.3Very high94.2Very high144 Ų14459 Ų5963%0.62632%0.322SS*.Hα-helixtrans-73.1-39.8177.7-59.3-178.8-178.1-179.60111.5L178 F179L178-K181 WeakPolarHBondContact O-CB 3.14Å; L178-K181 PolarHBondContact O-N 3.11Å; F179-K181 PolarHBondContact O-N 2.93Å
182I94.2Very high94.2Very high44 Ų4461.3 Ų61.323%0.22633%0.33CS..Hα-helixtrans-74.8-31.4179.4-58.3169.7000110.9V164 A168 A171 L178 F179 I184 V185 E186V164-I182 HydrophobicContact CG1-CG2 4.14Å; A168-I182 HydrophobicContact CB-CB 4.19Å; A168-I182 HydrophobicContact CB-CG2 3.63Å; A171-I182 HydrophobicContact CB-CD1 3.57Å; L178-I182 HydrophobicContact CB-CD1 4.35Å; L178-I182 PolarHBondContact O-N 3.38Å; L178-I182 VanDerWaalsContact O-N 3.12Å; F179-I182 PolarHBondContact O-N 3.47Å; F179-I182 VanDerWaalsContact O-N 3.14Å; I182-I184 PolarHBondContact O-N 3.32Å; I182-I184 VanDerWaalsContact O-N 3.12Å; I182-V185 WeakPolarHBondContact O-CA 3.43Å; I182-V185 VanDerWaalsContact O-CB 3.31Å; I182-V185 WeakPolarHBondContact O-CB 3.32Å; I182-V185 PolarHBondContact O-N 2.95Å; I182-E186 PolarHBondContact O-N 3.46Å
183L93.5Very high94.2Very high34 Ų3461.2 Ų61.218%0.17833%0.329CS..Hα-helixtrans-54.8-32.5176.9-169.568.6000113V98 F102 F179 V185 E186 I187V98-L183 HydrophobicContact CG1-CD1 4.02Å; F102-L183 HydrophobicContact CE2-CD1 3.84Å; F179-L183 HydrophobicContact CE1-CD1 4.43Å; F179-L183 HydrophobicContact CE1-CD2 4.35Å; F179-L183 HydrophobicContact CZ-CD1 4.1Å; F179-L183 WeakPolarHBondContact O-CB 3.36Å; F179-L183 PolarHBondContact O-N 3.29Å; L183-V185 PolarHBondContact O-N 3.23Å; L183-E186 WeakPolarHBondContact O-CB 3.5Å; L183-E186 PolarHBondContact O-N 3.32Å; L183-E186 VanDerWaalsContact O-N 3.15Å; L183-I187 WeakPolarHBondContact O-CG1 3.44Å; L183-I187 PolarHBondContact O-N 3.03Å
184I95.4Very high94.3Very high93 Ų9363.7 Ų63.748%0.47734%0.339SS..Hα-helixtrans-60-36.9176.3-60.1173000110.9I182 I187 F188I182-I184 PolarHBondContact O-N 3.32Å; I182-I184 VanDerWaalsContact O-N 3.12Å; I184-I187 PolarHBondContact O-N 2.98Å; I184-F188 HydrophobicContact CG2-CD2 4.01Å; I184-F188 HydrophobicContact CG2-CE2 3.61Å; I184-F188 WeakPolarHBondContact O-CD2 3.38Å; I184-F188 PolarHBondContact O-N 2.82Å
185V96Very high94.4Very high79 Ų7962 Ų6248%0.47933%0.33SS..Hα-helixtrans-69.7-38.1177.6-1730000110.8V164 I182 L183 I187 F188 G189V164-V185 HydrophobicContact CG1-CB 4.04Å; V164-V185 HydrophobicContact CG1-CG1 3.95Å; V164-V185 HydrophobicContact CG2-CG1 4.21Å; I182-V185 WeakPolarHBondContact O-CA 3.43Å; I182-V185 VanDerWaalsContact O-CB 3.31Å; I182-V185 WeakPolarHBondContact O-CB 3.32Å; I182-V185 PolarHBondContact O-N 2.95Å; L183-V185 PolarHBondContact O-N 3.23Å; V185-I187 VanDerWaalsContact C-N 3.3Å; V185-I187 PolarHBondContact O-N 3.27Å; V185-F188 PolarHBondContact O-N 2.98Å; V185-G189 PolarHBondContact O-N 2.76Å
186E94.8Very high94.5Very high0 Ų058.6 Ų58.60%031%0.312CS..Hα-helixtrans-61.6-39.7174.2-66.3-179.8-155.300111.6S99 F102 V164 G165 A168 I182 L183 G189 S190S99-E186 WeakPolarHBondContact CA-OE2 3.25Å; S99-E186 VanDerWaalsContact CB-OE2 3.3Å; S99-E186 WeakPolarHBondContact CB-OE2 3.16Å; S99-E186 VanDerWaalsContact OG-CD 3.24Å; S99-E186 PolarHBondContact OG-OE1 3.31Å; S99-E186 PolarHBondContact OG-OE2 3.4Å; F102-E186 HydrophobicContact CD2-CB 4.31Å; V164-E186 HydrophobicContact CB-CG 4.14Å; V164-E186 HydrophobicContact CG1-CG 3.53Å; G165-E186 WeakPolarHBondContact CA-OE1 3.49Å; A168-E186 VanDerWaalsContact CB-OE1 3.29Å; A168-E186 WeakPolarHBondContact CB-OE1 3.44Å; I182-E186 PolarHBondContact O-N 3.46Å; L183-E186 WeakPolarHBondContact O-CB 3.5Å; L183-E186 PolarHBondContact O-N 3.32Å; L183-E186 VanDerWaalsContact O-N 3.15Å; E186-G189 PolarHBondContact O-N 3.29Å; E186-S190 PolarHBondContact O-N 3.38Å
187I95.8Very high94.7Very high85 Ų8558.1 Ų58.144%0.43631%0.306SS..Hα-helixtrans-62.2-46.9176.9-65.5167.8000110.5F102 L183 I184 V185 G189 S190 A191F102-I187 HydrophobicContact CE2-CG1 4.49Å; F102-I187 HydrophobicContact CZ-CG1 4.15Å; L183-I187 WeakPolarHBondContact O-CG1 3.44Å; L183-I187 PolarHBondContact O-N 3.03Å; I184-I187 PolarHBondContact O-N 2.98Å; V185-I187 VanDerWaalsContact C-N 3.3Å; V185-I187 PolarHBondContact O-N 3.27Å; I187-G189 VanDerWaalsContact C-N 3.31Å; I187-G189 PolarHBondContact O-N 2.96Å; I187-S190 PolarHBondContact O-N 3.19Å; I187-S190 PolarHBondContact O-OG 3.03Å; I187-A191 PolarHBondContact O-N 3.45Å; I187-A191 VanDerWaalsContact O-N 3.16Å
188F95.7Very high94.9Very high150 Ų15059.2 Ų59.266%0.65831%0.306SS*.Hα-helixtrans-63.6-36.1175.7-73.5-59.9000112.8I184 V185 A191I184-F188 HydrophobicContact CG2-CD2 4.01Å; I184-F188 HydrophobicContact CG2-CE2 3.61Å; I184-F188 WeakPolarHBondContact O-CD2 3.38Å; I184-F188 PolarHBondContact O-N 2.82Å; V185-F188 PolarHBondContact O-N 2.98Å; F188-A191 WeakPolarHBondContact O-CB 3.42Å; F188-A191 PolarHBondContact O-N 2.86Å
189G94.4Very high95.2Very high7 Ų759.3 Ų59.37%0.07231%0.309CS..Hα-helixtrans-60.4-46.5172.200000111.9C157 V185 E186 I187 A191 I192C157-G189 PolarHBondContact SG-O 2.77Å; C157-G189 VanDerWaalsContact SG-O 3.34Å; V185-G189 PolarHBondContact O-N 2.76Å; E186-G189 PolarHBondContact O-N 3.29Å; I187-G189 VanDerWaalsContact C-N 3.31Å; I187-G189 PolarHBondContact O-N 2.96Å; G189-A191 VanDerWaalsContact C-N 3.26Å; G189-A191 PolarHBondContact O-N 2.96Å; G189-I192 WeakPolarHBondContact O-CB 3.4Å; G189-I192 WeakPolarHBondContact O-CG1 3.35Å; G189-I192 PolarHBondContact O-N 3.47Å
190S94.1Very high95.5Very high16 Ų1658.8 Ų58.811%0.11231%0.307CS..Hα-helixtrans-65.4-26.1-178.774.10000113.8E186 I187 I192 G193E186-S190 PolarHBondContact O-N 3.38Å; I187-S190 PolarHBondContact O-N 3.19Å; I187-S190 PolarHBondContact O-OG 3.03Å; S190-I192 PolarHBondContact O-N 2.59Å; S190-G193 PolarHBondContact O-N 3.29Å
191A95.6Very high95.7Very high27 Ų2758.1 Ų58.122%0.22330%0.299CS..Hα-helixtrans-62-26.117700000113.1I187 F188 G189 G193 L194 F195I187-A191 PolarHBondContact O-N 3.45Å; I187-A191 VanDerWaalsContact O-N 3.16Å; F188-A191 WeakPolarHBondContact O-CB 3.42Å; F188-A191 PolarHBondContact O-N 2.86Å; G189-A191 VanDerWaalsContact C-N 3.26Å; G189-A191 PolarHBondContact O-N 2.96Å; A191-G193 VanDerWaalsContact C-N 3.3Å; A191-G193 PolarHBondContact O-N 3.01Å; A191-L194 PolarHBondContact O-N 2.98Å; A191-F195 WeakPolarHBondContact O-CG 3.48Å; A191-F195 PolarHBondContact O-N 3.38Å
192I95.8Very high95.8Very high71 Ų7156.7 Ų56.736%0.36430%0.297SS..Hα-helixtrans-60.2-41.9176.9-58.1170.4000110.5S153 C157 G189 S190 L194 F195 G196S153-I192 PolarHBondContact OG-O 3.03Å; C157-I192 HydrophobicContact CB-CB 4.26Å; C157-I192 HydrophobicContact CB-CG2 4.42Å; G189-I192 WeakPolarHBondContact O-CB 3.4Å; G189-I192 WeakPolarHBondContact O-CG1 3.35Å; G189-I192 PolarHBondContact O-N 3.47Å; S190-I192 PolarHBondContact O-N 2.59Å; I192-L194 PolarHBondContact O-N 3.47Å; I192-F195 PolarHBondContact O-N 3.05Å; I192-G196 PolarHBondContact O-N 3.23Å
193G94.3Very high95.8Very high0 Ų058.1 Ų58.10%030%0.303CS..Hα-helixtrans-61.5-43.517700000112.1N154 C157 S190 A191 F195 G196 V197N154-G193 WeakPolarHBondContact OD1-CA 3.48Å; C157-G193 PolarHBondContact SG-N 2.96Å; S190-G193 PolarHBondContact O-N 3.29Å; A191-G193 VanDerWaalsContact C-N 3.3Å; A191-G193 PolarHBondContact O-N 3.01Å; G193-F195 PolarHBondContact O-N 3.32Å; G193-G196 PolarHBondContact O-N 3.39Å; G193-V197 PolarHBondContact O-N 2.97Å; G193-V197 VanDerWaalsContact O-N 3.13Å
194L95.6Very high95.9Very high73 Ų7356.6 Ų56.638%0.38230%0.295SS..Hα-helixtrans-63.1-38.8177.5-69.9174000112.7Y109 A191 I192 G196 V197 I198Y109-L194 HydrophobicContact CD1-CD2 4.48Å; Y109-L194 HydrophobicContact CE1-CD2 3.87Å; Y109-L194 HydrophobicContact CE2-CD2 3.92Å; Y109-L194 HydrophobicContact CE2-CG 4.12Å; A191-L194 PolarHBondContact O-N 2.98Å; I192-L194 PolarHBondContact O-N 3.47Å; L194-G196 VanDerWaalsContact C-N 3.32Å; L194-G196 PolarHBondContact O-N 3.23Å; L194-V197 PolarHBondContact O-N 3.33Å; L194-I198 WeakPolarHBondContact O-CG1 3.29Å; L194-I198 PolarHBondContact O-N 3.37Å
195F97.1Very high95.8Very high134 Ų13455.6 Ų55.659%0.58830%0.297SS*.Hα-helixtrans-61.8-40.8174.5-65.6-25.7000112.2A191 I192 G193 V197 I198 V199A191-F195 WeakPolarHBondContact O-CG 3.48Å; A191-F195 PolarHBondContact O-N 3.38Å; I192-F195 PolarHBondContact O-N 3.05Å; G193-F195 PolarHBondContact O-N 3.32Å; F195-V197 VanDerWaalsContact C-N 3.34Å; F195-V197 PolarHBondContact O-N 3.21Å; F195-I198 HydrophobicContact CD1-CD1 4.42Å; F195-I198 PolarHBondContact O-N 3.44Å; F195-V199 WeakPolarHBondContact O-CG2 3.46Å; F195-V199 PolarHBondContact O-N 3.45Å; F195-V199 VanDerWaalsContact O-N 3.07Å
196G96.7Very high95.4Very high4 Ų461.4 Ų61.44%0.04132%0.315CS..Hα-helixtrans-58.9-43.417400000112.8I192 G193 L194 V199 A200I192-G196 PolarHBondContact O-N 3.23Å; G193-G196 PolarHBondContact O-N 3.39Å; L194-G196 VanDerWaalsContact C-N 3.32Å; L194-G196 PolarHBondContact O-N 3.23Å; G196-V199 PolarHBondContact O-N 3.44Å; G196-A200 WeakPolarHBondContact O-CB 3.28Å; G196-A200 PolarHBondContact O-N 3.22Å
197V97.3Very high95.2Very high22 Ų2262.4 Ų62.413%0.13332%0.322CS..Hα-helixtrans-62.2-47.3176.3173.40000111.6Y109 M113 V150 G193 L194 F195 V199 A200 I201Y109-V197 HydrophobicContact CG-CG2 4.21Å; M113-V197 HydrophobicContact CG-CG1 4.07Å; M113-V197 HydrophobicContact CG-CG2 4.18Å; M113-V197 HydrophobicContact SD-CG1 3.87Å; V150-V197 HydrophobicContact CG2-CG2 4.07Å; G193-V197 PolarHBondContact O-N 2.97Å; G193-V197 VanDerWaalsContact O-N 3.13Å; L194-V197 PolarHBondContact O-N 3.33Å; F195-V197 VanDerWaalsContact C-N 3.34Å; F195-V197 PolarHBondContact O-N 3.21Å; V197-V199 VanDerWaalsContact C-N 3.34Å; V197-V199 PolarHBondContact O-N 3.3Å; V197-A200 PolarHBondContact O-N 2.96Å; V197-I201 HydrophobicContact CG1-CD1 3.84Å; V197-I201 HydrophobicContact CG1-CG1 4.48Å; V197-I201 WeakPolarHBondContact O-CG1 3.32Å; V197-I201 PolarHBondContact O-N 2.91Å
198I97.6Very high94.7Very high91 Ų9164.1 Ų64.147%0.46733%0.326SS..Hα-helixtrans-58.5-47.4179.7-68.2164.5000110.6L194 F195 A200 I201 L202L194-I198 WeakPolarHBondContact O-CG1 3.29Å; L194-I198 PolarHBondContact O-N 3.37Å; F195-I198 HydrophobicContact CD1-CD1 4.42Å; F195-I198 PolarHBondContact O-N 3.44Å; I198-A200 PolarHBondContact O-N 3.5Å; I198-I201 PolarHBondContact O-N 2.79Å; I198-L202 HydrophobicContact CG2-CD1 4.17Å; I198-L202 WeakPolarHBondContact O-CG 3.38Å; I198-L202 PolarHBondContact O-N 3.24Å
199V97.8Very high94.3Very high65 Ų6557 Ų5739%0.39430%0.295SS..Hα-helixtrans-63.8-42.7179.6175.50000111.1T149 F195 G196 V197 I201 L202 Q203T149-V199 HydrophobicContact CG2-CB 4.2Å; T149-V199 HydrophobicContact CG2-CG1 3.96Å; F195-V199 WeakPolarHBondContact O-CG2 3.46Å; F195-V199 PolarHBondContact O-N 3.45Å; F195-V199 VanDerWaalsContact O-N 3.07Å; G196-V199 PolarHBondContact O-N 3.44Å; V197-V199 VanDerWaalsContact C-N 3.34Å; V197-V199 PolarHBondContact O-N 3.3Å; V199-I201 PolarHBondContact O-N 3.13Å; V199-L202 PolarHBondContact O-N 3.11Å; V199-Q203 HydrophobicContact CG1-CG 4.41Å; V199-Q203 WeakPolarHBondContact O-CG 3.29Å; V199-Q203 PolarHBondContact O-N 2.8Å
200A96.9Very high93.9Very high0 Ų056.8 Ų56.80%029%0.292CS..Hα-helixtrans-61.7-41.6178.300000112.2M113 A146 V150 G196 V197 I198 Q203 T204M113-A200 HydrophobicContact CE-CB 3.83Å; A146-A200 HydrophobicContact CB-CB 4.12Å; V150-A200 HydrophobicContact CB-CB 4.17Å; G196-A200 WeakPolarHBondContact O-CB 3.28Å; G196-A200 PolarHBondContact O-N 3.22Å; V197-A200 PolarHBondContact O-N 2.96Å; I198-A200 PolarHBondContact O-N 3.5Å; A200-Q203 PolarHBondContact O-N 3.05Å; A200-T204 PolarHBondContact O-N 2.98Å; A200-T204 PolarHBondContact O-OG1 3.05Å
201I96.5Very high93Very high81 Ų8161.9 Ų61.942%0.41532%0.318SS..Hα-helixtrans-63.3-42.1174.5-67.2169.2000111M113 V197 I198 V199 Q203 T204 S205M113-I201 HydrophobicContact CE-CG1 3.76Å; M113-I201 HydrophobicContact SD-CD1 4.08Å; M113-I201 HydrophobicContact SD-CG1 3.67Å; V197-I201 HydrophobicContact CG1-CD1 3.84Å; V197-I201 HydrophobicContact CG1-CG1 4.48Å; V197-I201 WeakPolarHBondContact O-CG1 3.32Å; V197-I201 PolarHBondContact O-N 2.91Å; I198-I201 PolarHBondContact O-N 2.79Å; V199-I201 PolarHBondContact O-N 3.13Å; I201-Q203 VanDerWaalsContact C-N 3.34Å; I201-Q203 PolarHBondContact O-N 3.29Å; I201-T204 PolarHBondContact O-N 2.91Å; I201-T204 PolarHBondContact O-OG1 3.26Å; I201-S205 WeakPolarHBondContact O-CB 3.44Å; I201-S205 PolarHBondContact O-N 3.49Å
202L96.6Very high92.9Very high115 Ų11563.7 Ų63.760%0.60232%0.323SS*.Hα-helixtrans-63.8-40.3178.6-72.4174.4000112I198 V199 T204 S205I198-L202 HydrophobicContact CG2-CD1 4.17Å; I198-L202 WeakPolarHBondContact O-CG 3.38Å; I198-L202 PolarHBondContact O-N 3.24Å; V199-L202 PolarHBondContact O-N 3.11Å; L202-T204 VanDerWaalsContact C-N 3.32Å; L202-T204 PolarHBondContact O-N 3.08Å; L202-S205 PolarHBondContact O-N 3.09Å; L202-S205 PolarHBondContact O-OG 3.07Å
203Q95.1Very high92.8Very high73 Ų7363.3 Ų63.334%0.34132%0.321SS..Hα-helixtrans-61.3-39.4176.9-72.9174.62.300112S142 G145 A146 V199 A200 I201S142-Q203 PolarHBondContact OG-O 3.39Å; G145-Q203 VanDerWaalsContact C-OE1 3.27Å; G145-Q203 PolarHBondContact O-OE1 2.95Å; A146-Q203 HydrophobicContact CB-CB 4.36Å; A146-Q203 VanDerWaalsContact N-OE1 3.08Å; V199-Q203 HydrophobicContact CG1-CG 4.41Å; V199-Q203 WeakPolarHBondContact O-CG 3.29Å; V199-Q203 PolarHBondContact O-N 2.8Å; A200-Q203 PolarHBondContact O-N 3.05Å; I201-Q203 VanDerWaalsContact C-N 3.34Å; I201-Q203 PolarHBondContact O-N 3.29Å
204T94.6Very high92.7Very high2 Ų266.8 Ų66.81%0.01234%0.339CS..Hα-helixtrans-93.9-6-177.562.20000114.6I117 M120 A146 A200 I201 L202 K206 V207I117-T204 HydrophobicContact CG1-CG2 4.48Å; M120-T204 WeakPolarHBondContact CE-O 3.39Å; M120-T204 HydrophobicContact SD-CG2 4.41Å; A146-T204 HydrophobicContact CB-CG2 3.51Å; A200-T204 PolarHBondContact O-N 2.98Å; A200-T204 PolarHBondContact O-OG1 3.05Å; I201-T204 PolarHBondContact O-N 2.91Å; I201-T204 PolarHBondContact O-OG1 3.26Å; L202-T204 VanDerWaalsContact C-N 3.32Å; L202-T204 PolarHBondContact O-N 3.08Å; T204-K206 PolarHBondContact O-N 2.67Å; T204-K206 VanDerWaalsContact O-N 3.09Å; T204-V207 WeakPolarHBondContact O-CB 3.42Å; T204-V207 PolarHBondContact O-N 3.06Å; T204-V207 VanDerWaalsContact O-N 3.08Å
205S92.6Very high92.5Very high73 Ų7366.4 Ų66.451%0.5134%0.336SS..THydrogen-bonded Turntrans-57.2-29-174.663.20000115.8I201 L202I201-S205 WeakPolarHBondContact O-CB 3.44Å; I201-S205 PolarHBondContact O-N 3.49Å; L202-S205 PolarHBondContact O-N 3.09Å; L202-S205 PolarHBondContact O-OG 3.07Å
206K89.2Confident92.2Very high201 Ų20162.2 Ų62.287%0.87432%0.32SS*.THydrogen-bonded Turntrans-113.618.5-178.6-63.1-178.8-178.4178.60112.7T204T204-K206 PolarHBondContact O-N 2.67Å; T204-K206 VanDerWaalsContact O-N 3.09Å
207V90.6Very high91.9Very high21 Ų2166.1 Ų66.113%0.12734%0.339CS..  trans-105.9130.1-173.41750000109.6A139 M143 T204A139-V207 HydrophobicContact CB-CG1 3.46Å; A139-V207 VanDerWaalsContact CB-CG1 3.46Å; M143-V207 HydrophobicContact CE-CG1 4.23Å; T204-V207 WeakPolarHBondContact O-CB 3.42Å; T204-V207 PolarHBondContact O-N 3.06Å; T204-V207 VanDerWaalsContact O-N 3.08Å
208K83.8Confident91.5Very high121 Ų12169.2 Ų69.253%0.52635%0.354SS..  trans-136.5123.4168.4-170.8177.4-179.9-170.80108.9E122E122-K208 WeakPolarHBondContact OE1-CE 3.32Å; E122-K208 IonicContact OE1-NZ 3.93Å; E122-K208 WeakPolarHBondContact OE2-CE 3.3Å; E122-K208 IonicContact OE2-NZ 3.87Å
209M87.6Confident91.1Very high0 Ų067.5 Ų67.50%035%0.345CS..  trans-95.7145.9171.5-166.4171.9-175.500108.2P52 F53 A56 M120 A121 E122 F124 A139 M143P52-M209 HydrophobicContact CB-CE 4.05Å; F53-M209 HydrophobicContact CD1-CE 3.4Å; F53-M209 HydrophobicContact CE1-CE 3.43Å; F53-M209 VanDerWaalsContact CE1-CE 3.43Å; F53-M209 HydrophobicContact CE1-SD 4.49Å; F53-M209 HydrophobicContact CG-CE 3.97Å; F53-M209 HydrophobicContact CZ-CE 4.03Å; A56-M209 HydrophobicContact CB-SD 4.31Å; M120-M209 WeakPolarHBondContact O-CB 3.44Å; A121-M209 HydrophobicContact CB-SD 4.3Å; E122-M209 VanDerWaalsContact CB-O 3.26Å; E122-M209 WeakPolarHBondContact CB-O 3.26Å; E122-M209 WeakPolarHBondContact CG-O 3.45Å; F124-M209 HydrophobicContact CD1-CE 4.12Å; F124-M209 HydrophobicContact CD1-CG 4.38Å; F124-M209 HydrophobicContact CE1-CE 3.53Å; A139-M209 HydrophobicContact CB-CB 3.89Å; A139-M209 HydrophobicContact CB-CG 4.29Å; M143-M209 HydrophobicContact CE-CB 3.75Å; M143-M209 HydrophobicContact CE-SD 4.11Å; M143-M209 HydrophobicContact SD-SD 4.1Å
210G86.4Confident90.5Very high2 Ų267.8 Ų67.82%0.02134%0.341CS..  trans132.7-176.8-177.700000112.2R135 N136R135-G210 PolarHBondContact NH2-O 2.89Å; N136-G210 PolarHBondContact ND2-O 3.09Å; N136-G210 PolarHBondContact OD1-N 2.94Å; N136-G210 PolarHBondContact OD1-O 2.69Å; N136-G210 VanDerWaalsContact OD1-O 3.05Å
211D76.1Confident89.9Confident124 Ų12473.9 Ų73.966%0.66337%0.372SS*.  trans-88.80173.3-71.8-29.1000111.7F124 T125 R135F124-D211 WeakPolarHBondContact CB-OD1 3.38Å; T125-D211 PolarHBondContact N-OD2 3.45Å; T125-D211 VanDerWaalsContact N-OD2 3.09Å; T125-D211 PolarHBondContact OG1-OD2 3.17Å; R135-D211 PolarHBondContact NH2-OXT 3.44Å

Retrieved 211 of 211 residues in 157.5 ms (Link to these results)