A0A3Q0KVD7_SCHMA Loading...

Cytochrome c oxidase subunit 1

Component of the cytochrome c oxidase, the last enzyme in the mitochondrial electron transport chain which drives oxidative phosphorylation. The respiratory chain contains 3 multisubunit complexes succinate dehydrogenase (complex II, CII), ubiquinol-cytochrome c oxidoreductase (cytochrome b-c1 complex, complex III, CIII) and cytochrome c oxidase (complex IV, CIV), that cooperate to transfer electrons derived from NADH and succinate to molecular oxygen, creating an electrochemical gradient over the inner membrane that drives transmembrane transport and the ATP synthase. Cytochrome c oxidase is the component of the respiratory chain that catalyzes the reduction of oxygen to water. Electrons originating from reduced cytochrome c in the intermembrane space (IMS) are transferred via the dinuclear copper A center (CU(A)) of subunit 2 and heme A of subunit 1 to the active site in subunit 1, a binuclear center (BNC) formed by heme A3 and copper B (CU(B)). The BNC reduces molecular oxygen to 2 water molecules using 4 electrons from cytochrome c in the IMS and 4 protons from the mitochondrial matrix.

AlphaFold DB , UniProt , Accession A0A3Q0KVD7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 576 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
1M38.4Very low46.1Very low174 Ų174118.1 Ų118.186%0.85759%0.587SS**  0-59.50-147.5169.659.100113.3L3 I4 K5M1-L3 PolarHBondContact O-N 3.33Å; M1-I4 PolarHBondContact O-N 2.88Å; M1-K5 WeakPolarHBondContact O-CG 3.4Å; M1-K5 PolarHBondContact O-N 3.43Å
2K45.9Very low45.9Very low187 Ų187115.9 Ų115.981%0.81358%0.578SS**Hα-helixtrans-56.9-41.3175.3-77.8-176.4177.7178.60113.8K5 K6K2-K5 PolarHBondContact O-N 3.32Å; K2-K6 PolarHBondContact O-N 2.92Å
3L46.4Very low45.9Very low119 Ų119110.2 Ų110.262%0.62357%0.566SS**Hα-helixtrans-67.1-42.9177-174.465.7000112.7M1 K6 I7M1-L3 PolarHBondContact O-N 3.33Å; L3-K6 CarbonylContact O-C 3.59Å; L3-K6 WeakPolarHBondContact O-CB 3.5Å; L3-K6 PolarHBondContact O-N 2.81Å; L3-K6 VanDerWaalsContact O-N 3.16Å; L3-I7 HydrophobicContact CG-CD1 4.14Å; L3-I7 WeakPolarHBondContact O-CG1 3.18Å; L3-I7 PolarHBondContact O-N 2.87Å
4I41.7Very low45.8Very low98 Ų98114.2 Ų114.250%0.50357%0.571SS.*Hα-helixtrans-62.6-44.2174.1-64.4170.6000110.1M1 K6 I7 M8M1-I4 PolarHBondContact O-N 2.88Å; I4-K6 VanDerWaalsContact C-N 3.29Å; I4-K6 PolarHBondContact O-N 2.83Å; I4-I7 PolarHBondContact O-N 3.24Å; I4-M8 HydrophobicContact CG2-CG 4.26Å; I4-M8 HydrophobicContact CG2-SD 3.96Å; I4-M8 WeakPolarHBondContact O-CB 3.33Å; I4-M8 VanDerWaalsContact O-CG 3.26Å; I4-M8 WeakPolarHBondContact O-CG 3.36Å; I4-M8 PolarHBondContact O-N 2.97Å
5K45.7Very low45.4Very low138 Ų138109.4 Ų109.460%0.655%0.552SS**Hα-helixtrans-59.5-37.8173-75.2-172.5175.7-170.90112.2M1 K2 S9M1-K5 WeakPolarHBondContact O-CG 3.4Å; M1-K5 PolarHBondContact O-N 3.43Å; K2-K5 PolarHBondContact O-N 3.32Å; K5-S9 VanDerWaalsContact O-CB 3.26Å; K5-S9 WeakPolarHBondContact O-CB 3.41Å; K5-S9 PolarHBondContact O-N 3.31Å
6K51.7Low45.4Very low146 Ų146109.9 Ų109.964%0.63555%0.554SS**Hα-helixtrans-68.1-44.4174-95.5-173.8173.2-173.20112.6K2 L3 I4 S9 V10K2-K6 PolarHBondContact O-N 2.92Å; L3-K6 CarbonylContact O-C 3.59Å; L3-K6 WeakPolarHBondContact O-CB 3.5Å; L3-K6 PolarHBondContact O-N 2.81Å; L3-K6 VanDerWaalsContact O-N 3.16Å; I4-K6 VanDerWaalsContact C-N 3.29Å; I4-K6 PolarHBondContact O-N 2.83Å; K6-S9 PolarHBondContact O-N 2.99Å; K6-S9 PolarHBondContact O-OG 3.48Å; K6-S9 VanDerWaalsContact O-OG 3.1Å; K6-V10 WeakPolarHBondContact O-CB 3.25Å; K6-V10 VanDerWaalsContact O-CG2 3.23Å; K6-V10 WeakPolarHBondContact O-CG2 3.47Å; K6-V10 PolarHBondContact O-N 3.3Å
7I48.4Very low45.8Very low78 Ų78110.1 Ų110.140%0.455%0.55SS.*Hα-helixtrans-63.1-46.8176.3-68.6167.7000109.3L3 I4 S9 V10 I11L3-I7 HydrophobicContact CG-CD1 4.14Å; L3-I7 WeakPolarHBondContact O-CG1 3.18Å; L3-I7 PolarHBondContact O-N 2.87Å; I4-I7 PolarHBondContact O-N 3.24Å; I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 2.79Å; I7-V10 PolarHBondContact O-N 3.4Å; I7-I11 HydrophobicContact CG2-CD1 3.71Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CB 3.5Å; I7-I11 VanDerWaalsContact O-CG1 3.23Å; I7-I11 WeakPolarHBondContact O-CG1 3.42Å; I7-I11 PolarHBondContact O-N 3Å
8M44.8Very low45.6Very low107 Ų107109.3 Ų109.353%0.52755%0.546SS..Hα-helixtrans-60.5-39.8173.4-70.6-179.875.900111.9I4 L12I4-M8 HydrophobicContact CG2-CG 4.26Å; I4-M8 HydrophobicContact CG2-SD 3.96Å; I4-M8 WeakPolarHBondContact O-CB 3.33Å; I4-M8 VanDerWaalsContact O-CG 3.26Å; I4-M8 WeakPolarHBondContact O-CG 3.36Å; I4-M8 PolarHBondContact O-N 2.97Å; M8-L12 WeakPolarHBondContact O-CB 2.82Å; M8-L12 WeakPolarHBondContact O-CD1 3.27Å; M8-L12 VanDerWaalsContact O-CG 3.32Å; M8-L12 WeakPolarHBondContact O-CG 3.38Å; M8-L12 PolarHBondContact O-N 3.38Å
9S49.2Very low45.5Very low66 Ų66107.3 Ų107.346%0.46254%0.54SS..Hα-helixtrans-72.4-31.8177.984.30000112.9K5 K6 I7 G13K5-S9 VanDerWaalsContact O-CB 3.26Å; K5-S9 WeakPolarHBondContact O-CB 3.41Å; K5-S9 PolarHBondContact O-N 3.31Å; K6-S9 PolarHBondContact O-N 2.99Å; K6-S9 PolarHBondContact O-OG 3.48Å; K6-S9 VanDerWaalsContact O-OG 3.1Å; I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 2.79Å; S9-G13 WeakPolarHBondContact O-CA 3.23Å; S9-G13 PolarHBondContact O-N 3.06Å
10V51.5Low45.7Very low92 Ų92104.7 Ų104.756%0.55853%0.53SS*.Hα-helixtrans-70.7-44.9174169.30000109.7K6 I7 G13 W14K6-V10 WeakPolarHBondContact O-CB 3.25Å; K6-V10 VanDerWaalsContact O-CG2 3.23Å; K6-V10 WeakPolarHBondContact O-CG2 3.47Å; K6-V10 PolarHBondContact O-N 3.3Å; I7-V10 PolarHBondContact O-N 3.4Å; V10-G13 PolarHBondContact O-N 3.29Å; V10-W14 WeakPolarHBondContact O-CB 3.5Å; V10-W14 PolarHBondContact O-N 3.45Å
11I43.2Very low45.9Very low94 Ų94102.9 Ų102.948%0.48252%0.52SS..Hα-helixtrans-60.3-50.9173-67167.7000109.6I7 G13 W14 C15I7-I11 HydrophobicContact CG2-CD1 3.71Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CB 3.5Å; I7-I11 VanDerWaalsContact O-CG1 3.23Å; I7-I11 WeakPolarHBondContact O-CG1 3.42Å; I7-I11 PolarHBondContact O-N 3Å; I11-G13 VanDerWaalsContact C-N 3.31Å; I11-G13 PolarHBondContact O-N 3.41Å; I11-W14 PolarHBondContact O-N 3.04Å; I11-C15 VanDerWaalsContact O-CB 3.3Å; I11-C15 WeakPolarHBondContact O-CB 3.28Å; I11-C15 PolarHBondContact O-N 3.04Å; I11-C15 PolarHBondContact O-SG 2.88Å
12L43.8Very low46.1Very low92 Ų9296.4 Ų96.448%0.48249%0.492SS..Hα-helixtrans-57.6-41.7174.5-85.6157.1000112.1M8 C15 M16M8-L12 WeakPolarHBondContact O-CB 2.82Å; M8-L12 WeakPolarHBondContact O-CD1 3.27Å; M8-L12 VanDerWaalsContact O-CG 3.32Å; M8-L12 WeakPolarHBondContact O-CG 3.38Å; M8-L12 PolarHBondContact O-N 3.38Å; L12-C15 PolarHBondContact O-N 3.5Å; L12-M16 VanDerWaalsContact O-CB 3.25Å; L12-M16 WeakPolarHBondContact O-CB 3.48Å; L12-M16 WeakPolarHBondContact O-CG 3.4Å; L12-M16 PolarHBondContact O-N 2.74Å
13G46.1Very low46.2Very low41 Ų4191.6 Ų91.642%0.42348%0.478SS..Hα-helixtrans-65.6-43.6178.900000112.4S9 V10 I11 F17S9-G13 WeakPolarHBondContact O-CA 3.23Å; S9-G13 PolarHBondContact O-N 3.06Å; V10-G13 PolarHBondContact O-N 3.29Å; I11-G13 VanDerWaalsContact C-N 3.31Å; I11-G13 PolarHBondContact O-N 3.41Å; G13-F17 VanDerWaalsContact O-CB 3.28Å; G13-F17 WeakPolarHBondContact O-CB 3.47Å; G13-F17 PolarHBondContact O-N 3.37Å
14W45.1Very low46.2Very low167 Ų16793.4 Ų93.463%0.63348%0.477SS*.Hα-helixtrans-65.7-41.4173.7-112.885.8000111.8V10 I11 F17 M18V10-W14 WeakPolarHBondContact O-CB 3.5Å; V10-W14 PolarHBondContact O-N 3.45Å; I11-W14 PolarHBondContact O-N 3.04Å; W14-F17 PolarHBondContact O-N 3.47Å; W14-M18 HydrophobicContact CE3-CE 4.33Å; W14-M18 HydrophobicContact CE3-CG 4.06Å; W14-M18 HydrophobicContact CZ3-CE 3.77Å; W14-M18 HydrophobicContact CZ3-CG 4.38Å; W14-M18 HydrophobicContact CZ3-SD 4.34Å; W14-M18 WeakPolarHBondContact O-CB 3.4Å; W14-M18 WeakPolarHBondContact O-CG 3.42Å; W14-M18 PolarHBondContact O-N 3.36Å
15C38.6Very low46.1Very low42 Ų4293.1 Ų93.128%0.28448%0.476SS..Hα-helixtrans-66.6-43.8176.6-68.60000111.8I11 L12 F17 M18 V19 W51I11-C15 VanDerWaalsContact O-CB 3.3Å; I11-C15 WeakPolarHBondContact O-CB 3.28Å; I11-C15 PolarHBondContact O-N 3.04Å; I11-C15 PolarHBondContact O-SG 2.88Å; L12-C15 PolarHBondContact O-N 3.5Å; C15-F17 VanDerWaalsContact C-N 3.33Å; C15-F17 PolarHBondContact O-N 2.83Å; C15-M18 PolarHBondContact O-N 2.97Å; C15-V19 WeakPolarHBondContact O-CB 3.2Å; C15-V19 VanDerWaalsContact O-CG2 3.24Å; C15-V19 WeakPolarHBondContact O-CG2 3.34Å; C15-V19 PolarHBondContact O-N 3.01Å; C15-W51 HydrophobicContact CB-CZ2 4.35Å
16M45.3Very low45.9Very low118 Ų11891.9 Ų91.958%0.58148%0.475SS*.Hα-helixtrans-64.9-38.4174.9-74.1-70.4-72.400110.9L12 T20L12-M16 VanDerWaalsContact O-CB 3.25Å; L12-M16 WeakPolarHBondContact O-CB 3.48Å; L12-M16 WeakPolarHBondContact O-CG 3.4Å; L12-M16 PolarHBondContact O-N 2.74Å; M16-T20 WeakPolarHBondContact O-CB 3.11Å; M16-T20 PolarHBondContact O-N 3.26Å; M16-T20 PolarHBondContact O-OG1 2.85Å
17F52.3Low45.4Very low112 Ų11295.3 Ų95.349%0.49148%0.484SS..Hα-helixtrans-62-47.6172.7176.7-100.3000111.4G13 W14 C15 T20 M21G13-F17 VanDerWaalsContact O-CB 3.28Å; G13-F17 WeakPolarHBondContact O-CB 3.47Å; G13-F17 PolarHBondContact O-N 3.37Å; W14-F17 PolarHBondContact O-N 3.47Å; C15-F17 VanDerWaalsContact C-N 3.33Å; C15-F17 PolarHBondContact O-N 2.83Å; F17-T20 PolarHBondContact O-N 3.2Å; F17-M21 HydrophobicContact CD1-CG 4.29Å; F17-M21 HydrophobicContact CD2-CG 4.31Å; F17-M21 HydrophobicContact CE1-CG 3.87Å; F17-M21 HydrophobicContact CE2-CE 4.45Å; F17-M21 HydrophobicContact CE2-CG 3.9Å; F17-M21 HydrophobicContact CE2-SD 4.45Å; F17-M21 HydrophobicContact CG-CG 4.5Å; F17-M21 HydrophobicContact CZ-CG 3.66Å; F17-M21 HydrophobicContact CZ-SD 4.23Å; F17-M21 VanDerWaalsContact O-CB 3.25Å; F17-M21 WeakPolarHBondContact O-CB 3.34Å; F17-M21 WeakPolarHBondContact O-CG 3.4Å; F17-M21 PolarHBondContact O-N 3.35Å
18M43.4Very low45.1Very low97 Ų97101.6 Ų101.648%0.47850%0.504SS..Hα-helixtrans-61.4-45.2176.8-74.2-91.1119.700111.9W14 C15 M21 S22W14-M18 HydrophobicContact CE3-CE 4.33Å; W14-M18 HydrophobicContact CE3-CG 4.06Å; W14-M18 HydrophobicContact CZ3-CE 3.77Å; W14-M18 HydrophobicContact CZ3-CG 4.38Å; W14-M18 HydrophobicContact CZ3-SD 4.34Å; W14-M18 WeakPolarHBondContact O-CB 3.4Å; W14-M18 WeakPolarHBondContact O-CG 3.42Å; W14-M18 PolarHBondContact O-N 3.36Å; C15-M18 PolarHBondContact O-N 2.97Å; M18-M21 PolarHBondContact O-N 3.46Å; M18-S22 WeakPolarHBondContact O-CB 3.4Å; M18-S22 PolarHBondContact O-N 3.24Å; M18-S22 PolarHBondContact O-OG 3.12Å
19V43.9Very low44.7Very low70 Ų70101.9 Ų101.942%0.42451%0.507SS..Hα-helixtrans-65.3-43.8176.2172.30000111C15 S22 V23C15-V19 WeakPolarHBondContact O-CB 3.2Å; C15-V19 VanDerWaalsContact O-CG2 3.24Å; C15-V19 WeakPolarHBondContact O-CG2 3.34Å; C15-V19 PolarHBondContact O-N 3.01Å; V19-S22 VanDerWaalsContact CA-OG 3.27Å; V19-S22 WeakPolarHBondContact CA-OG 3.38Å; V19-S22 PolarHBondContact O-N 3.22Å; V19-S22 PolarHBondContact O-OG 3.07Å; V19-S22 VanDerWaalsContact O-OG 3.1Å; V19-V23 HydrophobicContact CG1-CG2 4.27Å; V19-V23 WeakPolarHBondContact O-CB 3.38Å; V19-V23 WeakPolarHBondContact O-CG2 3.5Å; V19-V23 PolarHBondContact O-N 3.03Å
20T48.5Very low44Very low55 Ų55108.5 Ų108.534%0.33752%0.524SS..Hα-helixtrans-68.7-37.4179-520000111.1M16 F17 R24M16-T20 WeakPolarHBondContact O-CB 3.11Å; M16-T20 PolarHBondContact O-N 3.26Å; M16-T20 PolarHBondContact O-OG1 2.85Å; F17-T20 PolarHBondContact O-N 3.2Å; T20-R24 HydrophobicContact CG2-CG 4.35Å; T20-R24 VanDerWaalsContact O-CB 3.23Å; T20-R24 WeakPolarHBondContact O-CB 3.47Å; T20-R24 VanDerWaalsContact O-CG 3.25Å; T20-R24 WeakPolarHBondContact O-CG 3.09Å; T20-R24 PolarHBondContact O-N 2.97Å
21M49.4Very low43.2Very low67 Ų67113.1 Ų113.133%0.3354%0.537SS..Hα-helixtrans-63.4-46.6172.2-82.1-68.810500111F17 M18 R24 L25F17-M21 HydrophobicContact CD1-CG 4.29Å; F17-M21 HydrophobicContact CD2-CG 4.31Å; F17-M21 HydrophobicContact CE1-CG 3.87Å; F17-M21 HydrophobicContact CE2-CE 4.45Å; F17-M21 HydrophobicContact CE2-CG 3.9Å; F17-M21 HydrophobicContact CE2-SD 4.45Å; F17-M21 HydrophobicContact CG-CG 4.5Å; F17-M21 HydrophobicContact CZ-CG 3.66Å; F17-M21 HydrophobicContact CZ-SD 4.23Å; F17-M21 VanDerWaalsContact O-CB 3.25Å; F17-M21 WeakPolarHBondContact O-CB 3.34Å; F17-M21 WeakPolarHBondContact O-CG 3.4Å; F17-M21 PolarHBondContact O-N 3.35Å; M18-M21 PolarHBondContact O-N 3.46Å; M21-R24 PolarHBondContact O-N 3.34Å; M21-L25 WeakPolarHBondContact O-CB 3.41Å; M21-L25 PolarHBondContact O-N 3.11Å
22S44.2Very low42.7Very low39 Ų39116.3 Ų116.327%0.27355%0.549SS..Hα-helixtrans-66.3-38.8177.837.40000112.2M18 V19 L25 L26M18-S22 WeakPolarHBondContact O-CB 3.4Å; M18-S22 PolarHBondContact O-N 3.24Å; M18-S22 PolarHBondContact O-OG 3.12Å; V19-S22 VanDerWaalsContact CA-OG 3.27Å; V19-S22 WeakPolarHBondContact CA-OG 3.38Å; V19-S22 PolarHBondContact O-N 3.22Å; V19-S22 PolarHBondContact O-OG 3.07Å; V19-S22 VanDerWaalsContact O-OG 3.1Å; S22-L25 PolarHBondContact O-N 3.17Å; S22-L26 VanDerWaalsContact O-CB 3.28Å; S22-L26 WeakPolarHBondContact O-CB 3.3Å; S22-L26 WeakPolarHBondContact O-CD1 3.48Å; S22-L26 WeakPolarHBondContact O-CG 3.49Å; S22-L26 PolarHBondContact O-N 3.41Å
23V46.8Very low42.4Very low85 Ų85120.8 Ų120.852%0.51556%0.561SS.*Hα-helixtrans-67.7-41.1173.3172.90000112.1V19 L26 R27V19-V23 HydrophobicContact CG1-CG2 4.27Å; V19-V23 WeakPolarHBondContact O-CB 3.38Å; V19-V23 WeakPolarHBondContact O-CG2 3.5Å; V19-V23 PolarHBondContact O-N 3.03Å; V23-L26 PolarHBondContact O-N 3.06Å; V23-R27 PolarHBondContact O-N 3.31Å
24R46.6Very low42Very low158 Ų158124 Ų12460%0.59657%0.573SS**Hα-helixtrans-66.3-40.4175.2-77.2179.8-178.6-170.51.3111.3T20 M21 R27 Y28T20-R24 HydrophobicContact CG2-CG 4.35Å; T20-R24 VanDerWaalsContact O-CB 3.23Å; T20-R24 WeakPolarHBondContact O-CB 3.47Å; T20-R24 VanDerWaalsContact O-CG 3.25Å; T20-R24 WeakPolarHBondContact O-CG 3.09Å; T20-R24 PolarHBondContact O-N 2.97Å; M21-R24 PolarHBondContact O-N 3.34Å; R24-R27 PolarHBondContact O-N 3.47Å; R24-Y28 WeakPolarHBondContact O-CD2 3.36Å; R24-Y28 PolarHBondContact O-N 3.36Å; R24-Y28 VanDerWaalsContact O-N 3.1Å
25L40.6Very low41.8Very low92 Ų92120.9 Ų120.948%0.48258%0.575SS.*Hα-helixtrans-64.4-43.7174-117.285.2000111.4M21 S22 R27 Y28 L29M21-L25 WeakPolarHBondContact O-CB 3.41Å; M21-L25 PolarHBondContact O-N 3.11Å; S22-L25 PolarHBondContact O-N 3.17Å; L25-R27 PolarHBondContact O-N 3.01Å; L25-Y28 PolarHBondContact O-N 3.49Å; L25-Y28 VanDerWaalsContact O-N 3.08Å; L25-L29 HydrophobicContact CD2-CD1 4.09Å; L25-L29 HydrophobicContact CG-CD1 4.31Å; L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 WeakPolarHBondContact O-CG 3.45Å; L25-L29 PolarHBondContact O-N 2.98Å
26L40.2Very low41.6Very low111 Ų111126.2 Ų126.258%0.58159%0.59SS**Hα-helixtrans-57.5-35.3174.6-81.8161.7000112S22 V23S22-L26 VanDerWaalsContact O-CB 3.28Å; S22-L26 WeakPolarHBondContact O-CB 3.3Å; S22-L26 WeakPolarHBondContact O-CD1 3.48Å; S22-L26 WeakPolarHBondContact O-CG 3.49Å; S22-L26 PolarHBondContact O-N 3.41Å; V23-L26 PolarHBondContact O-N 3.06Å
27R40.6Very low41Very low218 Ų218125.6 Ų125.682%0.82359%0.588SS**Hα-helixtrans-73.8-33.3176.4-150.4179.7-167.9-168.13.3112.7V23 R24 L25V23-R27 PolarHBondContact O-N 3.31Å; R24-R27 PolarHBondContact O-N 3.47Å; L25-R27 PolarHBondContact O-N 3.01Å
28Y43.2Very low40.3Very low210 Ų210128.3 Ų128.382%0.82460%0.6SS**Hα-helixtrans-75.6-30.5175.9-95.9-81.2000113R24 L25R24-Y28 WeakPolarHBondContact O-CD2 3.36Å; R24-Y28 PolarHBondContact O-N 3.36Å; R24-Y28 VanDerWaalsContact O-N 3.1Å; L25-Y28 PolarHBondContact O-N 3.49Å; L25-Y28 VanDerWaalsContact O-N 3.08Å
29L35.4Very low40.2Very low114 Ų114127.8 Ų127.860%0.59760%0.598SS**THydrogen-bonded Turntrans-99.920.8-174.1-63.6170.4000113.1L25 F31L25-L29 HydrophobicContact CD2-CD1 4.09Å; L25-L29 HydrophobicContact CG-CD1 4.31Å; L25-L29 WeakPolarHBondContact O-CB 3.33Å; L25-L29 WeakPolarHBondContact O-CG 3.45Å; L25-L29 PolarHBondContact O-N 2.98Å; L29-F31 PolarHBondContact O-N 3.46Å
30Y35.9Very low39.9Very low205 Ų205130.5 Ų130.580%0.80460%0.601SS**  trans-68.10.6177-143.6-94.6000113.7
31F33.6Very low39.3Very low189 Ų189136.3 Ų136.383%0.82962%0.617SS**SBendtrans-109.5113165.5-82.9-91.9000108.7L29L29-F31 PolarHBondContact O-N 3.46Å
32E33.8Very low39Very low160 Ų160135.8 Ų135.875%0.74861%0.613SS**SBendtrans107.9114.9161.4-60.9-152164.400120.6
33Y35.9Very low38.8Very low186 Ų186138.2 Ų138.273%0.72962%0.619SS**  trans66.9127.9149.3-76.3-81.9000123.3C35Y33-C35 VanDerWaalsContact C-N 3.32Å; Y33-C35 PolarHBondContact O-N 2.97Å
34V38.9Very low38.4Very low110 Ų110136.6 Ų136.667%0.66761%0.614SS**THydrogen-bonded Turntrans-63.8-16.8-171.9174.20000115.5Y36 L37V34-Y36 VanDerWaalsContact C-N 3.34Å; V34-Y36 PolarHBondContact O-N 2.96Å; V34-L37 PolarHBondContact O-N 2.81Å
35C40.2Very low38.2Very low101 Ų101134.4 Ų134.468%0.68261%0.609SS**Hα-helixtrans-67.9-34-178.5-136.10000112.3Y33 L37Y33-C35 VanDerWaalsContact C-N 3.32Å; Y33-C35 PolarHBondContact O-N 2.97Å; C35-L37 VanDerWaalsContact C-N 3.34Å; C35-L37 PolarHBondContact O-N 3.3Å
36Y34.6Very low38.1Very low154 Ų154131.4 Ų131.460%0.60459%0.593SS**Hα-helixtrans-70.3-28.1177.3-74.7-76.9000113.1V34 K38 I39 W40V34-Y36 VanDerWaalsContact C-N 3.34Å; V34-Y36 PolarHBondContact O-N 2.96Å; Y36-K38 VanDerWaalsContact C-N 3.34Å; Y36-K38 PolarHBondContact O-N 3.22Å; Y36-I39 PolarHBondContact O-N 3.19Å; Y36-W40 WeakPolarHBondContact O-CB 3.42Å; Y36-W40 PolarHBondContact O-N 3.45Å
37L34.2Very low38.1Very low104 Ų104131.1 Ų131.155%0.54559%0.592SS.*Hα-helixtrans-65.2-32.9-178.9-104.3124.7000113.3V34 C35 R41V34-L37 PolarHBondContact O-N 2.81Å; C35-L37 VanDerWaalsContact C-N 3.34Å; C35-L37 PolarHBondContact O-N 3.3Å; L37-R41 VanDerWaalsContact O-CB 3.25Å; L37-R41 WeakPolarHBondContact O-CB 3.31Å; L37-R41 WeakPolarHBondContact O-CG 3.35Å; L37-R41 PolarHBondContact O-N 3.5Å
38K37.1Very low37.9Very low169 Ų169127.2 Ų127.274%0.73558%0.584SS**Hα-helixtrans-72.6-44.3177.2-74.9-174176.5-175.50111.8Y36 W40 R41 F42Y36-K38 VanDerWaalsContact C-N 3.34Å; Y36-K38 PolarHBondContact O-N 3.22Å; K38-W40 VanDerWaalsContact C-N 3.35Å; K38-R41 PolarHBondContact O-N 2.92Å; K38-F42 WeakPolarHBondContact O-CB 3.39Å; K38-F42 PolarHBondContact O-N 2.95Å
39I40.2Very low37.5Very low86 Ų86118.1 Ų118.144%0.44155%0.554SS.*Hα-helixtrans-64.9-39.3176.1-67.7165.5000110.7Y36 F42 F43Y36-I39 PolarHBondContact O-N 3.19Å; I39-F42 VanDerWaalsContact O-CB 3.3Å; I39-F42 WeakPolarHBondContact O-CB 3.43Å; I39-F42 PolarHBondContact O-N 3.26Å; I39-F43 HydrophobicContact CG2-CD2 3.8Å; I39-F43 HydrophobicContact CG2-CE2 3.56Å; I39-F43 WeakPolarHBondContact O-CD2 3.28Å; I39-F43 PolarHBondContact O-N 3.11Å
40W38.3Very low37.6Very low128 Ų128113 Ų11349%0.48553%0.53SS..Hα-helixtrans-78.7-30.6178.4-79.3106.2000113.8Y36 K38 F42 F43 A44Y36-W40 WeakPolarHBondContact O-CB 3.42Å; Y36-W40 PolarHBondContact O-N 3.45Å; K38-W40 VanDerWaalsContact C-N 3.35Å; W40-F42 VanDerWaalsContact C-N 3.26Å; W40-F42 PolarHBondContact O-N 3.32Å; W40-F43 HydrophobicContact CE3-CB 3.91Å; W40-F43 HydrophobicContact CE3-CD2 4.31Å; W40-F43 HydrophobicContact CE3-CG 4.41Å; W40-F43 HydrophobicContact CZ3-CB 4.26Å; W40-F43 PolarHBondContact O-N 2.98Å; W40-A44 VanDerWaalsContact O-CB 3.27Å; W40-A44 WeakPolarHBondContact O-CB 3.25Å; W40-A44 PolarHBondContact O-N 2.8Å
41R36.8Very low37.7Very low177 Ų177108.7 Ų108.767%0.66851%0.512SS*.Hα-helixtrans-59.9-41165.9-82.1177.1173.8-165.4-1110.6L37 K38 A44 F45L37-R41 VanDerWaalsContact O-CB 3.25Å; L37-R41 WeakPolarHBondContact O-CB 3.31Å; L37-R41 WeakPolarHBondContact O-CG 3.35Å; L37-R41 PolarHBondContact O-N 3.5Å; K38-R41 PolarHBondContact O-N 2.92Å; R41-A44 PolarHBondContact O-N 3.37Å; R41-F45 VanDerWaalsContact O-CB 3.28Å; R41-F45 WeakPolarHBondContact O-CB 3.39Å; R41-F45 PolarHBondContact O-N 2.94Å
42F41.3Very low37.9Very low55 Ų55104.6 Ų104.624%0.24150%0.498CS..Hα-helixtrans-61-46.5172.7174.4-98000112.3K38 I39 W40 F45 I46 L319 L323K38-F42 WeakPolarHBondContact O-CB 3.39Å; K38-F42 PolarHBondContact O-N 2.95Å; I39-F42 VanDerWaalsContact O-CB 3.3Å; I39-F42 WeakPolarHBondContact O-CB 3.43Å; I39-F42 PolarHBondContact O-N 3.26Å; W40-F42 VanDerWaalsContact C-N 3.26Å; W40-F42 PolarHBondContact O-N 3.32Å; F42-F45 WeakPolarHBondContact O-CB 3.36Å; F42-F45 PolarHBondContact O-N 3.11Å; F42-I46 HydrophobicContact CD1-CD1 3.83Å; F42-I46 HydrophobicContact CE1-CD1 3.47Å; F42-I46 VanDerWaalsContact CE1-CD1 3.47Å; F42-I46 HydrophobicContact CE2-CD1 4.39Å; F42-I46 HydrophobicContact CG-CD1 4.44Å; F42-I46 HydrophobicContact CZ-CD1 3.78Å; F42-I46 WeakPolarHBondContact O-CG1 3.45Å; F42-I46 PolarHBondContact O-N 3.36Å; F42-L319 HydrophobicContact CD2-CD1 4.29Å; F42-L319 HydrophobicContact CE2-CD1 4.35Å; F42-L323 HydrophobicContact CE2-CD2 3.61Å; F42-L323 HydrophobicContact CE2-CG 4.42Å; F42-L323 HydrophobicContact CZ-CD2 4.12Å
43F41Very low38.1Very low91 Ų9198.6 Ų98.640%0.39947%0.474SS..Hα-helixtrans-66.1-41.3174.8-79.6-68.2000113.8I39 W40 F45 I46 L47I39-F43 HydrophobicContact CG2-CD2 3.8Å; I39-F43 HydrophobicContact CG2-CE2 3.56Å; I39-F43 WeakPolarHBondContact O-CD2 3.28Å; I39-F43 PolarHBondContact O-N 3.11Å; W40-F43 HydrophobicContact CE3-CB 3.91Å; W40-F43 HydrophobicContact CE3-CD2 4.31Å; W40-F43 HydrophobicContact CE3-CG 4.41Å; W40-F43 HydrophobicContact CZ3-CB 4.26Å; W40-F43 PolarHBondContact O-N 2.98Å; F43-F45 VanDerWaalsContact C-N 3.28Å; F43-F45 PolarHBondContact O-N 3.21Å; F43-I46 HydrophobicContact CD1-CD1 4.45Å; F43-I46 PolarHBondContact O-N 3.38Å; F43-L47 WeakPolarHBondContact O-CG 3.24Å; F43-L47 PolarHBondContact O-N 2.91Å
44A39Very low38.3Very low50 Ų5094 Ų9441%0.41346%0.461SS..Hα-helixtrans-63.4-35.9174.800000111.4W40 R41 L47 M48W40-A44 VanDerWaalsContact O-CB 3.27Å; W40-A44 WeakPolarHBondContact O-CB 3.25Å; W40-A44 PolarHBondContact O-N 2.8Å; R41-A44 PolarHBondContact O-N 3.37Å; A44-L47 PolarHBondContact O-N 3.37Å; A44-M48 PolarHBondContact O-N 3.01Å
45F41.6Very low38.1Very low112 Ų11294.4 Ų94.449%0.49146%0.459SS..Hα-helixtrans-65.7-45.3173-116.4-92.7000112.5R41 F42 F43 L47 M48 G49 M297 F308R41-F45 VanDerWaalsContact O-CB 3.28Å; R41-F45 WeakPolarHBondContact O-CB 3.39Å; R41-F45 PolarHBondContact O-N 2.94Å; F42-F45 WeakPolarHBondContact O-CB 3.36Å; F42-F45 PolarHBondContact O-N 3.11Å; F43-F45 VanDerWaalsContact C-N 3.28Å; F43-F45 PolarHBondContact O-N 3.21Å; F45-L47 VanDerWaalsContact C-N 3.25Å; F45-L47 PolarHBondContact O-N 2.93Å; F45-M48 PolarHBondContact O-N 3.3Å; F45-G49 PolarHBondContact O-N 3.35Å; F45-M297 HydrophobicContact CD1-SD 4.17Å; F45-M297 HydrophobicContact CE1-SD 4.1Å; F45-F308 HydrophobicContact CE1-CD1 4.22Å; F45-F308 AromaticContact CE1-CE1 3.68Å; F45-F308 HydrophobicContact CE1-CE1 3.68Å; F45-F308 AromaticContact CZ-CE1 3.96Å; F45-F308 HydrophobicContact CZ-CE1 3.96Å
46I38.8Very low37.9Very low30 Ų3093.4 Ų93.415%0.15445%0.453CS..Hα-helixtrans-57.2-43.3174.2-70.8166.4000110.1F42 F43 G50 V290F42-I46 HydrophobicContact CD1-CD1 3.83Å; F42-I46 HydrophobicContact CE1-CD1 3.47Å; F42-I46 VanDerWaalsContact CE1-CD1 3.47Å; F42-I46 HydrophobicContact CE2-CD1 4.39Å; F42-I46 HydrophobicContact CG-CD1 4.44Å; F42-I46 HydrophobicContact CZ-CD1 3.78Å; F42-I46 WeakPolarHBondContact O-CG1 3.45Å; F42-I46 PolarHBondContact O-N 3.36Å; F43-I46 HydrophobicContact CD1-CD1 4.45Å; F43-I46 PolarHBondContact O-N 3.38Å; I46-G50 PolarHBondContact O-N 2.96Å; I46-V290 HydrophobicContact CD1-CG2 4.43Å; I46-V290 HydrophobicContact CG2-CG2 4.17Å
47L39.4Very low38.1Very low104 Ų10489.2 Ų89.255%0.54544%0.438SS..Hα-helixtrans-64.6-49.6178.1-70.8167.1000111.3F43 A44 F45 G50 W51F43-L47 WeakPolarHBondContact O-CG 3.24Å; F43-L47 PolarHBondContact O-N 2.91Å; A44-L47 PolarHBondContact O-N 3.37Å; F45-L47 VanDerWaalsContact C-N 3.25Å; F45-L47 PolarHBondContact O-N 2.93Å; L47-G50 CarbonylContact O-C 3.6Å; L47-G50 WeakPolarHBondContact O-CA 3.27Å; L47-G50 PolarHBondContact O-N 3.49Å; L47-W51 PolarHBondContact O-N 3.36Å
48M36.6Very low38.2Very low136 Ų13685.8 Ų85.867%0.6743%0.428SS*.Hα-helixtrans-64.2-41.4179.2-76.1-176.475.700113.5A44 F45 G50 W51 L52A44-M48 PolarHBondContact O-N 3.01Å; F45-M48 PolarHBondContact O-N 3.3Å; M48-G50 VanDerWaalsContact C-N 3.34Å; M48-W51 WeakPolarHBondContact O-CB 2.85Å; M48-W51 PolarHBondContact O-N 3.09Å; M48-L52 PolarHBondContact O-N 3.24Å
49G36.1Very low38.1Very low19 Ų1984.8 Ų84.820%0.19643%0.427CS..Hα-helixtrans-64.6-39.217300000112.1F45 W51 L52 S53F45-G49 PolarHBondContact O-N 3.35Å; G49-W51 VanDerWaalsContact C-N 3.32Å; G49-W51 PolarHBondContact O-N 3.35Å; G49-L52 PolarHBondContact O-N 2.7Å; G49-S53 PolarHBondContact O-N 3.36Å
50G36.7Very low37.9Very low8 Ų882.4 Ų82.48%0.08242%0.419CS..Hα-helixtrans-57.1-41.9169.500000112.4I46 L47 M48 L52 S53 I54I46-G50 PolarHBondContact O-N 2.96Å; L47-G50 CarbonylContact O-C 3.6Å; L47-G50 WeakPolarHBondContact O-CA 3.27Å; L47-G50 PolarHBondContact O-N 3.49Å; M48-G50 VanDerWaalsContact C-N 3.34Å; G50-L52 PolarHBondContact O-N 3Å; G50-S53 PolarHBondContact O-N 3.07Å; G50-S53 PolarHBondContact O-OG 3.49Å; G50-I54 WeakPolarHBondContact O-CB 3.43Å; G50-I54 WeakPolarHBondContact O-CD1 3.42Å; G50-I54 WeakPolarHBondContact O-CG1 3.28Å; G50-I54 PolarHBondContact O-N 2.85Å
51W37.4Very low37.9Very low114 Ų11479.2 Ų79.243%0.43241%0.411SS..Hα-helixtrans-61.1-41.8176.6-78.9105.2000113.9C15 L47 M48 G49 I54 L55C15-W51 HydrophobicContact CB-CZ2 4.35Å; L47-W51 PolarHBondContact O-N 3.36Å; M48-W51 WeakPolarHBondContact O-CB 2.85Å; M48-W51 PolarHBondContact O-N 3.09Å; G49-W51 VanDerWaalsContact C-N 3.32Å; G49-W51 PolarHBondContact O-N 3.35Å; W51-I54 PolarHBondContact O-N 3.43Å; W51-L55 PolarHBondContact O-N 3.01Å
52L37.1Very low37.9Very low103 Ų10377 Ų7754%0.53941%0.411SS..Hα-helixtrans-65.4-39.8177.6-78.5165.2000111.6M48 G49 G50 I54 L55 S56M48-L52 PolarHBondContact O-N 3.24Å; G49-L52 PolarHBondContact O-N 2.7Å; G50-L52 PolarHBondContact O-N 3Å; L52-I54 VanDerWaalsContact C-N 3.35Å; L52-L55 PolarHBondContact O-N 2.95Å; L52-S56 WeakPolarHBondContact O-CB 3.31Å; L52-S56 PolarHBondContact O-N 3.2Å
53S38.6Very low37.7Very low34 Ų3482.8 Ų82.824%0.23843%0.432CS..Hα-helixtrans-65.2-35.7171.971.60000112.6G49 G50 S56 F57G49-S53 PolarHBondContact O-N 3.36Å; G50-S53 PolarHBondContact O-N 3.07Å; G50-S53 PolarHBondContact O-OG 3.49Å; S53-S56 PolarHBondContact O-N 2.95Å; S53-F57 WeakPolarHBondContact O-CB 3.46Å; S53-F57 PolarHBondContact O-N 2.86Å
54I39.6Very low37.7Very low90 Ų9079.2 Ų79.246%0.46242%0.417SS..Hα-helixtrans-71.8-31.9177.5-68.8162.3000112.2G50 W51 L52 F57 G58G50-I54 WeakPolarHBondContact O-CB 3.43Å; G50-I54 WeakPolarHBondContact O-CD1 3.42Å; G50-I54 WeakPolarHBondContact O-CG1 3.28Å; G50-I54 PolarHBondContact O-N 2.85Å; W51-I54 PolarHBondContact O-N 3.43Å; L52-I54 VanDerWaalsContact C-N 3.35Å; I54-F57 VanDerWaalsContact O-CB 3.29Å; I54-F57 WeakPolarHBondContact O-CB 3.43Å; I54-F57 PolarHBondContact O-N 3.03Å; I54-G58 PolarHBondContact O-N 2.84Å
55L34.5Very low37.7Very low118 Ų11884.5 Ų84.562%0.61843%0.428SS*.Hα-helixtrans-73.1-42.7173.3-78.1164.7000111.6W51 L52 F57 G58 M59W51-L55 PolarHBondContact O-N 3.01Å; L52-L55 PolarHBondContact O-N 2.95Å; L55-F57 PolarHBondContact O-N 3.07Å; L55-G58 PolarHBondContact O-N 3.15Å; L55-G58 VanDerWaalsContact O-N 3.15Å; L55-M59 PolarHBondContact O-N 3Å
56S36Very low37.8Very low80 Ų8082.9 Ų82.956%0.55943%0.43SS*.Hα-helixtrans-56.9-38.2168.2176.90000111.5L52 S53 M59 S60L52-S56 WeakPolarHBondContact O-CB 3.31Å; L52-S56 PolarHBondContact O-N 3.2Å; S53-S56 PolarHBondContact O-N 2.95Å; S56-M59 PolarHBondContact O-N 3.38Å; S56-S60 PolarHBondContact O-N 3.44Å; S56-S60 PolarHBondContact O-OG 2.82Å
57F40.8Very low38.1Very low66 Ų6683.7 Ų83.729%0.28944%0.437SS..Hα-helixtrans-64.9-39.7173.6172.6-101.2000113.7S53 I54 L55 M59 S60 L61 V249 I253S53-F57 WeakPolarHBondContact O-CB 3.46Å; S53-F57 PolarHBondContact O-N 2.86Å; I54-F57 VanDerWaalsContact O-CB 3.29Å; I54-F57 WeakPolarHBondContact O-CB 3.43Å; I54-F57 PolarHBondContact O-N 3.03Å; L55-F57 PolarHBondContact O-N 3.07Å; F57-M59 VanDerWaalsContact C-N 3.31Å; F57-M59 PolarHBondContact O-N 3.32Å; F57-S60 VanDerWaalsContact CA-OG 3.22Å; F57-S60 WeakPolarHBondContact CA-OG 3.44Å; F57-S60 PolarHBondContact O-N 2.88Å; F57-S60 PolarHBondContact O-OG 3.4Å; F57-L61 HydrophobicContact CD1-CD1 3.83Å; F57-L61 HydrophobicContact CE1-CD1 3.4Å; F57-L61 HydrophobicContact CE2-CD1 4.18Å; F57-L61 HydrophobicContact CG-CD1 4.38Å; F57-L61 HydrophobicContact CZ-CD1 3.6Å; F57-L61 HydrophobicContact CZ-CG 4.44Å; F57-L61 WeakPolarHBondContact O-CB 3.42Å; F57-L61 PolarHBondContact O-N 3.27Å; F57-V249 HydrophobicContact CD2-CG1 4.11Å; F57-I253 HydrophobicContact CE2-CD1 3.86Å; F57-I253 HydrophobicContact CE2-CG1 3.65Å; F57-I253 HydrophobicContact CZ-CG1 4.36Å
58G35Very low38.4Very low32 Ų3280.8 Ų80.833%0.3342%0.423SS..Hα-helixtrans-62.5-37.3173.800000112.9I54 L55 L62I54-G58 PolarHBondContact O-N 2.84Å; L55-G58 PolarHBondContact O-N 3.15Å; L55-G58 VanDerWaalsContact O-N 3.15Å; G58-L62 PolarHBondContact O-N 2.87Å
59M35.6Very low39Very low147 Ų14775.8 Ų75.872%0.72441%0.406SS*.Hα-helixtrans-73.9-39.8176.8-70.4-169.3166.100112.7L55 S56 F57 L62 W63L55-M59 PolarHBondContact O-N 3Å; S56-M59 PolarHBondContact O-N 3.38Å; F57-M59 VanDerWaalsContact C-N 3.31Å; F57-M59 PolarHBondContact O-N 3.32Å; M59-L62 PolarHBondContact O-N 3.44Å; M59-W63 PolarHBondContact O-N 3.41Å
60S36.6Very low39.8Very low37 Ų3776.1 Ų76.126%0.25941%0.41SS..Hα-helixtrans-68.1-33.3175.135.70000112.3S56 F57 W63 V64S56-S60 PolarHBondContact O-N 3.44Å; S56-S60 PolarHBondContact O-OG 2.82Å; F57-S60 VanDerWaalsContact CA-OG 3.22Å; F57-S60 WeakPolarHBondContact CA-OG 3.44Å; F57-S60 PolarHBondContact O-N 2.88Å; F57-S60 PolarHBondContact O-OG 3.4Å; S60-W63 PolarHBondContact O-N 3.34Å; S60-V64 WeakPolarHBondContact O-CG2 3.47Å; S60-V64 PolarHBondContact O-N 3.42Å
61L37.1Very low40.3Very low60 Ų6079.7 Ų79.731%0.31443%0.426SS..Hα-helixtrans-62-40.6169.4-90.5161.6000113.1F57 Y65 L194 L197F57-L61 HydrophobicContact CD1-CD1 3.83Å; F57-L61 HydrophobicContact CE1-CD1 3.4Å; F57-L61 HydrophobicContact CE2-CD1 4.18Å; F57-L61 HydrophobicContact CG-CD1 4.38Å; F57-L61 HydrophobicContact CZ-CD1 3.6Å; F57-L61 HydrophobicContact CZ-CG 4.44Å; F57-L61 WeakPolarHBondContact O-CB 3.42Å; F57-L61 PolarHBondContact O-N 3.27Å; L61-Y65 WeakPolarHBondContact O-CB 3.36Å; L61-Y65 PolarHBondContact O-N 3.24Å; L61-L194 HydrophobicContact CD2-CD2 4.03Å; L61-L197 HydrophobicContact CD2-CD2 3.95Å
62L36.3Very low41.2Very low130 Ų13077.8 Ų77.868%0.68142%0.42SS*.Hα-helixtrans-67.8-41.9176.1-77.3167.3000111.6G58 M59 S66G58-L62 PolarHBondContact O-N 2.87Å; M59-L62 PolarHBondContact O-N 3.44Å; L62-S66 VanDerWaalsContact O-CB 3.28Å; L62-S66 WeakPolarHBondContact O-CB 3.32Å; L62-S66 PolarHBondContact O-N 2.89Å; L62-S66 VanDerWaalsContact O-N 3.14Å
63W38.2Very low42.3Very low178 Ų17877.3 Ų77.367%0.67442%0.418SS*.Hα-helixtrans-65.9-37.3176.4-17279.2000112.3M59 S60 S66 T67M59-W63 PolarHBondContact O-N 3.41Å; S60-W63 PolarHBondContact O-N 3.34Å; W63-S66 CarbonylContact O-C 3.57Å; W63-S66 WeakPolarHBondContact O-CB 3.42Å; W63-S66 PolarHBondContact O-N 2.68Å; W63-T67 HydrophobicContact CH2-CG2 4.44Å; W63-T67 HydrophobicContact CZ2-CG2 4.2Å; W63-T67 PolarHBondContact O-N 3.2Å; W63-T67 PolarHBondContact O-OG1 3.35Å
64V39.8Very low43.6Very low16 Ų1682.3 Ų82.310%0.09744%0.436CS..Hα-helixtrans-82-36.6-179.1-176.30000114.6S60 S66 T67 V68 L197S60-V64 WeakPolarHBondContact O-CG2 3.47Å; S60-V64 PolarHBondContact O-N 3.42Å; V64-S66 PolarHBondContact O-N 3.13Å; V64-T67 VanDerWaalsContact CA-OG1 3.24Å; V64-T67 WeakPolarHBondContact CA-OG1 3.48Å; V64-T67 PolarHBondContact O-N 3.15Å; V64-T67 VanDerWaalsContact O-N 3.1Å; V64-T67 PolarHBondContact O-OG1 3.25Å; V64-V68 HydrophobicContact CG1-CG2 3.96Å; V64-V68 PolarHBondContact O-N 2.86Å; V64-L197 HydrophobicContact CB-CD1 3.67Å; V64-L197 HydrophobicContact CG1-CB 4.45Å; V64-L197 HydrophobicContact CG1-CD1 3.49Å; V64-L197 VanDerWaalsContact CG1-CD1 3.49Å; V64-L197 HydrophobicContact CG1-CG 4.43Å; V64-L197 HydrophobicContact CG2-CD1 3.59Å
65Y40.1Very low44.4Very low161 Ų16180 Ų8063%0.63142%0.424SS*.Hα-helixtrans-58.8-36.1168-173.5-94.9000110.7L61 G69L61-Y65 WeakPolarHBondContact O-CB 3.36Å; L61-Y65 PolarHBondContact O-N 3.24Å; Y65-G69 PolarHBondContact O-N 3.49Å
66S44.1Very low45.9Very low77 Ų7779.5 Ų79.554%0.53841%0.414SS..Hα-helixtrans-67.6-41171.5-172.70000112.7L62 W63 V64 G70L62-S66 VanDerWaalsContact O-CB 3.28Å; L62-S66 WeakPolarHBondContact O-CB 3.32Å; L62-S66 PolarHBondContact O-N 2.89Å; L62-S66 VanDerWaalsContact O-N 3.14Å; W63-S66 CarbonylContact O-C 3.57Å; W63-S66 WeakPolarHBondContact O-CB 3.42Å; W63-S66 PolarHBondContact O-N 2.68Å; V64-S66 PolarHBondContact O-N 3.13Å; S66-G70 WeakPolarHBondContact O-CA 3.46Å; S66-G70 PolarHBondContact O-N 3.3Å
67T45.5Very low47.6Very low47 Ų4778.7 Ų78.729%0.28841%0.408SS..Hα-helixtrans-78.2-44.3-177.730.30000114.4W63 V64 M71W63-T67 HydrophobicContact CH2-CG2 4.44Å; W63-T67 HydrophobicContact CZ2-CG2 4.2Å; W63-T67 PolarHBondContact O-N 3.2Å; W63-T67 PolarHBondContact O-OG1 3.35Å; V64-T67 VanDerWaalsContact CA-OG1 3.24Å; V64-T67 WeakPolarHBondContact CA-OG1 3.48Å; V64-T67 PolarHBondContact O-N 3.15Å; V64-T67 VanDerWaalsContact O-N 3.1Å; V64-T67 PolarHBondContact O-OG1 3.25Å; T67-M71 VanDerWaalsContact O-CB 3.24Å; T67-M71 WeakPolarHBondContact O-CB 3.34Å; T67-M71 PolarHBondContact O-N 3.31Å
68V44.7Very low48.8Very low43 Ų4377.8 Ų77.826%0.26141%0.408SS..Hα-helixtrans-76.8-44.6-178.4-179.60000111.3V64 K72 V105V64-V68 HydrophobicContact CG1-CG2 3.96Å; V64-V68 PolarHBondContact O-N 2.86Å; V68-K72 PolarHBondContact O-N 2.84Å; V68-V105 HydrophobicContact CG1-CG1 4.48Å
69G49.9Very low50.5Low31 Ų3179.4 Ų79.432%0.3241%0.405SS..Hα-helixtrans-66.5-39.6171.700000111.8Y65 K72 N73Y65-G69 PolarHBondContact O-N 3.49Å; G69-K72 PolarHBondContact O-N 3.24Å; G69-N73 WeakPolarHBondContact O-CB 3.36Å; G69-N73 VanDerWaalsContact O-CG 3.26Å; G69-N73 PolarHBondContact O-N 3.3Å; G69-N73 PolarHBondContact O-ND2 3.35Å
70G52Low52.3Low26 Ų2679.6 Ų79.627%0.26840%0.397SS..Hα-helixtrans-70.6-35.3177.600000113.5S66 K72 N73 F74S66-G70 WeakPolarHBondContact O-CA 3.46Å; S66-G70 PolarHBondContact O-N 3.3Å; G70-K72 VanDerWaalsContact C-N 3.35Å; G70-K72 PolarHBondContact O-N 3.45Å; G70-N73 CarbonylContact O-C 3.58Å; G70-N73 PolarHBondContact O-N 3.32Å; G70-F74 WeakPolarHBondContact O-CA 3.33Å; G70-F74 WeakPolarHBondContact O-CB 3.25Å; G70-F74 PolarHBondContact O-N 2.87Å
71M48.4Very low54.2Low84 Ų8483.9 Ų83.941%0.41441%0.409SS..Hα-helixtrans-62.8-43.3173.4-101.7164.773.400111.1T67 F74 M75 F101T67-M71 VanDerWaalsContact O-CB 3.24Å; T67-M71 WeakPolarHBondContact O-CB 3.34Å; T67-M71 PolarHBondContact O-N 3.31Å; M71-F74 PolarHBondContact O-N 3.38Å; M71-M75 WeakPolarHBondContact O-CB 3Å; M71-M75 WeakPolarHBondContact O-CG 3.35Å; M71-M75 PolarHBondContact O-N 2.89Å; M71-F101 HydrophobicContact CB-CZ 4.45Å; M71-F101 HydrophobicContact CE-CE2 3.47Å; M71-F101 VanDerWaalsContact CE-CE2 3.47Å; M71-F101 HydrophobicContact CE-CZ 3.59Å
72K54.6Low55.8Low73 Ų7386 Ų8632%0.31741%0.413SS..Hα-helixtrans-64.8-41.5176.1-168.7173.5-176.4171.40111.7V68 G69 G70 R76 Y97V68-K72 PolarHBondContact O-N 2.84Å; G69-K72 PolarHBondContact O-N 3.24Å; G70-K72 VanDerWaalsContact C-N 3.35Å; G70-K72 PolarHBondContact O-N 3.45Å; K72-R76 WeakPolarHBondContact O-CB 3.23Å; K72-R76 WeakPolarHBondContact O-CG 3.28Å; K72-R76 PolarHBondContact O-N 3Å; K72-R76 VanDerWaalsContact O-N 3.13Å; K72-Y97 WeakPolarHBondContact CE-OH 3.4Å
73N61.6Low57.7Low94 Ų9482.6 Ų82.650%0.50340%0.396SS..Hα-helixtrans-71.8-38.8177.3-73.7-20.7000112.7G69 G70 R76 S77G69-N73 WeakPolarHBondContact O-CB 3.36Å; G69-N73 VanDerWaalsContact O-CG 3.26Å; G69-N73 PolarHBondContact O-N 3.3Å; G69-N73 PolarHBondContact O-ND2 3.35Å; G70-N73 CarbonylContact O-C 3.58Å; G70-N73 PolarHBondContact O-N 3.32Å; N73-R76 PolarHBondContact O-N 3.45Å; N73-S77 VanDerWaalsContact O-CB 3.3Å; N73-S77 WeakPolarHBondContact O-CB 3.42Å; N73-S77 PolarHBondContact O-N 3.21Å
74F64.6Low59.6Low138 Ų13880.7 Ų80.761%0.60540%0.399SS*.Hα-helixtrans-62.2-50.8176.3174-104000109.8G70 M71 R76 S77 V78G70-F74 WeakPolarHBondContact O-CA 3.33Å; G70-F74 WeakPolarHBondContact O-CB 3.25Å; G70-F74 PolarHBondContact O-N 2.87Å; M71-F74 PolarHBondContact O-N 3.38Å; F74-R76 PolarHBondContact O-N 3.39Å; F74-S77 CarbonylContact O-C 3.47Å; F74-S77 WeakPolarHBondContact O-CA 3.49Å; F74-S77 VanDerWaalsContact O-CB 3.26Å; F74-S77 WeakPolarHBondContact O-CB 3.38Å; F74-S77 PolarHBondContact O-N 3.32Å; F74-V78 HydrophobicContact CD1-CG2 4.16Å; F74-V78 HydrophobicContact CD2-CG2 4.27Å; F74-V78 HydrophobicContact CE1-CG2 3.8Å; F74-V78 HydrophobicContact CE2-CG2 3.9Å; F74-V78 HydrophobicContact CG-CG2 4.38Å; F74-V78 HydrophobicContact CZ-CG2 3.65Å; F74-V78 WeakPolarHBondContact O-CG2 3.33Å; F74-V78 PolarHBondContact O-N 2.9Å
75M57.6Low61.3Low42 Ų4287.4 Ų87.421%0.20742%0.423CS..Hα-helixtrans-63.4-38.3176.5-78.8-117.3-95.900112.9M71 S77 V78 Y79 F101M71-M75 WeakPolarHBondContact O-CB 3Å; M71-M75 WeakPolarHBondContact O-CG 3.35Å; M71-M75 PolarHBondContact O-N 2.89Å; M75-S77 VanDerWaalsContact C-N 3.25Å; M75-S77 PolarHBondContact O-N 2.94Å; M75-V78 PolarHBondContact O-N 3.11Å; M75-Y79 WeakPolarHBondContact O-CB 3.43Å; M75-Y79 PolarHBondContact O-N 3.4Å; M75-F101 HydrophobicContact CE-CB 4.41Å; M75-F101 HydrophobicContact CE-CD1 3.35Å; M75-F101 HydrophobicContact CE-CD2 3.51Å; M75-F101 HydrophobicContact CE-CE1 3.22Å; M75-F101 HydrophobicContact CE-CE2 3.41Å; M75-F101 VanDerWaalsContact CE-CE2 3.41Å; M75-F101 HydrophobicContact CE-CG 3.49Å; M75-F101 VanDerWaalsContact CE-CG 3.49Å; M75-F101 HydrophobicContact CE-CZ 3.27Å
76R66.2Low62.8Low107 Ų10783.1 Ų83.140%0.40443%0.428SS..Hα-helixtrans-64.3-31169.8-79.1178.9-177.2171.7-5112.7K72 N73 F74 R80K72-R76 WeakPolarHBondContact O-CB 3.23Å; K72-R76 WeakPolarHBondContact O-CG 3.28Å; K72-R76 PolarHBondContact O-N 3Å; K72-R76 VanDerWaalsContact O-N 3.13Å; N73-R76 PolarHBondContact O-N 3.45Å; F74-R76 PolarHBondContact O-N 3.39Å; R76-R80 VanDerWaalsContact O-CB 3.3Å; R76-R80 WeakPolarHBondContact O-CB 3.44Å; R76-R80 VanDerWaalsContact O-CG 3.3Å; R76-R80 WeakPolarHBondContact O-CG 3.34Å; R76-R80 PolarHBondContact O-N 3.28Å; R76-R80 PolarHBondContact O-NE 2.95Å
77S70.5Confident63.9Low63 Ų6385.3 Ų85.344%0.44143%0.428SS..Hα-helixtrans-74.4-45.6177-161.90000110.9N73 F74 M75 R80 Y81N73-S77 VanDerWaalsContact O-CB 3.3Å; N73-S77 WeakPolarHBondContact O-CB 3.42Å; N73-S77 PolarHBondContact O-N 3.21Å; F74-S77 CarbonylContact O-C 3.47Å; F74-S77 WeakPolarHBondContact O-CA 3.49Å; F74-S77 VanDerWaalsContact O-CB 3.26Å; F74-S77 WeakPolarHBondContact O-CB 3.38Å; F74-S77 PolarHBondContact O-N 3.32Å; M75-S77 VanDerWaalsContact C-N 3.25Å; M75-S77 PolarHBondContact O-N 2.94Å; S77-R80 PolarHBondContact O-N 3.46Å; S77-Y81 WeakPolarHBondContact O-CB 3.32Å; S77-Y81 PolarHBondContact O-N 2.73Å
78V67.5Low65.3Low48 Ų4888.7 Ų88.729%0.29144%0.444SS..Hα-helixtrans-59.7-50.7173.5172.40000109.7F74 M75 R80 Y81 Y82F74-V78 HydrophobicContact CD1-CG2 4.16Å; F74-V78 HydrophobicContact CD2-CG2 4.27Å; F74-V78 HydrophobicContact CE1-CG2 3.8Å; F74-V78 HydrophobicContact CE2-CG2 3.9Å; F74-V78 HydrophobicContact CG-CG2 4.38Å; F74-V78 HydrophobicContact CZ-CG2 3.65Å; F74-V78 WeakPolarHBondContact O-CG2 3.33Å; F74-V78 PolarHBondContact O-N 2.9Å; M75-V78 PolarHBondContact O-N 3.11Å; V78-R80 PolarHBondContact O-N 2.9Å; V78-Y81 PolarHBondContact O-N 2.82Å; V78-Y82 HydrophobicContact CG1-CD2 3.75Å; V78-Y82 HydrophobicContact CG1-CE2 3.9Å; V78-Y82 WeakPolarHBondContact O-CD2 3.37Å; V78-Y82 PolarHBondContact O-N 3.5Å
79Y69Low66.3Low66 Ų6688.8 Ų88.826%0.25944%0.443SS..Hα-helixtrans-55.2-49.9175.7174.9-105.2000111.5M75 N83 L89 Y93M75-Y79 WeakPolarHBondContact O-CB 3.43Å; M75-Y79 PolarHBondContact O-N 3.4Å; Y79-N83 VanDerWaalsContact O-CB 3.32Å; Y79-N83 WeakPolarHBondContact O-CB 3.35Å; Y79-N83 PolarHBondContact O-N 3.5Å; Y79-N83 PolarHBondContact OH-ND2 3.22Å; Y79-L89 HydrophobicContact CD2-CB 4.16Å; Y79-L89 HydrophobicContact CE2-CB 4.49Å; Y79-Y93 HydrophobicContact CD2-CD1 4.46Å; Y79-Y93 HydrophobicContact CD2-CD2 4.01Å; Y79-Y93 AromaticContact CD2-CG 3.8Å; Y79-Y93 HydrophobicContact CD2-CG 3.8Å; Y79-Y93 HydrophobicContact CE2-CD1 4.44Å; Y79-Y93 HydrophobicContact CE2-CG 4.15Å; Y79-Y93 AromaticContact CG-CD2 4Å; Y79-Y93 HydrophobicContact CG-CD2 4Å; Y79-Y93 HydrophobicContact CG-CE2 4.42Å; Y79-Y93 HydrophobicContact CG-CG 4.19Å
80R74.3Confident67.1Low150 Ų15087.5 Ų87.557%0.56643%0.43SS*.Hα-helixtrans-63.9-41.4177.4-81.5-175.7-72.5164-1.9113.1R76 S77 V78 N84R76-R80 VanDerWaalsContact O-CB 3.3Å; R76-R80 WeakPolarHBondContact O-CB 3.44Å; R76-R80 VanDerWaalsContact O-CG 3.3Å; R76-R80 WeakPolarHBondContact O-CG 3.34Å; R76-R80 PolarHBondContact O-N 3.28Å; R76-R80 PolarHBondContact O-NE 2.95Å; S77-R80 PolarHBondContact O-N 3.46Å; V78-R80 PolarHBondContact O-N 2.9Å; R80-N84 WeakPolarHBondContact O-CB 3.33Å; R80-N84 PolarHBondContact O-N 3.16Å; R80-N84 PolarHBondContact O-ND2 3.36Å; R80-N84 PolarHBondContact O-OD1 3.26Å
81Y75.5Confident67.8Low128 Ų12889.7 Ų89.750%0.50244%0.44SS..Hα-helixtrans-60.3-53.8179.8179.2-94.8000110.3S77 V78 N84 Y85S77-Y81 WeakPolarHBondContact O-CB 3.32Å; S77-Y81 PolarHBondContact O-N 2.73Å; V78-Y81 PolarHBondContact O-N 2.82Å; Y81-N84 PolarHBondContact O-N 2.98Å; Y81-Y85 HydrophobicContact CD1-CD2 4.43Å; Y81-Y85 HydrophobicContact CD2-CE2 4.13Å; Y81-Y85 HydrophobicContact CE1-CD2 4.16Å; Y81-Y85 HydrophobicContact CE1-CE2 4.19Å; Y81-Y85 HydrophobicContact CE2-CD2 4.27Å; Y81-Y85 AromaticContact CE2-CE2 3.6Å; Y81-Y85 HydrophobicContact CE2-CE2 3.6Å; Y81-Y85 AromaticContact CZ-CE2 3.62Å; Y81-Y85 VanDerWaalsContact O-CD2 3.3Å; Y81-Y85 WeakPolarHBondContact O-CD2 3.48Å; Y81-Y85 PolarHBondContact O-N 2.98Å
82Y72.2Confident68.4Low103 Ų10390.2 Ų90.240%0.40444%0.444SS..Hα-helixtrans-68.9-36.6-179.8-79.8-81.2000113V78 N84 Y85 G86 F87 L89V78-Y82 HydrophobicContact CG1-CD2 3.75Å; V78-Y82 HydrophobicContact CG1-CE2 3.9Å; V78-Y82 WeakPolarHBondContact O-CD2 3.37Å; V78-Y82 PolarHBondContact O-N 3.5Å; Y82-N84 VanDerWaalsContact C-N 3.29Å; Y82-N84 PolarHBondContact O-N 3.22Å; Y82-Y85 CarbonylContact O-C 3.48Å; Y82-Y85 PolarHBondContact O-N 3.41Å; Y82-Y85 VanDerWaalsContact O-N 3.13Å; Y82-G86 PolarHBondContact O-N 3.13Å; Y82-F87 HydrophobicContact CD1-CB 4.41Å; Y82-F87 HydrophobicContact CD1-CD2 4.01Å; Y82-F87 HydrophobicContact CD1-CG 4.3Å; Y82-F87 PolarHBondContact O-N 3.34Å; Y82-F87 VanDerWaalsContact O-N 3.07Å; Y82-L89 HydrophobicContact CD2-CD1 3.95Å; Y82-L89 HydrophobicContact CG-CD1 3.72Å
83N75.4Confident68.8Low60 Ų6089.5 Ų89.532%0.32144%0.439SS..Hα-helixtrans-60.8-39.1172.9-113.514.7000111.9Y79 Y85 G86 F87Y79-N83 VanDerWaalsContact O-CB 3.32Å; Y79-N83 WeakPolarHBondContact O-CB 3.35Å; Y79-N83 PolarHBondContact O-N 3.5Å; Y79-N83 PolarHBondContact OH-ND2 3.22Å; N83-Y85 PolarHBondContact O-N 3.1Å; N83-G86 PolarHBondContact O-N 3.47Å; N83-G86 VanDerWaalsContact O-N 3.11Å; N83-F87 PolarHBondContact OD1-O 3.44Å
84N77.8Confident68.8Low138 Ų13892.6 Ų92.674%0.73844%0.444SS*.Hα-helixtrans-66.5-22.5178.3-73.8-6.5000112.9R80 Y81 Y82R80-N84 WeakPolarHBondContact O-CB 3.33Å; R80-N84 PolarHBondContact O-N 3.16Å; R80-N84 PolarHBondContact O-ND2 3.36Å; R80-N84 PolarHBondContact O-OD1 3.26Å; Y81-N84 PolarHBondContact O-N 2.98Å; Y82-N84 VanDerWaalsContact C-N 3.29Å; Y82-N84 PolarHBondContact O-N 3.22Å
85Y76.7Confident68.4Low156 Ų15695.4 Ų95.461%0.61245%0.45SS*.THydrogen-bonded Turntrans-96.214.2174-75.7-78.8000113.5Y81 Y82 N83Y81-Y85 HydrophobicContact CD1-CD2 4.43Å; Y81-Y85 HydrophobicContact CD2-CE2 4.13Å; Y81-Y85 HydrophobicContact CE1-CD2 4.16Å; Y81-Y85 HydrophobicContact CE1-CE2 4.19Å; Y81-Y85 HydrophobicContact CE2-CD2 4.27Å; Y81-Y85 AromaticContact CE2-CE2 3.6Å; Y81-Y85 HydrophobicContact CE2-CE2 3.6Å; Y81-Y85 AromaticContact CZ-CE2 3.62Å; Y81-Y85 VanDerWaalsContact O-CD2 3.3Å; Y81-Y85 WeakPolarHBondContact O-CD2 3.48Å; Y81-Y85 PolarHBondContact O-N 2.98Å; Y82-Y85 CarbonylContact O-C 3.48Å; Y82-Y85 PolarHBondContact O-N 3.41Å; Y82-Y85 VanDerWaalsContact O-N 3.13Å; N83-Y85 PolarHBondContact O-N 3.1Å
86G70.7Confident68.1Low71 Ų7197.5 Ų97.573%0.73246%0.462SS*.THydrogen-bonded Turntrans83.57.317400000115.6Y82 N83Y82-G86 PolarHBondContact O-N 3.13Å; N83-G86 PolarHBondContact O-N 3.47Å; N83-G86 VanDerWaalsContact O-N 3.11Å
87F67.8Low67.5Low124 Ų12495.4 Ų95.454%0.54446%0.455SS..  trans-87.8106.4172-64.4-86.8000109.9Y82 N83 L89Y82-F87 HydrophobicContact CD1-CB 4.41Å; Y82-F87 HydrophobicContact CD1-CD2 4.01Å; Y82-F87 HydrophobicContact CD1-CG 4.3Å; Y82-F87 PolarHBondContact O-N 3.34Å; Y82-F87 VanDerWaalsContact O-N 3.07Å; N83-F87 PolarHBondContact OD1-O 3.44Å; F87-L89 VanDerWaalsContact C-N 3.31Å; F87-L89 PolarHBondContact O-N 2.95Å
88D73.6Confident66.9Low117 Ų11798.3 Ų98.363%0.62647%0.465SS*.  trans-71.186.8172.4-177.314000110.6G90D88-G90 PolarHBondContact O-N 3.36Å; D88-G90 VanDerWaalsContact OD1-CA 3.29Å; D88-G90 WeakPolarHBondContact OD1-CA 3.4Å; D88-G90 PolarHBondContact OD1-N 3.5Å
89L66.5Low66.4Low45 Ų4597.8 Ų97.824%0.23647%0.469CS..  trans-79.96.6170.3-66.3-177.3000112Y79 Y82 F87 L92 Y93Y79-L89 HydrophobicContact CD2-CB 4.16Å; Y79-L89 HydrophobicContact CE2-CB 4.49Å; Y82-L89 HydrophobicContact CD2-CD1 3.95Å; Y82-L89 HydrophobicContact CG-CD1 3.72Å; F87-L89 VanDerWaalsContact C-N 3.31Å; F87-L89 PolarHBondContact O-N 2.95Å; L89-L92 HydrophobicContact CD2-CD2 3.99Å; L89-L92 PolarHBondContact O-N 2.95Å; L89-L92 VanDerWaalsContact O-N 3.16Å; L89-Y93 WeakPolarHBondContact O-CB 3.32Å; L89-Y93 PolarHBondContact O-N 2.93Å
90G67.2Low66.1Low4 Ų4103.8 Ų103.84%0.04149%0.492CS..Hα-helixtrans-51.8-45.2-179.300000114.5D88 R94D88-G90 PolarHBondContact O-N 3.36Å; D88-G90 VanDerWaalsContact OD1-CA 3.29Å; D88-G90 WeakPolarHBondContact OD1-CA 3.4Å; D88-G90 PolarHBondContact OD1-N 3.5Å; G90-R94 WeakPolarHBondContact O-CB 3.39Å; G90-R94 PolarHBondContact O-N 3.23Å
91P66.3Low65.5Low73 Ų7398.1 Ų98.147%0.47447%0.472SS..Hα-helixtrans-67.9-41.7175.8-20.832.9000113.1R94 R95P91-R94 PolarHBondContact O-N 2.74Å; P91-R95 VanDerWaalsContact O-CB 3.28Å; P91-R95 WeakPolarHBondContact O-CB 3.41Å; P91-R95 PolarHBondContact O-N 2.83Å
92L61.6Low65.2Low95 Ų9596 Ų9650%0.49747%0.466SS..Hα-helixtrans-68.5-44.2178.2-175.471.7000111L89 R95 L96L89-L92 HydrophobicContact CD2-CD2 3.99Å; L89-L92 PolarHBondContact O-N 2.95Å; L89-L92 VanDerWaalsContact O-N 3.16Å; L92-R95 PolarHBondContact O-N 3.45Å; L92-L96 HydrophobicContact CD1-CD1 4.1Å; L92-L96 HydrophobicContact CD1-CG 4.23Å; L92-L96 HydrophobicContact CD2-CD1 4.26Å; L92-L96 HydrophobicContact CG-CD1 3.78Å; L92-L96 HydrophobicContact CG-CG 4.26Å; L92-L96 VanDerWaalsContact O-CB 3.29Å; L92-L96 WeakPolarHBondContact O-CB 3.48Å; L92-L96 VanDerWaalsContact O-CG 3.31Å; L92-L96 WeakPolarHBondContact O-CG 3.3Å; L92-L96 PolarHBondContact O-N 3.47Å
93Y61.8Low65.1Low57 Ų5795.6 Ų95.622%0.22446%0.464CS..Hα-helixtrans-58.6-48173177.4-97.8000110.2Y79 L89 R95 Y97Y79-Y93 HydrophobicContact CD2-CD1 4.46Å; Y79-Y93 HydrophobicContact CD2-CD2 4.01Å; Y79-Y93 AromaticContact CD2-CG 3.8Å; Y79-Y93 HydrophobicContact CD2-CG 3.8Å; Y79-Y93 HydrophobicContact CE2-CD1 4.44Å; Y79-Y93 HydrophobicContact CE2-CG 4.15Å; Y79-Y93 AromaticContact CG-CD2 4Å; Y79-Y93 HydrophobicContact CG-CD2 4Å; Y79-Y93 HydrophobicContact CG-CE2 4.42Å; Y79-Y93 HydrophobicContact CG-CG 4.19Å; L89-Y93 WeakPolarHBondContact O-CB 3.32Å; L89-Y93 PolarHBondContact O-N 2.93Å; Y93-R95 PolarHBondContact O-N 2.82Å; Y93-Y97 HydrophobicContact CE1-CG 4.49Å; Y93-Y97 HydrophobicContact CE2-CD2 4.07Å; Y93-Y97 AromaticContact CZ-CD2 3.96Å; Y93-Y97 WeakPolarHBondContact O-CA 3.42Å; Y93-Y97 WeakPolarHBondContact O-CB 3.1Å; Y93-Y97 PolarHBondContact O-N 3.02Å
94R62.1Low64.9Low159 Ų15997.7 Ų97.760%0.647%0.471SS*.Hα-helixtrans-60.2-45.7172.9-99.2-173.9-80-120.5-5.2112.2G90 P91 L98G90-R94 WeakPolarHBondContact O-CB 3.39Å; G90-R94 PolarHBondContact O-N 3.23Å; P91-R94 PolarHBondContact O-N 2.74Å; R94-L98 HydrophobicContact CB-CD1 3.95Å; R94-L98 HydrophobicContact CG-CD1 3.65Å; R94-L98 HydrophobicContact CG-CG 4.43Å; R94-L98 WeakPolarHBondContact O-CA 3.2Å; R94-L98 WeakPolarHBondContact O-CB 3.37Å; R94-L98 VanDerWaalsContact O-CG 3.23Å; R94-L98 WeakPolarHBondContact O-CG 3.37Å; R94-L98 PolarHBondContact O-N 3.45Å
95R56.4Low64.8Low197 Ų19792.5 Ų92.574%0.74344%0.444SS*.Hα-helixtrans-69.2-40.6-176.2-164.2-178.8-71.7-169.3-2.3112.4P91 L92 Y93 G99P91-R95 VanDerWaalsContact O-CB 3.28Å; P91-R95 WeakPolarHBondContact O-CB 3.41Å; P91-R95 PolarHBondContact O-N 2.83Å; L92-R95 PolarHBondContact O-N 3.45Å; Y93-R95 PolarHBondContact O-N 2.82Å; R95-G99 VanDerWaalsContact O-CA 3.25Å; R95-G99 WeakPolarHBondContact O-CA 2.82Å; R95-G99 PolarHBondContact O-N 3.03Å
96L52Low65Low86 Ų8685.1 Ų85.145%0.4542%0.415SS..Iπ-helixtrans-68.4-52.8173.8-69.4173.5000110.2L92 F101L92-L96 HydrophobicContact CD1-CD1 4.1Å; L92-L96 HydrophobicContact CD1-CG 4.23Å; L92-L96 HydrophobicContact CD2-CD1 4.26Å; L92-L96 HydrophobicContact CG-CD1 3.78Å; L92-L96 HydrophobicContact CG-CG 4.26Å; L92-L96 VanDerWaalsContact O-CB 3.29Å; L92-L96 WeakPolarHBondContact O-CB 3.48Å; L92-L96 VanDerWaalsContact O-CG 3.31Å; L92-L96 WeakPolarHBondContact O-CG 3.3Å; L92-L96 PolarHBondContact O-N 3.47Å; L96-F101 WeakPolarHBondContact O-CA 3.46Å; L96-F101 WeakPolarHBondContact O-CB 3.31Å; L96-F101 PolarHBondContact O-N 3.49Å
97Y52.7Low65.9Low63 Ų6385.1 Ų85.125%0.24740%0.398CS..Iπ-helixtrans-69.8-36.6-175.3-161.6-88.2000113.6K72 Y93 F101K72-Y97 WeakPolarHBondContact CE-OH 3.4Å; Y93-Y97 HydrophobicContact CE1-CG 4.49Å; Y93-Y97 HydrophobicContact CE2-CD2 4.07Å; Y93-Y97 AromaticContact CZ-CD2 3.96Å; Y93-Y97 WeakPolarHBondContact O-CA 3.42Å; Y93-Y97 WeakPolarHBondContact O-CB 3.1Å; Y93-Y97 PolarHBondContact O-N 3.02Å; Y97-F101 HydrophobicContact CD2-CD1 4.45Å
98L57Low67.1Low125 Ų12581.9 Ų81.965%0.65439%0.386SS*.Iπ-helixtrans-91-24.7178.3-60.2169000113.5R94R94-L98 HydrophobicContact CB-CD1 3.95Å; R94-L98 HydrophobicContact CG-CD1 3.65Å; R94-L98 HydrophobicContact CG-CG 4.43Å; R94-L98 WeakPolarHBondContact O-CA 3.2Å; R94-L98 WeakPolarHBondContact O-CB 3.37Å; R94-L98 VanDerWaalsContact O-CG 3.23Å; R94-L98 WeakPolarHBondContact O-CG 3.37Å; R94-L98 PolarHBondContact O-N 3.45Å
99G58.3Low68.1Low36 Ų3676.5 Ų76.537%0.37136%0.357SS..Iπ-helixtrans-82.7-89.1-176.400000112.5R95R95-G99 VanDerWaalsContact O-CA 3.25Å; R95-G99 WeakPolarHBondContact O-CA 2.82Å; R95-G99 PolarHBondContact O-N 3.03Å
100Y61.3Low69.4Low192 Ų19278.5 Ų78.575%0.75336%0.364SS*.Iπ-helixtrans-103.8-28.4-172-61.9-75.4000113.8H102 W103Y100-H102 PolarHBondContact O-N 3.27Å; Y100-W103 PolarHBondContact O-N 3.09Å; Y100-W103 VanDerWaalsContact O-N 3.16Å
101F63.3Low70.6Confident32 Ų3282 Ų8214%0.1438%0.376CS..Hα-helixtrans-65.6-25.1-177.1-166.4-105.8000112.9M71 M75 L96 Y97 W103 F104 V105M71-F101 HydrophobicContact CB-CZ 4.45Å; M71-F101 HydrophobicContact CE-CE2 3.47Å; M71-F101 VanDerWaalsContact CE-CE2 3.47Å; M71-F101 HydrophobicContact CE-CZ 3.59Å; M75-F101 HydrophobicContact CE-CB 4.41Å; M75-F101 HydrophobicContact CE-CD1 3.35Å; M75-F101 HydrophobicContact CE-CD2 3.51Å; M75-F101 HydrophobicContact CE-CE1 3.22Å; M75-F101 HydrophobicContact CE-CE2 3.41Å; M75-F101 VanDerWaalsContact CE-CE2 3.41Å; M75-F101 HydrophobicContact CE-CG 3.49Å; M75-F101 VanDerWaalsContact CE-CG 3.49Å; M75-F101 HydrophobicContact CE-CZ 3.27Å; L96-F101 WeakPolarHBondContact O-CA 3.46Å; L96-F101 WeakPolarHBondContact O-CB 3.31Å; L96-F101 PolarHBondContact O-N 3.49Å; Y97-F101 HydrophobicContact CD2-CD1 4.45Å; F101-W103 PolarHBondContact O-N 2.88Å; F101-F104 HydrophobicContact CD2-CB 4.48Å; F101-F104 PolarHBondContact O-N 3.46Å; F101-V105 HydrophobicContact CD1-CG2 3.84Å; F101-V105 HydrophobicContact CE1-CB 4.38Å; F101-V105 HydrophobicContact CE1-CG2 3.25Å; F101-V105 HydrophobicContact CE2-CG2 4.42Å; F101-V105 HydrophobicContact CZ-CG2 3.58Å; F101-V105 PolarHBondContact O-N 2.81Å
102H69.4Low71.8Confident83 Ų8378.5 Ų78.538%0.38435%0.353SS..Hα-helixtrans-62.2-25.7177.9-168.730.8000113Y100 S106 R111Y100-H102 PolarHBondContact O-N 3.27Å; H102-S106 WeakPolarHBondContact O-CA 3.32Å; H102-S106 VanDerWaalsContact O-CB 3.32Å; H102-S106 WeakPolarHBondContact O-CB 3.46Å; H102-S106 PolarHBondContact O-N 3.26Å; H102-R111 PolarHBondContact CD2-NH1 3.27Å; H102-R111 PolarHBondContact NE2-NH1 3.34Å
103W68.5Low73.4Confident95 Ų9574 Ų7436%0.3633%0.33SS..Hα-helixtrans-68.4-41.2172.6-71.690.4000111.9Y100 F101 V105 S106 R111 L114 L115Y100-W103 PolarHBondContact O-N 3.09Å; Y100-W103 VanDerWaalsContact O-N 3.16Å; F101-W103 PolarHBondContact O-N 2.88Å; W103-V105 VanDerWaalsContact C-N 3.29Å; W103-V105 PolarHBondContact O-N 3.23Å; W103-S106 PolarHBondContact O-N 2.94Å; W103-R111 HydrophobicContact CE3-CB 4.21Å; W103-R111 HydrophobicContact CE3-CG 4.35Å; W103-R111 HydrophobicContact CH2-CG 4.12Å; W103-R111 HydrophobicContact CZ3-CB 3.89Å; W103-R111 HydrophobicContact CZ3-CG 3.85Å; W103-L114 HydrophobicContact CH2-CD1 4.39Å; W103-L114 HydrophobicContact CZ3-CB 4.5Å; W103-L115 HydrophobicContact CE3-CD1 4.35Å; W103-L115 HydrophobicContact CE3-CD2 4.12Å; W103-L115 HydrophobicContact CE3-CG 4.09Å; W103-L115 HydrophobicContact CZ3-CG 4.46Å
104F70.8Confident74.9Confident104 Ų10474.6 Ų74.646%0.45634%0.336SS..Hα-helixtrans-67.1-27.7179-67.5-81000113.7F101 W200F101-F104 HydrophobicContact CD2-CB 4.48Å; F101-F104 PolarHBondContact O-N 3.46Å; F104-W200 HydrophobicContact CB-CZ2 4.36Å; F104-W200 AromaticContact CD1-CH2 3.33Å; F104-W200 HydrophobicContact CD1-CH2 3.33Å; F104-W200 AromaticContact CD1-CZ2 3.89Å; F104-W200 HydrophobicContact CD1-CZ2 3.89Å; F104-W200 AromaticContact CD1-CZ3 3.89Å; F104-W200 HydrophobicContact CD1-CZ3 3.89Å; F104-W200 AromaticContact CE1-CH2 3.73Å; F104-W200 HydrophobicContact CE1-CH2 3.73Å; F104-W200 HydrophobicContact CE1-CZ3 4.08Å; F104-W200 HydrophobicContact CG-CH2 4.24Å; F104-W200 HydrophobicContact CG-CZ2 4.46Å; F104-W200 PolarHBondContact O-NE1 3.38Å
105V76.6Confident76.3Confident28 Ų2868.2 Ų68.217%0.1731%0.314CS..THydrogen-bonded Turntrans-115.818.3-178.4-164.70000111.6V68 F101 W103V68-V105 HydrophobicContact CG1-CG1 4.48Å; F101-V105 HydrophobicContact CD1-CG2 3.84Å; F101-V105 HydrophobicContact CE1-CB 4.38Å; F101-V105 HydrophobicContact CE1-CG2 3.25Å; F101-V105 HydrophobicContact CE2-CG2 4.42Å; F101-V105 HydrophobicContact CZ-CG2 3.58Å; F101-V105 PolarHBondContact O-N 2.81Å; W103-V105 VanDerWaalsContact C-N 3.29Å; W103-V105 PolarHBondContact O-N 3.23Å
106S81.3Confident78.2Confident2 Ų259.3 Ų59.31%0.01428%0.281CS..  trans-66.8153.8175.9-165.60000109.9H102 W103 D108 M112H102-S106 WeakPolarHBondContact O-CA 3.32Å; H102-S106 VanDerWaalsContact O-CB 3.32Å; H102-S106 WeakPolarHBondContact O-CB 3.46Å; H102-S106 PolarHBondContact O-N 3.26Å; W103-S106 PolarHBondContact O-N 2.94Å; S106-D108 PolarHBondContact OG-N 2.69Å; S106-M112 WeakPolarHBondContact O-CE 3.13Å
107L90.4Very high80.2Confident70 Ų7056.1 Ų56.137%0.36626%0.263SS..  trans-122.5-2.1167.5-64.7178.3000111H109 P192 R193L107-H109 PolarHBondContact O-N 3.47Å; L107-P192 HydrophobicContact CB-CB 3.99Å; L107-R193 HydrophobicContact CD1-CG 4.29Å; L107-R193 HydrophobicContact CD2-CG 4.18Å
108D91.1Very high81.9Confident57 Ų5757.8 Ų57.831%0.30528%0.279SS..  trans-71.5125.2-174.4173.184.1000110.7S106 K110 R111 M112S106-D108 PolarHBondContact OG-N 2.69Å; D108-K110 VanDerWaalsContact C-N 3.26Å; D108-K110 PolarHBondContact O-N 2.96Å; D108-K110 WeakPolarHBondContact OD2-CA 3.4Å; D108-K110 VanDerWaalsContact OD2-CB 3.32Å; D108-K110 WeakPolarHBondContact OD2-CB 3.26Å; D108-K110 PolarHBondContact OD2-N 3.22Å; D108-K110 VanDerWaalsContact OD2-N 3.12Å; D108-R111 HydrophobicContact CB-CB 4.4Å; D108-R111 HydrophobicContact CB-CG 4.49Å; D108-R111 PolarHBondContact O-N 3.29Å; D108-R111 PolarHBondContact OD2-N 2.91Å; D108-M112 WeakPolarHBondContact O-CG 2.97Å; D108-M112 PolarHBondContact O-N 3.37Å
109H95.3Very high83.5Confident3 Ų353.3 Ų53.31%0.01426%0.255CS..Hα-helixtrans-58.5-33.8-177.672.9102.6000113.9L107 M112 G113 N177 Y178 P181 D188 L189L107-H109 PolarHBondContact O-N 3.47Å; H109-M112 PolarHBondContact O-N 3.36Å; H109-G113 PolarHBondContact O-N 3.08Å; H109-N177 WeakPolarHBondContact CB-O 3.39Å; H109-N177 PolarHBondContact ND1-O 3.14Å; H109-Y178 PolarHBondContact CE1-O 3.21Å; H109-Y178 PolarHBondContact ND1-O 3.19Å; H109-P181 HydrophobicContact CB-CG 4.2Å; H109-D188 VanDerWaalsContact CB-OD1 3.27Å; H109-D188 WeakPolarHBondContact CB-OD1 3.41Å; H109-D188 IonicContact CD2-OD1 3.27Å; H109-D188 IonicContact CG-OD1 3.44Å; H109-D188 PolarHBondContact N-OD1 3.36Å; H109-L189 HydrophobicContact CB-CD1 4.25Å; H109-L189 HydrophobicContact CB-CG 4.36Å
110K94.5Very high85.3Confident87 Ų8751.6 Ų51.638%0.37824%0.237SC..Hα-helixtrans-68.9-46-178.8-52.5-177-166.6-175.40110.2D108 G113 L114 Y178 M182D108-K110 VanDerWaalsContact C-N 3.26Å; D108-K110 PolarHBondContact O-N 2.96Å; D108-K110 WeakPolarHBondContact OD2-CA 3.4Å; D108-K110 VanDerWaalsContact OD2-CB 3.32Å; D108-K110 WeakPolarHBondContact OD2-CB 3.26Å; D108-K110 PolarHBondContact OD2-N 3.22Å; D108-K110 VanDerWaalsContact OD2-N 3.12Å; K110-G113 PolarHBondContact O-N 2.85Å; K110-L114 WeakPolarHBondContact O-CG 3.3Å; K110-L114 PolarHBondContact O-N 3.48Å; K110-Y178 HydrophobicContact CB-CD2 4Å; K110-Y178 HydrophobicContact CB-CE2 3.78Å; K110-Y178 HydrophobicContact CG-CE2 4.39Å; K110-Y178 WeakPolarHBondContact O-CD2 3.34Å; K110-M182 HydrophobicContact CD-CE 3.75Å; K110-M182 HydrophobicContact CG-CE 4.03Å
111R91.2Very high86.7Confident78 Ų7844.7 Ų44.729%0.29421%0.213SC..Hα-helixtrans-65.6-37.9175.4-69.5-174-170.5161.16.2112.6H102 W103 D108 G113 L114 L115H102-R111 PolarHBondContact CD2-NH1 3.27Å; H102-R111 PolarHBondContact NE2-NH1 3.34Å; W103-R111 HydrophobicContact CE3-CB 4.21Å; W103-R111 HydrophobicContact CE3-CG 4.35Å; W103-R111 HydrophobicContact CH2-CG 4.12Å; W103-R111 HydrophobicContact CZ3-CB 3.89Å; W103-R111 HydrophobicContact CZ3-CG 3.85Å; D108-R111 HydrophobicContact CB-CB 4.4Å; D108-R111 HydrophobicContact CB-CG 4.49Å; D108-R111 PolarHBondContact O-N 3.29Å; D108-R111 PolarHBondContact OD2-N 2.91Å; R111-G113 VanDerWaalsContact C-N 3.34Å; R111-L114 PolarHBondContact O-N 3.06Å; R111-L115 WeakPolarHBondContact O-CG 3.33Å; R111-L115 PolarHBondContact O-N 3.24Å
112M92.4Very high87.9Confident0 Ų049.6 Ų49.60%023%0.231CC..Hα-helixtrans-60.2-46.4171.8-68.8-61157.200111S106 D108 H109 L114 L115 Y116 L199S106-M112 WeakPolarHBondContact O-CE 3.13Å; D108-M112 WeakPolarHBondContact O-CG 2.97Å; D108-M112 PolarHBondContact O-N 3.37Å; H109-M112 PolarHBondContact O-N 3.36Å; M112-L114 PolarHBondContact O-N 3.05Å; M112-L115 PolarHBondContact O-N 3.41Å; M112-Y116 VanDerWaalsContact O-CD2 3.24Å; M112-Y116 WeakPolarHBondContact O-CD2 3.37Å; M112-Y116 PolarHBondContact O-N 2.96Å; M112-L199 HydrophobicContact CB-CD1 4.31Å; M112-L199 VanDerWaalsContact O-CD1 3.24Å; M112-L199 WeakPolarHBondContact O-CD1 3.26Å; M112-L199 HydrophobicContact SD-CB 4.16Å; M112-L199 HydrophobicContact SD-CD1 3.77Å; M112-L199 HydrophobicContact SD-CD2 4.44Å; M112-L199 HydrophobicContact SD-CG 4.35Å
113G95.2Very high88.9Confident0 Ų045.6 Ų45.60%021%0.212CC..Hα-helixtrans-55.9-47.217400000112.4H109 K110 R111 L115 Y116 F117 G174H109-G113 PolarHBondContact O-N 3.08Å; K110-G113 PolarHBondContact O-N 2.85Å; R111-G113 VanDerWaalsContact C-N 3.34Å; G113-L115 PolarHBondContact O-N 3.32Å; G113-Y116 WeakPolarHBondContact O-CB 3.31Å; G113-Y116 PolarHBondContact O-N 3.45Å; G113-F117 WeakPolarHBondContact O-CD2 3.48Å; G113-F117 PolarHBondContact O-N 3.42Å; G113-G174 WeakPolarHBondContact CA-O 3.42Å; G113-G174 WeakPolarHBondContact O-CA 3.25Å
114L92.2Very high90Very high69 Ų6941.2 Ų41.236%0.36120%0.196SC..Hα-helixtrans-61.3-40176.5-69.3173.8000113.3W103 K110 R111 M112 F117 V118 Y178W103-L114 HydrophobicContact CH2-CD1 4.39Å; W103-L114 HydrophobicContact CZ3-CB 4.5Å; K110-L114 WeakPolarHBondContact O-CG 3.3Å; K110-L114 PolarHBondContact O-N 3.48Å; R111-L114 PolarHBondContact O-N 3.06Å; M112-L114 PolarHBondContact O-N 3.05Å; L114-F117 HydrophobicContact CD2-CD2 4.43Å; L114-F117 WeakPolarHBondContact O-CB 3.45Å; L114-F117 PolarHBondContact O-N 3.38Å; L114-V118 WeakPolarHBondContact O-CG2 3.48Å; L114-V118 PolarHBondContact O-N 2.96Å; L114-V118 VanDerWaalsContact O-N 3.12Å; L114-Y178 HydrophobicContact CD1-CE2 4.49Å; L114-Y178 HydrophobicContact CD2-CE2 4.28Å; L114-Y178 HydrophobicContact CG-CD2 4.36Å; L114-Y178 HydrophobicContact CG-CE2 4.14Å
115L92.8Very high91Very high26 Ų2638.7 Ų38.714%0.13619%0.185CC..Hα-helixtrans-66.7-38.5175.2-73.6173.2000111.8W103 R111 M112 G113 F117 V118 F119 L199 W200W103-L115 HydrophobicContact CE3-CD1 4.35Å; W103-L115 HydrophobicContact CE3-CD2 4.12Å; W103-L115 HydrophobicContact CE3-CG 4.09Å; W103-L115 HydrophobicContact CZ3-CG 4.46Å; R111-L115 WeakPolarHBondContact O-CG 3.33Å; R111-L115 PolarHBondContact O-N 3.24Å; M112-L115 PolarHBondContact O-N 3.41Å; G113-L115 PolarHBondContact O-N 3.32Å; L115-F117 VanDerWaalsContact C-N 3.32Å; L115-F117 PolarHBondContact O-N 3.31Å; L115-V118 PolarHBondContact O-N 2.72Å; L115-F119 WeakPolarHBondContact O-CD2 3.5Å; L115-F119 PolarHBondContact O-N 2.9Å; L115-L199 HydrophobicContact CB-CD1 3.42Å; L115-L199 VanDerWaalsContact CB-CD1 3.42Å; L115-L199 HydrophobicContact CB-CD2 4.34Å; L115-L199 HydrophobicContact CB-CG 4.45Å; L115-L199 HydrophobicContact CD1-CD1 4.22Å; L115-L199 HydrophobicContact CD1-CD2 4.23Å; L115-L199 HydrophobicContact CG-CD1 4.48Å; L115-W200 HydrophobicContact CD1-CZ2 4.26Å
116Y96.4Very high91.8Very high10 Ų1038.7 Ų38.74%0.03918%0.184CC..Hα-helixtrans-61.6-37.8171.4-85.3-68000112.5M112 G113 V118 F119 G120 P169 G173 N177 S198 L199 M202M112-Y116 VanDerWaalsContact O-CD2 3.24Å; M112-Y116 WeakPolarHBondContact O-CD2 3.37Å; M112-Y116 PolarHBondContact O-N 2.96Å; G113-Y116 WeakPolarHBondContact O-CB 3.31Å; G113-Y116 PolarHBondContact O-N 3.45Å; Y116-V118 VanDerWaalsContact C-N 3.33Å; Y116-V118 PolarHBondContact O-N 2.88Å; Y116-F119 PolarHBondContact O-N 3.29Å; Y116-G120 WeakPolarHBondContact O-CA 3.4Å; Y116-G120 PolarHBondContact O-N 2.94Å; Y116-P169 HydrophobicContact CD1-CB 4.26Å; Y116-G173 VanDerWaalsContact CB-C 3.42Å; Y116-G173 VanDerWaalsContact CD2-C 3.46Å; Y116-G173 WeakPolarHBondContact CD2-O 3.29Å; Y116-G173 VanDerWaalsContact CG-C 3.44Å; Y116-N177 VanDerWaalsContact CE2-ND2 3.3Å; Y116-N177 WeakPolarHBondContact CE2-ND2 3.49Å; Y116-S198 VanDerWaalsContact OH-C 3.23Å; Y116-S198 WeakPolarHBondContact OH-CB 3.4Å; Y116-S198 PolarHBondContact OH-OG 3.49Å; Y116-L199 HydrophobicContact CD2-CB 4.48Å; Y116-L199 HydrophobicContact CD2-CD1 3.62Å; Y116-L199 HydrophobicContact CD2-CG 4.37Å; Y116-L199 HydrophobicContact CE1-CB 4.38Å; Y116-L199 HydrophobicContact CE1-CG 4.48Å; Y116-L199 HydrophobicContact CE2-CB 3.75Å; Y116-L199 HydrophobicContact CE2-CD1 3.75Å; Y116-L199 HydrophobicContact CE2-CG 4.12Å; Y116-L199 HydrophobicContact CG-CD1 4.03Å; Y116-L199 VanDerWaalsContact OH-CA 3.24Å; Y116-L199 WeakPolarHBondContact OH-CA 3.24Å; Y116-L199 PolarHBondContact OH-N 2.74Å; Y116-M202 HydrophobicContact CE1-CG 4.12Å
117F93.4Very high92.4Very high19 Ų1938.6 Ų38.68%0.08318%0.183CC..Hα-helixtrans-59.9-42.8171.9-78.8-69.9000112G113 L114 L115 G120 L121 I170 F175 M490G113-F117 WeakPolarHBondContact O-CD2 3.48Å; G113-F117 PolarHBondContact O-N 3.42Å; L114-F117 HydrophobicContact CD2-CD2 4.43Å; L114-F117 WeakPolarHBondContact O-CB 3.45Å; L114-F117 PolarHBondContact O-N 3.38Å; L115-F117 VanDerWaalsContact C-N 3.32Å; L115-F117 PolarHBondContact O-N 3.31Å; F117-G120 PolarHBondContact O-N 3.06Å; F117-L121 VanDerWaalsContact O-CB 3.29Å; F117-L121 WeakPolarHBondContact O-CB 3.5Å; F117-L121 VanDerWaalsContact O-CG 3.24Å; F117-L121 WeakPolarHBondContact O-CG 3.47Å; F117-L121 PolarHBondContact O-N 2.93Å; F117-I170 HydrophobicContact CD1-CG2 3.81Å; F117-I170 HydrophobicContact CE1-CG2 3.59Å; F117-F175 AromaticContact CE1-CD2 3.81Å; F117-F175 HydrophobicContact CE1-CD2 3.81Å; F117-F175 HydrophobicContact CE1-CE1 4.07Å; F117-F175 AromaticContact CE1-CE2 3.31Å; F117-F175 HydrophobicContact CE1-CE2 3.31Å; F117-F175 HydrophobicContact CE1-CG 4.36Å; F117-F175 AromaticContact CE1-CZ 3.39Å; F117-F175 HydrophobicContact CE1-CZ 3.39Å; F117-F175 AromaticContact CZ-CD1 3.76Å; F117-F175 HydrophobicContact CZ-CD1 3.76Å; F117-F175 AromaticContact CZ-CD2 3.73Å; F117-F175 HydrophobicContact CZ-CD2 3.73Å; F117-F175 AromaticContact CZ-CE1 3.54Å; F117-F175 HydrophobicContact CZ-CE1 3.54Å; F117-F175 AromaticContact CZ-CE2 3.55Å; F117-F175 HydrophobicContact CZ-CE2 3.55Å; F117-F175 AromaticContact CZ-CG 3.8Å; F117-F175 HydrophobicContact CZ-CG 3.8Å; F117-F175 AromaticContact CZ-CZ 3.38Å; F117-F175 HydrophobicContact CZ-CZ 3.38Å; F117-M490 HydrophobicContact CE2-SD 4.39Å
118V89.1Confident92.5Very high97 Ų9736.8 Ų36.859%0.58817%0.174SC*.Hα-helixtrans-63.2-50.9178.2173.80000111.1L114 L115 Y116 G120 W122L114-V118 WeakPolarHBondContact O-CG2 3.48Å; L114-V118 PolarHBondContact O-N 2.96Å; L114-V118 VanDerWaalsContact O-N 3.12Å; L115-V118 PolarHBondContact O-N 2.72Å; Y116-V118 VanDerWaalsContact C-N 3.33Å; Y116-V118 PolarHBondContact O-N 2.88Å; V118-G120 VanDerWaalsContact C-N 3.34Å; V118-G120 PolarHBondContact O-N 2.97Å; V118-W122 WeakPolarHBondContact O-CB 3.38Å; V118-W122 PolarHBondContact O-N 2.91Å
119F90.8Very high92.6Very high32 Ų3235.7 Ų35.714%0.1418%0.176CC..Hα-helixtrans-61.8-43.5177.7-71.3-58.3000112.1L115 Y116 W122 G123 L199 W200 V203 I206L115-F119 WeakPolarHBondContact O-CD2 3.5Å; L115-F119 PolarHBondContact O-N 2.9Å; Y116-F119 PolarHBondContact O-N 3.29Å; F119-W122 PolarHBondContact O-N 3.24Å; F119-G123 PolarHBondContact O-N 3.06Å; F119-L199 HydrophobicContact CE2-CD2 3.85Å; F119-L199 HydrophobicContact CE2-CG 4.29Å; F119-W200 HydrophobicContact CZ-CZ3 4.35Å; F119-V203 HydrophobicContact CE1-CG2 3.77Å; F119-V203 HydrophobicContact CE2-CG2 4.31Å; F119-V203 HydrophobicContact CZ-CG2 3.47Å; F119-V203 VanDerWaalsContact CZ-CG2 3.47Å; F119-I206 HydrophobicContact CB-CD1 4.37Å; F119-I206 HydrophobicContact CD1-CD1 4.05Å
120G95Very high92.6Very high0 Ų036.1 Ų36.10%018%0.178CC..Hα-helixtrans-61.6-50.3178.900000112.6Y116 F117 V118 W122 G123 G124 F165 F166Y116-G120 WeakPolarHBondContact O-CA 3.4Å; Y116-G120 PolarHBondContact O-N 2.94Å; F117-G120 PolarHBondContact O-N 3.06Å; V118-G120 VanDerWaalsContact C-N 3.34Å; V118-G120 PolarHBondContact O-N 2.97Å; G120-W122 VanDerWaalsContact C-N 3.3Å; G120-W122 PolarHBondContact O-N 3.17Å; G120-G123 PolarHBondContact O-N 2.93Å; G120-G124 PolarHBondContact O-N 3.22Å; G120-F165 WeakPolarHBondContact CA-O 3.39Å; G120-F166 WeakPolarHBondContact O-CD2 3.46Å
121L90.4Very high92.6Very high46 Ų4633.2 Ų33.224%0.24117%0.169CC..Hα-helixtrans-61.3-41.4177.5-74.1172.9000111F117 G124 F125 I170F117-L121 VanDerWaalsContact O-CB 3.29Å; F117-L121 WeakPolarHBondContact O-CB 3.5Å; F117-L121 VanDerWaalsContact O-CG 3.24Å; F117-L121 WeakPolarHBondContact O-CG 3.47Å; F117-L121 PolarHBondContact O-N 2.93Å; L121-G124 PolarHBondContact O-N 2.98Å; L121-F125 VanDerWaalsContact O-CD2 3.32Å; L121-F125 WeakPolarHBondContact O-CD2 3.43Å; L121-F125 PolarHBondContact O-N 2.96Å; L121-I170 HydrophobicContact CD2-CD1 4.08Å; L121-I170 HydrophobicContact CG-CD1 4.2Å
122W88.1Confident92.8Very high135 Ų13531.8 Ų31.851%0.51117%0.167SC..Hα-helixtrans-61-48.5176.6-176.746000112.2V118 F119 G120 G124 F125 I126 I206V118-W122 WeakPolarHBondContact O-CB 3.38Å; V118-W122 PolarHBondContact O-N 2.91Å; F119-W122 PolarHBondContact O-N 3.24Å; G120-W122 VanDerWaalsContact C-N 3.3Å; G120-W122 PolarHBondContact O-N 3.17Å; W122-G124 VanDerWaalsContact C-N 3.27Å; W122-G124 PolarHBondContact O-N 3.38Å; W122-F125 PolarHBondContact O-N 2.95Å; W122-I126 HydrophobicContact CD2-CD1 4.08Å; W122-I126 HydrophobicContact CG-CD1 4.41Å; W122-I126 HydrophobicContact CZ2-CD1 4.09Å; W122-I126 WeakPolarHBondContact O-CG1 3.35Å; W122-I126 PolarHBondContact O-N 3.18Å; W122-I206 HydrophobicContact CE3-CD1 4.13Å; W122-I206 HydrophobicContact CE3-CG2 4.13Å; W122-I206 HydrophobicContact CH2-CG2 3.72Å; W122-I206 HydrophobicContact CZ3-CB 4.22Å; W122-I206 HydrophobicContact CZ3-CD1 4.09Å; W122-I206 HydrophobicContact CZ3-CG2 3.35Å
123G91.8Very high92.9Very high0 Ų035 Ų350%018%0.184CC..Hα-helixtrans-60.7-35.1173.400000113.2F119 G120 I126 G127 F165F119-G123 PolarHBondContact O-N 3.06Å; G120-G123 PolarHBondContact O-N 2.93Å; G123-I126 PolarHBondContact O-N 3.13Å; G123-G127 PolarHBondContact O-N 3.09Å; G123-F165 WeakPolarHBondContact CA-O 3.5Å
124G92.1Very high92.9Very high2 Ų236 Ų362%0.02119%0.189CC..Hα-helixtrans-62.5-43.5173.900000112.9G120 L121 W122 G127 L128 F166G120-G124 PolarHBondContact O-N 3.22Å; L121-G124 PolarHBondContact O-N 2.98Å; W122-G124 VanDerWaalsContact C-N 3.27Å; W122-G124 PolarHBondContact O-N 3.38Å; G124-G127 PolarHBondContact O-N 3.15Å; G124-L128 WeakPolarHBondContact O-CB 3.34Å; G124-L128 WeakPolarHBondContact O-CG 3.5Å; G124-L128 PolarHBondContact O-N 3.34Å; G124-F166 VanDerWaalsContact CA-CD2 3.46Å; G124-F166 VanDerWaalsContact CA-CG 3.46Å
125F90.8Very high93Very high51 Ų5133.4 Ų33.422%0.22417%0.174CC..Hα-helixtrans-72.2-30.4176.9-85.5-83.3000113.2L121 W122 L128 G129 F556 L559L121-F125 VanDerWaalsContact O-CD2 3.32Å; L121-F125 WeakPolarHBondContact O-CD2 3.43Å; L121-F125 PolarHBondContact O-N 2.96Å; W122-F125 PolarHBondContact O-N 2.95Å; F125-L128 HydrophobicContact CD1-CD1 4.42Å; F125-L128 HydrophobicContact CE1-CD1 4.38Å; F125-G129 PolarHBondContact O-N 3.38Å; F125-F556 HydrophobicContact CD1-CE1 4.09Å; F125-F556 HydrophobicContact CD1-CZ 4.03Å; F125-F556 AromaticContact CE1-CD1 3.83Å; F125-F556 HydrophobicContact CE1-CD1 3.83Å; F125-F556 HydrophobicContact CE1-CD2 4.33Å; F125-F556 AromaticContact CE1-CE1 3.63Å; F125-F556 HydrophobicContact CE1-CE1 3.63Å; F125-F556 HydrophobicContact CE1-CE2 4.16Å; F125-F556 HydrophobicContact CE1-CG 4.18Å; F125-F556 AromaticContact CE1-CZ 3.81Å; F125-F556 HydrophobicContact CE1-CZ 3.81Å; F125-F556 HydrophobicContact CZ-CD1 4.47Å; F125-L559 HydrophobicContact CD2-CD1 4.27Å; F125-L559 HydrophobicContact CE1-CD1 3.99Å; F125-L559 HydrophobicContact CE2-CD1 3.38Å; F125-L559 HydrophobicContact CE2-CD2 3.98Å; F125-L559 HydrophobicContact CE2-CG 3.68Å; F125-L559 HydrophobicContact CZ-CD1 3.21Å; F125-L559 HydrophobicContact CZ-CD2 4.36Å; F125-L559 HydrophobicContact CZ-CG 3.56Å
126I93.2Very high93Very high28 Ų2835.3 Ų35.314%0.14418%0.184CC..Hα-helixtrans-60.3-53.3167-68.2158.4000109.2W122 G123 L128 G129 L130 A161 M209 E210W122-I126 HydrophobicContact CD2-CD1 4.08Å; W122-I126 HydrophobicContact CG-CD1 4.41Å; W122-I126 HydrophobicContact CZ2-CD1 4.09Å; W122-I126 WeakPolarHBondContact O-CG1 3.35Å; W122-I126 PolarHBondContact O-N 3.18Å; G123-I126 PolarHBondContact O-N 3.13Å; I126-L128 VanDerWaalsContact C-N 3.34Å; I126-L128 PolarHBondContact O-N 3.31Å; I126-G129 PolarHBondContact O-N 3.21Å; I126-G129 VanDerWaalsContact O-N 3.14Å; I126-L130 HydrophobicContact CG2-CD1 4.06Å; I126-L130 HydrophobicContact CG2-CG 4.48Å; I126-L130 VanDerWaalsContact O-CG 3.32Å; I126-L130 WeakPolarHBondContact O-CG 3.1Å; I126-L130 PolarHBondContact O-N 3.04Å; I126-A161 HydrophobicContact CG2-CB 4.32Å; I126-M209 HydrophobicContact CD1-CE 4.4Å; I126-M209 HydrophobicContact CG2-CE 4.15Å; I126-E210 VanDerWaalsContact CD1-OE1 3.31Å; I126-E210 WeakPolarHBondContact CD1-OE1 3.49Å
127G94.7Very high92.9Very high0 Ų034.9 Ų34.90%018%0.183CC..Hα-helixtrans-58.1-41.3178.700000113.7G123 G124 L130 S131 H158G123-G127 PolarHBondContact O-N 3.09Å; G124-G127 PolarHBondContact O-N 3.15Å; G127-L130 PolarHBondContact O-N 3.25Å; G127-S131 PolarHBondContact O-N 3.12Å; G127-H158 PolarHBondContact O-ND1 2.94Å
128L91.6Very high93Very high32 Ų3234.1 Ų34.117%0.16818%0.18CC..Hα-helixtrans-67.5-37.4175.2-74.6173.4000112.9G124 F125 I126 S131 L132G124-L128 WeakPolarHBondContact O-CB 3.34Å; G124-L128 WeakPolarHBondContact O-CG 3.5Å; G124-L128 PolarHBondContact O-N 3.34Å; F125-L128 HydrophobicContact CD1-CD1 4.42Å; F125-L128 HydrophobicContact CE1-CD1 4.38Å; I126-L128 VanDerWaalsContact C-N 3.34Å; I126-L128 PolarHBondContact O-N 3.31Å; L128-S131 PolarHBondContact O-N 2.89Å; L128-S131 PolarHBondContact O-OG 3.12Å; L128-L132 WeakPolarHBondContact O-CB 3.32Å; L128-L132 PolarHBondContact O-N 3.26Å
129G93.1Very high93.1Very high34 Ų3431.6 Ų31.635%0.35117%0.166SC..Hα-helixtrans-64-43.517400000111.8F125 I126 L132 L133F125-G129 PolarHBondContact O-N 3.38Å; I126-G129 PolarHBondContact O-N 3.21Å; I126-G129 VanDerWaalsContact O-N 3.14Å; G129-L132 PolarHBondContact O-N 3.43Å; G129-L133 PolarHBondContact O-N 2.89Å; G129-L133 VanDerWaalsContact O-N 3.14Å
130L96Very high93.2Very high12 Ų1233.4 Ų33.46%0.06318%0.177CC..Hα-helixtrans-64.6-41.5176.6-62.3173.7000111.8I126 G127 L132 L133 I134 L154 N157 H158 L213I126-L130 HydrophobicContact CG2-CD1 4.06Å; I126-L130 HydrophobicContact CG2-CG 4.48Å; I126-L130 VanDerWaalsContact O-CG 3.32Å; I126-L130 WeakPolarHBondContact O-CG 3.1Å; I126-L130 PolarHBondContact O-N 3.04Å; G127-L130 PolarHBondContact O-N 3.25Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 3.31Å; L130-L133 PolarHBondContact O-N 3.25Å; L130-I134 WeakPolarHBondContact O-CG1 3.5Å; L130-I134 PolarHBondContact O-N 2.8Å; L130-I134 VanDerWaalsContact O-N 3.09Å; L130-L154 HydrophobicContact CD2-CD2 3.4Å; L130-N157 HydrophobicContact CD1-CB 3.75Å; L130-H158 HydrophobicContact CB-CB 3.91Å; L130-H158 HydrophobicContact CD1-CB 4.41Å; L130-L213 HydrophobicContact CD2-CD2 4.13Å
131S95.5Very high93Very high27 Ų2733.8 Ų33.819%0.18918%0.179CC..Hα-helixtrans-66.1-36.4176.770.20000112.6G127 L128 I134 R135G127-S131 PolarHBondContact O-N 3.12Å; L128-S131 PolarHBondContact O-N 2.89Å; L128-S131 PolarHBondContact O-OG 3.12Å; S131-I134 PolarHBondContact O-N 2.88Å; S131-R135 WeakPolarHBondContact O-CG 3.32Å; S131-R135 PolarHBondContact O-N 3.16Å
132L94.3Very high92.9Very high47 Ų4737.7 Ų37.725%0.24619%0.192CC..Hα-helixtrans-60.6-46.3174.2-177.960.7000111L128 G129 L130 I134 R135 L136 V549 V552L128-L132 WeakPolarHBondContact O-CB 3.32Å; L128-L132 PolarHBondContact O-N 3.26Å; G129-L132 PolarHBondContact O-N 3.43Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-L132 PolarHBondContact O-N 3.31Å; L132-I134 VanDerWaalsContact C-N 3.33Å; L132-I134 PolarHBondContact O-N 2.92Å; L132-R135 PolarHBondContact O-N 3.29Å; L132-R135 VanDerWaalsContact O-N 3.17Å; L132-L136 HydrophobicContact CD1-CD1 4.23Å; L132-L136 HydrophobicContact CD1-CG 4.13Å; L132-L136 HydrophobicContact CG-CD1 3.93Å; L132-L136 HydrophobicContact CG-CG 4.26Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.29Å; L132-L136 PolarHBondContact O-N 2.79Å; L132-V549 HydrophobicContact CD1-CG2 4.07Å; L132-V552 HydrophobicContact CB-CG2 4.16Å; L132-V552 HydrophobicContact CD1-CG2 4.36Å; L132-V552 HydrophobicContact CD2-CG1 4.46Å
133L94.7Very high92.4Very high68 Ų6836.3 Ų36.336%0.35619%0.187SC..Hα-helixtrans-61.6-40.3177.6-69.6173.6000112.2G129 L130 L136 N137 L145 L154G129-L133 PolarHBondContact O-N 2.89Å; G129-L133 VanDerWaalsContact O-N 3.14Å; L130-L133 PolarHBondContact O-N 3.25Å; L133-L136 PolarHBondContact O-N 2.78Å; L133-N137 WeakPolarHBondContact O-CB 3.4Å; L133-N137 PolarHBondContact O-N 3.39Å; L133-L145 HydrophobicContact CD2-CD2 4.43Å; L133-L154 HydrophobicContact CB-CD1 3.72Å; L133-L154 HydrophobicContact CD1-CD1 4.33Å; L133-L154 HydrophobicContact CD1-CD2 3.9Å
134I95.7Very high91.6Very high21 Ų2144 Ų4411%0.10822%0.22CC..Hα-helixtrans-59.6-47.9173.6-67163.8000110.1L130 S131 L132 N137 L138 Y151 L154 V155 H158L130-I134 WeakPolarHBondContact O-CG1 3.5Å; L130-I134 PolarHBondContact O-N 2.8Å; L130-I134 VanDerWaalsContact O-N 3.09Å; S131-I134 PolarHBondContact O-N 2.88Å; L132-I134 VanDerWaalsContact C-N 3.33Å; L132-I134 PolarHBondContact O-N 2.92Å; I134-N137 PolarHBondContact O-N 2.81Å; I134-L138 HydrophobicContact CG2-CD1 4.06Å; I134-L138 WeakPolarHBondContact O-CG 3.39Å; I134-L138 PolarHBondContact O-N 3.19Å; I134-L138 VanDerWaalsContact O-N 3.09Å; I134-Y151 HydrophobicContact CB-CE2 4.47Å; I134-Y151 HydrophobicContact CG1-CE2 4.46Å; I134-Y151 HydrophobicContact CG2-CE2 3.92Å; I134-L154 HydrophobicContact CD1-CB 4.27Å; I134-L154 HydrophobicContact CG1-CB 3.96Å; I134-V155 HydrophobicContact CD1-CB 4.47Å; I134-V155 HydrophobicContact CD1-CG2 3.85Å; I134-V155 HydrophobicContact CG1-CG2 4.19Å; I134-H158 HydrophobicContact CD1-CB 4.12Å
135R94.5Very high91.5Very high15 Ų1547.6 Ų47.66%0.05724%0.239CC..Hα-helixtrans-66.6-38.5-180-72.4-48.1-41.8173.94.5113.3S131 L132 L138 C139 N541 S545S131-R135 WeakPolarHBondContact O-CG 3.32Å; S131-R135 PolarHBondContact O-N 3.16Å; L132-R135 PolarHBondContact O-N 3.29Å; L132-R135 VanDerWaalsContact O-N 3.17Å; R135-L138 CarbonylContact O-C 3.59Å; R135-L138 PolarHBondContact O-N 3.22Å; R135-C139 PolarHBondContact O-N 3.19Å; R135-C139 VanDerWaalsContact O-N 3.15Å; R135-C139 PolarHBondContact O-SG 3.34Å; R135-C139 VanDerWaalsContact O-SG 3.36Å; R135-N541 PolarHBondContact NH1-OD1 3.41Å; R135-N541 VanDerWaalsContact NH1-OD1 3.14Å; R135-N541 PolarHBondContact NH2-O 2.94Å; R135-N541 PolarHBondContact NH2-OD1 2.98Å; R135-S545 PolarHBondContact NE-OG 3.39Å; R135-S545 VanDerWaalsContact NH2-N 3.16Å; R135-S545 PolarHBondContact NH2-OG 3.42Å; R135-S545 PolarHBondContact O-OG 3.11Å
136L92.8Very high91.6Very high65 Ų6546.6 Ų46.634%0.3424%0.237SC..Hα-helixtrans-66.3-40.2175.7-70.3175.2000111.6L132 L133 L138 C139 L145L132-L136 HydrophobicContact CD1-CD1 4.23Å; L132-L136 HydrophobicContact CD1-CG 4.13Å; L132-L136 HydrophobicContact CG-CD1 3.93Å; L132-L136 HydrophobicContact CG-CG 4.26Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.29Å; L132-L136 PolarHBondContact O-N 2.79Å; L133-L136 PolarHBondContact O-N 2.78Å; L136-L138 PolarHBondContact O-N 2.72Å; L136-C139 WeakPolarHBondContact O-CB 3.49Å; L136-C139 PolarHBondContact O-N 3.25Å; L136-L145 HydrophobicContact CB-CD2 3.84Å
137N93.9Very high91.6Very high1 Ų148.2 Ų48.21%0.00525%0.251CS..Hα-helixtrans-62.6-34.9174.3-168.583.1000111.7L133 I134 C139 Y143 L145 V146 Y151 S531L133-N137 WeakPolarHBondContact O-CB 3.4Å; L133-N137 PolarHBondContact O-N 3.39Å; I134-N137 PolarHBondContact O-N 2.81Å; N137-C139 VanDerWaalsContact C-N 3.34Å; N137-Y143 PolarHBondContact ND2-O 2.88Å; N137-L145 HydrophobicContact CB-CB 4.28Å; N137-L145 PolarHBondContact OD1-N 2.94Å; N137-V146 HydrophobicContact CB-CG2 4.38Å; N137-V146 PolarHBondContact OD1-N 3.22Å; N137-Y151 HydrophobicContact CB-CD2 4.42Å; N137-S531 PolarHBondContact ND2-O 3.36Å; N137-S531 VanDerWaalsContact ND2-O 3.13Å
138L94.5Very high91.5Very high4 Ų451.5 Ų51.52%0.02127%0.271CS..THydrogen-bonded Turntrans-84.81.6178.5-64.2172.9000113.4I134 R135 L136 D140 Y151 W461 Y533 N541I134-L138 HydrophobicContact CG2-CD1 4.06Å; I134-L138 WeakPolarHBondContact O-CG 3.39Å; I134-L138 PolarHBondContact O-N 3.19Å; I134-L138 VanDerWaalsContact O-N 3.09Å; R135-L138 CarbonylContact O-C 3.59Å; R135-L138 PolarHBondContact O-N 3.22Å; L136-L138 PolarHBondContact O-N 2.72Å; L138-D140 PolarHBondContact O-N 3.07Å; L138-D140 VanDerWaalsContact O-N 3.12Å; L138-Y151 HydrophobicContact CG-CE2 4.42Å; L138-W461 HydrophobicContact CD1-CH2 4.03Å; L138-W461 HydrophobicContact CD1-CZ2 4.04Å; L138-Y533 HydrophobicContact CB-CE1 4.39Å; L138-Y533 HydrophobicContact CD2-CD1 4Å; L138-Y533 HydrophobicContact CD2-CE1 4.32Å; L138-Y533 WeakPolarHBondContact O-CE1 3.4Å; L138-Y533 PolarHBondContact O-OH 3.5Å; L138-N541 PolarHBondContact O-ND2 3Å
139C92.3Very high91.5Very high44 Ų4454.8 Ų54.830%0.29729%0.288SS..THydrogen-bonded Turntrans-60.3-25.2-178.2-80.80000114.3R135 L136 N137 Y538 S545R135-C139 PolarHBondContact O-N 3.19Å; R135-C139 VanDerWaalsContact O-N 3.15Å; R135-C139 PolarHBondContact O-SG 3.34Å; R135-C139 VanDerWaalsContact O-SG 3.36Å; L136-C139 WeakPolarHBondContact O-CB 3.49Å; L136-C139 PolarHBondContact O-N 3.25Å; N137-C139 VanDerWaalsContact C-N 3.34Å; C139-Y538 WeakPolarHBondContact O-CE2 3.36Å; C139-S545 PolarHBondContact SG-OG 3.24Å
140D92.2Very high91.5Very high69 Ų6955.7 Ų55.737%0.36929%0.287SS..SBendtrans-138.8145.7-178.8-172.442.4000109.6L138 Y142 Y143 Y538L138-D140 PolarHBondContact O-N 3.07Å; L138-D140 VanDerWaalsContact O-N 3.12Å; D140-Y142 PolarHBondContact O-N 3.41Å; D140-Y143 HydrophobicContact CB-CG 4.26Å; D140-Y143 WeakPolarHBondContact O-CB 3.42Å; D140-Y143 PolarHBondContact O-N 3.11Å; D140-Y538 HydrophobicContact CB-CE2 4.34Å; D140-Y538 WeakPolarHBondContact OD1-CE2 3.17Å
141P90.9Very high91.5Very high9 Ų955.5 Ų55.56%0.05829%0.286CS..THydrogen-bonded Turntrans-67.2135.4-174.7-20.738.5000109.1Y143 Y533 Q535 Y538P141-Y143 PolarHBondContact O-N 3.46Å; P141-Y533 HydrophobicContact CB-CD2 4.49Å; P141-Y533 HydrophobicContact CB-CE2 4.13Å; P141-Y533 WeakPolarHBondContact CB-O 2.9Å; P141-Y533 HydrophobicContact CG-CD2 4.47Å; P141-Y533 HydrophobicContact CG-CE2 3.71Å; P141-Q535 VanDerWaalsContact CB-OE1 3.29Å; P141-Y538 VanDerWaalsContact CD-CD2 3.49Å; P141-Y538 HydrophobicContact CG-CD2 3.79Å; P141-Y538 HydrophobicContact CG-CG 4.31Å
142Y88.1Confident91.4Very high128 Ų12856 Ų5650%0.50229%0.286SS..THydrogen-bonded Turntrans57.713.8-175.5-44.4-79.9000115.2D140 C532 D534D140-Y142 PolarHBondContact O-N 3.41Å; Y142-C532 HydrophobicContact CD1-CB 3.67Å; Y142-C532 HydrophobicContact CE1-CB 4.21Å; Y142-C532 HydrophobicContact CG-CB 4.37Å; Y142-D534 PolarHBondContact OH-OD1 3.2Å
143Y77.1Confident91.4Very high105 Ų10557 Ų5741%0.41229%0.287SS..  trans-68.6133.6174.5-176.5-112.8000110.8N137 D140 P141 L145N137-Y143 PolarHBondContact ND2-O 2.88Å; D140-Y143 HydrophobicContact CB-CG 4.26Å; D140-Y143 WeakPolarHBondContact O-CB 3.42Å; D140-Y143 PolarHBondContact O-N 3.11Å; P141-Y143 PolarHBondContact O-N 3.46Å; Y143-L145 HydrophobicContact CD1-CB 4.28Å; Y143-L145 HydrophobicContact CE1-CB 3.75Å; Y143-L145 HydrophobicContact CE1-CD1 4.5Å
144K76Confident91.5Very high161 Ų16154.1 Ų54.170%0.727%0.272SS*.  trans-119.477.4-176.3-64-178.5-174.8178.30109.4V146K144-V146 VanDerWaalsContact C-N 3.26Å
145L90.5Very high91.5Very high78 Ų7854.4 Ų54.441%0.40828%0.275SS..SBendtrans-64.1-41.1165.8-177.865.6000109.9L133 L136 N137 Y143L133-L145 HydrophobicContact CD2-CD2 4.43Å; L136-L145 HydrophobicContact CB-CD2 3.84Å; N137-L145 HydrophobicContact CB-CB 4.28Å; N137-L145 PolarHBondContact OD1-N 2.94Å; Y143-L145 HydrophobicContact CD1-CB 4.28Å; Y143-L145 HydrophobicContact CE1-CB 3.75Å; Y143-L145 HydrophobicContact CE1-CD1 4.5Å
146V92.5Very high91.6Very high31 Ų3153.7 Ų53.719%0.18827%0.272CS..SBendtrans-124.4159.6177.6-63.90000110.4N137 K144 V150 L154N137-V146 HydrophobicContact CB-CG2 4.38Å; N137-V146 PolarHBondContact OD1-N 3.22Å; K144-V146 VanDerWaalsContact C-N 3.26Å; V146-V150 HydrophobicContact CB-CB 4.12Å; V146-V150 HydrophobicContact CB-CG1 3.83Å; V146-V150 HydrophobicContact CG1-CG1 4.03Å; V146-V150 HydrophobicContact CG2-CG1 4.38Å; V146-L154 HydrophobicContact CG1-CD1 4.49Å; V146-L154 HydrophobicContact CG2-CD1 4.16Å
147S93.2Very high91.8Very high61 Ų6150.7 Ų50.743%0.42726%0.256SS..  trans-66.2161.7172.470.60000111.2D149 V150 Y151S147-D149 VanDerWaalsContact C-N 3.28Å; S147-D149 PolarHBondContact O-N 3.05Å; S147-V150 PolarHBondContact O-N 2.68Å; S147-V150 VanDerWaalsContact OG-CG2 3.28Å; S147-V150 WeakPolarHBondContact OG-CG2 3.19Å; S147-V150 PolarHBondContact OG-N 3.37Å; S147-Y151 PolarHBondContact O-N 2.85Å
148V92.6Very high91.9Very high70 Ų7051.9 Ų51.942%0.42426%0.262SS..Hα-helixtrans-60.6-39.2179.3-176.40000111.3Y151 N152V148-Y151 WeakPolarHBondContact O-CB 3.29Å; V148-Y151 PolarHBondContact O-N 2.76Å; V148-N152 PolarHBondContact O-N 3.16Å; V148-N152 VanDerWaalsContact O-N 3.13Å; V148-N152 PolarHBondContact O-ND2 2.91Å
149D91.3Very high92Very high100 Ų10052.2 Ų52.254%0.53527%0.266SS..Hα-helixtrans-64.7-47.8177.4-55.8-45.1000111.3S147 Y151 N152 Y153S147-D149 VanDerWaalsContact C-N 3.28Å; S147-D149 PolarHBondContact O-N 3.05Å; D149-Y151 VanDerWaalsContact C-N 3.3Å; D149-Y151 PolarHBondContact O-N 2.99Å; D149-N152 WeakPolarHBondContact O-CB 3.33Å; D149-N152 PolarHBondContact O-N 3.41Å; D149-N152 VanDerWaalsContact O-N 3.09Å; D149-Y153 HydrophobicContact CB-CE1 4.4Å; D149-Y153 HydrophobicContact CB-CE2 4.33Å; D149-Y153 WeakPolarHBondContact O-CD1 2.9Å; D149-Y153 WeakPolarHBondContact O-CE1 3.49Å; D149-Y153 VanDerWaalsContact O-CG 3.22Å; D149-Y153 PolarHBondContact O-N 3.2Å
150V93.4Very high92.2Very high54 Ų5450.1 Ų50.133%0.32725%0.252SS..Hα-helixtrans-61.5-40.9177.6173.30000110.4V146 S147 N152 Y153 L154V146-V150 HydrophobicContact CB-CB 4.12Å; V146-V150 HydrophobicContact CB-CG1 3.83Å; V146-V150 HydrophobicContact CG1-CG1 4.03Å; V146-V150 HydrophobicContact CG2-CG1 4.38Å; S147-V150 PolarHBondContact O-N 2.68Å; S147-V150 VanDerWaalsContact OG-CG2 3.28Å; S147-V150 WeakPolarHBondContact OG-CG2 3.19Å; S147-V150 PolarHBondContact OG-N 3.37Å; V150-N152 VanDerWaalsContact C-N 3.3Å; V150-N152 PolarHBondContact O-N 2.79Å; V150-Y153 HydrophobicContact CG2-CD2 4.35Å; V150-Y153 WeakPolarHBondContact O-CA 3.31Å; V150-Y153 WeakPolarHBondContact O-CB 3.29Å; V150-Y153 PolarHBondContact O-N 3.14Å; V150-L154 HydrophobicContact CG1-CD1 4.48Å; V150-L154 HydrophobicContact CG1-CG 4.35Å; V150-L154 VanDerWaalsContact O-CG 3.32Å; V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.67Å
151Y95.1Very high92.4Very high8 Ų846.8 Ų46.83%0.03123%0.234CC..Hα-helixtrans-55-45.6174178.7-93.8000112I134 N137 L138 S147 V148 D149 Y153 L154 V155 V530I134-Y151 HydrophobicContact CB-CE2 4.47Å; I134-Y151 HydrophobicContact CG1-CE2 4.46Å; I134-Y151 HydrophobicContact CG2-CE2 3.92Å; N137-Y151 HydrophobicContact CB-CD2 4.42Å; L138-Y151 HydrophobicContact CG-CE2 4.42Å; S147-Y151 PolarHBondContact O-N 2.85Å; V148-Y151 WeakPolarHBondContact O-CB 3.29Å; V148-Y151 PolarHBondContact O-N 2.76Å; D149-Y151 VanDerWaalsContact C-N 3.3Å; D149-Y151 PolarHBondContact O-N 2.99Å; Y151-Y153 VanDerWaalsContact C-N 3.3Å; Y151-Y153 PolarHBondContact O-N 3.22Å; Y151-L154 WeakPolarHBondContact O-CB 3.1Å; Y151-L154 PolarHBondContact O-N 2.64Å; Y151-V155 HydrophobicContact CD1-CG2 4.1Å; Y151-V155 HydrophobicContact CE1-CG2 3.71Å; Y151-V155 HydrophobicContact CE2-CG2 4.43Å; Y151-V155 WeakPolarHBondContact O-CG2 3.26Å; Y151-V155 PolarHBondContact O-N 3.22Å; Y151-V530 VanDerWaalsContact CE1-C 3.42Å; Y151-V530 VanDerWaalsContact CE1-O 3.28Å; Y151-V530 WeakPolarHBondContact CE1-O 3.25Å; Y151-V530 VanDerWaalsContact CZ-O 3.27Å; Y151-V530 PolarHBondContact OH-O 2.86Å
152N94.4Very high92.7Very high36 Ų3648.1 Ų48.119%0.19324%0.24CC..Hα-helixtrans-66-32.1176.7-71-30.4000112.6V148 D149 V150 T156 R529V148-N152 PolarHBondContact O-N 3.16Å; V148-N152 VanDerWaalsContact O-N 3.13Å; V148-N152 PolarHBondContact O-ND2 2.91Å; D149-N152 WeakPolarHBondContact O-CB 3.33Å; D149-N152 PolarHBondContact O-N 3.41Å; D149-N152 VanDerWaalsContact O-N 3.09Å; V150-N152 VanDerWaalsContact C-N 3.3Å; V150-N152 PolarHBondContact O-N 2.79Å; N152-T156 WeakPolarHBondContact O-CB 3.26Å; N152-T156 PolarHBondContact O-N 3.01Å; N152-T156 PolarHBondContact O-OG1 3.09Å; N152-R529 PolarHBondContact OD1-O 2.61Å
153Y94.8Very high93.1Very high68 Ų6842.4 Ų42.427%0.26722%0.218SC..Hα-helixtrans-65.6-42.1173.4-53.8-16.4000111.3D149 V150 Y151 N157 C217D149-Y153 HydrophobicContact CB-CE1 4.4Å; D149-Y153 HydrophobicContact CB-CE2 4.33Å; D149-Y153 WeakPolarHBondContact O-CD1 2.9Å; D149-Y153 WeakPolarHBondContact O-CE1 3.49Å; D149-Y153 VanDerWaalsContact O-CG 3.22Å; D149-Y153 PolarHBondContact O-N 3.2Å; V150-Y153 HydrophobicContact CG2-CD2 4.35Å; V150-Y153 WeakPolarHBondContact O-CA 3.31Å; V150-Y153 WeakPolarHBondContact O-CB 3.29Å; V150-Y153 PolarHBondContact O-N 3.14Å; Y151-Y153 VanDerWaalsContact C-N 3.3Å; Y151-Y153 PolarHBondContact O-N 3.22Å; Y153-N157 WeakPolarHBondContact O-CB 3.41Å; Y153-N157 PolarHBondContact O-N 3.45Å; Y153-N157 PolarHBondContact O-ND2 3.1Å; Y153-C217 WeakPolarHBondContact CA-O 3.01Å; Y153-C217 VanDerWaalsContact CD1-N 3.33Å
154L95.2Very high94Very high9 Ų938.2 Ų38.25%0.04720%0.202CC..Hα-helixtrans-62.9-48.3176-61.9176.4000111L130 L133 I134 V146 V150 Y151 T156 N157 H158L130-L154 HydrophobicContact CD2-CD2 3.4Å; L133-L154 HydrophobicContact CB-CD1 3.72Å; L133-L154 HydrophobicContact CD1-CD1 4.33Å; L133-L154 HydrophobicContact CD1-CD2 3.9Å; I134-L154 HydrophobicContact CD1-CB 4.27Å; I134-L154 HydrophobicContact CG1-CB 3.96Å; V146-L154 HydrophobicContact CG1-CD1 4.49Å; V146-L154 HydrophobicContact CG2-CD1 4.16Å; V150-L154 HydrophobicContact CG1-CD1 4.48Å; V150-L154 HydrophobicContact CG1-CG 4.35Å; V150-L154 VanDerWaalsContact O-CG 3.32Å; V150-L154 WeakPolarHBondContact O-CG 3.43Å; V150-L154 PolarHBondContact O-N 2.67Å; Y151-L154 WeakPolarHBondContact O-CB 3.1Å; Y151-L154 PolarHBondContact O-N 2.64Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 2.85Å; L154-N157 PolarHBondContact O-N 3.09Å; L154-H158 WeakPolarHBondContact O-CB 3.48Å; L154-H158 PolarHBondContact O-N 3.07Å
155V96.6Very high95Very high26 Ų2630.6 Ų30.616%0.15817%0.169CC..Hα-helixtrans-61.7-42.5-179.8172.90000111.4I134 Y151 G159 R529I134-V155 HydrophobicContact CD1-CB 4.47Å; I134-V155 HydrophobicContact CD1-CG2 3.85Å; I134-V155 HydrophobicContact CG1-CG2 4.19Å; Y151-V155 HydrophobicContact CD1-CG2 4.1Å; Y151-V155 HydrophobicContact CE1-CG2 3.71Å; Y151-V155 HydrophobicContact CE2-CG2 4.43Å; Y151-V155 WeakPolarHBondContact O-CG2 3.26Å; Y151-V155 PolarHBondContact O-N 3.22Å; V155-G159 PolarHBondContact O-N 3.23Å; V155-R529 HydrophobicContact CG1-CG 4.13Å
156T96.9Very high95.3Very high1 Ų127.3 Ų27.31%0.00615%0.151CC..Hα-helixtrans-63.3-54178.5-580000111.2N152 L154 G159 V160 C217 G220 L240N152-T156 WeakPolarHBondContact O-CB 3.26Å; N152-T156 PolarHBondContact O-N 3.01Å; N152-T156 PolarHBondContact O-OG1 3.09Å; L154-T156 VanDerWaalsContact C-N 3.34Å; L154-T156 PolarHBondContact O-N 2.85Å; T156-G159 PolarHBondContact O-N 3.18Å; T156-V160 WeakPolarHBondContact O-CG2 3.45Å; T156-V160 PolarHBondContact O-N 3.48Å; T156-C217 WeakPolarHBondContact CB-O 3.4Å; T156-C217 WeakPolarHBondContact CG2-O 3Å; T156-C217 PolarHBondContact OG1-O 2.85Å; T156-G220 WeakPolarHBondContact OG1-CA 3.38Å; T156-G220 PolarHBondContact OG1-N 2.91Å; T156-L240 HydrophobicContact CG2-CD2 3.73Å
157N96Very high95.5Very high1 Ų126.1 Ų26.11%0.00514%0.144CC..Hα-helixtrans-73.1-28.5-176.2-75.1-75.3000112.9L130 Y153 L154 V160 A161 L213L130-N157 HydrophobicContact CD1-CB 3.75Å; Y153-N157 WeakPolarHBondContact O-CB 3.41Å; Y153-N157 PolarHBondContact O-N 3.45Å; Y153-N157 PolarHBondContact O-ND2 3.1Å; L154-N157 PolarHBondContact O-N 3.09Å; N157-V160 PolarHBondContact O-N 3.47Å; N157-A161 WeakPolarHBondContact O-CB 3.41Å; N157-A161 PolarHBondContact O-N 3.22Å; N157-L213 HydrophobicContact CB-CD1 4.17Å
158H96.2Very high95.7Very high26 Ų2623.6 Ų23.612%0.1213%0.126CC..Hα-helixtrans-58.3-51.3172.7168.864.5000111G127 L130 I134 L154 V160 A161 M162 H468G127-H158 PolarHBondContact O-ND1 2.94Å; L130-H158 HydrophobicContact CB-CB 3.91Å; L130-H158 HydrophobicContact CD1-CB 4.41Å; I134-H158 HydrophobicContact CD1-CB 4.12Å; L154-H158 WeakPolarHBondContact O-CB 3.48Å; L154-H158 PolarHBondContact O-N 3.07Å; H158-V160 PolarHBondContact O-N 3.17Å; H158-A161 PolarHBondContact O-N 3.49Å; H158-M162 VanDerWaalsContact CE1-CG 3.49Å; H158-M162 WeakPolarHBondContact CE1-CG 3.21Å; H158-M162 WeakPolarHBondContact O-CB 3.3Å; H158-M162 VanDerWaalsContact O-CG 3.24Å; H158-M162 WeakPolarHBondContact O-CG 3.41Å; H158-M162 PolarHBondContact O-N 2.85Å; H158-H468 AromaticContact NE2-NE2 3.87Å
159G96.1Very high95.9Very high11 Ų1120.6 Ų20.611%0.11311%0.107CC..Hα-helixtrans-61.1-46.117900000112.1V155 T156 M162 I163V155-G159 PolarHBondContact O-N 3.23Å; T156-G159 PolarHBondContact O-N 3.18Å; G159-M162 PolarHBondContact O-N 3.06Å; G159-I163 WeakPolarHBondContact O-CB 3.03Å; G159-I163 WeakPolarHBondContact O-CG1 3.27Å; G159-I163 PolarHBondContact O-N 2.9Å; G159-I163 VanDerWaalsContact O-N 3.1Å
160V97.5Very high96.2Very high0 Ų015.9 Ų15.90%08%0.082CC..Hα-helixtrans-63.5-46179.3170.70000111.9T156 N157 H158 M162 I163 F164 F165 M209 W221 L240 L244T156-V160 WeakPolarHBondContact O-CG2 3.45Å; T156-V160 PolarHBondContact O-N 3.48Å; N157-V160 PolarHBondContact O-N 3.47Å; H158-V160 PolarHBondContact O-N 3.17Å; V160-M162 PolarHBondContact O-N 3.02Å; V160-I163 PolarHBondContact O-N 2.91Å; V160-F164 HydrophobicContact CG1-CD2 4.2Å; V160-F164 PolarHBondContact O-N 2.93Å; V160-F165 HydrophobicContact CG1-CD2 4.08Å; V160-F165 HydrophobicContact CG1-CE2 3.75Å; V160-M209 HydrophobicContact CG1-CG 4.21Å; V160-M209 HydrophobicContact CG1-SD 4.14Å; V160-W221 HydrophobicContact CG2-CB 3.97Å; V160-L240 HydrophobicContact CB-CD1 4.47Å; V160-L240 HydrophobicContact CG1-CD1 3.98Å; V160-L240 HydrophobicContact CG2-CD1 4.18Å; V160-L240 HydrophobicContact CG2-CD2 4.42Å; V160-L244 HydrophobicContact CG1-CD2 4Å
161A96.1Very high96.3Very high0 Ų013.4 Ų13.40%07%0.067CC..Iπ-helixtrans-60-47.2178.400000111.6I126 N157 H158 I163 F165 F166 M209I126-A161 HydrophobicContact CG2-CB 4.32Å; N157-A161 WeakPolarHBondContact O-CB 3.41Å; N157-A161 PolarHBondContact O-N 3.22Å; H158-A161 PolarHBondContact O-N 3.49Å; A161-I163 PolarHBondContact O-N 3.35Å; A161-F165 CarbonylContact O-C 3.59Å; A161-F165 VanDerWaalsContact O-C 3.27Å; A161-F165 VanDerWaalsContact O-CA 3.32Å; A161-F165 WeakPolarHBondContact O-CA 3.45Å; A161-F165 WeakPolarHBondContact O-CB 3.39Å; A161-F165 PolarHBondContact O-N 3.46Å; A161-F166 PolarHBondContact O-N 3.35Å; A161-M209 HydrophobicContact CB-CE 4.41Å; A161-M209 HydrophobicContact CB-SD 4.03Å
162M96.9Very high96.4Very high36 Ų3613.7 Ų13.718%0.1777%0.069CC..Iπ-helixtrans-68.2-37.3-176.9-67.9-62.7-77.400113H158 G159 V160 F166 L167H158-M162 VanDerWaalsContact CE1-CG 3.49Å; H158-M162 WeakPolarHBondContact CE1-CG 3.21Å; H158-M162 WeakPolarHBondContact O-CB 3.3Å; H158-M162 VanDerWaalsContact O-CG 3.24Å; H158-M162 WeakPolarHBondContact O-CG 3.41Å; H158-M162 PolarHBondContact O-N 2.85Å; G159-M162 PolarHBondContact O-N 3.06Å; V160-M162 PolarHBondContact O-N 3.02Å; M162-F166 HydrophobicContact CE-CD1 3.69Å; M162-F166 HydrophobicContact CE-CE1 3.87Å; M162-F166 WeakPolarHBondContact O-CB 3.48Å; M162-F166 HydrophobicContact SD-CD1 3.83Å; M162-F166 HydrophobicContact SD-CE1 4.48Å; M162-L167 WeakPolarHBondContact O-CG 3.25Å; M162-L167 PolarHBondContact O-N 3.49Å
163I96.3Very high96.5Very high8 Ų812.3 Ų12.34%0.0416%0.063CC..Iπ-helixtrans-77.9-64.2-179.8-65.5168.9000110.1G159 V160 A161 M168 W221 E331 L335 F467G159-I163 WeakPolarHBondContact O-CB 3.03Å; G159-I163 WeakPolarHBondContact O-CG1 3.27Å; G159-I163 PolarHBondContact O-N 2.9Å; G159-I163 VanDerWaalsContact O-N 3.1Å; V160-I163 PolarHBondContact O-N 2.91Å; A161-I163 PolarHBondContact O-N 3.35Å; I163-M168 WeakPolarHBondContact O-CB 3.32Å; I163-M168 PolarHBondContact O-N 3.31Å; I163-M168 VanDerWaalsContact O-N 3.11Å; I163-W221 HydrophobicContact CD1-CE3 4.03Å; I163-W221 HydrophobicContact CD1-CH2 4.46Å; I163-W221 HydrophobicContact CD1-CZ3 3.98Å; I163-E331 HydrophobicContact CG2-CG 4.12Å; I163-L335 HydrophobicContact CG2-CD1 4.31Å; I163-F467 HydrophobicContact CD1-CZ 4.21Å
164F97Very high96.6Very high18 Ų189 Ų98%0.0795%0.05CC..Iπ-helixtrans-87.8-21-166.2-63.3-74.8000114.1V160 P169 L244 L291 F327V160-F164 HydrophobicContact CG1-CD2 4.2Å; V160-F164 PolarHBondContact O-N 2.93Å; F164-P169 VanDerWaalsContact O-CD 3.25Å; F164-P169 WeakPolarHBondContact O-CD 3.3Å; F164-P169 VanDerWaalsContact O-CG 3.23Å; F164-P169 WeakPolarHBondContact O-CG 3.35Å; F164-L244 HydrophobicContact CB-CD2 4.46Å; F164-L244 HydrophobicContact CD1-CD2 4.35Å; F164-L244 HydrophobicContact CD2-CD2 3.39Å; F164-L244 HydrophobicContact CE1-CD2 4.47Å; F164-L244 HydrophobicContact CE2-CD2 3.55Å; F164-L244 HydrophobicContact CG-CD2 3.82Å; F164-L244 HydrophobicContact CZ-CD2 4.09Å; F164-L291 HydrophobicContact CZ-CD2 4.36Å; F164-F327 HydrophobicContact CE1-CE1 4.48Å; F164-F327 AromaticContact CE1-CZ 3.78Å; F164-F327 HydrophobicContact CE1-CZ 3.78Å; F164-F327 AromaticContact CZ-CE1 3.94Å; F164-F327 HydrophobicContact CZ-CE1 3.94Å; F164-F327 AromaticContact CZ-CZ 3.69Å; F164-F327 HydrophobicContact CZ-CZ 3.69Å
165F96.8Very high96.7Very high1 Ų18.6 Ų8.60%0.0045%0.048CC..Iπ-helixtrans-118.1-2.7-174.2-59.7-73.6000114.2G120 G123 V160 A161 M202 S205 I206 M209 S243G120-F165 WeakPolarHBondContact CA-O 3.39Å; G123-F165 WeakPolarHBondContact CA-O 3.5Å; V160-F165 HydrophobicContact CG1-CD2 4.08Å; V160-F165 HydrophobicContact CG1-CE2 3.75Å; A161-F165 CarbonylContact O-C 3.59Å; A161-F165 VanDerWaalsContact O-C 3.27Å; A161-F165 VanDerWaalsContact O-CA 3.32Å; A161-F165 WeakPolarHBondContact O-CA 3.45Å; A161-F165 WeakPolarHBondContact O-CB 3.39Å; A161-F165 PolarHBondContact O-N 3.46Å; F165-M202 HydrophobicContact CD1-CE 3.48Å; F165-M202 VanDerWaalsContact CD1-CE 3.48Å; F165-M202 HydrophobicContact CE1-CE 3.69Å; F165-S205 VanDerWaalsContact CE1-OG 3.25Å; F165-S205 WeakPolarHBondContact CE1-OG 3.28Å; F165-S205 WeakPolarHBondContact CZ-OG 3.39Å; F165-I206 HydrophobicContact CD1-CB 4.36Å; F165-I206 HydrophobicContact CD1-CD1 4.08Å; F165-I206 HydrophobicContact CD1-CG1 3.2Å; F165-I206 HydrophobicContact CE1-CB 4.29Å; F165-I206 HydrophobicContact CE1-CG1 3.44Å; F165-I206 VanDerWaalsContact CE1-CG1 3.44Å; F165-I206 HydrophobicContact CG-CG1 4.12Å; F165-M209 HydrophobicContact CD2-CE 4.44Å; F165-M209 HydrophobicContact CD2-CG 4.38Å; F165-M209 HydrophobicContact CD2-SD 3.25Å; F165-M209 WeakPolarHBondContact CD2-SD 3.24Å; F165-M209 HydrophobicContact CE2-CB 3.98Å; F165-M209 HydrophobicContact CE2-CG 4Å; F165-M209 HydrophobicContact CE2-SD 3.48Å; F165-M209 WeakPolarHBondContact CE2-SD 3.36Å; F165-M209 HydrophobicContact CG-SD 4.05Å; F165-M209 HydrophobicContact CZ-CB 4.21Å; F165-M209 HydrophobicContact CZ-SD 4.43Å; F165-S243 WeakPolarHBondContact CZ-OG 3.1Å
166F96.3Very high96.7Very high8 Ų87.4 Ų7.44%0.0354%0.041CC..Iπ-helixtrans-123.5-75.5175.5174.5-132.6000112.8G120 G124 A161 M162 M168 P169 I170 Y476 M479G120-F166 WeakPolarHBondContact O-CD2 3.46Å; G124-F166 VanDerWaalsContact CA-CD2 3.46Å; G124-F166 VanDerWaalsContact CA-CG 3.46Å; A161-F166 PolarHBondContact O-N 3.35Å; M162-F166 HydrophobicContact CE-CD1 3.69Å; M162-F166 HydrophobicContact CE-CE1 3.87Å; M162-F166 WeakPolarHBondContact O-CB 3.48Å; M162-F166 HydrophobicContact SD-CD1 3.83Å; M162-F166 HydrophobicContact SD-CE1 4.48Å; F166-M168 PolarHBondContact O-N 3.3Å; F166-P169 WeakPolarHBondContact O-CD 3.44Å; F166-I170 HydrophobicContact CD2-CD1 3.52Å; F166-I170 HydrophobicContact CD2-CG1 4.45Å; F166-I170 HydrophobicContact CE2-CD1 3.4Å; F166-I170 WeakPolarHBondContact O-CB 3.29Å; F166-I170 WeakPolarHBondContact O-CG1 3.15Å; F166-I170 PolarHBondContact O-N 2.65Å; F166-I170 VanDerWaalsContact O-N 3.08Å; F166-Y476 HydrophobicContact CE1-CD2 4.03Å; F166-Y476 AromaticContact CZ-CD2 3.78Å; F166-Y476 HydrophobicContact CZ-CD2 3.78Å; F166-Y476 HydrophobicContact CZ-CE2 4.33Å; F166-M479 HydrophobicContact CE2-CE 4.22Å; F166-M479 HydrophobicContact CE2-SD 3.53Å; F166-M479 VanDerWaalsContact CE2-SD 3.53Å; F166-M479 HydrophobicContact CZ-CE 3.86Å; F166-M479 HydrophobicContact CZ-SD 3.54Å; F166-M479 VanDerWaalsContact CZ-SD 3.54Å
167L96.9Very high96.7Very high6 Ų67.5 Ų7.53%0.0314%0.041CC..Iπ-helixtrans-64.1-47.3-172.8-69.6176.5000111.2M162 I170 L171 L335 L471M162-L167 WeakPolarHBondContact O-CG 3.25Å; M162-L167 PolarHBondContact O-N 3.49Å; L167-I170 PolarHBondContact O-N 2.95Å; L167-L171 HydrophobicContact CB-CD1 4.42Å; L167-L171 HydrophobicContact CD2-CD1 4.4Å; L167-L171 VanDerWaalsContact O-CB 3.29Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.41Å; L167-L171 PolarHBondContact O-N 3.22Å; L167-L335 HydrophobicContact CB-CD1 4.45Å; L167-L335 HydrophobicContact CB-CD2 3.87Å; L167-L335 HydrophobicContact CD1-CD1 4.18Å; L167-L471 HydrophobicContact CD1-CB 4.3Å
168M96.7Very high96.7Very high9 Ų98.2 Ų8.24%0.0444%0.044CC..Hα-helixtrans-63.1-51.3-178.8-176.161.1176.100112.4I163 F166 I170 M172 G173 S251 L284 V334 L335I163-M168 WeakPolarHBondContact O-CB 3.32Å; I163-M168 PolarHBondContact O-N 3.31Å; I163-M168 VanDerWaalsContact O-N 3.11Å; F166-M168 PolarHBondContact O-N 3.3Å; M168-I170 VanDerWaalsContact C-N 3.33Å; M168-I170 PolarHBondContact O-N 2.99Å; M168-M172 HydrophobicContact CE-CB 4.03Å; M168-M172 HydrophobicContact CE-CG 3.99Å; M168-M172 VanDerWaalsContact O-CB 3.22Å; M168-M172 WeakPolarHBondContact O-CB 3.36Å; M168-M172 PolarHBondContact O-N 3.34Å; M168-M172 HydrophobicContact SD-CB 3.8Å; M168-M172 HydrophobicContact SD-CG 4.36Å; M168-G173 PolarHBondContact O-N 3.05Å; M168-S251 WeakPolarHBondContact CE-OG 3.18Å; M168-L284 HydrophobicContact CE-CD1 3.48Å; M168-L284 VanDerWaalsContact CE-CD1 3.48Å; M168-L284 HydrophobicContact CE-CD2 3.48Å; M168-L284 VanDerWaalsContact CE-CD2 3.48Å; M168-L284 HydrophobicContact CE-CG 4.1Å; M168-V334 HydrophobicContact CE-CG1 3.85Å; M168-V334 HydrophobicContact SD-CG1 3.58Å; M168-V334 VanDerWaalsContact SD-CG1 3.58Å; M168-L335 HydrophobicContact CB-CD2 3.9Å; M168-L335 HydrophobicContact SD-CD2 4.27Å
169P97.5Very high96.7Very high6 Ų67.2 Ų7.24%0.0394%0.039CC..Iπ-helixtrans-61-36.5176.5-27.637.9000113.8Y116 F164 F166 G173 G174 M202Y116-P169 HydrophobicContact CD1-CB 4.26Å; F164-P169 VanDerWaalsContact O-CD 3.25Å; F164-P169 WeakPolarHBondContact O-CD 3.3Å; F164-P169 VanDerWaalsContact O-CG 3.23Å; F164-P169 WeakPolarHBondContact O-CG 3.35Å; F166-P169 WeakPolarHBondContact O-CD 3.44Å; P169-G173 CarbonylContact O-C 3.5Å; P169-G173 VanDerWaalsContact O-C 3.24Å; P169-G173 WeakPolarHBondContact O-CA 3.4Å; P169-G173 PolarHBondContact O-N 3.12Å; P169-G174 PolarHBondContact O-N 2.94Å; P169-M202 HydrophobicContact CG-CE 3.8Å
170I96.9Very high96.8Very high1 Ų16.7 Ų6.71%0.0053%0.034CC..Iπ-helixtrans-77.1-53.3-178.5-64.5179.4000111.6F117 L121 F166 L167 M168 G174 F175 M479F117-I170 HydrophobicContact CD1-CG2 3.81Å; F117-I170 HydrophobicContact CE1-CG2 3.59Å; L121-I170 HydrophobicContact CD2-CD1 4.08Å; L121-I170 HydrophobicContact CG-CD1 4.2Å; F166-I170 HydrophobicContact CD2-CD1 3.52Å; F166-I170 HydrophobicContact CD2-CG1 4.45Å; F166-I170 HydrophobicContact CE2-CD1 3.4Å; F166-I170 WeakPolarHBondContact O-CB 3.29Å; F166-I170 WeakPolarHBondContact O-CG1 3.15Å; F166-I170 PolarHBondContact O-N 2.65Å; F166-I170 VanDerWaalsContact O-N 3.08Å; L167-I170 PolarHBondContact O-N 2.95Å; M168-I170 VanDerWaalsContact C-N 3.33Å; M168-I170 PolarHBondContact O-N 2.99Å; I170-G174 VanDerWaalsContact O-CA 3.29Å; I170-G174 WeakPolarHBondContact O-CA 3.29Å; I170-G174 PolarHBondContact O-N 3.01Å; I170-G174 VanDerWaalsContact O-N 3.11Å; I170-F175 HydrophobicContact CG2-CD2 3.91Å; I170-F175 HydrophobicContact CG2-CE2 3.65Å; I170-F175 WeakPolarHBondContact O-CD2 2.95Å; I170-F175 PolarHBondContact O-N 3.18Å; I170-M479 HydrophobicContact CB-CG 4.43Å; I170-M479 HydrophobicContact CB-SD 4.39Å; I170-M479 HydrophobicContact CD1-SD 3.55Å; I170-M479 VanDerWaalsContact CD1-SD 3.55Å; I170-M479 HydrophobicContact CG2-CG 3.55Å; I170-M479 HydrophobicContact CG2-SD 3.95Å
171L96.9Very high96.8Very high2 Ų26.7 Ų6.71%0.013%0.034CC..Iπ-helixtrans-69.6-40.6-173.6-66.8172.6000111.8L167 Y277 L335 M479 M482L167-L171 HydrophobicContact CB-CD1 4.42Å; L167-L171 HydrophobicContact CD2-CD1 4.4Å; L167-L171 VanDerWaalsContact O-CB 3.29Å; L167-L171 WeakPolarHBondContact O-CB 3.5Å; L167-L171 WeakPolarHBondContact O-CG 3.41Å; L167-L171 PolarHBondContact O-N 3.22Å; L171-Y277 WeakPolarHBondContact O-CE1 3.41Å; L171-Y277 PolarHBondContact O-OH 2.85Å; L171-Y277 VanDerWaalsContact O-OH 3.05Å; L171-L335 WeakPolarHBondContact CD1-O 3.43Å; L171-M479 HydrophobicContact CD2-CB 3.97Å; L171-M482 HydrophobicContact CD2-SD 3.66Å
172M96.3Very high96.8Very high14 Ų148.9 Ų8.97%0.0695%0.045CC..Iπ-helixtrans-94.4-52.9-178.6-160.761.4-17400112.1M168 G176 F258 Y277 T280 S281 L284M168-M172 HydrophobicContact CE-CB 4.03Å; M168-M172 HydrophobicContact CE-CG 3.99Å; M168-M172 VanDerWaalsContact O-CB 3.22Å; M168-M172 WeakPolarHBondContact O-CB 3.36Å; M168-M172 PolarHBondContact O-N 3.34Å; M168-M172 HydrophobicContact SD-CB 3.8Å; M168-M172 HydrophobicContact SD-CG 4.36Å; M172-G176 VanDerWaalsContact O-CA 3.25Å; M172-G176 WeakPolarHBondContact O-CA 3.37Å; M172-G176 PolarHBondContact O-N 3.26Å; M172-F258 HydrophobicContact CE-CD2 3.27Å; M172-F258 HydrophobicContact CE-CE2 3.49Å; M172-F258 VanDerWaalsContact CE-CE2 3.49Å; M172-F258 HydrophobicContact CE-CG 4.33Å; M172-F258 HydrophobicContact SD-CD2 4.41Å; M172-F258 HydrophobicContact SD-CE2 4.11Å; M172-Y277 HydrophobicContact CE-CD1 4.04Å; M172-Y277 HydrophobicContact SD-CD1 3.6Å; M172-Y277 HydrophobicContact SD-CE1 3.83Å; M172-T280 HydrophobicContact CE-CG2 3.97Å; M172-T280 HydrophobicContact SD-CG2 3.53Å; M172-T280 VanDerWaalsContact SD-CG2 3.53Å; M172-S281 WeakPolarHBondContact CE-OG 3.47Å; M172-L284 HydrophobicContact CE-CD1 4.3Å; M172-L284 HydrophobicContact CG-CD1 4.45Å
173G96.5Very high96.7Very high7 Ų79.2 Ų9.27%0.0725%0.045CC..Iπ-helixtrans-71.3-47.6-179.100000113.3Y116 M168 P169 N177Y116-G173 VanDerWaalsContact CB-C 3.42Å; Y116-G173 VanDerWaalsContact CD2-C 3.46Å; Y116-G173 WeakPolarHBondContact CD2-O 3.29Å; Y116-G173 VanDerWaalsContact CG-C 3.44Å; M168-G173 PolarHBondContact O-N 3.05Å; P169-G173 CarbonylContact O-C 3.5Å; P169-G173 VanDerWaalsContact O-C 3.24Å; P169-G173 WeakPolarHBondContact O-CA 3.4Å; P169-G173 PolarHBondContact O-N 3.12Å; G173-N177 WeakPolarHBondContact O-CB 3.25Å; G173-N177 PolarHBondContact O-N 3.35Å; G173-N177 PolarHBondContact O-ND2 3.43Å
174G96.5Very high96.7Very high0 Ų09.2 Ų9.20%05%0.045CC..Iπ-helixtrans-74.1-72.6-175.500000111.7G113 P169 I170 G176 N177 Y178G113-G174 WeakPolarHBondContact CA-O 3.42Å; G113-G174 WeakPolarHBondContact O-CA 3.25Å; P169-G174 PolarHBondContact O-N 2.94Å; I170-G174 VanDerWaalsContact O-CA 3.29Å; I170-G174 WeakPolarHBondContact O-CA 3.29Å; I170-G174 PolarHBondContact O-N 3.01Å; I170-G174 VanDerWaalsContact O-N 3.11Å; G174-G176 PolarHBondContact O-N 3.43Å; G174-N177 PolarHBondContact O-N 2.85Å; G174-Y178 WeakPolarHBondContact O-CB 3.33Å; G174-Y178 PolarHBondContact O-N 3.32Å
175F97.1Very high96.7Very high0 Ų013.6 Ų13.60%08%0.077CC..Iπ-helixtrans-63.3-40.2-178.1-71.6-74000112.6F117 I170 Y178 F179 Y277 M479 M482 L483 W486 M490F117-F175 AromaticContact CE1-CD2 3.81Å; F117-F175 HydrophobicContact CE1-CD2 3.81Å; F117-F175 HydrophobicContact CE1-CE1 4.07Å; F117-F175 AromaticContact CE1-CE2 3.31Å; F117-F175 HydrophobicContact CE1-CE2 3.31Å; F117-F175 HydrophobicContact CE1-CG 4.36Å; F117-F175 AromaticContact CE1-CZ 3.39Å; F117-F175 HydrophobicContact CE1-CZ 3.39Å; F117-F175 AromaticContact CZ-CD1 3.76Å; F117-F175 HydrophobicContact CZ-CD1 3.76Å; F117-F175 AromaticContact CZ-CD2 3.73Å; F117-F175 HydrophobicContact CZ-CD2 3.73Å; F117-F175 AromaticContact CZ-CE1 3.54Å; F117-F175 HydrophobicContact CZ-CE1 3.54Å; F117-F175 AromaticContact CZ-CE2 3.55Å; F117-F175 HydrophobicContact CZ-CE2 3.55Å; F117-F175 AromaticContact CZ-CG 3.8Å; F117-F175 HydrophobicContact CZ-CG 3.8Å; F117-F175 AromaticContact CZ-CZ 3.38Å; F117-F175 HydrophobicContact CZ-CZ 3.38Å; I170-F175 HydrophobicContact CG2-CD2 3.91Å; I170-F175 HydrophobicContact CG2-CE2 3.65Å; I170-F175 WeakPolarHBondContact O-CD2 2.95Å; I170-F175 PolarHBondContact O-N 3.18Å; F175-Y178 PolarHBondContact O-N 3.26Å; F175-F179 HydrophobicContact CB-CD2 4.31Å; F175-F179 AromaticContact CD1-CD2 3.78Å; F175-F179 HydrophobicContact CD1-CD2 3.78Å; F175-F179 AromaticContact CD1-CE2 3.5Å; F175-F179 HydrophobicContact CD1-CE2 3.5Å; F175-F179 HydrophobicContact CE1-CE2 4.02Å; F175-F179 WeakPolarHBondContact O-CB 3.29Å; F175-F179 WeakPolarHBondContact O-CD2 3.49Å; F175-F179 PolarHBondContact O-N 3.45Å; F175-Y277 VanDerWaalsContact CB-OH 3.25Å; F175-Y277 WeakPolarHBondContact CB-OH 3.3Å; F175-M479 HydrophobicContact CE2-CG 4.37Å; F175-M482 HydrophobicContact CB-SD 3.98Å; F175-M482 HydrophobicContact CD1-CB 4.01Å; F175-M482 HydrophobicContact CD1-CG 3.6Å; F175-M482 HydrophobicContact CD1-SD 4.07Å; F175-M482 HydrophobicContact CD2-CB 4.05Å; F175-M482 HydrophobicContact CD2-CG 3.86Å; F175-M482 HydrophobicContact CD2-SD 3.41Å; F175-M482 WeakPolarHBondContact CD2-SD 3.49Å; F175-M482 HydrophobicContact CE1-CB 3.58Å; F175-M482 HydrophobicContact CE1-CG 3.72Å; F175-M482 HydrophobicContact CE2-CB 3.57Å; F175-M482 HydrophobicContact CE2-CG 3.92Å; F175-M482 HydrophobicContact CE2-SD 3.9Å; F175-M482 HydrophobicContact CG-CB 4.28Å; F175-M482 HydrophobicContact CG-CG 3.73Å; F175-M482 HydrophobicContact CG-SD 3.54Å; F175-M482 VanDerWaalsContact CG-SD 3.54Å; F175-M482 HydrophobicContact CZ-CB 3.39Å; F175-M482 HydrophobicContact CZ-CG 3.92Å; F175-M482 HydrophobicContact CZ-SD 4.5Å; F175-L483 HydrophobicContact CZ-CB 4.18Å; F175-W486 HydrophobicContact CD1-CE3 4.19Å; F175-W486 HydrophobicContact CE1-CE3 4.29Å; F175-M490 HydrophobicContact CE1-CE 4.41Å
176G97.6Very high96.7Very high0 Ų015 Ų150%09%0.085CC..Iπ-helixtrans-62.2-47.818000000112.2M172 G174 L180 F258 Y277M172-G176 VanDerWaalsContact O-CA 3.25Å; M172-G176 WeakPolarHBondContact O-CA 3.37Å; M172-G176 PolarHBondContact O-N 3.26Å; G174-G176 PolarHBondContact O-N 3.43Å; G176-L180 WeakPolarHBondContact O-CB 3.48Å; G176-L180 PolarHBondContact O-N 3.25Å; G176-F258 VanDerWaalsContact C-CZ 3.41Å; G176-Y277 VanDerWaalsContact CA-CZ 3.41Å; G176-Y277 PolarHBondContact N-OH 3.12Å; G176-Y277 VanDerWaalsContact N-OH 3.14Å
177N97.4Very high96.6Very high3 Ų322.4 Ų22.42%0.01612%0.124CC..Hα-helixtrans-65.9-43.2176.4-80.6-72.5000112.3H109 Y116 G173 G174 P181 L189 N195H109-N177 WeakPolarHBondContact CB-O 3.39Å; H109-N177 PolarHBondContact ND1-O 3.14Å; Y116-N177 VanDerWaalsContact CE2-ND2 3.3Å; Y116-N177 WeakPolarHBondContact CE2-ND2 3.49Å; G173-N177 WeakPolarHBondContact O-CB 3.25Å; G173-N177 PolarHBondContact O-N 3.35Å; G173-N177 PolarHBondContact O-ND2 3.43Å; G174-N177 PolarHBondContact O-N 2.85Å; N177-P181 WeakPolarHBondContact O-CD 3.45Å; N177-L189 WeakPolarHBondContact OD1-CD1 3.29Å; N177-N195 PolarHBondContact OD1-ND2 2.75Å; N177-N195 PolarHBondContact OD1-OD1 2.95Å
178Y96.2Very high96.5Very high17 Ų1724.2 Ų24.27%0.06713%0.134CC..Hα-helixtrans-66.3-46.7-175-160.4-78000111.9H109 K110 L114 G174 F175 M182 F489 M490H109-Y178 PolarHBondContact CE1-O 3.21Å; H109-Y178 PolarHBondContact ND1-O 3.19Å; K110-Y178 HydrophobicContact CB-CD2 4Å; K110-Y178 HydrophobicContact CB-CE2 3.78Å; K110-Y178 HydrophobicContact CG-CE2 4.39Å; K110-Y178 WeakPolarHBondContact O-CD2 3.34Å; L114-Y178 HydrophobicContact CD1-CE2 4.49Å; L114-Y178 HydrophobicContact CD2-CE2 4.28Å; L114-Y178 HydrophobicContact CG-CD2 4.36Å; L114-Y178 HydrophobicContact CG-CE2 4.14Å; G174-Y178 WeakPolarHBondContact O-CB 3.33Å; G174-Y178 PolarHBondContact O-N 3.32Å; F175-Y178 PolarHBondContact O-N 3.26Å; Y178-M182 HydrophobicContact CD1-CE 3.91Å; Y178-M182 HydrophobicContact CD1-SD 4.38Å; Y178-M182 HydrophobicContact CE1-CE 3.61Å; Y178-M182 HydrophobicContact CE1-SD 4.35Å; Y178-M182 WeakPolarHBondContact O-CE 3.18Å; Y178-F489 HydrophobicContact CE1-CD1 4.34Å; Y178-F489 HydrophobicContact CE1-CE1 4.06Å; Y178-M490 HydrophobicContact CD1-CG 4.22Å; Y178-M490 HydrophobicContact CD1-SD 4.4Å; Y178-M490 HydrophobicContact CE1-CB 4.49Å; Y178-M490 HydrophobicContact CE1-CG 3.66Å; Y178-M490 HydrophobicContact CE1-SD 4.37Å; Y178-M490 HydrophobicContact CE2-CG 4.36Å; Y178-M490 WeakPolarHBondContact OH-CA 3.44Å
179F96.3Very high96.5Very high4 Ų424 Ų242%0.01813%0.133CC..Hα-helixtrans-102.1-24.1-168.5-66.6-74.8000115.3F175 M182 F183 W486 F489 M490F175-F179 HydrophobicContact CB-CD2 4.31Å; F175-F179 AromaticContact CD1-CD2 3.78Å; F175-F179 HydrophobicContact CD1-CD2 3.78Å; F175-F179 AromaticContact CD1-CE2 3.5Å; F175-F179 HydrophobicContact CD1-CE2 3.5Å; F175-F179 HydrophobicContact CE1-CE2 4.02Å; F175-F179 WeakPolarHBondContact O-CB 3.29Å; F175-F179 WeakPolarHBondContact O-CD2 3.49Å; F175-F179 PolarHBondContact O-N 3.45Å; F179-M182 HydrophobicContact CD1-SD 4.11Å; F179-M182 WeakPolarHBondContact O-CB 3.18Å; F179-M182 PolarHBondContact O-N 2.86Å; F179-F183 HydrophobicContact CB-CD2 3.86Å; F179-F183 HydrophobicContact CB-CE2 3.64Å; F179-F183 HydrophobicContact CG-CE2 4.35Å; F179-F183 VanDerWaalsContact O-CD2 3.32Å; F179-F183 WeakPolarHBondContact O-CD2 3.43Å; F179-F183 PolarHBondContact O-N 3.26Å; F179-W486 HydrophobicContact CD1-CD2 4.43Å; F179-W486 HydrophobicContact CD2-CE3 4.32Å; F179-W486 HydrophobicContact CE1-CB 3.94Å; F179-W486 AromaticContact CE1-CD1 3.8Å; F179-W486 AromaticContact CE1-CD2 3.97Å; F179-W486 HydrophobicContact CE1-CD2 3.97Å; F179-W486 AromaticContact CE1-CG 3.64Å; F179-W486 HydrophobicContact CE1-CG 3.64Å; F179-W486 HydrophobicContact CE2-CB 4.21Å; F179-W486 HydrophobicContact CE2-CD2 4.18Å; F179-W486 HydrophobicContact CE2-CE3 4.02Å; F179-W486 HydrophobicContact CE2-CG 4.28Å; F179-W486 HydrophobicContact CZ-CB 3.41Å; F179-W486 VanDerWaalsContact CZ-CB 3.41Å; F179-W486 AromaticContact CZ-CD2 3.86Å; F179-W486 HydrophobicContact CZ-CD2 3.86Å; F179-W486 HydrophobicContact CZ-CE3 4.17Å; F179-W486 AromaticContact CZ-CG 3.53Å; F179-W486 HydrophobicContact CZ-CG 3.53Å; F179-F489 AromaticContact CE1-CD1 3.75Å; F179-F489 HydrophobicContact CE1-CD1 3.75Å; F179-F489 AromaticContact CE1-CE1 3.89Å; F179-F489 HydrophobicContact CE1-CE1 3.89Å; F179-F489 HydrophobicContact CZ-CD1 4.41Å; F179-M490 HydrophobicContact CE2-CG 4.45Å; F179-M490 HydrophobicContact CE2-SD 3.9Å; F179-M490 HydrophobicContact CZ-CG 3.71Å; F179-M490 HydrophobicContact CZ-SD 3.75Å
180L97.7Very high96.4Very high0 Ų028 Ų280%015%0.153CC..Hα-helixtrans-59.1-46.8-173.8-17864.5000113.2G176 M182 F183 L184 L189 F258 I262 Y277G176-L180 WeakPolarHBondContact O-CB 3.48Å; G176-L180 PolarHBondContact O-N 3.25Å; L180-M182 VanDerWaalsContact C-N 3.26Å; L180-M182 PolarHBondContact O-N 3.49Å; L180-F183 PolarHBondContact O-N 2.98Å; L180-L184 HydrophobicContact CD1-CD1 4.06Å; L180-L184 HydrophobicContact CD1-CG 4.45Å; L180-L184 HydrophobicContact CG-CD1 4.09Å; L180-L184 WeakPolarHBondContact O-CG 3.27Å; L180-L184 PolarHBondContact O-N 3.05Å; L180-L189 HydrophobicContact CD2-CD2 4.12Å; L180-F258 HydrophobicContact CD2-CB 3.85Å; L180-F258 HydrophobicContact CD2-CD1 3.8Å; L180-F258 HydrophobicContact CD2-CD2 3.68Å; L180-F258 HydrophobicContact CD2-CE1 4.29Å; L180-F258 HydrophobicContact CD2-CE2 4.21Å; L180-F258 HydrophobicContact CD2-CG 3.49Å; L180-F258 VanDerWaalsContact CD2-CG 3.49Å; L180-I262 HydrophobicContact CD1-CD1 3.98Å; L180-I262 HydrophobicContact CD1-CG1 3.81Å; L180-I262 HydrophobicContact CD2-CD1 4.07Å; L180-I262 HydrophobicContact CD2-CG1 4.04Å; L180-I262 HydrophobicContact CG-CG1 4.34Å; L180-Y277 HydrophobicContact CD1-CD2 4.19Å
181P97.4Very high96.4Very high0 Ų030 Ų300%016%0.164CC..Hα-helixtrans-59.9-37.2175-26.638.8000112.6H109 N177 L184 C185 L186 L189H109-P181 HydrophobicContact CB-CG 4.2Å; N177-P181 WeakPolarHBondContact O-CD 3.45Å; P181-L184 CarbonylContact O-C 3.6Å; P181-L184 PolarHBondContact O-N 2.91Å; P181-C185 PolarHBondContact O-N 3.14Å; P181-L186 CarbonylContact C-O 3.36Å; P181-L186 HydrophobicContact CB-CB 4.29Å; P181-L186 PolarHBondContact O-N 3Å; P181-L189 HydrophobicContact CG-CD2 3.81Å; P181-L189 HydrophobicContact CG-CG 3.74Å
182M95.1Very high96.2Very high46 Ų4631.5 Ų31.523%0.22717%0.174CC..Hα-helixtrans-66.1-45-179.6-57.1179.2178.600111.9K110 Y178 F179 L180 L184 C185 F489K110-M182 HydrophobicContact CD-CE 3.75Å; K110-M182 HydrophobicContact CG-CE 4.03Å; Y178-M182 HydrophobicContact CD1-CE 3.91Å; Y178-M182 HydrophobicContact CD1-SD 4.38Å; Y178-M182 HydrophobicContact CE1-CE 3.61Å; Y178-M182 HydrophobicContact CE1-SD 4.35Å; Y178-M182 WeakPolarHBondContact O-CE 3.18Å; F179-M182 HydrophobicContact CD1-SD 4.11Å; F179-M182 WeakPolarHBondContact O-CB 3.18Å; F179-M182 PolarHBondContact O-N 2.86Å; L180-M182 VanDerWaalsContact C-N 3.26Å; L180-M182 PolarHBondContact O-N 3.49Å; M182-L184 PolarHBondContact O-N 2.89Å; M182-C185 PolarHBondContact O-N 3.3Å; M182-F489 HydrophobicContact CE-CE1 3.91Å; M182-F489 HydrophobicContact CE-CZ 4.2Å; M182-F489 HydrophobicContact SD-CE1 3.47Å; M182-F489 WeakPolarHBondContact SD-CE1 3.42Å; M182-F489 HydrophobicContact SD-CZ 3.66Å
183F95.4Very high96Very high43 Ų4339 Ų3919%0.18920%0.202CC..Hα-helixtrans-66-19.3175.8-75-57.9000113.6F179 L180 M273 V274 H345 W486F179-F183 HydrophobicContact CB-CD2 3.86Å; F179-F183 HydrophobicContact CB-CE2 3.64Å; F179-F183 HydrophobicContact CG-CE2 4.35Å; F179-F183 VanDerWaalsContact O-CD2 3.32Å; F179-F183 WeakPolarHBondContact O-CD2 3.43Å; F179-F183 PolarHBondContact O-N 3.26Å; L180-F183 PolarHBondContact O-N 2.98Å; F183-M273 HydrophobicContact CD2-CB 3.82Å; F183-M273 HydrophobicContact CD2-CG 4.36Å; F183-M273 HydrophobicContact CE2-CB 3.7Å; F183-M273 HydrophobicContact CE2-CE 4.17Å; F183-M273 HydrophobicContact CE2-CG 3.71Å; F183-M273 HydrophobicContact CG-CB 4.35Å; F183-M273 HydrophobicContact CZ-CB 4.15Å; F183-M273 HydrophobicContact CZ-CG 3.84Å; F183-V274 HydrophobicContact CB-CG2 3.7Å; F183-H345 AromaticContact CE1-CD2 3.93Å; F183-H345 AromaticContact CE1-NE2 3.73Å; F183-W486 HydrophobicContact CE2-CZ2 4.33Å; F183-W486 HydrophobicContact CZ-CH2 4.24Å; F183-W486 AromaticContact CZ-CZ2 3.7Å; F183-W486 HydrophobicContact CZ-CZ2 3.7Å
184L97.2Very high95.8Very high8 Ų840.9 Ų40.94%0.04221%0.209CC..THydrogen-bonded Turntrans-97.20.7175.2-65.9173.2000113.1L180 P181 M182 L186 T261 I262 R265 V274L180-L184 HydrophobicContact CD1-CD1 4.06Å; L180-L184 HydrophobicContact CD1-CG 4.45Å; L180-L184 HydrophobicContact CG-CD1 4.09Å; L180-L184 WeakPolarHBondContact O-CG 3.27Å; L180-L184 PolarHBondContact O-N 3.05Å; P181-L184 CarbonylContact O-C 3.6Å; P181-L184 PolarHBondContact O-N 2.91Å; M182-L184 PolarHBondContact O-N 2.89Å; L184-L186 VanDerWaalsContact C-N 3.29Å; L184-L186 HydrophobicContact CB-CD1 3.89Å; L184-L186 HydrophobicContact CB-CG 3.95Å; L184-L186 HydrophobicContact CD1-CD1 4.22Å; L184-L186 PolarHBondContact O-N 3.45Å; L184-T261 HydrophobicContact CD1-CG2 3.86Å; L184-I262 HydrophobicContact CD1-CG1 4.07Å; L184-R265 HydrophobicContact CB-CB 4.44Å; L184-R265 HydrophobicContact CD2-CB 4.11Å; L184-V274 HydrophobicContact CD2-CB 4.47Å; L184-V274 HydrophobicContact CD2-CG1 3.66Å; L184-V274 HydrophobicContact CD2-CG2 3.91Å; L184-V274 HydrophobicContact CG-CG2 4.3Å
185C95.7Very high95.6Very high110 Ų11040.9 Ų40.974%0.74321%0.209SC*.THydrogen-bonded Turntrans52.946.2-173.1-53.30000112.5P181 M182P181-C185 PolarHBondContact O-N 3.14Å; M182-C185 PolarHBondContact O-N 3.3Å
186L96.5Very high95.4Very high32 Ų3241 Ų4117%0.16821%0.21CC..  trans-114150.9175.9-63.1175.6000110.1P181 L184 T261 R265P181-L186 CarbonylContact C-O 3.36Å; P181-L186 HydrophobicContact CB-CB 4.29Å; P181-L186 PolarHBondContact O-N 3Å; L184-L186 VanDerWaalsContact C-N 3.29Å; L184-L186 HydrophobicContact CB-CD1 3.89Å; L184-L186 HydrophobicContact CB-CG 3.95Å; L184-L186 HydrophobicContact CD1-CD1 4.22Å; L184-L186 PolarHBondContact O-N 3.45Å; L186-T261 HydrophobicContact CD1-CG2 3.54Å; L186-R265 HydrophobicContact CD1-CG 4.27Å; L186-R265 HydrophobicContact CD2-CG 3.94Å; L186-R265 HydrophobicContact CG-CG 4.25Å
187D95.1Very high95.1Very high162 Ų16241.6 Ų41.687%0.86621%0.213SC*.SBendtrans-72.5-30.5177.9-60.6-40.2000112.7
188D95.2Very high94.9Very high44 Ų4441.5 Ų41.524%0.23521%0.213CC..SBendtrans-158.9174.8-177.7-154.1-18.3000110.1H109H109-D188 VanDerWaalsContact CB-OD1 3.27Å; H109-D188 WeakPolarHBondContact CB-OD1 3.41Å; H109-D188 IonicContact CD2-OD1 3.27Å; H109-D188 IonicContact CG-OD1 3.44Å; H109-D188 PolarHBondContact N-OD1 3.36Å
189L96.3Very high94.9Very high4 Ų440.7 Ų40.72%0.02121%0.21CC..  trans-69.4153.4167.9-65.8164.2000110.7H109 N177 L180 P181 L191 P192 N195 N257 F258 T261H109-L189 HydrophobicContact CB-CD1 4.25Å; H109-L189 HydrophobicContact CB-CG 4.36Å; N177-L189 WeakPolarHBondContact OD1-CD1 3.29Å; L180-L189 HydrophobicContact CD2-CD2 4.12Å; P181-L189 HydrophobicContact CG-CD2 3.81Å; P181-L189 HydrophobicContact CG-CG 3.74Å; L189-L191 VanDerWaalsContact C-N 3.31Å; L189-L191 PolarHBondContact O-N 3.04Å; L189-P192 VanDerWaalsContact O-CD 3.28Å; L189-P192 WeakPolarHBondContact O-CD 3.32Å; L189-P192 VanDerWaalsContact O-CG 3.3Å; L189-P192 WeakPolarHBondContact O-CG 3.47Å; L189-N195 HydrophobicContact CD1-CB 4.38Å; L189-N195 WeakPolarHBondContact CD1-ND2 3.46Å; L189-N257 WeakPolarHBondContact CD1-ND2 3.45Å; L189-F258 HydrophobicContact CD1-CD1 4.43Å; L189-F258 HydrophobicContact CD1-CE1 3.95Å; L189-F258 HydrophobicContact CD2-CD1 3.99Å; L189-F258 HydrophobicContact CD2-CE1 4.09Å; L189-T261 HydrophobicContact CD2-CG2 4.03Å
190L95.3Very high94.7Very high90 Ų9043 Ų4347%0.47122%0.218SC..SBendtrans-69.2-25.5-177.3-70.5-174000114.4P192 S260 T261L190-P192 WeakPolarHBondContact O-CD 3.44Å; L190-S260 WeakPolarHBondContact CD1-O 3.2Å; L190-T261 HydrophobicContact CG-CG2 4.32Å; L190-T261 PolarHBondContact N-OG1 3.17Å
191L96.1Very high94.6Very high43 Ų4343.8 Ų43.823%0.22522%0.222CC..  trans-120.165.2-179.5-49.4169000111.7L189 R193 L194 N195 V256 N257L189-L191 VanDerWaalsContact C-N 3.31Å; L189-L191 PolarHBondContact O-N 3.04Å; L191-R193 PolarHBondContact O-N 2.76Å; L191-R193 VanDerWaalsContact O-N 3.11Å; L191-L194 HydrophobicContact CB-CB 3.97Å; L191-L194 HydrophobicContact CB-CD1 4.01Å; L191-L194 HydrophobicContact CB-CG 4.34Å; L191-L194 HydrophobicContact CD1-CD1 3.71Å; L191-L194 HydrophobicContact CG-CD1 4.32Å; L191-L194 PolarHBondContact O-N 3.42Å; L191-N195 PolarHBondContact O-N 2.99Å; L191-V256 HydrophobicContact CD1-CG1 4.39Å; L191-N257 WeakPolarHBondContact CA-OD1 3.31Å; L191-N257 HydrophobicContact CB-CB 4.28Å; L191-N257 VanDerWaalsContact CB-OD1 3.28Å; L191-N257 WeakPolarHBondContact CB-OD1 3.48Å; L191-N257 HydrophobicContact CD1-CB 4.37Å; L191-N257 PolarHBondContact N-OD1 3.11Å
192P93.7Very high94.3Very high34 Ų3444 Ų4422%0.22122%0.224CC..Hα-helixtrans-58.8-31.8-173.7-24.634000114.3L107 L189 L190 N195 S196L107-P192 HydrophobicContact CB-CB 3.99Å; L189-P192 VanDerWaalsContact O-CD 3.28Å; L189-P192 WeakPolarHBondContact O-CD 3.32Å; L189-P192 VanDerWaalsContact O-CG 3.3Å; L189-P192 WeakPolarHBondContact O-CG 3.47Å; L190-P192 WeakPolarHBondContact O-CD 3.44Å; P192-N195 VanDerWaalsContact O-CB 3.31Å; P192-N195 WeakPolarHBondContact O-CB 3.36Å; P192-N195 PolarHBondContact O-N 3.38Å; P192-S196 PolarHBondContact O-N 3.11Å
193R92Very high94.1Very high173 Ų17344.8 Ų44.865%0.65323%0.231SC*.Hα-helixtrans-71.1-39177.8-63.5-178.2-173.8-176.21.6112.7L107 L191 S196 L197L107-R193 HydrophobicContact CD1-CG 4.29Å; L107-R193 HydrophobicContact CD2-CG 4.18Å; L191-R193 PolarHBondContact O-N 2.76Å; L191-R193 VanDerWaalsContact O-N 3.11Å; R193-S196 PolarHBondContact O-N 3.35Å; R193-L197 PolarHBondContact O-N 3.08Å
194L91.1Very high94.1Very high45 Ų4544.9 Ų44.924%0.23624%0.236CC..Hα-helixtrans-68-33.5173.5-76.7178.6000110.3L61 L191 L197 S198 I253L61-L194 HydrophobicContact CD2-CD2 4.03Å; L191-L194 HydrophobicContact CB-CB 3.97Å; L191-L194 HydrophobicContact CB-CD1 4.01Å; L191-L194 HydrophobicContact CB-CG 4.34Å; L191-L194 HydrophobicContact CD1-CD1 3.71Å; L191-L194 HydrophobicContact CG-CD1 4.32Å; L191-L194 PolarHBondContact O-N 3.42Å; L194-L197 HydrophobicContact CD2-CD2 4.04Å; L194-L197 WeakPolarHBondContact O-CB 3.14Å; L194-L197 PolarHBondContact O-N 3.48Å; L194-S198 PolarHBondContact O-N 3.42Å; L194-I253 HydrophobicContact CB-CG2 3.69Å; L194-I253 HydrophobicContact CD2-CG2 3.96Å; L194-I253 HydrophobicContact CG-CG2 4.3Å; L194-I253 VanDerWaalsContact O-CG2 3.23Å; L194-I253 WeakPolarHBondContact O-CG2 3.44Å
195N94Very high94.1Very high0 Ų044.5 Ų44.50%023%0.234CC..Hα-helixtrans-63.4-43.9173.8-160.938.9000113.7N177 L189 L191 P192 L197 S198 L199N177-N195 PolarHBondContact OD1-ND2 2.75Å; N177-N195 PolarHBondContact OD1-OD1 2.95Å; L189-N195 HydrophobicContact CD1-CB 4.38Å; L189-N195 WeakPolarHBondContact CD1-ND2 3.46Å; L191-N195 PolarHBondContact O-N 2.99Å; P192-N195 VanDerWaalsContact O-CB 3.31Å; P192-N195 WeakPolarHBondContact O-CB 3.36Å; P192-N195 PolarHBondContact O-N 3.38Å; N195-L197 VanDerWaalsContact C-N 3.32Å; N195-S198 PolarHBondContact O-N 2.9Å; N195-S198 PolarHBondContact O-OG 2.88Å; N195-L199 PolarHBondContact O-N 2.77Å
196S92.5Very high93.9Very high2 Ų239.4 Ų39.41%0.01420%0.199CC..Hα-helixtrans-62.7-41.9173.9-176.90000111.2P192 R193 L199 W200P192-S196 PolarHBondContact O-N 3.11Å; R193-S196 PolarHBondContact O-N 3.35Å; S196-L199 PolarHBondContact O-N 3.45Å; S196-W200 PolarHBondContact O-N 3.36Å
197L90Very high93.8Very high13 Ų1343.5 Ų43.57%0.06822%0.216CC..Hα-helixtrans-60.7-45.8176.2165.662.5000112.4L61 V64 R193 L194 N195 L199 W200 L201 I253L61-L197 HydrophobicContact CD2-CD2 3.95Å; V64-L197 HydrophobicContact CB-CD1 3.67Å; V64-L197 HydrophobicContact CG1-CB 4.45Å; V64-L197 HydrophobicContact CG1-CD1 3.49Å; V64-L197 VanDerWaalsContact CG1-CD1 3.49Å; V64-L197 HydrophobicContact CG1-CG 4.43Å; V64-L197 HydrophobicContact CG2-CD1 3.59Å; R193-L197 PolarHBondContact O-N 3.08Å; L194-L197 HydrophobicContact CD2-CD2 4.04Å; L194-L197 WeakPolarHBondContact O-CB 3.14Å; L194-L197 PolarHBondContact O-N 3.48Å; N195-L197 VanDerWaalsContact C-N 3.32Å; L197-L199 VanDerWaalsContact C-N 3.29Å; L197-L199 PolarHBondContact O-N 2.87Å; L197-W200 PolarHBondContact O-N 3.19Å; L197-L201 HydrophobicContact CD1-CD1 3.92Å; L197-L201 HydrophobicContact CD1-CD2 4.36Å; L197-L201 HydrophobicContact CD1-CG 3.89Å; L197-L201 HydrophobicContact CG-CD1 4.26Å; L197-L201 WeakPolarHBondContact O-CG 3.44Å; L197-L201 PolarHBondContact O-N 3.15Å; L197-L201 VanDerWaalsContact O-N 3.12Å; L197-I253 HydrophobicContact CD2-CD1 3.69Å; L197-I253 HydrophobicContact CG-CD1 3.87Å
198S94.9Very high93.9Very high1 Ų138.9 Ų38.91%0.00719%0.187CC..Hα-helixtrans-58.1-45.7178.6580000110.8Y116 L194 N195 W200 L201 S250Y116-S198 VanDerWaalsContact OH-C 3.23Å; Y116-S198 WeakPolarHBondContact OH-CB 3.4Å; Y116-S198 PolarHBondContact OH-OG 3.49Å; L194-S198 PolarHBondContact O-N 3.42Å; N195-S198 PolarHBondContact O-N 2.9Å; N195-S198 PolarHBondContact O-OG 2.88Å; S198-W200 PolarHBondContact O-N 3.04Å; S198-L201 PolarHBondContact O-N 2.71Å; S198-S250 VanDerWaalsContact CB-O 3.26Å; S198-S250 WeakPolarHBondContact CB-O 3.32Å; S198-S250 WeakPolarHBondContact O-CB 3.1Å; S198-S250 PolarHBondContact O-OG 3.29Å
199L94.7Very high93.9Very high0 Ų036.9 Ų36.90%018%0.176CC..Hα-helixtrans-60.7-48.7178.9-177.5143.8000112.1M112 L115 Y116 F119 N195 S196 L197 L201 M202M112-L199 HydrophobicContact CB-CD1 4.31Å; M112-L199 VanDerWaalsContact O-CD1 3.24Å; M112-L199 WeakPolarHBondContact O-CD1 3.26Å; M112-L199 HydrophobicContact SD-CB 4.16Å; M112-L199 HydrophobicContact SD-CD1 3.77Å; M112-L199 HydrophobicContact SD-CD2 4.44Å; M112-L199 HydrophobicContact SD-CG 4.35Å; L115-L199 HydrophobicContact CB-CD1 3.42Å; L115-L199 VanDerWaalsContact CB-CD1 3.42Å; L115-L199 HydrophobicContact CB-CD2 4.34Å; L115-L199 HydrophobicContact CB-CG 4.45Å; L115-L199 HydrophobicContact CD1-CD1 4.22Å; L115-L199 HydrophobicContact CD1-CD2 4.23Å; L115-L199 HydrophobicContact CG-CD1 4.48Å; Y116-L199 HydrophobicContact CD2-CB 4.48Å; Y116-L199 HydrophobicContact CD2-CD1 3.62Å; Y116-L199 HydrophobicContact CD2-CG 4.37Å; Y116-L199 HydrophobicContact CE1-CB 4.38Å; Y116-L199 HydrophobicContact CE1-CG 4.48Å; Y116-L199 HydrophobicContact CE2-CB 3.75Å; Y116-L199 HydrophobicContact CE2-CD1 3.75Å; Y116-L199 HydrophobicContact CE2-CG 4.12Å; Y116-L199 HydrophobicContact CG-CD1 4.03Å; Y116-L199 VanDerWaalsContact OH-CA 3.24Å; Y116-L199 WeakPolarHBondContact OH-CA 3.24Å; Y116-L199 PolarHBondContact OH-N 2.74Å; F119-L199 HydrophobicContact CE2-CD2 3.85Å; F119-L199 HydrophobicContact CE2-CG 4.29Å; N195-L199 PolarHBondContact O-N 2.77Å; S196-L199 PolarHBondContact O-N 3.45Å; L197-L199 VanDerWaalsContact C-N 3.29Å; L197-L199 PolarHBondContact O-N 2.87Å; L199-L201 VanDerWaalsContact C-N 3.26Å; L199-L201 PolarHBondContact O-N 3.48Å; L199-M202 VanDerWaalsContact O-CB 3.25Å; L199-M202 WeakPolarHBondContact O-CB 3.47Å; L199-M202 PolarHBondContact O-N 3.49Å
200W93.1Very high93.7Very high53 Ų5339.5 Ų39.520%0.20119%0.188CC..Hα-helixtrans-71.2-19.4-174.8-71118.4000114F104 L115 F119 S196 L197 S198 M202 V203 P204F104-W200 HydrophobicContact CB-CZ2 4.36Å; F104-W200 AromaticContact CD1-CH2 3.33Å; F104-W200 HydrophobicContact CD1-CH2 3.33Å; F104-W200 AromaticContact CD1-CZ2 3.89Å; F104-W200 HydrophobicContact CD1-CZ2 3.89Å; F104-W200 AromaticContact CD1-CZ3 3.89Å; F104-W200 HydrophobicContact CD1-CZ3 3.89Å; F104-W200 AromaticContact CE1-CH2 3.73Å; F104-W200 HydrophobicContact CE1-CH2 3.73Å; F104-W200 HydrophobicContact CE1-CZ3 4.08Å; F104-W200 HydrophobicContact CG-CH2 4.24Å; F104-W200 HydrophobicContact CG-CZ2 4.46Å; F104-W200 PolarHBondContact O-NE1 3.38Å; L115-W200 HydrophobicContact CD1-CZ2 4.26Å; F119-W200 HydrophobicContact CZ-CZ3 4.35Å; S196-W200 PolarHBondContact O-N 3.36Å; L197-W200 PolarHBondContact O-N 3.19Å; S198-W200 PolarHBondContact O-N 3.04Å; W200-M202 PolarHBondContact O-N 3.28Å; W200-V203 HydrophobicContact CE3-CG2 3.76Å; W200-V203 HydrophobicContact CZ3-CG2 3.99Å; W200-V203 PolarHBondContact O-N 2.83Å; W200-P204 WeakPolarHBondContact O-CD 3.24Å
201L94.6Very high93.7Very high16 Ų1637 Ų378%0.08418%0.175CC..Hα-helixtrans-67.6-21.1170-73.8171.3000113L197 S198 L199 V203 P204 S205 L246 V249 I253L197-L201 HydrophobicContact CD1-CD1 3.92Å; L197-L201 HydrophobicContact CD1-CD2 4.36Å; L197-L201 HydrophobicContact CD1-CG 3.89Å; L197-L201 HydrophobicContact CG-CD1 4.26Å; L197-L201 WeakPolarHBondContact O-CG 3.44Å; L197-L201 PolarHBondContact O-N 3.15Å; L197-L201 VanDerWaalsContact O-N 3.12Å; S198-L201 PolarHBondContact O-N 2.71Å; L199-L201 VanDerWaalsContact C-N 3.26Å; L199-L201 PolarHBondContact O-N 3.48Å; L201-V203 VanDerWaalsContact C-N 3.3Å; L201-V203 PolarHBondContact O-N 3.44Å; L201-P204 WeakPolarHBondContact O-CD 3.4Å; L201-P204 WeakPolarHBondContact O-CG 3.35Å; L201-S205 VanDerWaalsContact O-CB 3.29Å; L201-S205 WeakPolarHBondContact O-CB 2.79Å; L201-S205 PolarHBondContact O-N 3.17Å; L201-L246 HydrophobicContact CD2-CD2 4.21Å; L201-V249 HydrophobicContact CD1-CB 4.27Å; L201-V249 HydrophobicContact CD1-CG1 3.69Å; L201-I253 HydrophobicContact CD1-CD1 3.87Å
202M92.7Very high93.7Very high6 Ų635 Ų353%0.0316%0.164CC..Hα-helixtrans-66.9-31175.5-66-59.7-59.500112.6Y116 F165 P169 L199 W200 S205 I206Y116-M202 HydrophobicContact CE1-CG 4.12Å; F165-M202 HydrophobicContact CD1-CE 3.48Å; F165-M202 VanDerWaalsContact CD1-CE 3.48Å; F165-M202 HydrophobicContact CE1-CE 3.69Å; P169-M202 HydrophobicContact CG-CE 3.8Å; L199-M202 VanDerWaalsContact O-CB 3.25Å; L199-M202 WeakPolarHBondContact O-CB 3.47Å; L199-M202 PolarHBondContact O-N 3.49Å; W200-M202 PolarHBondContact O-N 3.28Å; M202-S205 WeakPolarHBondContact O-CB 3.32Å; M202-S205 PolarHBondContact O-N 3.43Å; M202-I206 WeakPolarHBondContact O-CG1 3.37Å; M202-I206 PolarHBondContact O-N 3.35Å
203V90.6Very high93.6Very high61 Ų6135.5 Ų35.537%0.3717%0.165SC..Hα-helixtrans-62.6-57-1791780000112.4F119 W200 L201 S205 I206 F207F119-V203 HydrophobicContact CE1-CG2 3.77Å; F119-V203 HydrophobicContact CE2-CG2 4.31Å; F119-V203 HydrophobicContact CZ-CG2 3.47Å; F119-V203 VanDerWaalsContact CZ-CG2 3.47Å; W200-V203 HydrophobicContact CE3-CG2 3.76Å; W200-V203 HydrophobicContact CZ3-CG2 3.99Å; W200-V203 PolarHBondContact O-N 2.83Å; L201-V203 VanDerWaalsContact C-N 3.3Å; L201-V203 PolarHBondContact O-N 3.44Å; V203-S205 PolarHBondContact O-N 3.32Å; V203-I206 PolarHBondContact O-N 2.94Å; V203-F207 PolarHBondContact O-N 3.34Å; V203-F207 VanDerWaalsContact O-N 3.13Å
204P94.5Very high93.6Very high45 Ų4536.3 Ų36.329%0.29217%0.169SC..Hα-helixtrans-62.8-35.217425.5-32.7000110.9W200 L201 I206 F207 Y208 L246W200-P204 WeakPolarHBondContact O-CD 3.24Å; L201-P204 WeakPolarHBondContact O-CD 3.4Å; L201-P204 WeakPolarHBondContact O-CG 3.35Å; P204-I206 PolarHBondContact O-N 3.48Å; P204-F207 WeakPolarHBondContact O-CB 3.2Å; P204-F207 PolarHBondContact O-N 2.84Å; P204-Y208 HydrophobicContact CB-CD2 4.46Å; P204-Y208 HydrophobicContact CB-CE2 4.37Å; P204-Y208 WeakPolarHBondContact O-CD2 3.42Å; P204-Y208 PolarHBondContact O-N 3.2Å; P204-L246 HydrophobicContact CB-CD1 3.81Å; P204-L246 HydrophobicContact CG-CD1 4.03Å
205S96.6Very high93.7Very high0 Ų039.7 Ų39.70%018%0.18CC..Hα-helixtrans-58.1-49.5178.2-176.10000112.7F165 L201 M202 V203 F207 Y208 M209 S243 A247F165-S205 VanDerWaalsContact CE1-OG 3.25Å; F165-S205 WeakPolarHBondContact CE1-OG 3.28Å; F165-S205 WeakPolarHBondContact CZ-OG 3.39Å; L201-S205 VanDerWaalsContact O-CB 3.29Å; L201-S205 WeakPolarHBondContact O-CB 2.79Å; L201-S205 PolarHBondContact O-N 3.17Å; M202-S205 WeakPolarHBondContact O-CB 3.32Å; M202-S205 PolarHBondContact O-N 3.43Å; V203-S205 PolarHBondContact O-N 3.32Å; S205-F207 PolarHBondContact O-N 3.14Å; S205-Y208 PolarHBondContact O-N 3.02Å; S205-M209 PolarHBondContact O-N 2.96Å; S205-M209 VanDerWaalsContact O-N 3.07Å; S205-S243 WeakPolarHBondContact O-CB 3.41Å; S205-S243 PolarHBondContact O-OG 3.49Å; S205-S243 PolarHBondContact OG-O 3.45Å; S205-A247 WeakPolarHBondContact OG-CB 3.2Å; S205-A247 PolarHBondContact OG-N 3.33Å
206I92.6Very high93.6Very high3 Ų339.8 Ų39.82%0.01518%0.181CC..Hα-helixtrans-63.7-42.1176.1-64.9163.5000110.7F119 W122 F165 M202 V203 P204 Y208 M209 E210F119-I206 HydrophobicContact CB-CD1 4.37Å; F119-I206 HydrophobicContact CD1-CD1 4.05Å; W122-I206 HydrophobicContact CE3-CD1 4.13Å; W122-I206 HydrophobicContact CE3-CG2 4.13Å; W122-I206 HydrophobicContact CH2-CG2 3.72Å; W122-I206 HydrophobicContact CZ3-CB 4.22Å; W122-I206 HydrophobicContact CZ3-CD1 4.09Å; W122-I206 HydrophobicContact CZ3-CG2 3.35Å; F165-I206 HydrophobicContact CD1-CB 4.36Å; F165-I206 HydrophobicContact CD1-CD1 4.08Å; F165-I206 HydrophobicContact CD1-CG1 3.2Å; F165-I206 HydrophobicContact CE1-CB 4.29Å; F165-I206 HydrophobicContact CE1-CG1 3.44Å; F165-I206 VanDerWaalsContact CE1-CG1 3.44Å; F165-I206 HydrophobicContact CG-CG1 4.12Å; M202-I206 WeakPolarHBondContact O-CG1 3.37Å; M202-I206 PolarHBondContact O-N 3.35Å; V203-I206 PolarHBondContact O-N 2.94Å; P204-I206 PolarHBondContact O-N 3.48Å; I206-Y208 VanDerWaalsContact C-N 3.28Å; I206-Y208 PolarHBondContact O-N 3.14Å; I206-M209 HydrophobicContact CG2-CE 4.46Å; I206-M209 WeakPolarHBondContact O-CB 3.43Å; I206-M209 PolarHBondContact O-N 3.3Å; I206-E210 HydrophobicContact CG2-CG 4.39Å; I206-E210 PolarHBondContact O-N 2.92Å
207F93.7Very high93.6Very high119 Ų11939.7 Ų39.752%0.52218%0.18SC..Hα-helixtrans-56.2-43177.2175.3-104.3000112.1V203 P204 S205 E210 L211V203-F207 PolarHBondContact O-N 3.34Å; V203-F207 VanDerWaalsContact O-N 3.13Å; P204-F207 WeakPolarHBondContact O-CB 3.2Å; P204-F207 PolarHBondContact O-N 2.84Å; S205-F207 PolarHBondContact O-N 3.14Å; F207-E210 PolarHBondContact O-N 2.95Å; F207-L211 HydrophobicContact CD1-CD1 3.97Å; F207-L211 HydrophobicContact CD1-CG 4.49Å; F207-L211 HydrophobicContact CE1-CD1 3.4Å; F207-L211 HydrophobicContact CE1-CG 4.11Å; F207-L211 HydrophobicContact CE2-CG 4.46Å; F207-L211 HydrophobicContact CZ-CD1 3.74Å; F207-L211 HydrophobicContact CZ-CD2 4.29Å; F207-L211 HydrophobicContact CZ-CG 4.09Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 3.04Å
208Y97.2Very high93.8Very high65 Ų6540 Ų4026%0.25519%0.186SC..Hα-helixtrans-71.5-28.5176.1-76.1-70.1000113.8P204 S205 I206 L211 S212 Y239 F242 L246P204-Y208 HydrophobicContact CB-CD2 4.46Å; P204-Y208 HydrophobicContact CB-CE2 4.37Å; P204-Y208 WeakPolarHBondContact O-CD2 3.42Å; P204-Y208 PolarHBondContact O-N 3.2Å; S205-Y208 PolarHBondContact O-N 3.02Å; I206-Y208 VanDerWaalsContact C-N 3.28Å; I206-Y208 PolarHBondContact O-N 3.14Å; Y208-L211 HydrophobicContact CD1-CD1 3.97Å; Y208-L211 HydrophobicContact CE1-CD1 4.24Å; Y208-S212 WeakPolarHBondContact O-CB 3.48Å; Y208-S212 PolarHBondContact O-N 2.84Å; Y208-Y239 AromaticContact CD1-CD1 3.73Å; Y208-Y239 HydrophobicContact CD1-CD1 3.73Å; Y208-Y239 HydrophobicContact CD1-CE1 4.46Å; Y208-Y239 HydrophobicContact CE1-CD1 4.04Å; Y208-Y239 HydrophobicContact CE1-CE1 4.37Å; Y208-F242 AromaticContact CD1-CD1 3.94Å; Y208-F242 HydrophobicContact CD1-CD1 3.94Å; Y208-F242 AromaticContact CD2-CD1 3.33Å; Y208-F242 HydrophobicContact CD2-CD1 3.33Å; Y208-F242 AromaticContact CD2-CE1 3.58Å; Y208-F242 HydrophobicContact CD2-CE1 3.58Å; Y208-F242 AromaticContact CE1-CD1 3.89Å; Y208-F242 HydrophobicContact CE1-CD1 3.89Å; Y208-F242 HydrophobicContact CE1-CE1 4.27Å; Y208-F242 AromaticContact CE2-CD1 3.36Å; Y208-F242 HydrophobicContact CE2-CD1 3.36Å; Y208-F242 AromaticContact CE2-CE1 3.17Å; Y208-F242 HydrophobicContact CE2-CE1 3.17Å; Y208-F242 HydrophobicContact CE2-CZ 4.43Å; Y208-F242 AromaticContact CG-CD1 3.65Å; Y208-F242 HydrophobicContact CG-CD1 3.65Å; Y208-F242 HydrophobicContact CG-CE1 4.33Å; Y208-F242 AromaticContact CZ-CD1 3.59Å; Y208-F242 AromaticContact CZ-CE1 3.52Å; Y208-L246 HydrophobicContact CD2-CD1 3.89Å; Y208-L246 HydrophobicContact CE2-CD1 4.22Å
209M95.6Very high93.8Very high2 Ų240.1 Ų40.11%0.0119%0.187CC..Hα-helixtrans-64.8-45.3170.7-174.7-16370.900110.5I126 V160 A161 F165 S205 I206 L211 S212 L213 S243I126-M209 HydrophobicContact CD1-CE 4.4Å; I126-M209 HydrophobicContact CG2-CE 4.15Å; V160-M209 HydrophobicContact CG1-CG 4.21Å; V160-M209 HydrophobicContact CG1-SD 4.14Å; A161-M209 HydrophobicContact CB-CE 4.41Å; A161-M209 HydrophobicContact CB-SD 4.03Å; F165-M209 HydrophobicContact CD2-CE 4.44Å; F165-M209 HydrophobicContact CD2-CG 4.38Å; F165-M209 HydrophobicContact CD2-SD 3.25Å; F165-M209 WeakPolarHBondContact CD2-SD 3.24Å; F165-M209 HydrophobicContact CE2-CB 3.98Å; F165-M209 HydrophobicContact CE2-CG 4Å; F165-M209 HydrophobicContact CE2-SD 3.48Å; F165-M209 WeakPolarHBondContact CE2-SD 3.36Å; F165-M209 HydrophobicContact CG-SD 4.05Å; F165-M209 HydrophobicContact CZ-CB 4.21Å; F165-M209 HydrophobicContact CZ-SD 4.43Å; S205-M209 PolarHBondContact O-N 2.96Å; S205-M209 VanDerWaalsContact O-N 3.07Å; I206-M209 HydrophobicContact CG2-CE 4.46Å; I206-M209 WeakPolarHBondContact O-CB 3.43Å; I206-M209 PolarHBondContact O-N 3.3Å; M209-L211 PolarHBondContact O-N 3.2Å; M209-S212 WeakPolarHBondContact O-CA 3.39Å; M209-S212 WeakPolarHBondContact O-CB 3.28Å; M209-S212 PolarHBondContact O-N 2.84Å; M209-S212 VanDerWaalsContact O-N 3.1Å; M209-L213 PolarHBondContact O-N 3.32Å; M209-S243 PolarHBondContact N-OG 3.36Å
210E92.1Very high93.8Very high59 Ų5940.3 Ų40.328%0.27619%0.188SC..Hα-helixtrans-65.1-38.8176.9-67-59.414700112.1I126 I206 F207 S212 L213 Y214I126-E210 VanDerWaalsContact CD1-OE1 3.31Å; I126-E210 WeakPolarHBondContact CD1-OE1 3.49Å; I206-E210 HydrophobicContact CG2-CG 4.39Å; I206-E210 PolarHBondContact O-N 2.92Å; F207-E210 PolarHBondContact O-N 2.95Å; E210-S212 VanDerWaalsContact C-N 3.29Å; E210-S212 PolarHBondContact O-N 3.41Å; E210-L213 PolarHBondContact O-N 3.38Å; E210-Y214 WeakPolarHBondContact O-CB 3.43Å; E210-Y214 PolarHBondContact O-N 3.49Å
211L95.1Very high93.9Very high37 Ų3739.6 Ų39.619%0.19419%0.186CC..Hα-helixtrans-61.4-38.9170.7-72.8-179.9000111.8F207 Y208 M209 L213 Y214 Y215 Y239F207-L211 HydrophobicContact CD1-CD1 3.97Å; F207-L211 HydrophobicContact CD1-CG 4.49Å; F207-L211 HydrophobicContact CE1-CD1 3.4Å; F207-L211 HydrophobicContact CE1-CG 4.11Å; F207-L211 HydrophobicContact CE2-CG 4.46Å; F207-L211 HydrophobicContact CZ-CD1 3.74Å; F207-L211 HydrophobicContact CZ-CD2 4.29Å; F207-L211 HydrophobicContact CZ-CG 4.09Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 3.04Å; Y208-L211 HydrophobicContact CD1-CD1 3.97Å; Y208-L211 HydrophobicContact CE1-CD1 4.24Å; M209-L211 PolarHBondContact O-N 3.2Å; L211-L213 VanDerWaalsContact C-N 3.32Å; L211-L213 PolarHBondContact O-N 2.81Å; L211-Y214 PolarHBondContact O-N 3Å; L211-Y215 HydrophobicContact CD2-CE2 4.21Å; L211-Y215 VanDerWaalsContact O-CD2 3.3Å; L211-Y215 WeakPolarHBondContact O-CD2 3.42Å; L211-Y215 PolarHBondContact O-N 3.48Å; L211-Y239 HydrophobicContact CB-CD1 4.39Å; L211-Y239 HydrophobicContact CB-CD2 4.13Å; L211-Y239 HydrophobicContact CB-CG 4.01Å; L211-Y239 HydrophobicContact CD1-CD1 4.27Å; L211-Y239 HydrophobicContact CD1-CE1 4.24Å
212S96.4Very high94Very high0 Ų038.8 Ų38.80%018%0.182CC..Hα-helixtrans-60-43.6174.7-1780000112.1Y208 M209 E210 G216 C217 G236 L240Y208-S212 WeakPolarHBondContact O-CB 3.48Å; Y208-S212 PolarHBondContact O-N 2.84Å; M209-S212 WeakPolarHBondContact O-CA 3.39Å; M209-S212 WeakPolarHBondContact O-CB 3.28Å; M209-S212 PolarHBondContact O-N 2.84Å; M209-S212 VanDerWaalsContact O-N 3.1Å; E210-S212 VanDerWaalsContact C-N 3.29Å; E210-S212 PolarHBondContact O-N 3.41Å; S212-G216 CarbonylContact O-C 3.58Å; S212-G216 WeakPolarHBondContact O-CA 3.44Å; S212-G216 PolarHBondContact O-N 3.17Å; S212-C217 PolarHBondContact O-N 3.46Å; S212-C217 WeakPolarHBondContact OG-CB 3.44Å; S212-G236 VanDerWaalsContact CB-O 3.27Å; S212-G236 WeakPolarHBondContact CB-O 3.45Å; S212-G236 PolarHBondContact OG-O 3.49Å; S212-L240 WeakPolarHBondContact OG-CB 3.46Å
213L91.6Very high94.1Very high45 Ų4538.5 Ų38.524%0.23618%0.18CC..Hα-helixtrans-64.1-43175.6-178.861000111.6L130 N157 M209 E210 L211 G216L130-L213 HydrophobicContact CD2-CD2 4.13Å; N157-L213 HydrophobicContact CB-CD1 4.17Å; M209-L213 PolarHBondContact O-N 3.32Å; E210-L213 PolarHBondContact O-N 3.38Å; L211-L213 VanDerWaalsContact C-N 3.32Å; L211-L213 PolarHBondContact O-N 2.81Å; L213-G216 PolarHBondContact O-N 3.47Å
214Y92Very high94.4Very high191 Ų19137.2 Ų37.275%0.74917%0.169SC*.Hα-helixtrans-65.3-44.8179.7-179.5-98.9000113.2E210 L211 G216E210-Y214 WeakPolarHBondContact O-CB 3.43Å; E210-Y214 PolarHBondContact O-N 3.49Å; L211-Y214 PolarHBondContact O-N 3Å; Y214-G216 VanDerWaalsContact C-N 3.3Å
215Y93.8Very high94.5Very high115 Ų11535.6 Ų35.645%0.45116%0.158SC..Hα-helixtrans-81.5-8.7178-76.7-78.1000113.8L211 Y239L211-Y215 HydrophobicContact CD2-CE2 4.21Å; L211-Y215 VanDerWaalsContact O-CD2 3.3Å; L211-Y215 WeakPolarHBondContact O-CD2 3.42Å; L211-Y215 PolarHBondContact O-N 3.48Å; Y215-Y239 AromaticContact CD2-CD2 3.64Å; Y215-Y239 HydrophobicContact CD2-CD2 3.64Å; Y215-Y239 AromaticContact CD2-CE2 3.2Å; Y215-Y239 HydrophobicContact CD2-CE2 3.2Å; Y215-Y239 HydrophobicContact CE2-CD2 4.3Å; Y215-Y239 AromaticContact CE2-CE2 3.49Å; Y215-Y239 HydrophobicContact CE2-CE2 3.49Å; Y215-Y239 VanDerWaalsContact CE2-CE2 3.49Å; Y215-Y239 AromaticContact CE2-CZ 4Å; Y215-Y239 HydrophobicContact CG-CD2 4.18Å; Y215-Y239 AromaticContact CG-CE2 3.78Å; Y215-Y239 HydrophobicContact CG-CE2 3.78Å
216G90.6Very high94.4Very high2 Ų239.6 Ų39.62%0.02118%0.184CC..  trans83.6118.317900000113.5S212 L213 Y214 G236S212-G216 CarbonylContact O-C 3.58Å; S212-G216 WeakPolarHBondContact O-CA 3.44Å; S212-G216 PolarHBondContact O-N 3.17Å; L213-G216 PolarHBondContact O-N 3.47Å; Y214-G216 VanDerWaalsContact C-N 3.3Å; G216-G236 WeakPolarHBondContact O-CA 3.49Å
217C93.7Very high94.5Very high0 Ų043.5 Ų43.50%021%0.205CC..  trans-136.196.1174.2-176.50000109.8Y153 T156 S212 L240Y153-C217 WeakPolarHBondContact CA-O 3.01Å; Y153-C217 VanDerWaalsContact CD1-N 3.33Å; T156-C217 WeakPolarHBondContact CB-O 3.4Å; T156-C217 WeakPolarHBondContact CG2-O 3Å; T156-C217 PolarHBondContact OG1-O 2.85Å; S212-C217 PolarHBondContact O-N 3.46Å; S212-C217 WeakPolarHBondContact OG-CB 3.44Å; C217-L240 HydrophobicContact CB-CD2 4.46Å; C217-L240 WeakPolarHBondContact SG-CD2 3.39Å
218G93Very high94.6Very high19 Ų1937.8 Ų37.820%0.19618%0.18CC..  trans-106.225.9-169.400000114.9
219I94.9Very high94.4Very high5 Ų535.8 Ų35.83%0.02617%0.173CC..SBendtrans-96.42.5-168.765.4177.1000113.7L223 L227 V237I219-L223 HydrophobicContact CD1-CB 4.23Å; I219-L223 HydrophobicContact CD1-CD2 3.4Å; I219-L223 VanDerWaalsContact CD1-CD2 3.4Å; I219-L223 HydrophobicContact CD1-CG 4.42Å; I219-L223 HydrophobicContact CG1-CD2 3.92Å; I219-L227 HydrophobicContact CB-CD2 4.17Å; I219-L227 HydrophobicContact CB-CG 4.2Å; I219-L227 HydrophobicContact CG2-CD2 4.2Å; I219-L227 HydrophobicContact CG2-CG 3.83Å; I219-V237 HydrophobicContact CD1-CB 4.16Å; I219-V237 HydrophobicContact CD1-CG1 3.52Å; I219-V237 HydrophobicContact CD1-CG2 3.67Å; I219-V237 HydrophobicContact CG1-CG2 4.34Å; I219-V237 HydrophobicContact CG2-CG2 3.93Å
220G94.6Very high94.1Very high3 Ų343.3 Ų43.33%0.03120%0.202CC..THydrogen-bonded Turntrans79.1153.9-170.800000112.2T156 T222 L223T156-G220 WeakPolarHBondContact OG1-CA 3.38Å; T156-G220 PolarHBondContact OG1-N 2.91Å; G220-T222 PolarHBondContact O-N 2.98Å; G220-L223 PolarHBondContact O-N 2.95Å
221W95.9Very high93.4Very high38 Ų3849.4 Ų49.414%0.14423%0.23CC..THydrogen-bonded Turntrans-62.6-10.9179.171-90.3000113.6V160 I163 F324 W325 F467V160-W221 HydrophobicContact CG2-CB 3.97Å; I163-W221 HydrophobicContact CD1-CE3 4.03Å; I163-W221 HydrophobicContact CD1-CH2 4.46Å; I163-W221 HydrophobicContact CD1-CZ3 3.98Å; W221-F324 HydrophobicContact CE3-CE1 4.47Å; W221-F324 AromaticContact CE3-CZ 3.71Å; W221-F324 HydrophobicContact CE3-CZ 3.71Å; W221-F324 HydrophobicContact CH2-CE1 4.2Å; W221-F324 HydrophobicContact CH2-CZ 4.18Å; W221-F324 AromaticContact CZ3-CE1 3.92Å; W221-F324 HydrophobicContact CZ3-CE1 3.92Å; W221-F324 AromaticContact CZ3-CZ 3.45Å; W221-F324 HydrophobicContact CZ3-CZ 3.45Å; W221-F324 VanDerWaalsContact CZ3-CZ 3.45Å; W221-W325 AromaticContact CH2-CH2 3.82Å; W221-W325 HydrophobicContact CH2-CH2 3.82Å; W221-W325 AromaticContact CH2-CZ3 3.83Å; W221-W325 HydrophobicContact CH2-CZ3 3.83Å; W221-W325 AromaticContact CZ2-CH2 3.94Å; W221-W325 HydrophobicContact CZ2-CH2 3.94Å; W221-W325 HydrophobicContact CZ2-CZ3 4.38Å; W221-F467 HydrophobicContact CZ2-CZ 4.46Å
222T96.3Very high92.8Very high0 Ų050 Ų500%025%0.245CC..THydrogen-bonded Turntrans-90.1-8.3177.564.30000114.1G220 Y224 F320 F324 W325 R529G220-T222 PolarHBondContact O-N 2.98Å; T222-Y224 VanDerWaalsContact C-N 3.34Å; T222-Y224 HydrophobicContact CG2-CE1 4.41Å; T222-Y224 WeakPolarHBondContact O-CD1 3.15Å; T222-Y224 PolarHBondContact O-N 3.21Å; T222-Y224 WeakPolarHBondContact OG1-CD2 3.4Å; T222-Y224 WeakPolarHBondContact OG1-CE2 3.49Å; T222-F320 VanDerWaalsContact O-CE1 3.24Å; T222-F320 WeakPolarHBondContact O-CE1 3.41Å; T222-F324 HydrophobicContact CG2-CD1 4.43Å; T222-F324 HydrophobicContact CG2-CE1 3.63Å; T222-F324 HydrophobicContact CG2-CZ 3.85Å; T222-W325 HydrophobicContact CG2-CH2 4.07Å; T222-W325 HydrophobicContact CG2-CZ2 4Å; T222-R529 PolarHBondContact OG1-NH2 2.81Å
223L96.3Very high92.2Very high0 Ų050.8 Ų50.80%025%0.251CS..THydrogen-bonded Turntrans56.335.4172.6-49.8172000115.9I219 G220 S228 L240 M241 L244 M295 L298 F320I219-L223 HydrophobicContact CD1-CB 4.23Å; I219-L223 HydrophobicContact CD1-CD2 3.4Å; I219-L223 VanDerWaalsContact CD1-CD2 3.4Å; I219-L223 HydrophobicContact CD1-CG 4.42Å; I219-L223 HydrophobicContact CG1-CD2 3.92Å; G220-L223 PolarHBondContact O-N 2.95Å; L223-S228 VanDerWaalsContact O-CB 3.23Å; L223-S228 WeakPolarHBondContact O-CB 3.48Å; L223-S228 PolarHBondContact O-OG 3.44Å; L223-L240 HydrophobicContact CD2-CD2 3.71Å; L223-L240 HydrophobicContact CD2-CG 4.36Å; L223-M241 HydrophobicContact CD1-CG 4.31Å; L223-L244 HydrophobicContact CD1-CD1 3.93Å; L223-M295 HydrophobicContact CD1-CG 4.18Å; L223-M295 HydrophobicContact CD1-SD 4.13Å; L223-L298 HydrophobicContact CB-CD2 4.24Å; L223-F320 HydrophobicContact CB-CE1 4.31Å; L223-F320 HydrophobicContact CB-CZ 3.98Å; L223-F320 WeakPolarHBondContact O-CE1 3.39Å
224Y96.3Very high92.1Very high33 Ų3350 Ų5013%0.12925%0.254CS..  trans-69.5131.8-171.7-67.5-23.5000114.6T222 L227 S228 F320 Q321 F324 W325T222-Y224 VanDerWaalsContact C-N 3.34Å; T222-Y224 HydrophobicContact CG2-CE1 4.41Å; T222-Y224 WeakPolarHBondContact O-CD1 3.15Å; T222-Y224 PolarHBondContact O-N 3.21Å; T222-Y224 WeakPolarHBondContact OG1-CD2 3.4Å; T222-Y224 WeakPolarHBondContact OG1-CE2 3.49Å; Y224-L227 PolarHBondContact O-N 2.93Å; Y224-S228 PolarHBondContact O-N 2.97Å; Y224-S228 PolarHBondContact O-OG 3.03Å; Y224-S228 VanDerWaalsContact O-OG 3.14Å; Y224-F320 AromaticContact CD1-CD1 3.94Å; Y224-F320 HydrophobicContact CD1-CD1 3.94Å; Y224-F320 HydrophobicContact CD1-CE1 4.03Å; Y224-Q321 HydrophobicContact CD1-CG 4.11Å; Y224-Q321 HydrophobicContact CE1-CG 3.86Å; Y224-F324 HydrophobicContact CE1-CD1 4.38Å; Y224-W325 AromaticContact CZ-NE1 3.84Å; Y224-W325 WeakPolarHBondContact OH-CZ2 3.28Å; Y224-W325 PolarHBondContact OH-NE1 3.11Å
225P96.3Very high92.2Very high11 Ų1147.1 Ų47.17%0.07125%0.245CC..THydrogen-bonded Turntrans-70.9155.5162.830.9-33.5000110.5S228 I229 L298 F309 P317 F320P225-S228 WeakPolarHBondContact CA-OG 3.49Å; P225-S228 VanDerWaalsContact N-OG 3.09Å; P225-I229 HydrophobicContact CB-CD1 3.59Å; P225-I229 HydrophobicContact CB-CG1 3.98Å; P225-L298 HydrophobicContact CB-CD1 4.34Å; P225-F309 HydrophobicContact CB-CB 3.95Å; P225-F309 HydrophobicContact CG-CB 3.74Å; P225-F309 HydrophobicContact CG-CD2 4.5Å; P225-F309 HydrophobicContact CG-CG 4.09Å; P225-P317 HydrophobicContact CB-CB 4.3Å; P225-P317 HydrophobicContact CG-CB 3.92Å; P225-F320 VanDerWaalsContact CD-CD1 3.45Å; P225-F320 HydrophobicContact CG-CB 3.65Å; P225-F320 HydrophobicContact CG-CD1 4.35Å; P225-F320 HydrophobicContact CG-CG 3.98Å
226P94.9Very high92.2Very high84 Ų8441.7 Ų41.755%0.54522%0.224SC..THydrogen-bonded Turncis-80.1-102.532.8-35.9000113.7S228 I229 W230P226-S228 VanDerWaalsContact C-N 3.27Å; P226-S228 PolarHBondContact O-N 3.28Å; P226-I229 PolarHBondContact O-N 3.37Å; P226-W230 PolarHBondContact O-N 3.22Å
227L94.5Very high92.5Very high85 Ų8541.6 Ų41.645%0.44522%0.223SC..THydrogen-bonded Turntrans-59.2-38.1-176.6-178.362.2000112.5I219 Y224 I229 W230I219-L227 HydrophobicContact CB-CD2 4.17Å; I219-L227 HydrophobicContact CB-CG 4.2Å; I219-L227 HydrophobicContact CG2-CD2 4.2Å; I219-L227 HydrophobicContact CG2-CG 3.83Å; Y224-L227 PolarHBondContact O-N 2.93Å; L227-I229 VanDerWaalsContact C-N 3.32Å; L227-W230 HydrophobicContact CD1-CE3 4.39Å
228S95.3Very high92.6Very high0 Ų042.6 Ų42.60%023%0.228CC..THydrogen-bonded Turntrans-77-12.9176.663.10000114.4L223 Y224 P225 P226 L298 R302L223-S228 VanDerWaalsContact O-CB 3.23Å; L223-S228 WeakPolarHBondContact O-CB 3.48Å; L223-S228 PolarHBondContact O-OG 3.44Å; Y224-S228 PolarHBondContact O-N 2.97Å; Y224-S228 PolarHBondContact O-OG 3.03Å; Y224-S228 VanDerWaalsContact O-OG 3.14Å; P225-S228 WeakPolarHBondContact CA-OG 3.49Å; P225-S228 VanDerWaalsContact N-OG 3.09Å; P226-S228 VanDerWaalsContact C-N 3.27Å; P226-S228 PolarHBondContact O-N 3.28Å; S228-L298 WeakPolarHBondContact OG-CD1 3.38Å; S228-L298 WeakPolarHBondContact OG-CD2 3.33Å; S228-R302 WeakPolarHBondContact O-CD 3.29Å; S228-R302 PolarHBondContact O-NH1 3.39Å
229I93.4Very high92.8Very high22 Ų2244.8 Ų44.811%0.11323%0.231CC..THydrogen-bonded Turntrans-96.4-30.8175-60.6173.5000111P225 P226 L227 E231 L298 D301 F309P225-I229 HydrophobicContact CB-CD1 3.59Å; P225-I229 HydrophobicContact CB-CG1 3.98Å; P226-I229 PolarHBondContact O-N 3.37Å; L227-I229 VanDerWaalsContact C-N 3.32Å; I229-E231 PolarHBondContact O-N 2.96Å; I229-L298 HydrophobicContact CD1-CD1 3.9Å; I229-L298 HydrophobicContact CG1-CD1 3.49Å; I229-L298 VanDerWaalsContact CG1-CD1 3.49Å; I229-D301 HydrophobicContact CD1-CB 3.89Å; I229-D301 HydrophobicContact CG1-CB 4.23Å; I229-D301 HydrophobicContact CG2-CB 4.24Å; I229-F309 HydrophobicContact CD1-CB 3.79Å; I229-F309 HydrophobicContact CD1-CD2 4.31Å
230W88.5Confident92.9Very high161 Ų16144.6 Ų44.661%0.6123%0.23SC*.SBendtrans-51126.6-178.4-17957000112.1P226 L227 G232 S233P226-W230 PolarHBondContact O-N 3.22Å; L227-W230 HydrophobicContact CD1-CE3 4.39Å; W230-G232 VanDerWaalsContact CE3-C 3.47Å; W230-G232 VanDerWaalsContact CZ3-C 3.43Å; W230-G232 PolarHBondContact O-N 3.41Å; W230-G232 VanDerWaalsContact O-N 3.14Å; W230-S233 VanDerWaalsContact O-CB 3.28Å; W230-S233 WeakPolarHBondContact O-CB 3.04Å; W230-S233 PolarHBondContact O-N 2.96Å; W230-S233 PolarHBondContact O-OG 3.34Å
231E78.5Confident93Very high187 Ų18744.4 Ų44.487%0.87423%0.228SC*.G310 helixtrans-57.6-32.4-175.6-64.5-174.8163.700112.7I229 S233 G234I229-E231 PolarHBondContact O-N 2.96Å; E231-S233 PolarHBondContact O-N 3.4Å; E231-S233 VanDerWaalsContact O-N 3.16Å; E231-G234 PolarHBondContact O-N 3.25Å
232G81.4Confident93.1Very high49 Ų4947 Ų4751%0.50524%0.241SC..G310 helixtrans-66.7-10.4177.300000115W230 G234W230-G232 VanDerWaalsContact CE3-C 3.47Å; W230-G232 VanDerWaalsContact CZ3-C 3.43Å; W230-G232 PolarHBondContact O-N 3.41Å; W230-G232 VanDerWaalsContact O-N 3.14Å; G232-G234 PolarHBondContact O-N 3.06Å
233S84.9Confident93.2Very high17 Ų1747 Ų4712%0.11924%0.241CC..G310 helixtrans-72-11.9175.463.70000114.2W230 E231 R302W230-S233 VanDerWaalsContact O-CB 3.28Å; W230-S233 WeakPolarHBondContact O-CB 3.04Å; W230-S233 PolarHBondContact O-N 2.96Å; W230-S233 PolarHBondContact O-OG 3.34Å; E231-S233 PolarHBondContact O-N 3.4Å; E231-S233 VanDerWaalsContact O-N 3.16Å; S233-R302 PolarHBondContact OG-NH1 3.48Å
234G89.2Confident93.2Very high29 Ų2947.4 Ų47.430%0.29924%0.243SC..  trans74.1-175.9171.500000115.6E231 G232 R302E231-G234 PolarHBondContact O-N 3.25Å; G232-G234 PolarHBondContact O-N 3.06Å; G234-R302 PolarHBondContact O-NH2 2.82Å
235F93Very high93.3Very high130 Ų13047.5 Ų47.557%0.5725%0.245SC*.THydrogen-bonded Turntrans-76.4-19.3-177.1-63.7-69.7000113.7V237 D238 Y239F235-V237 PolarHBondContact O-N 3.11Å; F235-D238 WeakPolarHBondContact O-CB 3.49Å; F235-D238 PolarHBondContact O-N 3.38Å; F235-Y239 HydrophobicContact CB-CD2 4.45Å; F235-Y239 HydrophobicContact CB-CE2 4Å; F235-Y239 VanDerWaalsContact O-CD2 3.29Å; F235-Y239 WeakPolarHBondContact O-CD2 3.48Å; F235-Y239 PolarHBondContact O-N 3.31Å
236G95.4Very high93.3Very high0 Ų048.3 Ų48.30%025%0.248CC..Hα-helixtrans-59-32.4179.800000112.8S212 G216 Y239 L240S212-G236 VanDerWaalsContact CB-O 3.27Å; S212-G236 WeakPolarHBondContact CB-O 3.45Å; S212-G236 PolarHBondContact OG-O 3.49Å; G216-G236 WeakPolarHBondContact O-CA 3.49Å; G236-Y239 PolarHBondContact O-N 3.37Å; G236-L240 PolarHBondContact O-N 3.36Å
237V96.7Very high93.4Very high0 Ų044.4 Ų44.40%022%0.223CC..Hα-helixtrans-63.2-41.3173.9178.10000111.9I219 F235 L240 M241I219-V237 HydrophobicContact CD1-CB 4.16Å; I219-V237 HydrophobicContact CD1-CG1 3.52Å; I219-V237 HydrophobicContact CD1-CG2 3.67Å; I219-V237 HydrophobicContact CG1-CG2 4.34Å; I219-V237 HydrophobicContact CG2-CG2 3.93Å; F235-V237 PolarHBondContact O-N 3.11Å; V237-L240 PolarHBondContact O-N 3.4Å; V237-M241 HydrophobicContact CG1-CE 3.77Å; V237-M241 WeakPolarHBondContact O-CG 3.4Å; V237-M241 PolarHBondContact O-N 3.17Å
238D95.8Very high93.5Very high22 Ų2241 Ų4112%0.11821%0.208CC..Hα-helixtrans-66.8-43.2-180-55.6-37.7000110.9F235 L240 M241 F242 R302 K303F235-D238 WeakPolarHBondContact O-CB 3.49Å; F235-D238 PolarHBondContact O-N 3.38Å; D238-L240 VanDerWaalsContact C-N 3.33Å; D238-L240 PolarHBondContact O-N 3.25Å; D238-M241 PolarHBondContact O-N 3.37Å; D238-F242 PolarHBondContact O-N 3.02Å; D238-R302 IonicContact OD1-CZ 2.59Å; D238-R302 VanDerWaalsContact OD1-CZ 3.27Å; D238-R302 IonicContact OD1-NE 2.76Å; D238-R302 PolarHBondContact OD1-NE 3.41Å; D238-R302 IonicContact OD1-NH2 3.77Å; D238-R302 PolarHBondContact OD1-NH2 2.74Å; D238-R302 IonicContact OD2-NH2 2.7Å; D238-R302 PolarHBondContact OD2-NH2 3.19Å; D238-K303 WeakPolarHBondContact OD1-CE 3.36Å; D238-K303 IonicContact OD1-NZ 2.72Å; D238-K303 WeakPolarHBondContact OD2-CE 3.19Å; D238-K303 IonicContact OD2-NZ 3.63Å; D238-K303 PolarHBondContact OD2-NZ 3.23Å
239Y96.7Very high93.6Very high65 Ų6542.7 Ų42.726%0.25522%0.218SC..Hα-helixtrans-62.3-39.7174.7-65.3-52.1000112Y208 L211 Y215 F235 G236 F242 S243Y208-Y239 AromaticContact CD1-CD1 3.73Å; Y208-Y239 HydrophobicContact CD1-CD1 3.73Å; Y208-Y239 HydrophobicContact CD1-CE1 4.46Å; Y208-Y239 HydrophobicContact CE1-CD1 4.04Å; Y208-Y239 HydrophobicContact CE1-CE1 4.37Å; L211-Y239 HydrophobicContact CB-CD1 4.39Å; L211-Y239 HydrophobicContact CB-CD2 4.13Å; L211-Y239 HydrophobicContact CB-CG 4.01Å; L211-Y239 HydrophobicContact CD1-CD1 4.27Å; L211-Y239 HydrophobicContact CD1-CE1 4.24Å; Y215-Y239 AromaticContact CD2-CD2 3.64Å; Y215-Y239 HydrophobicContact CD2-CD2 3.64Å; Y215-Y239 AromaticContact CD2-CE2 3.2Å; Y215-Y239 HydrophobicContact CD2-CE2 3.2Å; Y215-Y239 HydrophobicContact CE2-CD2 4.3Å; Y215-Y239 AromaticContact CE2-CE2 3.49Å; Y215-Y239 HydrophobicContact CE2-CE2 3.49Å; Y215-Y239 VanDerWaalsContact CE2-CE2 3.49Å; Y215-Y239 AromaticContact CE2-CZ 4Å; Y215-Y239 HydrophobicContact CG-CD2 4.18Å; Y215-Y239 AromaticContact CG-CE2 3.78Å; Y215-Y239 HydrophobicContact CG-CE2 3.78Å; F235-Y239 HydrophobicContact CB-CD2 4.45Å; F235-Y239 HydrophobicContact CB-CE2 4Å; F235-Y239 VanDerWaalsContact O-CD2 3.29Å; F235-Y239 WeakPolarHBondContact O-CD2 3.48Å; F235-Y239 PolarHBondContact O-N 3.31Å; G236-Y239 PolarHBondContact O-N 3.37Å; Y239-F242 PolarHBondContact O-N 3.13Å; Y239-S243 WeakPolarHBondContact O-CB 3.36Å; Y239-S243 PolarHBondContact O-N 3.46Å
240L97.4Very high93.7Very high0 Ų041.8 Ų41.80%021%0.214CC..Hα-helixtrans-63.8-46.5176.6-166.753.5000111.9T156 V160 S212 C217 L223 G236 V237 D238 F242 S243 L244T156-L240 HydrophobicContact CG2-CD2 3.73Å; V160-L240 HydrophobicContact CB-CD1 4.47Å; V160-L240 HydrophobicContact CG1-CD1 3.98Å; V160-L240 HydrophobicContact CG2-CD1 4.18Å; V160-L240 HydrophobicContact CG2-CD2 4.42Å; S212-L240 WeakPolarHBondContact OG-CB 3.46Å; C217-L240 HydrophobicContact CB-CD2 4.46Å; C217-L240 WeakPolarHBondContact SG-CD2 3.39Å; L223-L240 HydrophobicContact CD2-CD2 3.71Å; L223-L240 HydrophobicContact CD2-CG 4.36Å; G236-L240 PolarHBondContact O-N 3.36Å; V237-L240 PolarHBondContact O-N 3.4Å; D238-L240 VanDerWaalsContact C-N 3.33Å; D238-L240 PolarHBondContact O-N 3.25Å; L240-F242 VanDerWaalsContact C-N 3.32Å; L240-F242 PolarHBondContact O-N 2.86Å; L240-S243 WeakPolarHBondContact O-CB 3.48Å; L240-S243 PolarHBondContact O-N 3.29Å; L240-L244 HydrophobicContact CG-CD1 4.32Å; L240-L244 WeakPolarHBondContact O-CG 3.44Å; L240-L244 PolarHBondContact O-N 3.47Å
241M96.9Very high94.1Very high0 Ų035.2 Ų35.20%019%0.193CC..Hα-helixtrans-61.4-43.1178.3-73.3-168.1-79.200110.9L223 V237 D238 L244 H245 L298 L299L223-M241 HydrophobicContact CD1-CG 4.31Å; V237-M241 HydrophobicContact CG1-CE 3.77Å; V237-M241 WeakPolarHBondContact O-CG 3.4Å; V237-M241 PolarHBondContact O-N 3.17Å; D238-M241 PolarHBondContact O-N 3.37Å; M241-L244 PolarHBondContact O-N 3.48Å; M241-H245 PolarHBondContact O-N 3.15Å; M241-H245 PolarHBondContact O-ND1 3.07Å; M241-L298 HydrophobicContact SD-CB 4.03Å; M241-L298 HydrophobicContact SD-CD2 3.63Å; M241-L298 HydrophobicContact SD-CG 3.99Å; M241-L299 HydrophobicContact CB-CD1 4.24Å; M241-L299 HydrophobicContact CB-CD2 4.25Å; M241-L299 HydrophobicContact CB-CG 4.22Å; M241-L299 HydrophobicContact CE-CD2 3.36Å; M241-L299 HydrophobicContact CE-CG 3.66Å; M241-L299 HydrophobicContact SD-CD2 4.08Å; M241-L299 HydrophobicContact SD-CG 3.72Å
242F96.7Very high95Very high92 Ų9228.1 Ų28.140%0.40416%0.16SC..Hα-helixtrans-64.6-40.3176.6-168.4-101.8000112.4Y208 D238 Y239 L240 L244 H245 L246Y208-F242 AromaticContact CD1-CD1 3.94Å; Y208-F242 HydrophobicContact CD1-CD1 3.94Å; Y208-F242 AromaticContact CD2-CD1 3.33Å; Y208-F242 HydrophobicContact CD2-CD1 3.33Å; Y208-F242 AromaticContact CD2-CE1 3.58Å; Y208-F242 HydrophobicContact CD2-CE1 3.58Å; Y208-F242 AromaticContact CE1-CD1 3.89Å; Y208-F242 HydrophobicContact CE1-CD1 3.89Å; Y208-F242 HydrophobicContact CE1-CE1 4.27Å; Y208-F242 AromaticContact CE2-CD1 3.36Å; Y208-F242 HydrophobicContact CE2-CD1 3.36Å; Y208-F242 AromaticContact CE2-CE1 3.17Å; Y208-F242 HydrophobicContact CE2-CE1 3.17Å; Y208-F242 HydrophobicContact CE2-CZ 4.43Å; Y208-F242 AromaticContact CG-CD1 3.65Å; Y208-F242 HydrophobicContact CG-CD1 3.65Å; Y208-F242 HydrophobicContact CG-CE1 4.33Å; Y208-F242 AromaticContact CZ-CD1 3.59Å; Y208-F242 AromaticContact CZ-CE1 3.52Å; D238-F242 PolarHBondContact O-N 3.02Å; Y239-F242 PolarHBondContact O-N 3.13Å; L240-F242 VanDerWaalsContact C-N 3.32Å; L240-F242 PolarHBondContact O-N 2.86Å; F242-L244 PolarHBondContact O-N 3.27Å; F242-H245 PolarHBondContact O-N 2.88Å; F242-L246 HydrophobicContact CD1-CD1 3.87Å; F242-L246 HydrophobicContact CD1-CG 4.36Å; F242-L246 HydrophobicContact CE1-CD1 3.48Å; F242-L246 VanDerWaalsContact CE1-CD1 3.48Å; F242-L246 HydrophobicContact CE1-CD2 4.43Å; F242-L246 HydrophobicContact CE1-CG 4.01Å; F242-L246 HydrophobicContact CZ-CD1 4.21Å; F242-L246 HydrophobicContact CZ-CD2 4.37Å; F242-L246 HydrophobicContact CZ-CG 4.34Å; F242-L246 WeakPolarHBondContact O-CG 3.31Å; F242-L246 PolarHBondContact O-N 3.09Å; F242-L246 VanDerWaalsContact O-N 3.14Å
243S98.1Very high95.7Very high0 Ų026 Ų260%014%0.138CC..Hα-helixtrans-54.6-50.3173176.80000111.8F165 S205 M209 Y239 L240 L246 A247F165-S243 WeakPolarHBondContact CZ-OG 3.1Å; S205-S243 WeakPolarHBondContact O-CB 3.41Å; S205-S243 PolarHBondContact O-OG 3.49Å; S205-S243 PolarHBondContact OG-O 3.45Å; M209-S243 PolarHBondContact N-OG 3.36Å; Y239-S243 WeakPolarHBondContact O-CB 3.36Å; Y239-S243 PolarHBondContact O-N 3.46Å; L240-S243 WeakPolarHBondContact O-CB 3.48Å; L240-S243 PolarHBondContact O-N 3.29Å; S243-L246 PolarHBondContact O-N 3.25Å; S243-A247 PolarHBondContact O-N 2.84Å
244L97.8Very high96.2Very high8 Ų825.7 Ų25.74%0.04214%0.137CC..Hα-helixtrans-68.7-33.4-178.8-68.7175.7000113.2V160 F164 L223 L240 M241 F242 A247 G248 M295V160-L244 HydrophobicContact CG1-CD2 4Å; F164-L244 HydrophobicContact CB-CD2 4.46Å; F164-L244 HydrophobicContact CD1-CD2 4.35Å; F164-L244 HydrophobicContact CD2-CD2 3.39Å; F164-L244 HydrophobicContact CE1-CD2 4.47Å; F164-L244 HydrophobicContact CE2-CD2 3.55Å; F164-L244 HydrophobicContact CG-CD2 3.82Å; F164-L244 HydrophobicContact CZ-CD2 4.09Å; L223-L244 HydrophobicContact CD1-CD1 3.93Å; L240-L244 HydrophobicContact CG-CD1 4.32Å; L240-L244 WeakPolarHBondContact O-CG 3.44Å; L240-L244 PolarHBondContact O-N 3.47Å; M241-L244 PolarHBondContact O-N 3.48Å; F242-L244 PolarHBondContact O-N 3.27Å; L244-A247 PolarHBondContact O-N 3.46Å; L244-G248 PolarHBondContact O-N 3.09Å; L244-M295 HydrophobicContact CB-CE 3.93Å; L244-M295 HydrophobicContact CB-SD 3.64Å; L244-M295 HydrophobicContact CD1-SD 3.89Å; L244-M295 HydrophobicContact CG-SD 4.44Å
245H97.7Very high96.7Very high36 Ų3624.4 Ų24.417%0.16712%0.123CC..Hα-helixtrans-61.3-45.2171.2-77.790.3000111.4M241 F242 G248 V249 A292 M295 T296M241-H245 PolarHBondContact O-N 3.15Å; M241-H245 PolarHBondContact O-ND1 3.07Å; F242-H245 PolarHBondContact O-N 2.88Å; H245-G248 PolarHBondContact O-N 2.84Å; H245-V249 VanDerWaalsContact O-CG2 3.32Å; H245-V249 WeakPolarHBondContact O-CG2 3.15Å; H245-V249 PolarHBondContact O-N 3.27Å; H245-A292 PolarHBondContact NE2-O 3.37Å; H245-M295 WeakPolarHBondContact CE1-CB 3.49Å; H245-T296 PolarHBondContact NE2-OG1 3.28Å; H245-T296 VanDerWaalsContact NE2-OG1 3.13Å
246L97.1Very high96.9Very high27 Ų2721 Ų2114%0.14111%0.113CC..Hα-helixtrans-64.5-42.5178.3-68.8174.5000112.1L201 P204 Y208 F242 S243 G248 V249 S250L201-L246 HydrophobicContact CD2-CD2 4.21Å; P204-L246 HydrophobicContact CB-CD1 3.81Å; P204-L246 HydrophobicContact CG-CD1 4.03Å; Y208-L246 HydrophobicContact CD2-CD1 3.89Å; Y208-L246 HydrophobicContact CE2-CD1 4.22Å; F242-L246 HydrophobicContact CD1-CD1 3.87Å; F242-L246 HydrophobicContact CD1-CG 4.36Å; F242-L246 HydrophobicContact CE1-CD1 3.48Å; F242-L246 VanDerWaalsContact CE1-CD1 3.48Å; F242-L246 HydrophobicContact CE1-CD2 4.43Å; F242-L246 HydrophobicContact CE1-CG 4.01Å; F242-L246 HydrophobicContact CZ-CD1 4.21Å; F242-L246 HydrophobicContact CZ-CD2 4.37Å; F242-L246 HydrophobicContact CZ-CG 4.34Å; F242-L246 WeakPolarHBondContact O-CG 3.31Å; F242-L246 PolarHBondContact O-N 3.09Å; F242-L246 VanDerWaalsContact O-N 3.14Å; S243-L246 PolarHBondContact O-N 3.25Å; L246-G248 VanDerWaalsContact C-N 3.34Å; L246-V249 PolarHBondContact O-N 3.48Å; L246-S250 PolarHBondContact O-N 3.21Å
247A97.1Very high97Very high3 Ų321 Ų213%0.02511%0.113CC..Hα-helixtrans-61.2-43.217400000111.5S205 S243 L244 S250 S251S205-A247 WeakPolarHBondContact OG-CB 3.2Å; S205-A247 PolarHBondContact OG-N 3.33Å; S243-A247 PolarHBondContact O-N 2.84Å; L244-A247 PolarHBondContact O-N 3.46Å; A247-S250 WeakPolarHBondContact O-CB 3.49Å; A247-S250 PolarHBondContact O-N 2.89Å; A247-S251 PolarHBondContact O-N 3.24Å; A247-S251 PolarHBondContact O-OG 2.84Å
248G96.6Very high97.1Very high12 Ų1221.2 Ų21.212%0.12411%0.114CC..Hα-helixtrans-61.3-45.2176.200000112.6L244 H245 L246 S250 S251 L252L244-G248 PolarHBondContact O-N 3.09Å; H245-G248 PolarHBondContact O-N 2.84Å; L246-G248 VanDerWaalsContact C-N 3.34Å; G248-S250 VanDerWaalsContact C-N 3.34Å; G248-S250 PolarHBondContact O-N 3.46Å; G248-S251 PolarHBondContact O-N 3.22Å; G248-L252 WeakPolarHBondContact O-CB 3.2Å; G248-L252 VanDerWaalsContact O-CG 3.31Å; G248-L252 WeakPolarHBondContact O-CG 3.4Å; G248-L252 PolarHBondContact O-N 3.13Å
249V96Very high97.2Very high37 Ų3721.2 Ų21.222%0.22411%0.114CC..Hα-helixtrans-63.2-41176.6175.90000111.2F57 L201 H245 L246 L252 I253F57-V249 HydrophobicContact CD2-CG1 4.11Å; L201-V249 HydrophobicContact CD1-CB 4.27Å; L201-V249 HydrophobicContact CD1-CG1 3.69Å; H245-V249 VanDerWaalsContact O-CG2 3.32Å; H245-V249 WeakPolarHBondContact O-CG2 3.15Å; H245-V249 PolarHBondContact O-N 3.27Å; L246-V249 PolarHBondContact O-N 3.48Å; V249-L252 PolarHBondContact O-N 3.01Å; V249-I253 HydrophobicContact CG1-CD1 3.74Å; V249-I253 HydrophobicContact CG1-CG1 4.4Å; V249-I253 WeakPolarHBondContact O-CD1 3.17Å; V249-I253 VanDerWaalsContact O-CG1 3.26Å; V249-I253 WeakPolarHBondContact O-CG1 3.38Å; V249-I253 PolarHBondContact O-N 2.98Å
250S96.9Very high97.3Very high3 Ų320.3 Ų20.32%0.02112%0.117CC..Hα-helixtrans-54.9-53.2173.5171.90000111.9S198 L246 A247 G248 L252 I253 G254S198-S250 VanDerWaalsContact CB-O 3.26Å; S198-S250 WeakPolarHBondContact CB-O 3.32Å; S198-S250 WeakPolarHBondContact O-CB 3.1Å; S198-S250 PolarHBondContact O-OG 3.29Å; L246-S250 PolarHBondContact O-N 3.21Å; A247-S250 WeakPolarHBondContact O-CB 3.49Å; A247-S250 PolarHBondContact O-N 2.89Å; G248-S250 VanDerWaalsContact C-N 3.34Å; G248-S250 PolarHBondContact O-N 3.46Å; S250-L252 PolarHBondContact O-N 3.16Å; S250-I253 PolarHBondContact O-N 3.44Å; S250-G254 PolarHBondContact O-N 3.32Å
251S97.2Very high97.3Very high23 Ų2320.3 Ų20.316%0.16112%0.117CC..Hα-helixtrans-65.8-36.5-178.7-67.60000113.3M168 A247 G248 G254 S255M168-S251 WeakPolarHBondContact CE-OG 3.18Å; A247-S251 PolarHBondContact O-N 3.24Å; A247-S251 PolarHBondContact O-OG 2.84Å; G248-S251 PolarHBondContact O-N 3.22Å; S251-G254 PolarHBondContact O-N 3.03Å; S251-S255 VanDerWaalsContact O-CB 3.31Å; S251-S255 WeakPolarHBondContact O-CB 3.45Å; S251-S255 PolarHBondContact O-N 3.35Å; S251-S255 PolarHBondContact O-OG 3Å
252L97.1Very high97.4Very high37 Ų3720.3 Ų20.319%0.19412%0.117CC..Hα-helixtrans-62.7-46.9174.8-76.2172.8000111.3G248 V249 S250 S255 V256 L285 L288 P289G248-L252 WeakPolarHBondContact O-CB 3.2Å; G248-L252 VanDerWaalsContact O-CG 3.31Å; G248-L252 WeakPolarHBondContact O-CG 3.4Å; G248-L252 PolarHBondContact O-N 3.13Å; V249-L252 PolarHBondContact O-N 3.01Å; S250-L252 PolarHBondContact O-N 3.16Å; L252-S255 PolarHBondContact O-N 3.39Å; L252-V256 WeakPolarHBondContact O-CG2 3.32Å; L252-V256 PolarHBondContact O-N 3.27Å; L252-L285 HydrophobicContact CD2-CD2 3.82Å; L252-L288 HydrophobicContact CD1-CB 4.46Å; L252-L288 HydrophobicContact CD2-CB 3.95Å; L252-L288 HydrophobicContact CD2-CD1 4.16Å; L252-L288 HydrophobicContact CG-CB 4.11Å; L252-L288 HydrophobicContact CG-CD1 3.99Å; L252-P289 HydrophobicContact CD2-CG 4.24Å
253I95.4Very high97.5Very high6 Ų622 Ų223%0.03112%0.124CC..Hα-helixtrans-63.1-44.8178.3-67.6167.4000111F57 L194 L197 L201 V249 S250 S255 V256 N257F57-I253 HydrophobicContact CE2-CD1 3.86Å; F57-I253 HydrophobicContact CE2-CG1 3.65Å; F57-I253 HydrophobicContact CZ-CG1 4.36Å; L194-I253 HydrophobicContact CB-CG2 3.69Å; L194-I253 HydrophobicContact CD2-CG2 3.96Å; L194-I253 HydrophobicContact CG-CG2 4.3Å; L194-I253 VanDerWaalsContact O-CG2 3.23Å; L194-I253 WeakPolarHBondContact O-CG2 3.44Å; L197-I253 HydrophobicContact CD2-CD1 3.69Å; L197-I253 HydrophobicContact CG-CD1 3.87Å; L201-I253 HydrophobicContact CD1-CD1 3.87Å; V249-I253 HydrophobicContact CG1-CD1 3.74Å; V249-I253 HydrophobicContact CG1-CG1 4.4Å; V249-I253 WeakPolarHBondContact O-CD1 3.17Å; V249-I253 VanDerWaalsContact O-CG1 3.26Å; V249-I253 WeakPolarHBondContact O-CG1 3.38Å; V249-I253 PolarHBondContact O-N 2.98Å; S250-I253 PolarHBondContact O-N 3.44Å; I253-S255 VanDerWaalsContact C-N 3.3Å; I253-S255 PolarHBondContact O-N 3.37Å; I253-V256 PolarHBondContact O-N 3.47Å; I253-N257 PolarHBondContact O-N 2.95Å; I253-N257 VanDerWaalsContact O-N 3.15Å
254G96.3Very high97.4Very high10 Ų1024.5 Ų24.510%0.10314%0.142CC..Hα-helixtrans-57.7-44174.800000112S250 S251 N257 F258S250-G254 PolarHBondContact O-N 3.32Å; S251-G254 PolarHBondContact O-N 3.03Å; G254-N257 WeakPolarHBondContact O-CB 3.24Å; G254-N257 PolarHBondContact O-N 3.41Å; G254-F258 WeakPolarHBondContact O-CD1 3.22Å; G254-F258 PolarHBondContact O-N 3.14Å
255S98.1Very high97.3Very high2 Ų230.9 Ų30.91%0.01417%0.166CC..Hα-helixtrans-64.2-43.6179.9-60.90000113S251 L252 I253 N257 F258 I259 L284S251-S255 VanDerWaalsContact O-CB 3.31Å; S251-S255 WeakPolarHBondContact O-CB 3.45Å; S251-S255 PolarHBondContact O-N 3.35Å; S251-S255 PolarHBondContact O-OG 3Å; L252-S255 PolarHBondContact O-N 3.39Å; I253-S255 VanDerWaalsContact C-N 3.3Å; I253-S255 PolarHBondContact O-N 3.37Å; S255-N257 VanDerWaalsContact C-N 3.28Å; S255-N257 PolarHBondContact O-N 2.8Å; S255-F258 PolarHBondContact O-N 3.32Å; S255-I259 WeakPolarHBondContact O-CB 3.17Å; S255-I259 VanDerWaalsContact O-CG1 3.32Å; S255-I259 WeakPolarHBondContact O-CG1 3.37Å; S255-I259 PolarHBondContact O-N 3.17Å; S255-L284 VanDerWaalsContact OG-CB 3.28Å; S255-L284 WeakPolarHBondContact OG-CB 3.23Å; S255-L284 WeakPolarHBondContact OG-CD1 3.48Å
256V98Very high97.3Very high59 Ų5931.7 Ų31.736%0.35817%0.171SC..Hα-helixtrans-58.6-42.4173.7174.10000111L191 L252 I253 S260 L285L191-V256 HydrophobicContact CD1-CG1 4.39Å; L252-V256 WeakPolarHBondContact O-CG2 3.32Å; L252-V256 PolarHBondContact O-N 3.27Å; I253-V256 PolarHBondContact O-N 3.47Å; V256-S260 WeakPolarHBondContact O-CB 3.1Å; V256-S260 PolarHBondContact O-N 2.91Å; V256-S260 PolarHBondContact O-OG 3.16Å; V256-L285 HydrophobicContact CG2-CD1 4.48Å; V256-L285 HydrophobicContact CG2-CD2 3.85Å
257N97.6Very high97.2Very high0 Ų032.8 Ų32.80%018%0.181CC..Hα-helixtrans-65.7-45.5179-175.223.9000112.2L189 L191 I253 G254 S255 S260 T261L189-N257 WeakPolarHBondContact CD1-ND2 3.45Å; L191-N257 WeakPolarHBondContact CA-OD1 3.31Å; L191-N257 HydrophobicContact CB-CB 4.28Å; L191-N257 VanDerWaalsContact CB-OD1 3.28Å; L191-N257 WeakPolarHBondContact CB-OD1 3.48Å; L191-N257 HydrophobicContact CD1-CB 4.37Å; L191-N257 PolarHBondContact N-OD1 3.11Å; I253-N257 PolarHBondContact O-N 2.95Å; I253-N257 VanDerWaalsContact O-N 3.15Å; G254-N257 WeakPolarHBondContact O-CB 3.24Å; G254-N257 PolarHBondContact O-N 3.41Å; S255-N257 VanDerWaalsContact C-N 3.28Å; S255-N257 PolarHBondContact O-N 2.8Å; N257-S260 PolarHBondContact O-N 3.31Å; N257-T261 WeakPolarHBondContact O-CB 3.48Å; N257-T261 PolarHBondContact O-N 3.45Å; N257-T261 PolarHBondContact O-OG1 2.88Å
258F98.4Very high97Very high3 Ų338.9 Ų38.91%0.01321%0.207CC..Hα-helixtrans-64.7-46.1178.9-79.120.3000111.4M172 G176 L180 L189 G254 S255 S260 T261 I262 Y277 S281M172-F258 HydrophobicContact CE-CD2 3.27Å; M172-F258 HydrophobicContact CE-CE2 3.49Å; M172-F258 VanDerWaalsContact CE-CE2 3.49Å; M172-F258 HydrophobicContact CE-CG 4.33Å; M172-F258 HydrophobicContact SD-CD2 4.41Å; M172-F258 HydrophobicContact SD-CE2 4.11Å; G176-F258 VanDerWaalsContact C-CZ 3.41Å; L180-F258 HydrophobicContact CD2-CB 3.85Å; L180-F258 HydrophobicContact CD2-CD1 3.8Å; L180-F258 HydrophobicContact CD2-CD2 3.68Å; L180-F258 HydrophobicContact CD2-CE1 4.29Å; L180-F258 HydrophobicContact CD2-CE2 4.21Å; L180-F258 HydrophobicContact CD2-CG 3.49Å; L180-F258 VanDerWaalsContact CD2-CG 3.49Å; L189-F258 HydrophobicContact CD1-CD1 4.43Å; L189-F258 HydrophobicContact CD1-CE1 3.95Å; L189-F258 HydrophobicContact CD2-CD1 3.99Å; L189-F258 HydrophobicContact CD2-CE1 4.09Å; G254-F258 WeakPolarHBondContact O-CD1 3.22Å; G254-F258 PolarHBondContact O-N 3.14Å; S255-F258 PolarHBondContact O-N 3.32Å; F258-S260 PolarHBondContact O-N 3.15Å; F258-T261 PolarHBondContact O-N 2.84Å; F258-I262 WeakPolarHBondContact O-CB 3.49Å; F258-I262 WeakPolarHBondContact O-CG1 3.24Å; F258-I262 PolarHBondContact O-N 3.36Å; F258-Y277 HydrophobicContact CD2-CD1 4.36Å; F258-Y277 HydrophobicContact CE2-CD1 4.17Å; F258-S281 WeakPolarHBondContact CB-OG 3.32Å
259I98.6Very high96.8Very high22 Ų2247.7 Ų47.711%0.11324%0.242CC..Hα-helixtrans-58.9-48.3177.2-72.8165.2000111.1S255 T261 I262 F263 L278 V282 L285S255-I259 WeakPolarHBondContact O-CB 3.17Å; S255-I259 VanDerWaalsContact O-CG1 3.32Å; S255-I259 WeakPolarHBondContact O-CG1 3.37Å; S255-I259 PolarHBondContact O-N 3.17Å; I259-T261 VanDerWaalsContact C-N 3.3Å; I259-T261 PolarHBondContact O-N 3.21Å; I259-I262 PolarHBondContact O-N 3.1Å; I259-F263 HydrophobicContact CG2-CD2 3.45Å; I259-F263 VanDerWaalsContact CG2-CD2 3.45Å; I259-F263 HydrophobicContact CG2-CE2 3.34Å; I259-F263 HydrophobicContact CG2-CZ 4.41Å; I259-F263 WeakPolarHBondContact O-CB 3.47Å; I259-F263 WeakPolarHBondContact O-CD2 3.48Å; I259-F263 PolarHBondContact O-N 3.16Å; I259-L278 HydrophobicContact CG1-CD1 4.33Å; I259-V282 HydrophobicContact CD1-CG2 4.23Å; I259-L285 HydrophobicContact CD1-CD1 3.32Å; I259-L285 HydrophobicContact CD1-CG 4.04Å
260S98.2Very high96.7Very high46 Ų4646.6 Ų46.632%0.32224%0.236SC..Hα-helixtrans-59.5-43.9178.9-58.30000111.1L190 V256 N257 F258 S264L190-S260 WeakPolarHBondContact CD1-O 3.2Å; V256-S260 WeakPolarHBondContact O-CB 3.1Å; V256-S260 PolarHBondContact O-N 2.91Å; V256-S260 PolarHBondContact O-OG 3.16Å; N257-S260 PolarHBondContact O-N 3.31Å; F258-S260 PolarHBondContact O-N 3.15Å; S260-S264 PolarHBondContact O-N 2.94Å
261T98.3Very high96.5Very high0 Ų047.8 Ų47.80%024%0.244CC..Hα-helixtrans-66.3-46.6179.5-54.40000111.4L184 L186 L189 L190 N257 F258 I259 S264L184-T261 HydrophobicContact CD1-CG2 3.86Å; L186-T261 HydrophobicContact CD1-CG2 3.54Å; L189-T261 HydrophobicContact CD2-CG2 4.03Å; L190-T261 HydrophobicContact CG-CG2 4.32Å; L190-T261 PolarHBondContact N-OG1 3.17Å; N257-T261 WeakPolarHBondContact O-CB 3.48Å; N257-T261 PolarHBondContact O-N 3.45Å; N257-T261 PolarHBondContact O-OG1 2.88Å; F258-T261 PolarHBondContact O-N 2.84Å; I259-T261 VanDerWaalsContact C-N 3.3Å; I259-T261 PolarHBondContact O-N 3.21Å; T261-S264 WeakPolarHBondContact O-CB 3.34Å; T261-S264 PolarHBondContact O-N 3.33Å; T261-S264 PolarHBondContact O-OG 3.06Å
262I98.5Very high96.4Very high0 Ų046.8 Ų46.80%024%0.237CC..Hα-helixtrans-62.1-49.8179.8-68.5165.1000110.7L180 L184 F258 I259 S264 R265 L266 V274 L278L180-I262 HydrophobicContact CD1-CD1 3.98Å; L180-I262 HydrophobicContact CD1-CG1 3.81Å; L180-I262 HydrophobicContact CD2-CD1 4.07Å; L180-I262 HydrophobicContact CD2-CG1 4.04Å; L180-I262 HydrophobicContact CG-CG1 4.34Å; L184-I262 HydrophobicContact CD1-CG1 4.07Å; F258-I262 WeakPolarHBondContact O-CB 3.49Å; F258-I262 WeakPolarHBondContact O-CG1 3.24Å; F258-I262 PolarHBondContact O-N 3.36Å; I259-I262 PolarHBondContact O-N 3.1Å; I262-S264 PolarHBondContact O-N 2.85Å; I262-S264 VanDerWaalsContact O-N 3.08Å; I262-R265 CarbonylContact O-C 3.41Å; I262-R265 PolarHBondContact O-N 2.78Å; I262-L266 HydrophobicContact CG2-CB 4.16Å; I262-L266 HydrophobicContact CG2-CD1 3.84Å; I262-L266 HydrophobicContact CG2-CG 4.4Å; I262-L266 WeakPolarHBondContact O-CA 3.45Å; I262-L266 WeakPolarHBondContact O-CB 3.41Å; I262-L266 PolarHBondContact O-N 3.47Å; I262-V274 HydrophobicContact CG1-CG1 4.21Å; I262-V274 HydrophobicContact CG2-CG1 3.74Å; I262-L278 HydrophobicContact CB-CD1 4.45Å; I262-L278 HydrophobicContact CD1-CB 3.94Å; I262-L278 HydrophobicContact CD1-CD1 4.47Å; I262-L278 HydrophobicContact CG2-CB 4.22Å; I262-L278 HydrophobicContact CG2-CD1 4.09Å; I262-L278 HydrophobicContact CG2-CD2 4.32Å; I262-L278 HydrophobicContact CG2-CG 4.44Å
263F98Very high96.4Very high127 Ų12745 Ų4556%0.55723%0.228SC*.Hα-helixtrans-62.4-20.2-179-76.4-41.4000114I259 R265 L266 L278I259-F263 HydrophobicContact CG2-CD2 3.45Å; I259-F263 VanDerWaalsContact CG2-CD2 3.45Å; I259-F263 HydrophobicContact CG2-CE2 3.34Å; I259-F263 HydrophobicContact CG2-CZ 4.41Å; I259-F263 WeakPolarHBondContact O-CB 3.47Å; I259-F263 WeakPolarHBondContact O-CD2 3.48Å; I259-F263 PolarHBondContact O-N 3.16Å; F263-R265 PolarHBondContact O-N 3.37Å; F263-L266 HydrophobicContact CD1-CD2 3.89Å; F263-L266 HydrophobicContact CE1-CD2 3.93Å; F263-L278 HydrophobicContact CE1-CD1 4.16Å; F263-L278 HydrophobicContact CE1-CD2 4.35Å; F263-L278 HydrophobicContact CZ-CD1 4.04Å
264S97.3Very high96.5Very high54 Ų5444.8 Ų44.838%0.37823%0.226SC..THydrogen-bonded Turntrans-68.3-21.4174.878.20000114.4S260 T261 I262S260-S264 PolarHBondContact O-N 2.94Å; T261-S264 WeakPolarHBondContact O-CB 3.34Å; T261-S264 PolarHBondContact O-N 3.33Å; T261-S264 PolarHBondContact O-OG 3.06Å; I262-S264 PolarHBondContact O-N 2.85Å; I262-S264 VanDerWaalsContact O-N 3.08Å
265R96Very high96.6Very high142 Ų14245.2 Ų45.254%0.53623%0.225SC..THydrogen-bonded Turntrans-137.73.7-175.8-67.2-60.2-176.5106.21.3114.2L184 L186 I262 F263 S267L184-R265 HydrophobicContact CB-CB 4.44Å; L184-R265 HydrophobicContact CD2-CB 4.11Å; L186-R265 HydrophobicContact CD1-CG 4.27Å; L186-R265 HydrophobicContact CD2-CG 3.94Å; L186-R265 HydrophobicContact CG-CG 4.25Å; I262-R265 CarbonylContact O-C 3.41Å; I262-R265 PolarHBondContact O-N 2.78Å; F263-R265 PolarHBondContact O-N 3.37Å; R265-S267 PolarHBondContact O-N 2.89Å
266L96.5Very high96.6Very high53 Ų5345.1 Ų45.128%0.27722%0.224SC..  trans-58.7128.1-175.1-175.966.1000110.8I262 F263 V274 W275 L278I262-L266 HydrophobicContact CG2-CB 4.16Å; I262-L266 HydrophobicContact CG2-CD1 3.84Å; I262-L266 HydrophobicContact CG2-CG 4.4Å; I262-L266 WeakPolarHBondContact O-CA 3.45Å; I262-L266 WeakPolarHBondContact O-CB 3.41Å; I262-L266 PolarHBondContact O-N 3.47Å; F263-L266 HydrophobicContact CD1-CD2 3.89Å; F263-L266 HydrophobicContact CE1-CD2 3.93Å; L266-V274 HydrophobicContact CD1-CG1 4.22Å; L266-W275 HydrophobicContact CD1-CD2 4.32Å; L266-W275 HydrophobicContact CD1-CE3 4.35Å; L266-W275 HydrophobicContact CD1-CH2 3.95Å; L266-W275 HydrophobicContact CD1-CZ2 3.9Å; L266-W275 HydrophobicContact CD1-CZ3 4.18Å; L266-W275 HydrophobicContact CD2-CH2 4.06Å; L266-W275 HydrophobicContact CD2-CZ3 4.18Å; L266-W275 HydrophobicContact CG-CH2 4.19Å; L266-W275 HydrophobicContact CG-CZ2 4.41Å; L266-L278 HydrophobicContact CD1-CD2 4.39Å; L266-L278 HydrophobicContact CD2-CD2 3.84Å
267S95.3Very high96.6Very high50 Ų5042.3 Ų42.335%0.3521%0.207SC..  trans-145160.8171.674.10000109.6R265 K269 C270R265-S267 PolarHBondContact O-N 2.89Å; S267-K269 PolarHBondContact O-N 3.36Å; S267-K269 PolarHBondContact OG-N 2.81Å; S267-C270 PolarHBondContact N-SG 2.68Å; S267-C270 WeakPolarHBondContact O-CB 3.25Å; S267-C270 PolarHBondContact O-N 3.26Å; S267-C270 VanDerWaalsContact O-N 3.07Å; S267-C270 PolarHBondContact O-SG 2.97Å; S267-C270 PolarHBondContact OG-SG 3.08Å
268F93.5Very high96.7Very high130 Ų13042.7 Ų42.757%0.5721%0.209SC*.THydrogen-bonded Turntrans-67.42.8171.3-70-73000113.6W275 Y359 Y360F268-W275 HydrophobicContact CD1-CH2 4.19Å; F268-W275 AromaticContact CD1-CZ2 3.75Å; F268-W275 HydrophobicContact CD1-CZ2 3.75Å; F268-W275 AromaticContact CE1-CH2 3.92Å; F268-W275 HydrophobicContact CE1-CH2 3.92Å; F268-W275 AromaticContact CE1-CZ2 3.97Å; F268-W275 HydrophobicContact CE1-CZ2 3.97Å; F268-W275 HydrophobicContact CG-CZ2 4.47Å; F268-Y359 VanDerWaalsContact C-OH 3.3Å; F268-Y359 WeakPolarHBondContact O-CE1 3.35Å; F268-Y359 PolarHBondContact O-OH 3.01Å; F268-Y360 HydrophobicContact CB-CE1 4.42Å; F268-Y360 HydrophobicContact CD1-CE1 4.12Å; F268-Y360 HydrophobicContact CG-CE1 4.43Å
269K90.9Very high96.7Very high197 Ų19743.9 Ų43.986%0.85721%0.214SC*.THydrogen-bonded Turntrans-100.1-3.7171.6-58.1-174.8-179.7-176.80113.3S267S267-K269 PolarHBondContact O-N 3.36Å; S267-K269 PolarHBondContact OG-N 2.81Å
270C94.3Very high96.6Very high14 Ų1442.8 Ų42.810%0.09521%0.209CC..SBendtrans-66.8153.1-179.7-69.30000111.9S267 V274 Y359S267-C270 PolarHBondContact N-SG 2.68Å; S267-C270 WeakPolarHBondContact O-CB 3.25Å; S267-C270 PolarHBondContact O-N 3.26Å; S267-C270 VanDerWaalsContact O-N 3.07Å; S267-C270 PolarHBondContact O-SG 2.97Å; S267-C270 PolarHBondContact OG-SG 3.08Å; C270-V274 HydrophobicContact CB-CB 3.97Å; C270-V274 HydrophobicContact CB-CG1 4.09Å; C270-V274 HydrophobicContact CB-CG2 4.12Å; C270-Y359 PolarHBondContact O-OH 3.13Å
271S93.9Very high96.7Very high28 Ų2840.6 Ų40.620%0.19619%0.194CC..  trans-55.9149174.9172.70000111.9M273 V274S271-M273 PolarHBondContact O-N 3.15Å; S271-M273 PolarHBondContact OG-N 2.62Å; S271-V274 WeakPolarHBondContact O-CB 3.3Å; S271-V274 PolarHBondContact O-N 2.78Å
272M95.3Very high96.7Very high3 Ų343.2 Ų43.22%0.01521%0.21CC..Hα-helixtrans-53.5-27171.2-72-56.6-57.100112.8W275 A276 Y359 L362 I363 M366M272-W275 PolarHBondContact O-N 3.11Å; M272-A276 WeakPolarHBondContact O-CB 3.03Å; M272-A276 PolarHBondContact O-N 3.09Å; M272-Y359 HydrophobicContact CG-CD2 4.19Å; M272-Y359 HydrophobicContact CG-CE2 4.21Å; M272-Y359 HydrophobicContact SD-CD2 3.52Å; M272-Y359 VanDerWaalsContact SD-CD2 3.52Å; M272-Y359 HydrophobicContact SD-CE2 3.54Å; M272-Y359 VanDerWaalsContact SD-CE2 3.54Å; M272-Y359 HydrophobicContact SD-CG 4.49Å; M272-L362 HydrophobicContact CE-CB 3.4Å; M272-L362 VanDerWaalsContact CE-CB 3.4Å; M272-L362 HydrophobicContact CE-CD1 4.23Å; M272-L362 HydrophobicContact CE-CG 4.45Å; M272-L362 HydrophobicContact SD-CB 4.19Å; M272-L362 HydrophobicContact SD-CD1 4.5Å; M272-I363 HydrophobicContact CE-CG1 4.3Å; M272-I363 HydrophobicContact SD-CG1 4.09Å; M272-M366 HydrophobicContact CE-CE 3.36Å; M272-M366 HydrophobicContact CE-SD 4.3Å
273M95.6Very high96.6Very high0 Ų043.2 Ų43.20%021%0.21CC..Hα-helixtrans-61.6-40.3172.8-73.8-64.2-76.500113F183 S271 A276 Y277 M342 H345 M482 W486F183-M273 HydrophobicContact CD2-CB 3.82Å; F183-M273 HydrophobicContact CD2-CG 4.36Å; F183-M273 HydrophobicContact CE2-CB 3.7Å; F183-M273 HydrophobicContact CE2-CE 4.17Å; F183-M273 HydrophobicContact CE2-CG 3.71Å; F183-M273 HydrophobicContact CG-CB 4.35Å; F183-M273 HydrophobicContact CZ-CB 4.15Å; F183-M273 HydrophobicContact CZ-CG 3.84Å; S271-M273 PolarHBondContact O-N 3.15Å; S271-M273 PolarHBondContact OG-N 2.62Å; M273-A276 PolarHBondContact O-N 2.99Å; M273-Y277 HydrophobicContact CE-CD2 4.49Å; M273-Y277 HydrophobicContact CE-CE2 3.55Å; M273-Y277 WeakPolarHBondContact O-CD2 3.37Å; M273-Y277 PolarHBondContact O-N 3.13Å; M273-M342 HydrophobicContact CE-CB 4.22Å; M273-M342 WeakPolarHBondContact SD-CA 3.13Å; M273-M342 HydrophobicContact SD-CB 3.59Å; M273-M342 VanDerWaalsContact SD-CB 3.59Å; M273-M342 PolarHBondContact SD-N 3.22Å; M273-H345 HydrophobicContact CG-CB 4.4Å; M273-M482 HydrophobicContact CE-CE 3.64Å; M273-M482 HydrophobicContact SD-CE 4.31Å; M273-W486 HydrophobicContact CE-CH2 3.82Å; M273-W486 HydrophobicContact CE-CZ3 4.11Å; M273-W486 HydrophobicContact CG-CH2 4.42Å; M273-W486 HydrophobicContact SD-CH2 4.24Å
274V98Very high96.6Very high0 Ų037.2 Ų37.20%018%0.183CC..Hα-helixtrans-65-45.3-179.81770000110.3F183 L184 I262 L266 C270 S271 Y277 L278F183-V274 HydrophobicContact CB-CG2 3.7Å; L184-V274 HydrophobicContact CD2-CB 4.47Å; L184-V274 HydrophobicContact CD2-CG1 3.66Å; L184-V274 HydrophobicContact CD2-CG2 3.91Å; L184-V274 HydrophobicContact CG-CG2 4.3Å; I262-V274 HydrophobicContact CG1-CG1 4.21Å; I262-V274 HydrophobicContact CG2-CG1 3.74Å; L266-V274 HydrophobicContact CD1-CG1 4.22Å; C270-V274 HydrophobicContact CB-CB 3.97Å; C270-V274 HydrophobicContact CB-CG1 4.09Å; C270-V274 HydrophobicContact CB-CG2 4.12Å; S271-V274 WeakPolarHBondContact O-CB 3.3Å; S271-V274 PolarHBondContact O-N 2.78Å; V274-Y277 PolarHBondContact O-N 3.41Å; V274-L278 WeakPolarHBondContact O-CB 3.47Å; V274-L278 PolarHBondContact O-N 3.01Å
275W98.2Very high96.5Very high19 Ų1937.8 Ų37.87%0.07218%0.181CC..Hα-helixtrans-63.3-42.7176.1-70.7105.2000112.1L266 F268 M272 Y277 L278 F279 Y359 I363 M366L266-W275 HydrophobicContact CD1-CD2 4.32Å; L266-W275 HydrophobicContact CD1-CE3 4.35Å; L266-W275 HydrophobicContact CD1-CH2 3.95Å; L266-W275 HydrophobicContact CD1-CZ2 3.9Å; L266-W275 HydrophobicContact CD1-CZ3 4.18Å; L266-W275 HydrophobicContact CD2-CH2 4.06Å; L266-W275 HydrophobicContact CD2-CZ3 4.18Å; L266-W275 HydrophobicContact CG-CH2 4.19Å; L266-W275 HydrophobicContact CG-CZ2 4.41Å; F268-W275 HydrophobicContact CD1-CH2 4.19Å; F268-W275 AromaticContact CD1-CZ2 3.75Å; F268-W275 HydrophobicContact CD1-CZ2 3.75Å; F268-W275 AromaticContact CE1-CH2 3.92Å; F268-W275 HydrophobicContact CE1-CH2 3.92Å; F268-W275 AromaticContact CE1-CZ2 3.97Å; F268-W275 HydrophobicContact CE1-CZ2 3.97Å; F268-W275 HydrophobicContact CG-CZ2 4.47Å; M272-W275 PolarHBondContact O-N 3.11Å; W275-Y277 PolarHBondContact O-N 3.03Å; W275-L278 HydrophobicContact CE3-CD2 4.05Å; W275-L278 HydrophobicContact CZ3-CD2 4.07Å; W275-L278 WeakPolarHBondContact O-CB 3.03Å; W275-L278 PolarHBondContact O-N 2.77Å; W275-F279 HydrophobicContact CB-CD2 4.44Å; W275-F279 HydrophobicContact CB-CE2 4.21Å; W275-F279 AromaticContact CE3-CE2 3.98Å; W275-F279 HydrophobicContact CE3-CE2 3.98Å; W275-F279 HydrophobicContact CE3-CZ 4.02Å; W275-F279 HydrophobicContact CZ3-CZ 4.47Å; W275-F279 WeakPolarHBondContact O-CD2 3.48Å; W275-F279 PolarHBondContact O-N 3.03Å; W275-Y359 PolarHBondContact NE1-OH 3.45Å; W275-Y359 VanDerWaalsContact NE1-OH 3.09Å; W275-I363 HydrophobicContact CD2-CD1 4.06Å; W275-I363 HydrophobicContact CD2-CG1 4.17Å; W275-I363 HydrophobicContact CD2-CG2 4.16Å; W275-I363 HydrophobicContact CE3-CG2 4.06Å; W275-I363 HydrophobicContact CG-CD1 4.12Å; W275-I363 HydrophobicContact CG-CG1 3.97Å; W275-I363 HydrophobicContact CZ2-CD1 4.17Å; W275-I363 HydrophobicContact CZ3-CG2 4.35Å; W275-M366 HydrophobicContact CB-CE 3.58Å
276A98.2Very high96.5Very high0 Ų035 Ų350%018%0.177CC..Hα-helixtrans-58-47.4175.900000112.1M272 M273 F279 T280 L337 M366M272-A276 WeakPolarHBondContact O-CB 3.03Å; M272-A276 PolarHBondContact O-N 3.09Å; M273-A276 PolarHBondContact O-N 2.99Å; A276-F279 PolarHBondContact O-N 3.03Å; A276-T280 WeakPolarHBondContact O-CB 3.28Å; A276-T280 PolarHBondContact O-N 3.14Å; A276-T280 PolarHBondContact O-OG1 3.39Å; A276-L337 VanDerWaalsContact CB-O 3.29Å; A276-L337 WeakPolarHBondContact CB-O 3.44Å; A276-M366 HydrophobicContact CB-SD 4.1Å
277Y98.5Very high96.5Very high0 Ų032.6 Ų32.60%016%0.164CC..Hα-helixtrans-66.9-36.1176.9-76.9-59.1000113L171 M172 F175 G176 L180 F258 M273 V274 W275 T280 S281 P338L171-Y277 WeakPolarHBondContact O-CE1 3.41Å; L171-Y277 PolarHBondContact O-OH 2.85Å; L171-Y277 VanDerWaalsContact O-OH 3.05Å; M172-Y277 HydrophobicContact CE-CD1 4.04Å; M172-Y277 HydrophobicContact SD-CD1 3.6Å; M172-Y277 HydrophobicContact SD-CE1 3.83Å; F175-Y277 VanDerWaalsContact CB-OH 3.25Å; F175-Y277 WeakPolarHBondContact CB-OH 3.3Å; G176-Y277 VanDerWaalsContact CA-CZ 3.41Å; G176-Y277 PolarHBondContact N-OH 3.12Å; G176-Y277 VanDerWaalsContact N-OH 3.14Å; L180-Y277 HydrophobicContact CD1-CD2 4.19Å; F258-Y277 HydrophobicContact CD2-CD1 4.36Å; F258-Y277 HydrophobicContact CE2-CD1 4.17Å; M273-Y277 HydrophobicContact CE-CD2 4.49Å; M273-Y277 HydrophobicContact CE-CE2 3.55Å; M273-Y277 WeakPolarHBondContact O-CD2 3.37Å; M273-Y277 PolarHBondContact O-N 3.13Å; V274-Y277 PolarHBondContact O-N 3.41Å; W275-Y277 PolarHBondContact O-N 3.03Å; Y277-T280 PolarHBondContact O-N 3.02Å; Y277-S281 WeakPolarHBondContact O-CB 3.35Å; Y277-S281 PolarHBondContact O-N 2.71Å; Y277-S281 PolarHBondContact O-OG 2.63Å; Y277-S281 VanDerWaalsContact O-OG 3.11Å; Y277-P338 HydrophobicContact CD1-CG 4.44Å; Y277-P338 HydrophobicContact CE1-CB 3.95Å; Y277-P338 HydrophobicContact CE1-CG 4.09Å
278L98.6Very high96.5Very high9 Ų930.5 Ų30.55%0.04715%0.149CC..Hα-helixtrans-59.4-53.4174.4-179.961.2000111.2I259 I262 F263 L266 V274 W275 T280 S281 V282I259-L278 HydrophobicContact CG1-CD1 4.33Å; I262-L278 HydrophobicContact CB-CD1 4.45Å; I262-L278 HydrophobicContact CD1-CB 3.94Å; I262-L278 HydrophobicContact CD1-CD1 4.47Å; I262-L278 HydrophobicContact CG2-CB 4.22Å; I262-L278 HydrophobicContact CG2-CD1 4.09Å; I262-L278 HydrophobicContact CG2-CD2 4.32Å; I262-L278 HydrophobicContact CG2-CG 4.44Å; F263-L278 HydrophobicContact CE1-CD1 4.16Å; F263-L278 HydrophobicContact CE1-CD2 4.35Å; F263-L278 HydrophobicContact CZ-CD1 4.04Å; L266-L278 HydrophobicContact CD1-CD2 4.39Å; L266-L278 HydrophobicContact CD2-CD2 3.84Å; V274-L278 WeakPolarHBondContact O-CB 3.47Å; V274-L278 PolarHBondContact O-N 3.01Å; W275-L278 HydrophobicContact CE3-CD2 4.05Å; W275-L278 HydrophobicContact CZ3-CD2 4.07Å; W275-L278 WeakPolarHBondContact O-CB 3.03Å; W275-L278 PolarHBondContact O-N 2.77Å; L278-T280 VanDerWaalsContact C-N 3.33Å; L278-T280 PolarHBondContact O-N 3.48Å; L278-S281 PolarHBondContact O-N 2.74Å; L278-V282 HydrophobicContact CD1-CG2 4.5Å; L278-V282 WeakPolarHBondContact O-CG2 3.2Å; L278-V282 PolarHBondContact O-N 2.85Å
279F98.5Very high96.7Very high27 Ų2725.8 Ų25.812%0.11813%0.132CC..Hα-helixtrans-64.3-38.8-178.6-71.9-50.3000112.2W275 A276 V282 L283 L337 I363 M366 A367 V370W275-F279 HydrophobicContact CB-CD2 4.44Å; W275-F279 HydrophobicContact CB-CE2 4.21Å; W275-F279 AromaticContact CE3-CE2 3.98Å; W275-F279 HydrophobicContact CE3-CE2 3.98Å; W275-F279 HydrophobicContact CE3-CZ 4.02Å; W275-F279 HydrophobicContact CZ3-CZ 4.47Å; W275-F279 WeakPolarHBondContact O-CD2 3.48Å; W275-F279 PolarHBondContact O-N 3.03Å; A276-F279 PolarHBondContact O-N 3.03Å; F279-V282 PolarHBondContact O-N 3.47Å; F279-L283 PolarHBondContact O-N 3.5Å; F279-L337 HydrophobicContact CB-CD1 4.12Å; F279-I363 HydrophobicContact CE2-CG2 4.22Å; F279-I363 HydrophobicContact CZ-CG2 4.26Å; F279-M366 HydrophobicContact CD2-CB 3.48Å; F279-M366 VanDerWaalsContact CD2-CB 3.48Å; F279-M366 HydrophobicContact CD2-CE 4.12Å; F279-M366 HydrophobicContact CE2-CB 3.77Å; F279-M366 HydrophobicContact CE2-CE 4.15Å; F279-M366 HydrophobicContact CG-CB 4.32Å; F279-A367 HydrophobicContact CE1-CB 3.82Å; F279-A367 HydrophobicContact CE2-CB 4.45Å; F279-A367 HydrophobicContact CZ-CB 3.68Å; F279-V370 HydrophobicContact CB-CG2 3.56Å; F279-V370 HydrophobicContact CD1-CG2 3.74Å; F279-V370 HydrophobicContact CG-CG2 3.9Å
280T98.2Very high97Very high0 Ų016.6 Ų16.60%09%0.092CC..Hα-helixtrans-60.5-48.2174-570000111.4M172 A276 Y277 L278 V282 L283 L284 V334 L337 P338M172-T280 HydrophobicContact CE-CG2 3.97Å; M172-T280 HydrophobicContact SD-CG2 3.53Å; M172-T280 VanDerWaalsContact SD-CG2 3.53Å; A276-T280 WeakPolarHBondContact O-CB 3.28Å; A276-T280 PolarHBondContact O-N 3.14Å; A276-T280 PolarHBondContact O-OG1 3.39Å; Y277-T280 PolarHBondContact O-N 3.02Å; L278-T280 VanDerWaalsContact C-N 3.33Å; L278-T280 PolarHBondContact O-N 3.48Å; T280-V282 VanDerWaalsContact C-N 3.34Å; T280-V282 PolarHBondContact O-N 3.11Å; T280-L283 PolarHBondContact O-N 2.96Å; T280-L284 HydrophobicContact CG2-CD1 4.18Å; T280-L284 WeakPolarHBondContact O-CG 3.42Å; T280-L284 PolarHBondContact O-N 3.01Å; T280-L284 VanDerWaalsContact O-N 3.07Å; T280-V334 HydrophobicContact CG2-CB 4.13Å; T280-V334 HydrophobicContact CG2-CG1 3.58Å; T280-V334 HydrophobicContact CG2-CG2 4.4Å; T280-L337 WeakPolarHBondContact OG1-CB 3.42Å; T280-P338 HydrophobicContact CG2-CG 4.23Å; T280-P338 WeakPolarHBondContact OG1-CD 3.4Å
281S98.5Very high97.1Very high0 Ų016.3 Ų16.30%09%0.09CC..Hα-helixtrans-65.4-34.5177.8-65.40000113.4M172 F258 Y277 L278 L285M172-S281 WeakPolarHBondContact CE-OG 3.47Å; F258-S281 WeakPolarHBondContact CB-OG 3.32Å; Y277-S281 WeakPolarHBondContact O-CB 3.35Å; Y277-S281 PolarHBondContact O-N 2.71Å; Y277-S281 PolarHBondContact O-OG 2.63Å; Y277-S281 VanDerWaalsContact O-OG 3.11Å; L278-S281 PolarHBondContact O-N 2.74Å; S281-L285 PolarHBondContact O-N 3.33Å; S281-L285 VanDerWaalsContact O-N 3.1Å
282V98.4Very high97.2Very high55 Ų5515.7 Ų15.733%0.3339%0.086SC..Hα-helixtrans-65.1-44.5174.51690000110.9I259 L278 F279 T280 L284 L285 L286 V370I259-V282 HydrophobicContact CD1-CG2 4.23Å; L278-V282 HydrophobicContact CD1-CG2 4.5Å; L278-V282 WeakPolarHBondContact O-CG2 3.2Å; L278-V282 PolarHBondContact O-N 2.85Å; F279-V282 PolarHBondContact O-N 3.47Å; T280-V282 VanDerWaalsContact C-N 3.34Å; T280-V282 PolarHBondContact O-N 3.11Å; V282-L284 PolarHBondContact O-N 2.94Å; V282-L285 PolarHBondContact O-N 3.01Å; V282-L286 WeakPolarHBondContact O-CB 3.39Å; V282-L286 PolarHBondContact O-N 3.2Å; V282-L286 VanDerWaalsContact O-N 3.08Å; V282-V370 HydrophobicContact CG1-CG1 4.23Å
283L97.6Very high97.3Very high0 Ų015.8 Ų15.80%09%0.087CC..Hα-helixtrans-58.6-46.9175.8-80.1171.3000111.7F279 T280 L285 L286 S287 P330 V334 L337 V370F279-L283 PolarHBondContact O-N 3.5Å; T280-L283 PolarHBondContact O-N 2.96Å; L283-L285 PolarHBondContact O-N 3.46Å; L283-L286 PolarHBondContact O-N 3.09Å; L283-L286 VanDerWaalsContact O-N 3.12Å; L283-S287 WeakPolarHBondContact O-CB 3.32Å; L283-S287 PolarHBondContact O-N 3.37Å; L283-S287 PolarHBondContact O-OG 2.93Å; L283-P330 HydrophobicContact CD2-CB 4.14Å; L283-V334 HydrophobicContact CB-CG2 3.79Å; L283-V334 HydrophobicContact CD1-CG2 4.33Å; L283-L337 HydrophobicContact CD1-CD1 3.73Å; L283-V370 HydrophobicContact CD1-CG2 4Å; L283-V370 HydrophobicContact CD2-CB 4.27Å; L283-V370 HydrophobicContact CD2-CG1 3.83Å; L283-V370 HydrophobicContact CD2-CG2 4.43Å; L283-V370 HydrophobicContact CG-CB 4.29Å; L283-V370 HydrophobicContact CG-CG1 3.97Å; L283-V370 HydrophobicContact CG-CG2 3.92Å
284L97.4Very high97.4Very high1 Ų115.9 Ų15.91%0.0059%0.088CC..Hα-helixtrans-60.7-42.2179.1-71.2163.3000112.9M168 M172 S255 T280 V282 L286 L288 V334M168-L284 HydrophobicContact CE-CD1 3.48Å; M168-L284 VanDerWaalsContact CE-CD1 3.48Å; M168-L284 HydrophobicContact CE-CD2 3.48Å; M168-L284 VanDerWaalsContact CE-CD2 3.48Å; M168-L284 HydrophobicContact CE-CG 4.1Å; M172-L284 HydrophobicContact CE-CD1 4.3Å; M172-L284 HydrophobicContact CG-CD1 4.45Å; S255-L284 VanDerWaalsContact OG-CB 3.28Å; S255-L284 WeakPolarHBondContact OG-CB 3.23Å; S255-L284 WeakPolarHBondContact OG-CD1 3.48Å; T280-L284 HydrophobicContact CG2-CD1 4.18Å; T280-L284 WeakPolarHBondContact O-CG 3.42Å; T280-L284 PolarHBondContact O-N 3.01Å; T280-L284 VanDerWaalsContact O-N 3.07Å; V282-L284 PolarHBondContact O-N 2.94Å; L284-L286 VanDerWaalsContact C-N 3.28Å; L284-L286 PolarHBondContact O-N 3.09Å; L284-L288 HydrophobicContact CB-CD1 4.11Å; L284-L288 HydrophobicContact CD2-CD1 3.67Å; L284-L288 HydrophobicContact CD2-CG 4.08Å; L284-L288 VanDerWaalsContact O-CB 3.31Å; L284-L288 WeakPolarHBondContact O-CB 3.14Å; L284-L288 WeakPolarHBondContact O-CG 3.24Å; L284-L288 PolarHBondContact O-N 3.32Å; L284-V334 HydrophobicContact CD1-CG1 4Å; L284-V334 HydrophobicContact CD2-CB 4.41Å; L284-V334 HydrophobicContact CD2-CG1 3.7Å; L284-V334 HydrophobicContact CD2-CG2 3.92Å; L284-V334 HydrophobicContact CG-CG1 3.87Å; L284-V334 HydrophobicContact CG-CG2 3.85Å
285L96.2Very high97.3Very high65 Ų6516 Ų1634%0.349%0.089SC..Hα-helixtrans-64.8-33.5175.9-78.6-170.8000112.8L252 V256 I259 S281 V282 L283 P289L252-L285 HydrophobicContact CD2-CD2 3.82Å; V256-L285 HydrophobicContact CG2-CD1 4.48Å; V256-L285 HydrophobicContact CG2-CD2 3.85Å; I259-L285 HydrophobicContact CD1-CD1 3.32Å; I259-L285 HydrophobicContact CD1-CG 4.04Å; S281-L285 PolarHBondContact O-N 3.33Å; S281-L285 VanDerWaalsContact O-N 3.1Å; V282-L285 PolarHBondContact O-N 3.01Å; L283-L285 PolarHBondContact O-N 3.46Å; L285-P289 WeakPolarHBondContact O-CD 3.31Å; L285-P289 WeakPolarHBondContact O-CG 3.43Å
286L95.4Very high97.3Very high85 Ų8516.7 Ų16.745%0.44510%0.095SC..Hα-helixtrans-76.7-43-179.9-178.465.9000112V282 L283 L284 S374V282-L286 WeakPolarHBondContact O-CB 3.39Å; V282-L286 PolarHBondContact O-N 3.2Å; V282-L286 VanDerWaalsContact O-N 3.08Å; L283-L286 PolarHBondContact O-N 3.09Å; L283-L286 VanDerWaalsContact O-N 3.12Å; L284-L286 VanDerWaalsContact C-N 3.28Å; L284-L286 PolarHBondContact O-N 3.09Å; L286-S374 VanDerWaalsContact CD2-OG 3.28Å; L286-S374 WeakPolarHBondContact CD2-OG 3.04Å
287S95.6Very high97.2Very high1 Ų117.6 Ų17.61%0.00710%0.099CC..Hα-helixtrans-95.8-41.5-164.371.50000114.1L283 P289 V290 L291L283-S287 WeakPolarHBondContact O-CB 3.32Å; L283-S287 PolarHBondContact O-N 3.37Å; L283-S287 PolarHBondContact O-OG 2.93Å; S287-P289 VanDerWaalsContact C-CD 3.45Å; S287-V290 WeakPolarHBondContact O-CB 3.23Å; S287-V290 PolarHBondContact O-N 2.99Å; S287-V290 VanDerWaalsContact O-N 3.08Å; S287-L291 PolarHBondContact O-N 3.05Å
288L95.7Very high97.1Very high7 Ų717.6 Ų17.64%0.03710%0.099CC..Hα-helixtrans-59.8-36.9-175.7-74173.8000114.7L252 L284 V290 L291 A292 F327L252-L288 HydrophobicContact CD1-CB 4.46Å; L252-L288 HydrophobicContact CD2-CB 3.95Å; L252-L288 HydrophobicContact CD2-CD1 4.16Å; L252-L288 HydrophobicContact CG-CB 4.11Å; L252-L288 HydrophobicContact CG-CD1 3.99Å; L284-L288 HydrophobicContact CB-CD1 4.11Å; L284-L288 HydrophobicContact CD2-CD1 3.67Å; L284-L288 HydrophobicContact CD2-CG 4.08Å; L284-L288 VanDerWaalsContact O-CB 3.31Å; L284-L288 WeakPolarHBondContact O-CB 3.14Å; L284-L288 WeakPolarHBondContact O-CG 3.24Å; L284-L288 PolarHBondContact O-N 3.32Å; L288-V290 PolarHBondContact O-N 3.46Å; L288-L291 PolarHBondContact O-N 3.38Å; L288-A292 PolarHBondContact O-N 3.39Å; L288-F327 HydrophobicContact CD2-CD2 3.94Å; L288-F327 HydrophobicContact CD2-CE2 3.43Å; L288-F327 VanDerWaalsContact CD2-CE2 3.43Å; L288-F327 HydrophobicContact CD2-CZ 4.26Å; L288-F327 HydrophobicContact CG-CE2 4.32Å
289P97.4Very high96.9Very high31 Ų3119.1 Ų19.120%0.20111%0.107CC..Hα-helixtrans-61.5-28.5176.9-2536.7000113.2L252 L285 S287 S293L252-P289 HydrophobicContact CD2-CG 4.24Å; L285-P289 WeakPolarHBondContact O-CD 3.31Å; L285-P289 WeakPolarHBondContact O-CG 3.43Å; S287-P289 VanDerWaalsContact C-CD 3.45Å; P289-S293 WeakPolarHBondContact O-CB 3.37Å; P289-S293 PolarHBondContact O-N 3.25Å
290V97Very high96.8Very high4 Ų421.5 Ų21.52%0.02412%0.118CC..Hα-helixtrans-72.9-40.6177.5-174.50000110.9I46 S287 L288 S293 G294 L323 F326I46-V290 HydrophobicContact CD1-CG2 4.43Å; I46-V290 HydrophobicContact CG2-CG2 4.17Å; S287-V290 WeakPolarHBondContact O-CB 3.23Å; S287-V290 PolarHBondContact O-N 2.99Å; S287-V290 VanDerWaalsContact O-N 3.08Å; L288-V290 PolarHBondContact O-N 3.46Å; V290-S293 PolarHBondContact O-N 2.98Å; V290-S293 PolarHBondContact O-OG 2.92Å; V290-G294 PolarHBondContact O-N 2.98Å; V290-L323 HydrophobicContact CG1-CB 4.22Å; V290-L323 HydrophobicContact CG1-CD2 3.74Å; V290-F326 HydrophobicContact CB-CD1 3.85Å; V290-F326 HydrophobicContact CB-CE1 4.41Å; V290-F326 HydrophobicContact CG1-CB 4.26Å; V290-F326 HydrophobicContact CG1-CD1 3.9Å; V290-F326 HydrophobicContact CG1-CG 4.33Å; V290-F326 HydrophobicContact CG2-CD1 3.62Å; V290-F326 HydrophobicContact CG2-CE1 3.69Å
291L95.9Very high96.7Very high8 Ų822.1 Ų22.14%0.04212%0.121CC..Hα-helixtrans-62.5-46.3171.6178.863.2000111.2F164 S287 L288 S293 G294 M295 F324 F327F164-L291 HydrophobicContact CZ-CD2 4.36Å; S287-L291 PolarHBondContact O-N 3.05Å; L288-L291 PolarHBondContact O-N 3.38Å; L291-S293 VanDerWaalsContact C-N 3.31Å; L291-S293 PolarHBondContact O-N 2.99Å; L291-G294 PolarHBondContact O-N 2.82Å; L291-M295 HydrophobicContact CD1-CE 4.48Å; L291-M295 HydrophobicContact CD1-CG 4.08Å; L291-M295 HydrophobicContact CD1-SD 4.16Å; L291-M295 HydrophobicContact CD2-CE 4.18Å; L291-M295 HydrophobicContact CD2-SD 4.46Å; L291-M295 HydrophobicContact CG-CE 3.8Å; L291-M295 HydrophobicContact CG-CG 4.37Å; L291-M295 HydrophobicContact CG-SD 4.1Å; L291-M295 WeakPolarHBondContact O-CG 3.31Å; L291-M295 PolarHBondContact O-N 3.02Å; L291-F324 HydrophobicContact CD1-CD2 3.77Å; L291-F324 HydrophobicContact CD1-CE2 4.11Å; L291-F327 HydrophobicContact CB-CB 3.78Å; L291-F327 HydrophobicContact CB-CD1 3.86Å; L291-F327 HydrophobicContact CB-CD2 4.09Å; L291-F327 HydrophobicContact CB-CG 3.6Å; L291-F327 HydrophobicContact CD1-CD1 3.91Å; L291-F327 HydrophobicContact CD1-CE1 4.42Å; L291-F327 HydrophobicContact CD1-CG 4.5Å; L291-F327 HydrophobicContact CD2-CD1 3.53Å; L291-F327 HydrophobicContact CD2-CD2 4.25Å; L291-F327 HydrophobicContact CD2-CE1 3.4Å; L291-F327 HydrophobicContact CD2-CE2 4.13Å; L291-F327 HydrophobicContact CD2-CG 3.97Å; L291-F327 HydrophobicContact CD2-CZ 3.71Å; L291-F327 HydrophobicContact CG-CD1 3.93Å; L291-F327 HydrophobicContact CG-CE1 4.3Å; L291-F327 HydrophobicContact CG-CG 4.19Å
292A97Very high96.5Very high14 Ų1423.9 Ų23.912%0.11613%0.128CC..Hα-helixtrans-59.9-40.5179.300000112.2H245 L288 T296H245-A292 PolarHBondContact NE2-O 3.37Å; L288-A292 PolarHBondContact O-N 3.39Å; A292-T296 WeakPolarHBondContact O-CB 3.39Å; A292-T296 PolarHBondContact O-N 3.3Å; A292-T296 PolarHBondContact O-OG1 3.39Å
293S97.3Very high96.2Very high6 Ų626 Ų264%0.04213%0.132CC..Hα-helixtrans-66.7-43.3175.573.50000111.9P289 V290 L291 T296 M297P289-S293 WeakPolarHBondContact O-CB 3.37Å; P289-S293 PolarHBondContact O-N 3.25Å; V290-S293 PolarHBondContact O-N 2.98Å; V290-S293 PolarHBondContact O-OG 2.92Å; L291-S293 VanDerWaalsContact C-N 3.31Å; L291-S293 PolarHBondContact O-N 2.99Å; S293-T296 PolarHBondContact O-N 2.99Å; S293-M297 WeakPolarHBondContact O-CE 3.5Å; S293-M297 WeakPolarHBondContact O-CG 3.25Å; S293-M297 PolarHBondContact O-N 3.45Å
294G97.2Very high96Very high2 Ų233.1 Ų33.12%0.02116%0.164CC..Hα-helixtrans-57.1-49.4174.800000112.9V290 L291 T296 M297 L298V290-G294 PolarHBondContact O-N 2.98Å; L291-G294 PolarHBondContact O-N 2.82Å; G294-T296 PolarHBondContact O-N 3.44Å; G294-M297 PolarHBondContact O-N 3.34Å; G294-L298 WeakPolarHBondContact O-CB 3.39Å; G294-L298 PolarHBondContact O-N 3.19Å
295M96.3Very high95.7Very high3 Ų336.4 Ų36.42%0.01520%0.198CC..Hα-helixtrans-67.4-34.1177.4-64.5-175.3-58.300112.5L223 L244 H245 L291 L298 L299L223-M295 HydrophobicContact CD1-CG 4.18Å; L223-M295 HydrophobicContact CD1-SD 4.13Å; L244-M295 HydrophobicContact CB-CE 3.93Å; L244-M295 HydrophobicContact CB-SD 3.64Å; L244-M295 HydrophobicContact CD1-SD 3.89Å; L244-M295 HydrophobicContact CG-SD 4.44Å; H245-M295 WeakPolarHBondContact CE1-CB 3.49Å; L291-M295 HydrophobicContact CD1-CE 4.48Å; L291-M295 HydrophobicContact CD1-CG 4.08Å; L291-M295 HydrophobicContact CD1-SD 4.16Å; L291-M295 HydrophobicContact CD2-CE 4.18Å; L291-M295 HydrophobicContact CD2-SD 4.46Å; L291-M295 HydrophobicContact CG-CE 3.8Å; L291-M295 HydrophobicContact CG-CG 4.37Å; L291-M295 HydrophobicContact CG-SD 4.1Å; L291-M295 WeakPolarHBondContact O-CG 3.31Å; L291-M295 PolarHBondContact O-N 3.02Å; M295-L298 PolarHBondContact O-N 3.32Å; M295-L299 PolarHBondContact O-N 3.07Å
296T97.6Very high95.7Very high32 Ų3235.4 Ų35.420%0.19619%0.194CC..Hα-helixtrans-65-46.5174.6-62.80000110.8H245 A292 S293 G294 L298 L299 F300H245-T296 PolarHBondContact NE2-OG1 3.28Å; H245-T296 VanDerWaalsContact NE2-OG1 3.13Å; A292-T296 WeakPolarHBondContact O-CB 3.39Å; A292-T296 PolarHBondContact O-N 3.3Å; A292-T296 PolarHBondContact O-OG1 3.39Å; S293-T296 PolarHBondContact O-N 2.99Å; G294-T296 PolarHBondContact O-N 3.44Å; T296-L298 PolarHBondContact O-N 3.48Å; T296-L299 WeakPolarHBondContact O-CB 3.35Å; T296-L299 PolarHBondContact O-N 3.13Å; T296-F300 HydrophobicContact CG2-CD2 4.03Å; T296-F300 HydrophobicContact CG2-CE2 3.79Å; T296-F300 WeakPolarHBondContact O-CD2 3.26Å; T296-F300 PolarHBondContact O-N 3.04Å
297M97.2Very high95.7Very high19 Ų1932.9 Ų32.99%0.09419%0.186CC..Hα-helixtrans-59-39.9174.9-74.2-178.2-75.400111.4F45 S293 G294 F300 D301 F308 F309 L323F45-M297 HydrophobicContact CD1-SD 4.17Å; F45-M297 HydrophobicContact CE1-SD 4.1Å; S293-M297 WeakPolarHBondContact O-CE 3.5Å; S293-M297 WeakPolarHBondContact O-CG 3.25Å; S293-M297 PolarHBondContact O-N 3.45Å; G294-M297 PolarHBondContact O-N 3.34Å; M297-F300 PolarHBondContact O-N 3.47Å; M297-F300 VanDerWaalsContact O-N 3.14Å; M297-D301 PolarHBondContact O-N 3.49Å; M297-F308 HydrophobicContact CB-CB 4.1Å; M297-F308 HydrophobicContact CB-CD2 3.67Å; M297-F308 HydrophobicContact CB-CE2 4.23Å; M297-F308 HydrophobicContact CB-CG 3.85Å; M297-F308 HydrophobicContact CG-CD1 4.07Å; M297-F308 HydrophobicContact CG-CD2 3.83Å; M297-F308 HydrophobicContact CG-CE1 4.23Å; M297-F308 HydrophobicContact CG-CE2 4Å; M297-F308 HydrophobicContact CG-CG 3.87Å; M297-F308 HydrophobicContact CG-CZ 4.2Å; M297-F308 HydrophobicContact SD-CB 4.44Å; M297-F308 HydrophobicContact SD-CD1 3.78Å; M297-F308 HydrophobicContact SD-CE1 4.16Å; M297-F308 HydrophobicContact SD-CG 4.02Å; M297-F309 HydrophobicContact CB-CE2 3.65Å; M297-F309 HydrophobicContact CB-CZ 3.73Å; M297-F309 HydrophobicContact CE-CZ 4.25Å; M297-F309 HydrophobicContact SD-CZ 4.45Å; M297-L323 HydrophobicContact CE-CD1 3.32Å
298L95.7Very high95.8Very high0 Ų035.7 Ų35.70%020%0.198CC..Hα-helixtrans-65.4-41178.3-167.669.8000112.4L223 P225 S228 I229 M241 G294 M295 T296 F300 D301 R302 F309 F320L223-L298 HydrophobicContact CB-CD2 4.24Å; P225-L298 HydrophobicContact CB-CD1 4.34Å; S228-L298 WeakPolarHBondContact OG-CD1 3.38Å; S228-L298 WeakPolarHBondContact OG-CD2 3.33Å; I229-L298 HydrophobicContact CD1-CD1 3.9Å; I229-L298 HydrophobicContact CG1-CD1 3.49Å; I229-L298 VanDerWaalsContact CG1-CD1 3.49Å; M241-L298 HydrophobicContact SD-CB 4.03Å; M241-L298 HydrophobicContact SD-CD2 3.63Å; M241-L298 HydrophobicContact SD-CG 3.99Å; G294-L298 WeakPolarHBondContact O-CB 3.39Å; G294-L298 PolarHBondContact O-N 3.19Å; M295-L298 PolarHBondContact O-N 3.32Å; T296-L298 PolarHBondContact O-N 3.48Å; L298-F300 VanDerWaalsContact C-N 3.26Å; L298-F300 PolarHBondContact O-N 2.91Å; L298-D301 PolarHBondContact O-N 2.98Å; L298-R302 VanDerWaalsContact O-CG 3.3Å; L298-R302 WeakPolarHBondContact O-CG 3.35Å; L298-R302 PolarHBondContact O-N 3.3Å; L298-R302 VanDerWaalsContact O-N 3.11Å; L298-F309 HydrophobicContact CB-CE2 4.1Å; L298-F309 HydrophobicContact CD1-CD2 3.84Å; L298-F309 HydrophobicContact CD1-CE2 4.2Å; L298-F320 HydrophobicContact CB-CE2 4.22Å; L298-F320 HydrophobicContact CD1-CD2 4.49Å; L298-F320 HydrophobicContact CD1-CE2 4.49Å; L298-F320 HydrophobicContact CD2-CE2 3.95Å; L298-F320 HydrophobicContact CD2-CZ 4.2Å; L298-F320 HydrophobicContact CG-CE2 4.47Å
299L95Very high95.9Very high41 Ų4135.4 Ų35.422%0.21520%0.197CC..Hα-helixtrans-60.7-37172.1-80.4165.2000112M241 M295 T296 R302 K303M241-L299 HydrophobicContact CB-CD1 4.24Å; M241-L299 HydrophobicContact CB-CD2 4.25Å; M241-L299 HydrophobicContact CB-CG 4.22Å; M241-L299 HydrophobicContact CE-CD2 3.36Å; M241-L299 HydrophobicContact CE-CG 3.66Å; M241-L299 HydrophobicContact SD-CD2 4.08Å; M241-L299 HydrophobicContact SD-CG 3.72Å; M295-L299 PolarHBondContact O-N 3.07Å; T296-L299 WeakPolarHBondContact O-CB 3.35Å; T296-L299 PolarHBondContact O-N 3.13Å; L299-R302 PolarHBondContact O-N 2.94Å; L299-K303 WeakPolarHBondContact O-CB 3.3Å; L299-K303 PolarHBondContact O-N 3.05Å
300F95.8Very high95.7Very high78 Ų7837 Ų3734%0.34220%0.201SC..Hα-helixtrans-70.4-40.1178.7-83.4-123.7000112.2T296 M297 L298 R302 K303 F304 G305 T306 F308T296-F300 HydrophobicContact CG2-CD2 4.03Å; T296-F300 HydrophobicContact CG2-CE2 3.79Å; T296-F300 WeakPolarHBondContact O-CD2 3.26Å; T296-F300 PolarHBondContact O-N 3.04Å; M297-F300 PolarHBondContact O-N 3.47Å; M297-F300 VanDerWaalsContact O-N 3.14Å; L298-F300 VanDerWaalsContact C-N 3.26Å; L298-F300 PolarHBondContact O-N 2.91Å; F300-R302 PolarHBondContact O-N 2.81Å; F300-K303 PolarHBondContact O-N 2.96Å; F300-F304 HydrophobicContact CB-CD2 4.3Å; F300-F304 HydrophobicContact CD1-CB 4.35Å; F300-F304 AromaticContact CD1-CD2 3.9Å; F300-F304 HydrophobicContact CD1-CD2 3.9Å; F300-F304 HydrophobicContact CD1-CG 4.46Å; F300-F304 AromaticContact CD2-CD2 3.92Å; F300-F304 HydrophobicContact CD2-CD2 3.92Å; F300-F304 HydrophobicContact CD2-CE2 4.27Å; F300-F304 HydrophobicContact CE1-CD2 4.18Å; F300-F304 HydrophobicContact CE2-CD2 4.22Å; F300-F304 HydrophobicContact CE2-CE2 4.24Å; F300-F304 AromaticContact CG-CD2 3.78Å; F300-F304 HydrophobicContact CG-CD2 3.78Å; F300-F304 HydrophobicContact CZ-CD2 4.34Å; F300-F304 HydrophobicContact CZ-CE2 4.45Å; F300-F304 CarbonylContact O-C 3.5Å; F300-F304 WeakPolarHBondContact O-CA 3.33Å; F300-F304 PolarHBondContact O-N 2.76Å; F300-G305 PolarHBondContact O-N 2.97Å; F300-T306 HydrophobicContact CB-CG2 4.04Å; F300-T306 VanDerWaalsContact CB-OG1 3.23Å; F300-T306 WeakPolarHBondContact CB-OG1 3.3Å; F300-T306 HydrophobicContact CD1-CG2 4.2Å; F300-T306 PolarHBondContact O-N 3.48Å; F300-T306 PolarHBondContact O-OG1 3.35Å; F300-F308 HydrophobicContact CB-CE2 4.14Å
301D95.7Very high95.7Very high12 Ų1240.5 Ų40.56%0.06422%0.224CC..Hα-helixtrans-61.6-38.8174.4-76.98.7000110.6I229 M297 L298 T306 A307 F308 F309I229-D301 HydrophobicContact CD1-CB 3.89Å; I229-D301 HydrophobicContact CG1-CB 4.23Å; I229-D301 HydrophobicContact CG2-CB 4.24Å; M297-D301 PolarHBondContact O-N 3.49Å; L298-D301 PolarHBondContact O-N 2.98Å; D301-T306 WeakPolarHBondContact CA-O 3.36Å; D301-T306 WeakPolarHBondContact CA-OG1 3.26Å; D301-T306 PolarHBondContact N-OG1 3.16Å; D301-T306 WeakPolarHBondContact OD1-CB 3.3Å; D301-T306 VanDerWaalsContact OD1-O 3.06Å; D301-T306 PolarHBondContact OD1-OG1 3.43Å; D301-A307 WeakPolarHBondContact OD1-CA 3.32Å; D301-A307 PolarHBondContact OD1-N 3.03Å; D301-F308 VanDerWaalsContact CG-N 3.31Å; D301-F308 VanDerWaalsContact OD1-CD2 3.23Å; D301-F308 WeakPolarHBondContact OD1-CD2 3.3Å; D301-F308 PolarHBondContact OD1-N 2.69Å; D301-F308 PolarHBondContact OD2-N 3.34Å; D301-F309 PolarHBondContact OD2-N 2.84Å
302R94.2Very high95.5Very high37 Ų3745.2 Ų45.214%0.1426%0.258CS..Hα-helixtrans-73.4-34.5179.6-71.2170.664.869.95.2115.4S228 S233 G234 D238 L298 L299 F300S228-R302 WeakPolarHBondContact O-CD 3.29Å; S228-R302 PolarHBondContact O-NH1 3.39Å; S233-R302 PolarHBondContact OG-NH1 3.48Å; G234-R302 PolarHBondContact O-NH2 2.82Å; D238-R302 IonicContact OD1-CZ 2.59Å; D238-R302 VanDerWaalsContact OD1-CZ 3.27Å; D238-R302 IonicContact OD1-NE 2.76Å; D238-R302 PolarHBondContact OD1-NE 3.41Å; D238-R302 IonicContact OD1-NH2 3.77Å; D238-R302 PolarHBondContact OD1-NH2 2.74Å; D238-R302 IonicContact OD2-NH2 2.7Å; D238-R302 PolarHBondContact OD2-NH2 3.19Å; L298-R302 VanDerWaalsContact O-CG 3.3Å; L298-R302 WeakPolarHBondContact O-CG 3.35Å; L298-R302 PolarHBondContact O-N 3.3Å; L298-R302 VanDerWaalsContact O-N 3.11Å; L299-R302 PolarHBondContact O-N 2.94Å; F300-R302 PolarHBondContact O-N 2.81Å
303K92.6Very high95.4Very high100 Ų10047 Ų4744%0.43528%0.278SS..Hα-helixtrans-119.5-25.4-166.8-61.5-57.5-178.3-167.30115D238 L299 F300D238-K303 WeakPolarHBondContact OD1-CE 3.36Å; D238-K303 IonicContact OD1-NZ 2.72Å; D238-K303 WeakPolarHBondContact OD2-CE 3.19Å; D238-K303 IonicContact OD2-NZ 3.63Å; D238-K303 PolarHBondContact OD2-NZ 3.23Å; L299-K303 WeakPolarHBondContact O-CB 3.3Å; L299-K303 PolarHBondContact O-N 3.05Å; F300-K303 PolarHBondContact O-N 2.96Å
304F94Very high95.3Very high150 Ų15050.1 Ų50.166%0.65831%0.311SS*.THydrogen-bonded Turntrans-116.54.4-174.6-60.5-64.2000112.7F300 T306F300-F304 HydrophobicContact CB-CD2 4.3Å; F300-F304 HydrophobicContact CD1-CB 4.35Å; F300-F304 AromaticContact CD1-CD2 3.9Å; F300-F304 HydrophobicContact CD1-CD2 3.9Å; F300-F304 HydrophobicContact CD1-CG 4.46Å; F300-F304 AromaticContact CD2-CD2 3.92Å; F300-F304 HydrophobicContact CD2-CD2 3.92Å; F300-F304 HydrophobicContact CD2-CE2 4.27Å; F300-F304 HydrophobicContact CE1-CD2 4.18Å; F300-F304 HydrophobicContact CE2-CD2 4.22Å; F300-F304 HydrophobicContact CE2-CE2 4.24Å; F300-F304 AromaticContact CG-CD2 3.78Å; F300-F304 HydrophobicContact CG-CD2 3.78Å; F300-F304 HydrophobicContact CZ-CD2 4.34Å; F300-F304 HydrophobicContact CZ-CE2 4.45Å; F300-F304 CarbonylContact O-C 3.5Å; F300-F304 WeakPolarHBondContact O-CA 3.33Å; F300-F304 PolarHBondContact O-N 2.76Å; F304-T306 VanDerWaalsContact C-N 3.25Å; F304-T306 PolarHBondContact O-N 3.04Å
305G90.6Very high95.3Very high70 Ų7050.8 Ų50.872%0.72232%0.318SS*.  trans66.625.9175.900000113.4F300F300-G305 PolarHBondContact O-N 2.97Å
306T95.9Very high95.3Very high44 Ų4454.1 Ų54.127%0.2734%0.335SS..  trans-73.3168.7166.961.70000110.1F300 D301 F304 F308F300-T306 HydrophobicContact CB-CG2 4.04Å; F300-T306 VanDerWaalsContact CB-OG1 3.23Å; F300-T306 WeakPolarHBondContact CB-OG1 3.3Å; F300-T306 HydrophobicContact CD1-CG2 4.2Å; F300-T306 PolarHBondContact O-N 3.48Å; F300-T306 PolarHBondContact O-OG1 3.35Å; D301-T306 WeakPolarHBondContact CA-O 3.36Å; D301-T306 WeakPolarHBondContact CA-OG1 3.26Å; D301-T306 PolarHBondContact N-OG1 3.16Å; D301-T306 WeakPolarHBondContact OD1-CB 3.3Å; D301-T306 VanDerWaalsContact OD1-O 3.06Å; D301-T306 PolarHBondContact OD1-OG1 3.43Å; F304-T306 VanDerWaalsContact C-N 3.25Å; F304-T306 PolarHBondContact O-N 3.04Å; T306-F308 HydrophobicContact CG2-CE2 4.03Å; T306-F308 WeakPolarHBondContact OG1-CD2 3.14Å; T306-F308 WeakPolarHBondContact OG1-CE2 3.45Å
307A95.7Very high95.2Very high32 Ų3254.1 Ų54.126%0.26434%0.336SS..  trans-136.557.6-179.700000110.9D301 E310 G315D301-A307 WeakPolarHBondContact OD1-CA 3.32Å; D301-A307 PolarHBondContact OD1-N 3.03Å; A307-E310 HydrophobicContact CB-CB 4.07Å; A307-G315 WeakPolarHBondContact O-CA 3.45Å; A307-G315 PolarHBondContact O-N 3.31Å
308F97.4Very high95.3Very high60 Ų6055.9 Ų55.926%0.26335%0.345SS..SBendtrans-67.6-38.8174.8-67.9-72.5000111.7F45 M297 F300 D301 T306 G315 D316F45-F308 HydrophobicContact CE1-CD1 4.22Å; F45-F308 AromaticContact CE1-CE1 3.68Å; F45-F308 HydrophobicContact CE1-CE1 3.68Å; F45-F308 AromaticContact CZ-CE1 3.96Å; F45-F308 HydrophobicContact CZ-CE1 3.96Å; M297-F308 HydrophobicContact CB-CB 4.1Å; M297-F308 HydrophobicContact CB-CD2 3.67Å; M297-F308 HydrophobicContact CB-CE2 4.23Å; M297-F308 HydrophobicContact CB-CG 3.85Å; M297-F308 HydrophobicContact CG-CD1 4.07Å; M297-F308 HydrophobicContact CG-CD2 3.83Å; M297-F308 HydrophobicContact CG-CE1 4.23Å; M297-F308 HydrophobicContact CG-CE2 4Å; M297-F308 HydrophobicContact CG-CG 3.87Å; M297-F308 HydrophobicContact CG-CZ 4.2Å; M297-F308 HydrophobicContact SD-CB 4.44Å; M297-F308 HydrophobicContact SD-CD1 3.78Å; M297-F308 HydrophobicContact SD-CE1 4.16Å; M297-F308 HydrophobicContact SD-CG 4.02Å; F300-F308 HydrophobicContact CB-CE2 4.14Å; D301-F308 VanDerWaalsContact CG-N 3.31Å; D301-F308 VanDerWaalsContact OD1-CD2 3.23Å; D301-F308 WeakPolarHBondContact OD1-CD2 3.3Å; D301-F308 PolarHBondContact OD1-N 2.69Å; D301-F308 PolarHBondContact OD2-N 3.34Å; T306-F308 HydrophobicContact CG2-CE2 4.03Å; T306-F308 WeakPolarHBondContact OG1-CD2 3.14Å; T306-F308 WeakPolarHBondContact OG1-CE2 3.45Å; F308-G315 WeakPolarHBondContact O-CA 3.46Å; F308-D316 PolarHBondContact O-N 3.2Å
309F97.5Very high95.3Very high1 Ų158.6 Ų58.60%0.00436%0.36CS..SBendtrans-120.80.3-175.3-48-60.2000113.8P225 I229 M297 L298 D301 P311 D316 P317 L319 F320 L323P225-F309 HydrophobicContact CB-CB 3.95Å; P225-F309 HydrophobicContact CG-CB 3.74Å; P225-F309 HydrophobicContact CG-CD2 4.5Å; P225-F309 HydrophobicContact CG-CG 4.09Å; I229-F309 HydrophobicContact CD1-CB 3.79Å; I229-F309 HydrophobicContact CD1-CD2 4.31Å; M297-F309 HydrophobicContact CB-CE2 3.65Å; M297-F309 HydrophobicContact CB-CZ 3.73Å; M297-F309 HydrophobicContact CE-CZ 4.25Å; M297-F309 HydrophobicContact SD-CZ 4.45Å; L298-F309 HydrophobicContact CB-CE2 4.1Å; L298-F309 HydrophobicContact CD1-CD2 3.84Å; L298-F309 HydrophobicContact CD1-CE2 4.2Å; D301-F309 PolarHBondContact OD2-N 2.84Å; F309-P311 WeakPolarHBondContact O-CD 3.43Å; F309-D316 WeakPolarHBondContact CD1-O 3.03Å; F309-P317 WeakPolarHBondContact O-CD 3.49Å; F309-L319 HydrophobicContact CD1-CB 4.34Å; F309-L319 HydrophobicContact CE1-CB 4.3Å; F309-L319 HydrophobicContact CE1-CD2 4.23Å; F309-L319 HydrophobicContact CE1-CG 4.14Å; F309-F320 HydrophobicContact CD1-CB 3.62Å; F309-F320 HydrophobicContact CD2-CB 4.44Å; F309-F320 HydrophobicContact CD2-CD2 4.18Å; F309-F320 HydrophobicContact CE1-CB 3.59Å; F309-F320 HydrophobicContact CE1-CD2 4.09Å; F309-F320 HydrophobicContact CE1-CG 4.35Å; F309-F320 HydrophobicContact CE2-CB 4.41Å; F309-F320 AromaticContact CE2-CD2 3.63Å; F309-F320 HydrophobicContact CE2-CD2 3.63Å; F309-F320 HydrophobicContact CE2-CE2 4.47Å; F309-F320 HydrophobicContact CE2-CG 4.46Å; F309-F320 HydrophobicContact CG-CB 4.06Å; F309-F320 HydrophobicContact CZ-CB 4.01Å; F309-F320 AromaticContact CZ-CD2 3.58Å; F309-F320 HydrophobicContact CZ-CD2 3.58Å; F309-F320 HydrophobicContact CZ-CG 4.28Å; F309-L323 HydrophobicContact CE1-CD1 4.21Å; F309-L323 HydrophobicContact CZ-CD1 4.23Å
310E94.5Very high95.5Very high63 Ų6356.7 Ų56.729%0.29435%0.35SS..  trans-92.4110.9179.9176.253.4-115.300110.4A307 S312 G313 G314 G315A307-E310 HydrophobicContact CB-CB 4.07Å; E310-S312 VanDerWaalsContact CD-OG 3.26Å; E310-S312 WeakPolarHBondContact CG-OG 3.43Å; E310-S312 PolarHBondContact O-N 3.39Å; E310-S312 PolarHBondContact OE1-N 3.14Å; E310-S312 PolarHBondContact OE1-OG 3.07Å; E310-G313 PolarHBondContact O-N 3.32Å; E310-G313 VanDerWaalsContact O-N 3.1Å; E310-G314 PolarHBondContact O-N 3.23Å; E310-G315 WeakPolarHBondContact O-CA 3.37Å; E310-G315 PolarHBondContact O-N 3.41Å
311P95.8Very high95.6Very high78 Ų7854.9 Ų54.951%0.50634%0.342SS..G310 helixtrans-58.8-32.6-177.3-26.736.3000114.2F309 G313 G314 G315 P317F309-P311 WeakPolarHBondContact O-CD 3.43Å; P311-G313 PolarHBondContact O-N 3.14Å; P311-G314 PolarHBondContact O-N 2.96Å; P311-G315 WeakPolarHBondContact CA-O 3.45Å; P311-P317 HydrophobicContact CG-CG 4.38Å
312S93.5Very high95.7Very high107 Ų10756.7 Ų56.775%0.74835%0.35SS*.G310 helixtrans-64.4-25.5179.358.50000113.4E310E310-S312 VanDerWaalsContact CD-OG 3.26Å; E310-S312 WeakPolarHBondContact CG-OG 3.43Å; E310-S312 PolarHBondContact O-N 3.39Å; E310-S312 PolarHBondContact OE1-N 3.14Å; E310-S312 PolarHBondContact OE1-OG 3.07Å
313G94.5Very high95.9Very high53 Ų5355.1 Ų55.155%0.54635%0.345SS..G310 helixtrans-98.37.8171.700000114.6E310 P311E310-G313 PolarHBondContact O-N 3.32Å; E310-G313 VanDerWaalsContact O-N 3.1Å; P311-G313 PolarHBondContact O-N 3.14Å
314G94.6Very high96.2Very high71 Ų7150.7 Ų50.773%0.73233%0.325SS*.THydrogen-bonded Turntrans87.49.3-177.900000115.2E310 P311E310-G314 PolarHBondContact O-N 3.23Å; P311-G314 PolarHBondContact O-N 2.96Å
315G96.7Very high96.4Very high16 Ų1643.9 Ų43.917%0.16530%0.295CS..  trans-76.5173.717200000113.1A307 F308 E310 P311A307-G315 WeakPolarHBondContact O-CA 3.45Å; A307-G315 PolarHBondContact O-N 3.31Å; F308-G315 WeakPolarHBondContact O-CA 3.46Å; E310-G315 WeakPolarHBondContact O-CA 3.37Å; E310-G315 PolarHBondContact O-N 3.41Å; P311-G315 WeakPolarHBondContact CA-O 3.45Å
316D96.6Very high96.7Very high72 Ų7242 Ų4239%0.38527%0.267SS..  trans-137115.4178.9179.74.7000111.1F308 F309 I318 L319F308-D316 PolarHBondContact O-N 3.2Å; F309-D316 WeakPolarHBondContact CD1-O 3.03Å; D316-I318 PolarHBondContact O-N 3.31Å; D316-I318 VanDerWaalsContact OD1-CB 3.32Å; D316-I318 WeakPolarHBondContact OD1-CB 3.34Å; D316-I318 PolarHBondContact OD1-N 3.07Å; D316-L319 HydrophobicContact CB-CB 4.26Å; D316-L319 VanDerWaalsContact O-CB 3.23Å; D316-L319 WeakPolarHBondContact O-CB 3.35Å; D316-L319 PolarHBondContact O-N 2.97Å; D316-L319 VanDerWaalsContact O-N 3.12Å
317P96.5Very high96.8Very high33 Ų3340 Ų4021%0.21426%0.255CS..Hα-helixtrans-64.4-24.3177.726.7-34.3000113.3P225 F309 P311 L319 F320P225-P317 HydrophobicContact CB-CB 4.3Å; P225-P317 HydrophobicContact CG-CB 3.92Å; F309-P317 WeakPolarHBondContact O-CD 3.49Å; P311-P317 HydrophobicContact CG-CG 4.38Å; P317-L319 VanDerWaalsContact C-N 3.28Å; P317-L319 PolarHBondContact O-N 3.47Å; P317-F320 WeakPolarHBondContact O-CB 3.46Å; P317-F320 PolarHBondContact O-N 3.43Å
318I97.4Very high96.8Very high55 Ų5538.7 Ų38.728%0.28224%0.244SC..Hα-helixtrans-69.2-29.6176.5-60.4169.7000110.6D316 F320 Q321 H322 M381 V384D316-I318 PolarHBondContact O-N 3.31Å; D316-I318 VanDerWaalsContact OD1-CB 3.32Å; D316-I318 WeakPolarHBondContact OD1-CB 3.34Å; D316-I318 PolarHBondContact OD1-N 3.07Å; I318-F320 PolarHBondContact O-N 3.13Å; I318-Q321 WeakPolarHBondContact O-CB 3.44Å; I318-Q321 PolarHBondContact O-N 2.88Å; I318-Q321 VanDerWaalsContact O-N 3.08Å; I318-H322 PolarHBondContact O-CD2 3.48Å; I318-H322 PolarHBondContact O-N 3.31Å; I318-H322 VanDerWaalsContact O-N 3.09Å; I318-M381 HydrophobicContact CG2-CE 3.77Å; I318-V384 HydrophobicContact CD1-CB 4.34Å; I318-V384 HydrophobicContact CG2-CB 4.21Å; I318-V384 HydrophobicContact CG2-CG1 4.39Å; I318-V384 HydrophobicContact CG2-CG2 4.19Å
319L97.5Very high96.8Very high58 Ų5836.5 Ų36.530%0.30424%0.235SC..Hα-helixtrans-57.5-40.1172.7178.362.7000111.4F42 F309 D316 P317 Q321 H322 L323F42-L319 HydrophobicContact CD2-CD1 4.29Å; F42-L319 HydrophobicContact CE2-CD1 4.35Å; F309-L319 HydrophobicContact CD1-CB 4.34Å; F309-L319 HydrophobicContact CE1-CB 4.3Å; F309-L319 HydrophobicContact CE1-CD2 4.23Å; F309-L319 HydrophobicContact CE1-CG 4.14Å; D316-L319 HydrophobicContact CB-CB 4.26Å; D316-L319 VanDerWaalsContact O-CB 3.23Å; D316-L319 WeakPolarHBondContact O-CB 3.35Å; D316-L319 PolarHBondContact O-N 2.97Å; D316-L319 VanDerWaalsContact O-N 3.12Å; P317-L319 VanDerWaalsContact C-N 3.28Å; P317-L319 PolarHBondContact O-N 3.47Å; L319-Q321 VanDerWaalsContact C-N 3.32Å; L319-Q321 PolarHBondContact O-N 2.95Å; L319-H322 WeakPolarHBondContact O-CB 3.23Å; L319-H322 PolarHBondContact O-N 3.38Å; L319-L323 HydrophobicContact CG-CD1 4.26Å; L319-L323 WeakPolarHBondContact O-CG 3.44Å; L319-L323 PolarHBondContact O-N 3.36Å; L319-L323 VanDerWaalsContact O-N 3.1Å
320F98.2Very high96.7Very high1 Ų136.5 Ų36.50%0.00424%0.235CC..Hα-helixtrans-62.2-41.4176.7-175.4-89000111.4T222 L223 Y224 P225 L298 F309 P317 I318 H322 L323 F324T222-F320 VanDerWaalsContact O-CE1 3.24Å; T222-F320 WeakPolarHBondContact O-CE1 3.41Å; L223-F320 HydrophobicContact CB-CE1 4.31Å; L223-F320 HydrophobicContact CB-CZ 3.98Å; L223-F320 WeakPolarHBondContact O-CE1 3.39Å; Y224-F320 AromaticContact CD1-CD1 3.94Å; Y224-F320 HydrophobicContact CD1-CD1 3.94Å; Y224-F320 HydrophobicContact CD1-CE1 4.03Å; P225-F320 VanDerWaalsContact CD-CD1 3.45Å; P225-F320 HydrophobicContact CG-CB 3.65Å; P225-F320 HydrophobicContact CG-CD1 4.35Å; P225-F320 HydrophobicContact CG-CG 3.98Å; L298-F320 HydrophobicContact CB-CE2 4.22Å; L298-F320 HydrophobicContact CD1-CD2 4.49Å; L298-F320 HydrophobicContact CD1-CE2 4.49Å; L298-F320 HydrophobicContact CD2-CE2 3.95Å; L298-F320 HydrophobicContact CD2-CZ 4.2Å; L298-F320 HydrophobicContact CG-CE2 4.47Å; F309-F320 HydrophobicContact CD1-CB 3.62Å; F309-F320 HydrophobicContact CD2-CB 4.44Å; F309-F320 HydrophobicContact CD2-CD2 4.18Å; F309-F320 HydrophobicContact CE1-CB 3.59Å; F309-F320 HydrophobicContact CE1-CD2 4.09Å; F309-F320 HydrophobicContact CE1-CG 4.35Å; F309-F320 HydrophobicContact CE2-CB 4.41Å; F309-F320 AromaticContact CE2-CD2 3.63Å; F309-F320 HydrophobicContact CE2-CD2 3.63Å; F309-F320 HydrophobicContact CE2-CE2 4.47Å; F309-F320 HydrophobicContact CE2-CG 4.46Å; F309-F320 HydrophobicContact CG-CB 4.06Å; F309-F320 HydrophobicContact CZ-CB 4.01Å; F309-F320 AromaticContact CZ-CD2 3.58Å; F309-F320 HydrophobicContact CZ-CD2 3.58Å; F309-F320 HydrophobicContact CZ-CG 4.28Å; P317-F320 WeakPolarHBondContact O-CB 3.46Å; P317-F320 PolarHBondContact O-N 3.43Å; I318-F320 PolarHBondContact O-N 3.13Å; F320-H322 VanDerWaalsContact C-N 3.32Å; F320-H322 PolarHBondContact O-N 3.24Å; F320-L323 PolarHBondContact O-N 3.24Å; F320-F324 HydrophobicContact CD1-CB 4.33Å; F320-F324 HydrophobicContact CE1-CB 3.97Å; F320-F324 HydrophobicContact CE1-CD2 4.31Å; F320-F324 HydrophobicContact CE1-CG 4.37Å; F320-F324 HydrophobicContact CZ-CD2 4.49Å; F320-F324 VanDerWaalsContact O-CB 3.32Å; F320-F324 WeakPolarHBondContact O-CB 3.23Å; F320-F324 PolarHBondContact O-N 3.27Å
321Q97.9Very high96.8Very high39 Ų3933.9 Ų33.918%0.18222%0.223CC..Hα-helixtrans-61.7-40.7177.2-62.6-166.124.200111.9Y224 I318 L319 F324 W325 M381 V384Y224-Q321 HydrophobicContact CD1-CG 4.11Å; Y224-Q321 HydrophobicContact CE1-CG 3.86Å; I318-Q321 WeakPolarHBondContact O-CB 3.44Å; I318-Q321 PolarHBondContact O-N 2.88Å; I318-Q321 VanDerWaalsContact O-N 3.08Å; L319-Q321 VanDerWaalsContact C-N 3.32Å; L319-Q321 PolarHBondContact O-N 2.95Å; Q321-F324 PolarHBondContact O-N 3.17Å; Q321-W325 WeakPolarHBondContact O-CB 3.23Å; Q321-W325 VanDerWaalsContact O-CD1 3.23Å; Q321-W325 PolarHBondContact O-N 3.29Å; Q321-M381 HydrophobicContact CB-CE 3.57Å; Q321-M381 HydrophobicContact CB-CG 4.24Å; Q321-M381 HydrophobicContact CB-SD 3.97Å; Q321-V384 VanDerWaalsContact OE1-CG1 3.3Å
322H98.1Very high96.8Very high50 Ų5031.4 Ų31.423%0.23121%0.206CC..Hα-helixtrans-59-47.9174.3-82.9-63.2000112.3I318 L319 F320 F326 W377 M381 F386I318-H322 PolarHBondContact O-CD2 3.48Å; I318-H322 PolarHBondContact O-N 3.31Å; I318-H322 VanDerWaalsContact O-N 3.09Å; L319-H322 WeakPolarHBondContact O-CB 3.23Å; L319-H322 PolarHBondContact O-N 3.38Å; F320-H322 VanDerWaalsContact C-N 3.32Å; F320-H322 PolarHBondContact O-N 3.24Å; H322-F326 VanDerWaalsContact O-CB 3.28Å; H322-F326 WeakPolarHBondContact O-CB 3.45Å; H322-F326 PolarHBondContact O-N 3.17Å; H322-W377 AromaticContact CE1-NE1 3.99Å; H322-W377 AromaticContact ND1-CD1 3.85Å; H322-W377 AromaticContact ND1-NE1 3.25Å; H322-W377 PolarHBondContact ND1-NE1 3.46Å; H322-M381 HydrophobicContact CB-CE 4.41Å; H322-M381 VanDerWaalsContact CD2-CE 3.48Å; H322-M381 WeakPolarHBondContact CD2-CE 3.44Å; H322-M381 WeakPolarHBondContact NE2-CE 2.96Å; H322-F386 AromaticContact CE1-CE1 4Å; H322-F386 AromaticContact CE1-CZ 3.96Å
323L97.8Very high97Very high5 Ų527.6 Ų27.63%0.02618%0.175CC..Hα-helixtrans-65.3-44.8179.5-65.5169000111.7F42 V290 M297 F309 L319 F320 F327F42-L323 HydrophobicContact CE2-CD2 3.61Å; F42-L323 HydrophobicContact CE2-CG 4.42Å; F42-L323 HydrophobicContact CZ-CD2 4.12Å; V290-L323 HydrophobicContact CG1-CB 4.22Å; V290-L323 HydrophobicContact CG1-CD2 3.74Å; M297-L323 HydrophobicContact CE-CD1 3.32Å; F309-L323 HydrophobicContact CE1-CD1 4.21Å; F309-L323 HydrophobicContact CZ-CD1 4.23Å; L319-L323 HydrophobicContact CG-CD1 4.26Å; L319-L323 WeakPolarHBondContact O-CG 3.44Å; L319-L323 PolarHBondContact O-N 3.36Å; L319-L323 VanDerWaalsContact O-N 3.1Å; F320-L323 PolarHBondContact O-N 3.24Å; L323-F327 PolarHBondContact O-N 2.88Å
324F98.4Very high97.1Very high6 Ų625.1 Ų25.13%0.02615%0.15CC..Hα-helixtrans-62.7-49.2179.6-178.8-91.3000111.3W221 T222 Y224 L291 F320 Q321 F327 G328W221-F324 HydrophobicContact CE3-CE1 4.47Å; W221-F324 AromaticContact CE3-CZ 3.71Å; W221-F324 HydrophobicContact CE3-CZ 3.71Å; W221-F324 HydrophobicContact CH2-CE1 4.2Å; W221-F324 HydrophobicContact CH2-CZ 4.18Å; W221-F324 AromaticContact CZ3-CE1 3.92Å; W221-F324 HydrophobicContact CZ3-CE1 3.92Å; W221-F324 AromaticContact CZ3-CZ 3.45Å; W221-F324 HydrophobicContact CZ3-CZ 3.45Å; W221-F324 VanDerWaalsContact CZ3-CZ 3.45Å; T222-F324 HydrophobicContact CG2-CD1 4.43Å; T222-F324 HydrophobicContact CG2-CE1 3.63Å; T222-F324 HydrophobicContact CG2-CZ 3.85Å; Y224-F324 HydrophobicContact CE1-CD1 4.38Å; L291-F324 HydrophobicContact CD1-CD2 3.77Å; L291-F324 HydrophobicContact CD1-CE2 4.11Å; F320-F324 HydrophobicContact CD1-CB 4.33Å; F320-F324 HydrophobicContact CE1-CB 3.97Å; F320-F324 HydrophobicContact CE1-CD2 4.31Å; F320-F324 HydrophobicContact CE1-CG 4.37Å; F320-F324 HydrophobicContact CZ-CD2 4.49Å; F320-F324 VanDerWaalsContact O-CB 3.32Å; F320-F324 WeakPolarHBondContact O-CB 3.23Å; F320-F324 PolarHBondContact O-N 3.27Å; Q321-F324 PolarHBondContact O-N 3.17Å; F324-F327 CarbonylContact O-C 3.53Å; F324-F327 WeakPolarHBondContact O-CA 3.43Å; F324-F327 WeakPolarHBondContact O-CB 3.49Å; F324-F327 PolarHBondContact O-N 3.27Å; F324-F327 VanDerWaalsContact O-N 3.14Å; F324-G328 PolarHBondContact O-N 3.13Å
325W98.3Very high97.2Very high8 Ų821.8 Ų21.83%0.0312%0.115CC..Hα-helixtrans-78.1-24.7-175.7-70.5126.7000114.2W221 T222 Y224 Q321 F327 G328 H329 W377 H380W221-W325 AromaticContact CH2-CH2 3.82Å; W221-W325 HydrophobicContact CH2-CH2 3.82Å; W221-W325 AromaticContact CH2-CZ3 3.83Å; W221-W325 HydrophobicContact CH2-CZ3 3.83Å; W221-W325 AromaticContact CZ2-CH2 3.94Å; W221-W325 HydrophobicContact CZ2-CH2 3.94Å; W221-W325 HydrophobicContact CZ2-CZ3 4.38Å; T222-W325 HydrophobicContact CG2-CH2 4.07Å; T222-W325 HydrophobicContact CG2-CZ2 4Å; Y224-W325 AromaticContact CZ-NE1 3.84Å; Y224-W325 WeakPolarHBondContact OH-CZ2 3.28Å; Y224-W325 PolarHBondContact OH-NE1 3.11Å; Q321-W325 WeakPolarHBondContact O-CB 3.23Å; Q321-W325 VanDerWaalsContact O-CD1 3.23Å; Q321-W325 PolarHBondContact O-N 3.29Å; W325-F327 PolarHBondContact O-N 3.22Å; W325-G328 PolarHBondContact O-N 3.47Å; W325-H329 PolarHBondContact O-N 3.2Å; W325-H329 VanDerWaalsContact O-N 3.08Å; W325-W377 VanDerWaalsContact C-CB 3.41Å; W325-W377 HydrophobicContact CB-CB 3.96Å; W325-W377 VanDerWaalsContact O-CB 3.25Å; W325-W377 WeakPolarHBondContact O-CB 2.97Å; W325-H380 HydrophobicContact CB-CB 4.25Å; W325-H380 HydrophobicContact CD2-CB 3.36Å; W325-H380 AromaticContact CD2-CD2 3.65Å; W325-H380 AromaticContact CD2-CG 3.52Å; W325-H380 AromaticContact CE2-CG 3.85Å; W325-H380 HydrophobicContact CE3-CB 3.93Å; W325-H380 AromaticContact CE3-CD2 3.36Å; W325-H380 AromaticContact CE3-CG 3.52Å; W325-H380 AromaticContact CE3-ND1 3.95Å; W325-H380 AromaticContact CE3-NE2 3.68Å; W325-H380 HydrophobicContact CG-CB 3.51Å; W325-H380 HydrophobicContact CH2-CB 4.49Å; W325-H380 AromaticContact CH2-ND1 3.97Å; W325-H380 HydrophobicContact CZ2-CB 3.98Å; W325-H380 HydrophobicContact CZ3-CB 4.46Å; W325-H380 AromaticContact CZ3-CD2 3.96Å; W325-H380 AromaticContact CZ3-CE1 3.83Å; W325-H380 AromaticContact CZ3-CG 3.88Å; W325-H380 AromaticContact CZ3-ND1 3.81Å; W325-H380 AromaticContact CZ3-NE2 3.9Å
326F97.9Very high97.1Very high30 Ų3021.2 Ų21.213%0.13211%0.109CC..Hα-helixtrans-55.8-35165.9-176.9-85.1000110.8V290 H322 P330 W377V290-F326 HydrophobicContact CB-CD1 3.85Å; V290-F326 HydrophobicContact CB-CE1 4.41Å; V290-F326 HydrophobicContact CG1-CB 4.26Å; V290-F326 HydrophobicContact CG1-CD1 3.9Å; V290-F326 HydrophobicContact CG1-CG 4.33Å; V290-F326 HydrophobicContact CG2-CD1 3.62Å; V290-F326 HydrophobicContact CG2-CE1 3.69Å; H322-F326 VanDerWaalsContact O-CB 3.28Å; H322-F326 WeakPolarHBondContact O-CB 3.45Å; H322-F326 PolarHBondContact O-N 3.17Å; F326-P330 WeakPolarHBondContact O-CD 3.42Å; F326-P330 WeakPolarHBondContact O-CG 3.34Å; F326-W377 HydrophobicContact CD2-CD2 4.21Å; F326-W377 AromaticContact CD2-CE3 3.71Å; F326-W377 HydrophobicContact CD2-CE3 3.71Å; F326-W377 AromaticContact CD2-CZ3 3.86Å; F326-W377 HydrophobicContact CD2-CZ3 3.86Å; F326-W377 HydrophobicContact CE2-CE3 4.3Å; F326-W377 HydrophobicContact CE2-CZ3 4.1Å
327F97.1Very high97.2Very high2 Ų217.8 Ų17.81%0.0099%0.09CC..Hα-helixtrans-80.8-50.2169.5155.2-98.3000113F164 L288 L291 L323 F324 W325 H329 P330 E331F164-F327 HydrophobicContact CE1-CE1 4.48Å; F164-F327 AromaticContact CE1-CZ 3.78Å; F164-F327 HydrophobicContact CE1-CZ 3.78Å; F164-F327 AromaticContact CZ-CE1 3.94Å; F164-F327 HydrophobicContact CZ-CE1 3.94Å; F164-F327 AromaticContact CZ-CZ 3.69Å; F164-F327 HydrophobicContact CZ-CZ 3.69Å; L288-F327 HydrophobicContact CD2-CD2 3.94Å; L288-F327 HydrophobicContact CD2-CE2 3.43Å; L288-F327 VanDerWaalsContact CD2-CE2 3.43Å; L288-F327 HydrophobicContact CD2-CZ 4.26Å; L288-F327 HydrophobicContact CG-CE2 4.32Å; L291-F327 HydrophobicContact CB-CB 3.78Å; L291-F327 HydrophobicContact CB-CD1 3.86Å; L291-F327 HydrophobicContact CB-CD2 4.09Å; L291-F327 HydrophobicContact CB-CG 3.6Å; L291-F327 HydrophobicContact CD1-CD1 3.91Å; L291-F327 HydrophobicContact CD1-CE1 4.42Å; L291-F327 HydrophobicContact CD1-CG 4.5Å; L291-F327 HydrophobicContact CD2-CD1 3.53Å; L291-F327 HydrophobicContact CD2-CD2 4.25Å; L291-F327 HydrophobicContact CD2-CE1 3.4Å; L291-F327 HydrophobicContact CD2-CE2 4.13Å; L291-F327 HydrophobicContact CD2-CG 3.97Å; L291-F327 HydrophobicContact CD2-CZ 3.71Å; L291-F327 HydrophobicContact CG-CD1 3.93Å; L291-F327 HydrophobicContact CG-CE1 4.3Å; L291-F327 HydrophobicContact CG-CG 4.19Å; L323-F327 PolarHBondContact O-N 2.88Å; F324-F327 CarbonylContact O-C 3.53Å; F324-F327 WeakPolarHBondContact O-CA 3.43Å; F324-F327 WeakPolarHBondContact O-CB 3.49Å; F324-F327 PolarHBondContact O-N 3.27Å; F324-F327 VanDerWaalsContact O-N 3.14Å; W325-F327 PolarHBondContact O-N 3.22Å; F327-H329 VanDerWaalsContact C-N 3.29Å; F327-H329 PolarHBondContact O-N 3.48Å; F327-P330 WeakPolarHBondContact O-CB 3.42Å; F327-P330 VanDerWaalsContact O-CD 3.24Å; F327-P330 WeakPolarHBondContact O-CD 3.37Å; F327-E331 HydrophobicContact CE1-CB 4.26Å; F327-E331 HydrophobicContact CE1-CG 4.41Å; F327-E331 HydrophobicContact CE2-CB 3.86Å; F327-E331 HydrophobicContact CE2-CG 4.06Å; F327-E331 VanDerWaalsContact CE2-OE2 3.24Å; F327-E331 WeakPolarHBondContact CE2-OE2 3.41Å; F327-E331 HydrophobicContact CZ-CB 3.7Å; F327-E331 HydrophobicContact CZ-CG 3.64Å; F327-E331 PolarHBondContact O-N 3.48Å
328G96.3Very high97.2Very high4 Ų416.2 Ų16.24%0.0418%0.08CC..Hα-helixtrans-64.7-30.8-165.200000113.6F324 W325F324-G328 PolarHBondContact O-N 3.13Å; W325-G328 PolarHBondContact O-N 3.47Å
329H96.5Very high97.1Very high14 Ų1413.6 Ų13.67%0.0657%0.067CC..Hα-helixtrans-75.2-48.2174.8-167.780.8000113W325 F327 E331 V332 Y333 V376 H379 H380W325-H329 PolarHBondContact O-N 3.2Å; W325-H329 VanDerWaalsContact O-N 3.08Å; F327-H329 VanDerWaalsContact C-N 3.29Å; F327-H329 PolarHBondContact O-N 3.48Å; H329-E331 PolarHBondContact O-N 2.94Å; H329-V332 WeakPolarHBondContact O-CG2 3.49Å; H329-V332 PolarHBondContact O-N 3.21Å; H329-Y333 AromaticContact CD2-CE2 3.42Å; H329-Y333 VanDerWaalsContact CD2-CE2 3.42Å; H329-Y333 WeakPolarHBondContact CD2-CE2 3.44Å; H329-Y333 AromaticContact NE2-CE2 3.11Å; H329-Y333 WeakPolarHBondContact NE2-CE2 3.07Å; H329-Y333 AromaticContact NE2-CZ 3.39Å; H329-Y333 PolarHBondContact NE2-OH 3.11Å; H329-V376 WeakPolarHBondContact CD2-CG2 3.19Å; H329-V376 WeakPolarHBondContact NE2-CG2 3.49Å; H329-H379 AromaticContact CE1-CE1 3.17Å; H329-H379 PolarHBondContact CE1-CE1 3.39Å; H329-H379 AromaticContact CE1-NE2 3.44Å; H329-H379 PolarHBondContact CE1-NE2 3.4Å; H329-H379 AromaticContact CG-CE1 3.72Å; H329-H379 AromaticContact CG-NE2 3.82Å; H329-H379 AromaticContact ND1-CE1 3.06Å; H329-H379 PolarHBondContact ND1-CE1 3.25Å; H329-H379 AromaticContact ND1-NE2 2.96Å; H329-H379 PolarHBondContact ND1-NE2 3.38Å; H329-H379 AromaticContact NE2-CE1 3.81Å; H329-H380 AromaticContact CG-NE2 3.89Å; H329-H380 AromaticContact ND1-NE2 3.38Å; H329-H380 PolarHBondContact ND1-NE2 3.29Å
330P97.1Very high97.1Very high1 Ų111 Ų111%0.0065%0.053CC..Hα-helixtrans-49.3-38.2166.1-37.441.7000115.3L283 F326 F327 V332 Y333 V334 G373L283-P330 HydrophobicContact CD2-CB 4.14Å; F326-P330 WeakPolarHBondContact O-CD 3.42Å; F326-P330 WeakPolarHBondContact O-CG 3.34Å; F327-P330 WeakPolarHBondContact O-CB 3.42Å; F327-P330 VanDerWaalsContact O-CD 3.24Å; F327-P330 WeakPolarHBondContact O-CD 3.37Å; P330-V332 VanDerWaalsContact C-N 3.31Å; P330-V332 PolarHBondContact O-N 3.49Å; P330-Y333 WeakPolarHBondContact O-CA 3.33Å; P330-Y333 WeakPolarHBondContact O-CB 3.43Å; P330-Y333 PolarHBondContact O-N 3.31Å; P330-V334 PolarHBondContact O-N 3.05Å; P330-G373 WeakPolarHBondContact CD-O 3.43Å; P330-G373 WeakPolarHBondContact CG-O 3.47Å
331E96.7Very high97Very high8 Ų810.9 Ų10.94%0.0375%0.052CC..Hα-helixtrans-59.1-39-178.1-173.861.1-163.400112.5I163 F327 H329 Y333 V334 L335I163-E331 HydrophobicContact CG2-CG 4.12Å; F327-E331 HydrophobicContact CE1-CB 4.26Å; F327-E331 HydrophobicContact CE1-CG 4.41Å; F327-E331 HydrophobicContact CE2-CB 3.86Å; F327-E331 HydrophobicContact CE2-CG 4.06Å; F327-E331 VanDerWaalsContact CE2-OE2 3.24Å; F327-E331 WeakPolarHBondContact CE2-OE2 3.41Å; F327-E331 HydrophobicContact CZ-CB 3.7Å; F327-E331 HydrophobicContact CZ-CG 3.64Å; F327-E331 PolarHBondContact O-N 3.48Å; H329-E331 PolarHBondContact O-N 2.94Å; E331-Y333 PolarHBondContact O-N 3.07Å; E331-V334 WeakPolarHBondContact O-CB 3.34Å; E331-V334 PolarHBondContact O-N 3.24Å; E331-V334 VanDerWaalsContact O-N 3.11Å; E331-L335 WeakPolarHBondContact O-CG 3.32Å; E331-L335 PolarHBondContact O-N 2.99Å
332V95.6Very high96.9Very high27 Ų279 Ų916%0.1644%0.044CC..Hα-helixtrans-65.6-26.5176.7-60.80000112.6H329 P330 I336 F467 L471H329-V332 WeakPolarHBondContact O-CG2 3.49Å; H329-V332 PolarHBondContact O-N 3.21Å; P330-V332 VanDerWaalsContact C-N 3.31Å; P330-V332 PolarHBondContact O-N 3.49Å; V332-I336 WeakPolarHBondContact O-CG2 3.17Å; V332-I336 PolarHBondContact O-N 3.28Å; V332-F467 HydrophobicContact CG1-CE2 3.71Å; V332-L471 HydrophobicContact CB-CD2 4.37Å; V332-L471 HydrophobicContact CG1-CD1 4.47Å; V332-L471 HydrophobicContact CG1-CD2 4.36Å
333Y96.4Very high96.8Very high26 Ų266.7 Ų6.710%0.1023%0.033CC..Hα-helixtrans-75.6-37.2171.9-64.3-60.2000112.5H329 P330 E331 L335 I336 L337 M369 G373 M401H329-Y333 AromaticContact CD2-CE2 3.42Å; H329-Y333 VanDerWaalsContact CD2-CE2 3.42Å; H329-Y333 WeakPolarHBondContact CD2-CE2 3.44Å; H329-Y333 AromaticContact NE2-CE2 3.11Å; H329-Y333 WeakPolarHBondContact NE2-CE2 3.07Å; H329-Y333 AromaticContact NE2-CZ 3.39Å; H329-Y333 PolarHBondContact NE2-OH 3.11Å; P330-Y333 WeakPolarHBondContact O-CA 3.33Å; P330-Y333 WeakPolarHBondContact O-CB 3.43Å; P330-Y333 PolarHBondContact O-N 3.31Å; E331-Y333 PolarHBondContact O-N 3.07Å; Y333-L335 PolarHBondContact O-N 3.33Å; Y333-I336 HydrophobicContact CD1-CG2 4.34Å; Y333-I336 PolarHBondContact O-N 3.29Å; Y333-I336 VanDerWaalsContact O-N 3.16Å; Y333-L337 WeakPolarHBondContact O-CB 3.28Å; Y333-L337 VanDerWaalsContact O-CG 3.23Å; Y333-L337 WeakPolarHBondContact O-CG 3.32Å; Y333-L337 PolarHBondContact O-N 3.3Å; Y333-M369 HydrophobicContact CD1-CB 4.42Å; Y333-G373 VanDerWaalsContact CE2-CA 3.49Å; Y333-M401 HydrophobicContact CD1-CE 4.49Å; Y333-M401 HydrophobicContact CE1-CE 3.52Å; Y333-M401 HydrophobicContact CE2-CE 3.96Å; Y333-M401 WeakPolarHBondContact OH-CE 3.44Å; Y333-M401 WeakPolarHBondContact OH-CG 3.38Å
334V97.1Very high96.7Very high2 Ų26.4 Ų6.41%0.0123%0.031CC..Hα-helixtrans-54.7-42.6172.3170.40000110.1M168 T280 L283 L284 P330 E331 I336 P338M168-V334 HydrophobicContact CE-CG1 3.85Å; M168-V334 HydrophobicContact SD-CG1 3.58Å; M168-V334 VanDerWaalsContact SD-CG1 3.58Å; T280-V334 HydrophobicContact CG2-CB 4.13Å; T280-V334 HydrophobicContact CG2-CG1 3.58Å; T280-V334 HydrophobicContact CG2-CG2 4.4Å; L283-V334 HydrophobicContact CB-CG2 3.79Å; L283-V334 HydrophobicContact CD1-CG2 4.33Å; L284-V334 HydrophobicContact CD1-CG1 4Å; L284-V334 HydrophobicContact CD2-CB 4.41Å; L284-V334 HydrophobicContact CD2-CG1 3.7Å; L284-V334 HydrophobicContact CD2-CG2 3.92Å; L284-V334 HydrophobicContact CG-CG1 3.87Å; L284-V334 HydrophobicContact CG-CG2 3.85Å; P330-V334 PolarHBondContact O-N 3.05Å; E331-V334 WeakPolarHBondContact O-CB 3.34Å; E331-V334 PolarHBondContact O-N 3.24Å; E331-V334 VanDerWaalsContact O-N 3.11Å; V334-I336 PolarHBondContact O-N 2.94Å; V334-P338 WeakPolarHBondContact O-CD 3.28Å
335L96.2Very high96.5Very high1 Ų17.5 Ų7.51%0.0054%0.037CC..Hα-helixtrans-74.7-17.9-178.7-62.2-178.8000114.7I163 L167 M168 L171 E331 Y333 L471 S475I163-L335 HydrophobicContact CG2-CD1 4.31Å; L167-L335 HydrophobicContact CB-CD1 4.45Å; L167-L335 HydrophobicContact CB-CD2 3.87Å; L167-L335 HydrophobicContact CD1-CD1 4.18Å; M168-L335 HydrophobicContact CB-CD2 3.9Å; M168-L335 HydrophobicContact SD-CD2 4.27Å; L171-L335 WeakPolarHBondContact CD1-O 3.43Å; E331-L335 WeakPolarHBondContact O-CG 3.32Å; E331-L335 PolarHBondContact O-N 2.99Å; Y333-L335 PolarHBondContact O-N 3.33Å; L335-L471 HydrophobicContact CB-CD2 3.94Å; L335-L471 HydrophobicContact CD1-CD1 4.01Å; L335-L471 HydrophobicContact CD1-CD2 3.73Å; L335-S475 WeakPolarHBondContact O-CB 3.24Å; L335-S475 PolarHBondContact O-OG 2.99Å
336I96.4Very high96.3Very high4 Ų47.1 Ų7.12%0.0214%0.035CC..Hα-helixtrans-110.6-28.5-176.7-162.165.3000113.7V332 Y333 V334 G339 F340 F434 F438V332-I336 WeakPolarHBondContact O-CG2 3.17Å; V332-I336 PolarHBondContact O-N 3.28Å; Y333-I336 HydrophobicContact CD1-CG2 4.34Å; Y333-I336 PolarHBondContact O-N 3.29Å; Y333-I336 VanDerWaalsContact O-N 3.16Å; V334-I336 PolarHBondContact O-N 2.94Å; I336-G339 CarbonylContact O-C 3.46Å; I336-G339 VanDerWaalsContact O-CA 3.32Å; I336-G339 WeakPolarHBondContact O-CA 3.32Å; I336-G339 PolarHBondContact O-N 3.07Å; I336-F340 HydrophobicContact CD1-CD1 4.42Å; I336-F340 HydrophobicContact CD1-CE1 4.1Å; I336-F340 HydrophobicContact CG1-CD1 3.82Å; I336-F340 HydrophobicContact CG1-CE1 3.42Å; I336-F340 VanDerWaalsContact CG1-CE1 3.42Å; I336-F340 HydrophobicContact CG1-CE2 4.15Å; I336-F340 HydrophobicContact CG1-CG 4.4Å; I336-F340 HydrophobicContact CG1-CZ 3.62Å; I336-F340 HydrophobicContact CG2-CD2 4.39Å; I336-F340 HydrophobicContact CG2-CE2 3.96Å; I336-F340 HydrophobicContact CG2-CZ 4.16Å; I336-F340 PolarHBondContact O-N 3.46Å; I336-F434 HydrophobicContact CD1-CE2 4.18Å; I336-F434 HydrophobicContact CD1-CZ 4.46Å; I336-F438 HydrophobicContact CD1-CD2 4.29Å; I336-F438 HydrophobicContact CD1-CE2 3.83Å; I336-F438 HydrophobicContact CG1-CE2 3.79Å; I336-F438 HydrophobicContact CG1-CZ 4.1Å
337L97.2Very high96.1Very high0 Ų05.7 Ų5.70%03%0.029CC..Hα-helixtrans-58-44.6-177.8-78.4172.6000113.3A276 F279 T280 L283 Y333 G339 F340 G341 M366 M369 V370A276-L337 VanDerWaalsContact CB-O 3.29Å; A276-L337 WeakPolarHBondContact CB-O 3.44Å; F279-L337 HydrophobicContact CB-CD1 4.12Å; T280-L337 WeakPolarHBondContact OG1-CB 3.42Å; L283-L337 HydrophobicContact CD1-CD1 3.73Å; Y333-L337 WeakPolarHBondContact O-CB 3.28Å; Y333-L337 VanDerWaalsContact O-CG 3.23Å; Y333-L337 WeakPolarHBondContact O-CG 3.32Å; Y333-L337 PolarHBondContact O-N 3.3Å; L337-G339 VanDerWaalsContact C-N 3.27Å; L337-G339 PolarHBondContact O-N 3.44Å; L337-F340 HydrophobicContact CD2-CD2 4.24Å; L337-F340 WeakPolarHBondContact O-CB 3.48Å; L337-F340 PolarHBondContact O-N 3.49Å; L337-G341 PolarHBondContact O-N 3.35Å; L337-M366 HydrophobicContact CD2-CB 4Å; L337-M366 HydrophobicContact CD2-CG 3.76Å; L337-M366 HydrophobicContact CD2-SD 4.28Å; L337-M369 HydrophobicContact CD2-SD 4.01Å; L337-V370 HydrophobicContact CD1-CG2 4.48Å
338P97.3Very high95.9Very high0 Ų07.3 Ų7.30%04%0.037CC..Hα-helixtrans-58.6-41172.3-24.535.7000112Y277 T280 V334 F340 G341 M342 M482Y277-P338 HydrophobicContact CD1-CG 4.44Å; Y277-P338 HydrophobicContact CE1-CB 3.95Å; Y277-P338 HydrophobicContact CE1-CG 4.09Å; T280-P338 HydrophobicContact CG2-CG 4.23Å; T280-P338 WeakPolarHBondContact OG1-CD 3.4Å; V334-P338 WeakPolarHBondContact O-CD 3.28Å; P338-F340 VanDerWaalsContact C-N 3.35Å; P338-F340 PolarHBondContact O-N 3.01Å; P338-G341 PolarHBondContact O-N 2.96Å; P338-M342 PolarHBondContact O-N 3.43Å; P338-M342 VanDerWaalsContact O-N 3.1Å; P338-M482 HydrophobicContact CB-CE 4.2Å; P338-M482 VanDerWaalsContact O-CE 3.25Å; P338-M482 WeakPolarHBondContact O-CE 3.38Å
339G95.9Very high95.6Very high0 Ų09 Ų90%05%0.048CC..Hα-helixtrans-58-45.9174.400000112.2I336 L337 G341 M342 V343 S478I336-G339 CarbonylContact O-C 3.46Å; I336-G339 VanDerWaalsContact O-CA 3.32Å; I336-G339 WeakPolarHBondContact O-CA 3.32Å; I336-G339 PolarHBondContact O-N 3.07Å; L337-G339 VanDerWaalsContact C-N 3.27Å; L337-G339 PolarHBondContact O-N 3.44Å; G339-G341 PolarHBondContact O-N 3.11Å; G339-M342 PolarHBondContact O-N 2.94Å; G339-V343 WeakPolarHBondContact O-CG2 3.49Å; G339-V343 PolarHBondContact O-N 3.4Å; G339-S478 WeakPolarHBondContact CA-OG 3.39Å
340F97Very high95.3Very high2 Ų210.3 Ų10.31%0.0096%0.055CC..Hα-helixtrans-63.9-38.3175.5-72.7-9.8000114I336 L337 P338 M342 S344 M369 K408 W412 F434 F438I336-F340 HydrophobicContact CD1-CD1 4.42Å; I336-F340 HydrophobicContact CD1-CE1 4.1Å; I336-F340 HydrophobicContact CG1-CD1 3.82Å; I336-F340 HydrophobicContact CG1-CE1 3.42Å; I336-F340 VanDerWaalsContact CG1-CE1 3.42Å; I336-F340 HydrophobicContact CG1-CE2 4.15Å; I336-F340 HydrophobicContact CG1-CG 4.4Å; I336-F340 HydrophobicContact CG1-CZ 3.62Å; I336-F340 HydrophobicContact CG2-CD2 4.39Å; I336-F340 HydrophobicContact CG2-CE2 3.96Å; I336-F340 HydrophobicContact CG2-CZ 4.16Å; I336-F340 PolarHBondContact O-N 3.46Å; L337-F340 HydrophobicContact CD2-CD2 4.24Å; L337-F340 WeakPolarHBondContact O-CB 3.48Å; L337-F340 PolarHBondContact O-N 3.49Å; P338-F340 VanDerWaalsContact C-N 3.35Å; P338-F340 PolarHBondContact O-N 3.01Å; F340-M342 VanDerWaalsContact C-N 3.26Å; F340-M342 PolarHBondContact O-N 3.38Å; F340-S344 WeakPolarHBondContact O-CB 3.38Å; F340-S344 PolarHBondContact O-N 3Å; F340-S344 VanDerWaalsContact O-N 3.09Å; F340-S344 PolarHBondContact O-OG 2.93Å; F340-M369 HydrophobicContact CD2-CE 4.37Å; F340-M369 HydrophobicContact CD2-SD 4.1Å; F340-M369 HydrophobicContact CE2-CE 3.67Å; F340-M369 HydrophobicContact CE2-SD 3.74Å; F340-K408 VanDerWaalsContact CB-CE 3.43Å; F340-K408 HydrophobicContact CD2-CD 3.92Å; F340-K408 HydrophobicContact CE2-CD 4.25Å; F340-K408 HydrophobicContact CG-CD 4.46Å; F340-W412 HydrophobicContact CB-CH2 4.37Å; F340-W412 HydrophobicContact CB-CZ2 4.11Å; F340-W412 AromaticContact CD1-CH2 3.39Å; F340-W412 HydrophobicContact CD1-CH2 3.39Å; F340-W412 AromaticContact CD1-CZ2 3.99Å; F340-W412 HydrophobicContact CD1-CZ2 3.99Å; F340-W412 HydrophobicContact CD1-CZ3 4.42Å; F340-W412 AromaticContact CE1-CH2 3.69Å; F340-W412 HydrophobicContact CE1-CH2 3.69Å; F340-W412 HydrophobicContact CE1-CZ3 4.41Å; F340-W412 AromaticContact CG-CH2 3.94Å; F340-W412 HydrophobicContact CG-CH2 3.94Å; F340-W412 HydrophobicContact CG-CZ2 4.17Å; F340-W412 HydrophobicContact CZ-CH2 4.49Å; F340-F434 AromaticContact CD1-CZ 3.96Å; F340-F434 HydrophobicContact CD1-CZ 3.96Å; F340-F434 AromaticContact CE1-CZ 3.88Å; F340-F434 HydrophobicContact CE1-CZ 3.88Å; F340-F438 HydrophobicContact CE1-CD1 4.31Å; F340-F438 AromaticContact CE1-CE1 3.76Å; F340-F438 HydrophobicContact CE1-CE1 3.76Å; F340-F438 HydrophobicContact CE1-CE2 4.23Å; F340-F438 AromaticContact CE1-CZ 3.73Å; F340-F438 HydrophobicContact CE1-CZ 3.73Å; F340-F438 HydrophobicContact CZ-CD1 4.47Å; F340-F438 AromaticContact CZ-CE1 3.51Å; F340-F438 HydrophobicContact CZ-CE1 3.51Å; F340-F438 HydrophobicContact CZ-CE2 4.23Å; F340-F438 AromaticContact CZ-CZ 3.38Å; F340-F438 HydrophobicContact CZ-CZ 3.38Å
341G96.6Very high94.8Very high0 Ų010.6 Ų10.60%06%0.057CC..Hα-helixtrans-58.5-43173.900000111L337 P338 G339 S344 H345L337-G341 PolarHBondContact O-N 3.35Å; P338-G341 PolarHBondContact O-N 2.96Å; G339-G341 PolarHBondContact O-N 3.11Å; G341-S344 PolarHBondContact O-N 2.92Å; G341-H345 PolarHBondContact O-N 3.34Å
342M95.2Very high94.3Very high0 Ų016.4 Ų16.40%09%0.089CC..Hα-helixtrans-77.8-41.7-177.1167.2-100.1-52.300112.7M273 P338 G339 F340 S344 H345 I346 S478 M481 M482 W486M273-M342 HydrophobicContact CE-CB 4.22Å; M273-M342 WeakPolarHBondContact SD-CA 3.13Å; M273-M342 HydrophobicContact SD-CB 3.59Å; M273-M342 VanDerWaalsContact SD-CB 3.59Å; M273-M342 PolarHBondContact SD-N 3.22Å; P338-M342 PolarHBondContact O-N 3.43Å; P338-M342 VanDerWaalsContact O-N 3.1Å; G339-M342 PolarHBondContact O-N 2.94Å; F340-M342 VanDerWaalsContact C-N 3.26Å; F340-M342 PolarHBondContact O-N 3.38Å; M342-S344 PolarHBondContact O-N 2.73Å; M342-H345 CarbonylContact O-C 3.59Å; M342-H345 WeakPolarHBondContact O-CA 3.26Å; M342-H345 WeakPolarHBondContact O-CB 3.28Å; M342-H345 PolarHBondContact O-N 2.91Å; M342-I346 HydrophobicContact CG-CD1 3.82Å; M342-I346 HydrophobicContact CG-CG1 4.18Å; M342-I346 WeakPolarHBondContact O-CG1 3.44Å; M342-I346 PolarHBondContact O-N 3.2Å; M342-I346 HydrophobicContact SD-CD1 3.43Å; M342-I346 WeakPolarHBondContact SD-CD1 3.48Å; M342-I346 HydrophobicContact SD-CG1 4.34Å; M342-S478 VanDerWaalsContact CE-C 3.4Å; M342-S478 WeakPolarHBondContact CE-O 3.49Å; M342-M481 HydrophobicContact CE-CB 4.12Å; M342-M481 HydrophobicContact SD-CB 3.66Å; M342-M482 HydrophobicContact CB-CE 3.49Å; M342-M482 VanDerWaalsContact CB-CE 3.49Å; M342-M482 HydrophobicContact CB-CG 4.27Å; M342-M482 HydrophobicContact CE-CB 3.64Å; M342-M482 HydrophobicContact CE-CE 3.86Å; M342-M482 HydrophobicContact CE-CG 3.49Å; M342-M482 VanDerWaalsContact CE-CG 3.49Å; M342-M482 HydrophobicContact CE-SD 3.8Å; M342-M482 HydrophobicContact CG-CE 4.14Å; M342-M482 HydrophobicContact CG-CG 3.84Å; M342-M482 HydrophobicContact SD-CB 4.32Å; M342-M482 HydrophobicContact SD-CG 4.19Å; M342-W486 HydrophobicContact CB-CH2 4.05Å; M342-W486 HydrophobicContact CB-CZ3 4.25Å; M342-W486 HydrophobicContact CG-CH2 3.73Å; M342-W486 HydrophobicContact CG-CZ3 3.74Å
343V95.9Very high93.8Very high0 Ų021 Ų210%011%0.107CC..Hα-helixtrans-56.1-41.4171.7171.80000110.2G339 H345 I346 C347 W412 L431 F434 M481G339-V343 WeakPolarHBondContact O-CG2 3.49Å; G339-V343 PolarHBondContact O-N 3.4Å; V343-H345 PolarHBondContact O-N 3.38Å; V343-I346 PolarHBondContact O-N 3.15Å; V343-C347 WeakPolarHBondContact O-CB 3.35Å; V343-C347 PolarHBondContact O-N 3.44Å; V343-C347 PolarHBondContact O-SG 2.89Å; V343-W412 HydrophobicContact CB-CZ2 4.22Å; V343-W412 HydrophobicContact CG1-CD2 3.56Å; V343-W412 HydrophobicContact CG1-CE3 3.92Å; V343-W412 HydrophobicContact CG1-CG 3.91Å; V343-W412 HydrophobicContact CG1-CH2 4.41Å; V343-W412 HydrophobicContact CG1-CZ2 4.04Å; V343-W412 HydrophobicContact CG1-CZ3 4.35Å; V343-L431 HydrophobicContact CB-CD2 4.49Å; V343-L431 HydrophobicContact CG1-CD2 3.94Å; V343-L431 HydrophobicContact CG2-CD2 4.38Å; V343-F434 HydrophobicContact CB-CE1 4.42Å; V343-F434 HydrophobicContact CG1-CD1 4.36Å; V343-F434 HydrophobicContact CG1-CE1 4.2Å; V343-F434 HydrophobicContact CG2-CD1 3.97Å; V343-F434 HydrophobicContact CG2-CE1 3.78Å; V343-F434 HydrophobicContact CG2-CZ 4.15Å; V343-M481 HydrophobicContact CG2-CE 3.58Å; V343-M481 HydrophobicContact CG2-SD 4.46Å
344S96.2Very high93.2Very high0 Ų028 Ų280%015%0.145CC..Hα-helixtrans-62.9-41.6175.3-51.10000112.3F340 G341 M342 M348 W412F340-S344 WeakPolarHBondContact O-CB 3.38Å; F340-S344 PolarHBondContact O-N 3Å; F340-S344 VanDerWaalsContact O-N 3.09Å; F340-S344 PolarHBondContact O-OG 2.93Å; G341-S344 PolarHBondContact O-N 2.92Å; M342-S344 PolarHBondContact O-N 2.73Å; S344-M348 WeakPolarHBondContact O-CB 3.11Å; S344-M348 PolarHBondContact O-N 2.94Å; S344-M348 VanDerWaalsContact O-N 3.09Å; S344-W412 PolarHBondContact OG-NE1 3.08Å
345H94.5Very high92.8Very high29 Ų2931.5 Ų31.513%0.13417%0.17CC..Hα-helixtrans-64.4-47.9176.9-177.6-75.8000112F183 M273 G341 M342 V343 M348 S349F183-H345 AromaticContact CE1-CD2 3.93Å; F183-H345 AromaticContact CE1-NE2 3.73Å; M273-H345 HydrophobicContact CG-CB 4.4Å; G341-H345 PolarHBondContact O-N 3.34Å; M342-H345 CarbonylContact O-C 3.59Å; M342-H345 WeakPolarHBondContact O-CA 3.26Å; M342-H345 WeakPolarHBondContact O-CB 3.28Å; M342-H345 PolarHBondContact O-N 2.91Å; V343-H345 PolarHBondContact O-N 3.38Å; H345-M348 PolarHBondContact O-N 2.73Å; H345-S349 PolarHBondContact O-N 3.03Å; H345-S349 PolarHBondContact O-OG 2.84Å
346I93.8Very high92.6Very high0 Ų031.7 Ų31.70%017%0.171CC..Hα-helixtrans-65.1-46.7-179.2-63.2177.6000110.6M342 V343 M348 S349 L350 M427 L431 M481 W485M342-I346 HydrophobicContact CG-CD1 3.82Å; M342-I346 HydrophobicContact CG-CG1 4.18Å; M342-I346 WeakPolarHBondContact O-CG1 3.44Å; M342-I346 PolarHBondContact O-N 3.2Å; M342-I346 HydrophobicContact SD-CD1 3.43Å; M342-I346 WeakPolarHBondContact SD-CD1 3.48Å; M342-I346 HydrophobicContact SD-CG1 4.34Å; V343-I346 PolarHBondContact O-N 3.15Å; I346-M348 VanDerWaalsContact C-N 3.28Å; I346-M348 PolarHBondContact O-N 3.46Å; I346-S349 PolarHBondContact O-N 3.25Å; I346-L350 HydrophobicContact CG2-CD1 3.92Å; I346-L350 HydrophobicContact CG2-CG 4.18Å; I346-L350 WeakPolarHBondContact O-CB 3.2Å; I346-L350 WeakPolarHBondContact O-CG 3.48Å; I346-L350 PolarHBondContact O-N 3.44Å; I346-M427 HydrophobicContact CD1-CE 3.83Å; I346-M427 HydrophobicContact CD1-SD 4.31Å; I346-L431 HydrophobicContact CB-CD2 4.47Å; I346-L431 HydrophobicContact CG2-CD1 3.81Å; I346-L431 HydrophobicContact CG2-CD2 4.29Å; I346-L431 HydrophobicContact CG2-CG 4.43Å; I346-M481 HydrophobicContact CD1-CB 4.24Å; I346-W485 HydrophobicContact CB-CE3 4.48Å; I346-W485 HydrophobicContact CD1-CB 3.92Å; I346-W485 HydrophobicContact CD1-CD2 4.04Å; I346-W485 HydrophobicContact CD1-CE3 4.22Å; I346-W485 HydrophobicContact CD1-CG 3.91Å; I346-W485 HydrophobicContact CG1-CB 4.44Å; I346-W485 HydrophobicContact CG1-CD2 3.73Å; I346-W485 HydrophobicContact CG1-CE3 4.07Å; I346-W485 HydrophobicContact CG1-CG 3.89Å; I346-W485 HydrophobicContact CG2-CD2 4.24Å; I346-W485 HydrophobicContact CG2-CE3 3.73Å; I346-W485 HydrophobicContact CG2-CH2 4.11Å; I346-W485 HydrophobicContact CG2-CZ3 3.67Å
347C93.9Very high92.4Very high0 Ų036 Ų360%019%0.19CC..Hα-helixtrans-59-41.1177-70.50000111.7V343 S351 M415 L416V343-C347 WeakPolarHBondContact O-CB 3.35Å; V343-C347 PolarHBondContact O-N 3.44Å; V343-C347 PolarHBondContact O-SG 2.89Å; C347-S351 VanDerWaalsContact O-CB 3.25Å; C347-S351 WeakPolarHBondContact O-CB 3.25Å; C347-S351 PolarHBondContact O-N 3.39Å; C347-S351 PolarHBondContact O-OG 3.49Å; C347-M415 HydrophobicContact CB-CB 4.12Å; C347-M415 HydrophobicContact CB-CE 3.63Å; C347-M415 HydrophobicContact CB-SD 4.26Å; C347-L416 HydrophobicContact CB-CD2 4.35Å
348M92.2Very high92.2Very high36 Ų3637.7 Ų37.718%0.17721%0.208CC..Hα-helixtrans-61.8-48.8175-179.8-16778.500111.4S344 H345 I346 S351 N352 K353 M415S344-M348 WeakPolarHBondContact O-CB 3.11Å; S344-M348 PolarHBondContact O-N 2.94Å; S344-M348 VanDerWaalsContact O-N 3.09Å; H345-M348 PolarHBondContact O-N 2.73Å; I346-M348 VanDerWaalsContact C-N 3.28Å; I346-M348 PolarHBondContact O-N 3.46Å; M348-S351 WeakPolarHBondContact CA-OG 3.35Å; M348-S351 WeakPolarHBondContact O-CA 3.25Å; M348-S351 PolarHBondContact O-N 3.1Å; M348-S351 VanDerWaalsContact O-N 3.07Å; M348-S351 PolarHBondContact O-OG 2.95Å; M348-N352 PolarHBondContact O-N 3.39Å; M348-K353 VanDerWaalsContact CG-O 3.31Å; M348-K353 WeakPolarHBondContact CG-O 3.23Å; M348-K353 PolarHBondContact O-N 3.33Å; M348-M415 HydrophobicContact CB-SD 4.19Å
349S90.3Very high92.1Very high40 Ų4039.2 Ų39.228%0.2821%0.214SC..Hα-helixtrans-61.5-46.8178.7-63.90000112.5H345 I346 S351 N352H345-S349 PolarHBondContact O-N 3.03Å; H345-S349 PolarHBondContact O-OG 2.84Å; I346-S349 PolarHBondContact O-N 3.25Å; S349-S351 PolarHBondContact O-N 2.92Å; S349-N352 PolarHBondContact O-N 3.47Å; S349-N352 VanDerWaalsContact O-N 3.11Å
350L89.9Confident92.1Very high40 Ų4046.5 Ų46.521%0.20924%0.242CC..Hα-helixtrans-62.6-25.7175.4-70178.7000112.2I346 N352 L416 V428 L431 W485I346-L350 HydrophobicContact CG2-CD1 3.92Å; I346-L350 HydrophobicContact CG2-CG 4.18Å; I346-L350 WeakPolarHBondContact O-CB 3.2Å; I346-L350 WeakPolarHBondContact O-CG 3.48Å; I346-L350 PolarHBondContact O-N 3.44Å; L350-N352 VanDerWaalsContact C-N 3.3Å; L350-L416 HydrophobicContact CD1-CD2 4.37Å; L350-V428 HydrophobicContact CD1-CG2 4.32Å; L350-L431 HydrophobicContact CD1-CD1 3.51Å; L350-W485 HydrophobicContact CD2-CH2 4.14Å; L350-W485 HydrophobicContact CD2-CZ3 4.08Å; L350-W485 HydrophobicContact CG-CH2 4.26Å; L350-W485 HydrophobicContact CG-CZ3 4.29Å
351S87.6Confident92.1Very high8 Ų847.9 Ų47.96%0.05626%0.257CS..THydrogen-bonded Turntrans-81.3-5.6178.175.50000115.6C347 M348 S349 K353 M415 C419C347-S351 VanDerWaalsContact O-CB 3.25Å; C347-S351 WeakPolarHBondContact O-CB 3.25Å; C347-S351 PolarHBondContact O-N 3.39Å; C347-S351 PolarHBondContact O-OG 3.49Å; M348-S351 WeakPolarHBondContact CA-OG 3.35Å; M348-S351 WeakPolarHBondContact O-CA 3.25Å; M348-S351 PolarHBondContact O-N 3.1Å; M348-S351 VanDerWaalsContact O-N 3.07Å; M348-S351 PolarHBondContact O-OG 2.95Å; S349-S351 PolarHBondContact O-N 2.92Å; S351-K353 PolarHBondContact O-N 3.5Å; S351-K353 WeakPolarHBondContact OG-CG 3.38Å; S351-M415 WeakPolarHBondContact CB-O 3.31Å; S351-C419 WeakPolarHBondContact CA-SG 3.47Å; S351-C419 WeakPolarHBondContact CB-SG 3.38Å; S351-C419 PolarHBondContact O-SG 3.43Å
352N85Confident92.1Very high129 Ų12947.9 Ų47.969%0.6926%0.257SS*.THydrogen-bonded Turntrans50.138.8-173-60.9-45.6000112.4M348 S349 L350M348-N352 PolarHBondContact O-N 3.39Å; S349-N352 PolarHBondContact O-N 3.47Å; S349-N352 VanDerWaalsContact O-N 3.11Å; L350-N352 VanDerWaalsContact C-N 3.3Å
353K84.9Confident92.3Very high125 Ų12548.5 Ų48.554%0.54326%0.26SS..  trans-110.3145.5175.9-63.2-61.2-175.2-179.40110M348 S351 S355M348-K353 VanDerWaalsContact CG-O 3.31Å; M348-K353 WeakPolarHBondContact CG-O 3.23Å; M348-K353 PolarHBondContact O-N 3.33Å; S351-K353 PolarHBondContact O-N 3.5Å; S351-K353 WeakPolarHBondContact OG-CG 3.38Å; K353-S355 PolarHBondContact O-N 3.04Å
354D84.7Confident92.4Very high171 Ų17152.4 Ų52.491%0.91429%0.287SS*.SBendtrans-72.9-16.4178.9-60.1-35.9000113.5
355S88Confident92.5Very high76 Ų7652.5 Ų52.553%0.53129%0.288SS..SBendtrans-144.3151.2179.865.90000111.8K353K353-S355 PolarHBondContact O-N 3.04Å
356S91.5Very high92.6Very high5 Ų551.1 Ų51.14%0.03528%0.281CS..  trans-65.9137.7173.8-51.80000110.4G358 Y359S356-G358 PolarHBondContact O-N 2.97Å; S356-Y359 WeakPolarHBondContact O-CB 3.49Å; S356-Y359 PolarHBondContact O-N 3.45Å; S356-Y359 VanDerWaalsContact O-N 3.13Å
357F92.7Very high92.8Very high94 Ų9452.7 Ų52.741%0.41229%0.294SS..THydrogen-bonded Turntrans-56.4133.4171.5176.3-100.3000110.3Y359 Y414 M415F357-Y359 VanDerWaalsContact C-N 3.28Å; F357-Y359 PolarHBondContact O-N 3.31Å; F357-Y414 HydrophobicContact CB-CD1 3.78Å; F357-Y414 HydrophobicContact CB-CE1 4.28Å; F357-Y414 AromaticContact CD1-CD1 3.72Å; F357-Y414 HydrophobicContact CD1-CD1 3.72Å; F357-Y414 HydrophobicContact CD1-CE1 4.44Å; F357-Y414 HydrophobicContact CD1-CG 4.1Å; F357-Y414 AromaticContact CD2-CD1 3.35Å; F357-Y414 HydrophobicContact CD2-CD1 3.35Å; F357-Y414 AromaticContact CD2-CE1 3.24Å; F357-Y414 HydrophobicContact CD2-CE1 3.24Å; F357-Y414 HydrophobicContact CD2-CG 4.3Å; F357-Y414 HydrophobicContact CE1-CD1 4.09Å; F357-Y414 HydrophobicContact CE1-CG 4.16Å; F357-Y414 AromaticContact CE2-CD1 3.76Å; F357-Y414 HydrophobicContact CE2-CD1 3.76Å; F357-Y414 AromaticContact CE2-CE1 3.54Å; F357-Y414 HydrophobicContact CE2-CE1 3.54Å; F357-Y414 HydrophobicContact CE2-CG 4.36Å; F357-Y414 AromaticContact CE2-CZ 3.97Å; F357-Y414 AromaticContact CG-CD1 3.31Å; F357-Y414 HydrophobicContact CG-CD1 3.31Å; F357-Y414 AromaticContact CG-CE1 3.74Å; F357-Y414 HydrophobicContact CG-CE1 3.74Å; F357-Y414 HydrophobicContact CG-CG 4.15Å; F357-Y414 HydrophobicContact CZ-CD1 4.1Å; F357-Y414 HydrophobicContact CZ-CE1 4.26Å; F357-Y414 HydrophobicContact CZ-CG 4.28Å; F357-M415 HydrophobicContact CB-CG 3.64Å; F357-M415 HydrophobicContact CB-SD 4.3Å; F357-M415 PolarHBondContact N-SD 3.35Å; F357-M415 VanDerWaalsContact N-SD 3.41Å
358G92.9Very high93Very high36 Ų3654.4 Ų54.437%0.37131%0.306SS..THydrogen-bonded Turntrans62.432.9-178.800000113.5S356 Y360 G361 L362S356-G358 PolarHBondContact O-N 2.97Å; G358-Y360 VanDerWaalsContact C-N 3.32Å; G358-Y360 PolarHBondContact O-N 2.99Å; G358-Y360 VanDerWaalsContact O-N 3.14Å; G358-G361 CarbonylContact O-C 3.52Å; G358-G361 VanDerWaalsContact O-CA 3.26Å; G358-G361 WeakPolarHBondContact O-CA 3.44Å; G358-G361 PolarHBondContact O-N 3.04Å; G358-L362 PolarHBondContact O-N 3.11Å
359Y95.3Very high93.3Very high32 Ų3252.7 Ų52.713%0.12530%0.298CS..Hα-helixtrans-41.2-51.7-177177-99.1000114.5F268 C270 M272 W275 S356 F357 G361 L362 I363F268-Y359 VanDerWaalsContact C-OH 3.3Å; F268-Y359 WeakPolarHBondContact O-CE1 3.35Å; F268-Y359 PolarHBondContact O-OH 3.01Å; C270-Y359 PolarHBondContact O-OH 3.13Å; M272-Y359 HydrophobicContact CG-CD2 4.19Å; M272-Y359 HydrophobicContact CG-CE2 4.21Å; M272-Y359 HydrophobicContact SD-CD2 3.52Å; M272-Y359 VanDerWaalsContact SD-CD2 3.52Å; M272-Y359 HydrophobicContact SD-CE2 3.54Å; M272-Y359 VanDerWaalsContact SD-CE2 3.54Å; M272-Y359 HydrophobicContact SD-CG 4.49Å; W275-Y359 PolarHBondContact NE1-OH 3.45Å; W275-Y359 VanDerWaalsContact NE1-OH 3.09Å; S356-Y359 WeakPolarHBondContact O-CB 3.49Å; S356-Y359 PolarHBondContact O-N 3.45Å; S356-Y359 VanDerWaalsContact O-N 3.13Å; F357-Y359 VanDerWaalsContact C-N 3.28Å; F357-Y359 PolarHBondContact O-N 3.31Å; Y359-G361 PolarHBondContact O-N 3.47Å; Y359-L362 PolarHBondContact O-N 3.45Å; Y359-I363 HydrophobicContact CD1-CD1 3.94Å; Y359-I363 HydrophobicContact CE1-CD1 3.37Å; Y359-I363 HydrophobicContact CE2-CD1 4.13Å; Y359-I363 VanDerWaalsContact CZ-CD1 3.49Å; Y359-I363 WeakPolarHBondContact O-CG1 3.32Å; Y359-I363 PolarHBondContact O-N 3Å; Y359-I363 VanDerWaalsContact O-N 3.07Å
360Y96.3Very high93.6Very high153 Ų15351.4 Ų51.460%0.629%0.288SS*.Hα-helixtrans-64.2-40176-64.3-70.4000112.8F268 G358 L362 I363 C364F268-Y360 HydrophobicContact CB-CE1 4.42Å; F268-Y360 HydrophobicContact CD1-CE1 4.12Å; F268-Y360 HydrophobicContact CG-CE1 4.43Å; G358-Y360 VanDerWaalsContact C-N 3.32Å; G358-Y360 PolarHBondContact O-N 2.99Å; G358-Y360 VanDerWaalsContact O-N 3.14Å; Y360-L362 VanDerWaalsContact C-N 3.32Å; Y360-L362 PolarHBondContact O-N 3.49Å; Y360-I363 PolarHBondContact O-N 2.96Å; Y360-C364 WeakPolarHBondContact O-CB 3.46Å; Y360-C364 PolarHBondContact O-N 3.43Å; Y360-C364 PolarHBondContact O-SG 2.81Å
361G96.7Very high93.9Very high31 Ų3153.7 Ų53.732%0.3231%0.306SS..Hα-helixtrans-60.9-38.917400000112.6G358 Y359 C364 A365G358-G361 CarbonylContact O-C 3.52Å; G358-G361 VanDerWaalsContact O-CA 3.26Å; G358-G361 WeakPolarHBondContact O-CA 3.44Å; G358-G361 PolarHBondContact O-N 3.04Å; Y359-G361 PolarHBondContact O-N 3.47Å; G361-C364 PolarHBondContact O-N 3.41Å; G361-A365 VanDerWaalsContact O-CB 3.28Å; G361-A365 WeakPolarHBondContact O-CB 3.21Å; G361-A365 PolarHBondContact O-N 3.22Å
362L97.6Very high94.3Very high0 Ų054.5 Ų54.50%031%0.31CS..Hα-helixtrans-67.9-37.7175.8-66.2175.4000112.5M272 G358 Y359 Y360 M366 K408M272-L362 HydrophobicContact CE-CB 3.4Å; M272-L362 VanDerWaalsContact CE-CB 3.4Å; M272-L362 HydrophobicContact CE-CD1 4.23Å; M272-L362 HydrophobicContact CE-CG 4.45Å; M272-L362 HydrophobicContact SD-CB 4.19Å; M272-L362 HydrophobicContact SD-CD1 4.5Å; G358-L362 PolarHBondContact O-N 3.11Å; Y359-L362 PolarHBondContact O-N 3.45Å; Y360-L362 VanDerWaalsContact C-N 3.32Å; Y360-L362 PolarHBondContact O-N 3.49Å; L362-M366 WeakPolarHBondContact O-CG 3.38Å; L362-M366 PolarHBondContact O-N 2.82Å; L362-M366 VanDerWaalsContact O-N 3.16Å; L362-K408 HydrophobicContact CD2-CB 4.1Å; L362-K408 HydrophobicContact CD2-CG 3.75Å
363I98Very high94.7Very high13 Ų1348.3 Ų48.37%0.06728%0.277CS..Hα-helixtrans-65.7-50173.6-67.5169.4000110M272 W275 F279 Y359 Y360 A365 M366 A367M272-I363 HydrophobicContact CE-CG1 4.3Å; M272-I363 HydrophobicContact SD-CG1 4.09Å; W275-I363 HydrophobicContact CD2-CD1 4.06Å; W275-I363 HydrophobicContact CD2-CG1 4.17Å; W275-I363 HydrophobicContact CD2-CG2 4.16Å; W275-I363 HydrophobicContact CE3-CG2 4.06Å; W275-I363 HydrophobicContact CG-CD1 4.12Å; W275-I363 HydrophobicContact CG-CG1 3.97Å; W275-I363 HydrophobicContact CZ2-CD1 4.17Å; W275-I363 HydrophobicContact CZ3-CG2 4.35Å; F279-I363 HydrophobicContact CE2-CG2 4.22Å; F279-I363 HydrophobicContact CZ-CG2 4.26Å; Y359-I363 HydrophobicContact CD1-CD1 3.94Å; Y359-I363 HydrophobicContact CE1-CD1 3.37Å; Y359-I363 HydrophobicContact CE2-CD1 4.13Å; Y359-I363 VanDerWaalsContact CZ-CD1 3.49Å; Y359-I363 WeakPolarHBondContact O-CG1 3.32Å; Y359-I363 PolarHBondContact O-N 3Å; Y359-I363 VanDerWaalsContact O-N 3.07Å; Y360-I363 PolarHBondContact O-N 2.96Å; I363-A365 VanDerWaalsContact C-N 3.26Å; I363-A365 PolarHBondContact O-N 3.23Å; I363-M366 PolarHBondContact O-N 2.72Å; I363-M366 VanDerWaalsContact O-N 3.13Å; I363-A367 PolarHBondContact O-N 3.44Å
364C98Very high95.1Very high83 Ų8343.1 Ų43.156%0.56126%0.256SS*.Hα-helixtrans-59.7-37.6177.7-69.40000111.8Y360 G361 A367 S368Y360-C364 WeakPolarHBondContact O-CB 3.46Å; Y360-C364 PolarHBondContact O-N 3.43Å; Y360-C364 PolarHBondContact O-SG 2.81Å; G361-C364 PolarHBondContact O-N 3.41Å; C364-A367 PolarHBondContact O-N 3.44Å; C364-S368 WeakPolarHBondContact O-CB 3.44Å; C364-S368 PolarHBondContact O-N 3.01Å; C364-S368 PolarHBondContact O-OG 3.38Å
365A98.2Very high95.6Very high2 Ų237.9 Ų37.92%0.01723%0.23CC..Hα-helixtrans-60.9-47.1174.100000111.5G361 I363 S368 M369 P404 I407 K408G361-A365 VanDerWaalsContact O-CB 3.28Å; G361-A365 WeakPolarHBondContact O-CB 3.21Å; G361-A365 PolarHBondContact O-N 3.22Å; I363-A365 VanDerWaalsContact C-N 3.26Å; I363-A365 PolarHBondContact O-N 3.23Å; A365-S368 PolarHBondContact O-N 3.06Å; A365-S368 PolarHBondContact O-OG 3.27Å; A365-M369 WeakPolarHBondContact O-CG 3.29Å; A365-M369 PolarHBondContact O-N 3.37Å; A365-P404 HydrophobicContact CB-CB 3.92Å; A365-I407 HydrophobicContact CB-CG2 4.39Å; A365-K408 HydrophobicContact CB-CD 4.14Å; A365-K408 HydrophobicContact CB-CG 3.9Å
366M98Very high96Very high0 Ų034.2 Ų34.20%021%0.205CC..Hα-helixtrans-65.9-40.8176.6-66.1-176.1-56.600112.3M272 W275 A276 F279 L337 L362 I363 S368 M369 V370M272-M366 HydrophobicContact CE-CE 3.36Å; M272-M366 HydrophobicContact CE-SD 4.3Å; W275-M366 HydrophobicContact CB-CE 3.58Å; A276-M366 HydrophobicContact CB-SD 4.1Å; F279-M366 HydrophobicContact CD2-CB 3.48Å; F279-M366 VanDerWaalsContact CD2-CB 3.48Å; F279-M366 HydrophobicContact CD2-CE 4.12Å; F279-M366 HydrophobicContact CE2-CB 3.77Å; F279-M366 HydrophobicContact CE2-CE 4.15Å; F279-M366 HydrophobicContact CG-CB 4.32Å; L337-M366 HydrophobicContact CD2-CB 4Å; L337-M366 HydrophobicContact CD2-CG 3.76Å; L337-M366 HydrophobicContact CD2-SD 4.28Å; L362-M366 WeakPolarHBondContact O-CG 3.38Å; L362-M366 PolarHBondContact O-N 2.82Å; L362-M366 VanDerWaalsContact O-N 3.16Å; I363-M366 PolarHBondContact O-N 2.72Å; I363-M366 VanDerWaalsContact O-N 3.13Å; M366-S368 VanDerWaalsContact C-N 3.32Å; M366-S368 PolarHBondContact O-N 2.88Å; M366-M369 WeakPolarHBondContact O-CB 3.44Å; M366-M369 PolarHBondContact O-N 2.91Å; M366-V370 WeakPolarHBondContact O-CG2 3.48Å; M366-V370 PolarHBondContact O-N 3.37Å
367A97.9Very high96.3Very high32 Ų3236.6 Ų36.626%0.26421%0.213SC..Hα-helixtrans-59.4-43.5174.300000111.6F279 I363 C364 M369 V370 C371F279-A367 HydrophobicContact CE1-CB 3.82Å; F279-A367 HydrophobicContact CE2-CB 4.45Å; F279-A367 HydrophobicContact CZ-CB 3.68Å; I363-A367 PolarHBondContact O-N 3.44Å; C364-A367 PolarHBondContact O-N 3.44Å; A367-M369 VanDerWaalsContact C-N 3.34Å; A367-M369 PolarHBondContact O-N 3.02Å; A367-V370 WeakPolarHBondContact O-CB 3.36Å; A367-V370 PolarHBondContact O-N 2.89Å; A367-V370 VanDerWaalsContact O-N 3.16Å; A367-C371 PolarHBondContact O-N 3.1Å; A367-C371 VanDerWaalsContact O-N 3.08Å; A367-C371 PolarHBondContact O-SG 3.3Å
368S97.6Very high96.6Very high37 Ų3732.1 Ų32.126%0.25919%0.194SC..Hα-helixtrans-65.9-34.7176.971.60000112.6C364 A365 M366 V370 C371 L372 P404C364-S368 WeakPolarHBondContact O-CB 3.44Å; C364-S368 PolarHBondContact O-N 3.01Å; C364-S368 PolarHBondContact O-OG 3.38Å; A365-S368 PolarHBondContact O-N 3.06Å; A365-S368 PolarHBondContact O-OG 3.27Å; M366-S368 VanDerWaalsContact C-N 3.32Å; M366-S368 PolarHBondContact O-N 2.88Å; S368-V370 VanDerWaalsContact C-N 3.3Å; S368-V370 PolarHBondContact O-N 3.38Å; S368-C371 PolarHBondContact O-N 3.48Å; S368-L372 VanDerWaalsContact O-CB 3.25Å; S368-L372 WeakPolarHBondContact O-CB 3.39Å; S368-L372 WeakPolarHBondContact O-CG 3.37Å; S368-L372 PolarHBondContact O-N 3.04Å; S368-P404 WeakPolarHBondContact OG-CB 3.24Å
369M97.8Very high96.8Very high0 Ų031.4 Ų31.40%018%0.181CC..Hα-helixtrans-63.1-37.3172.4-71171.2175.900111.5Y333 L337 F340 A365 M366 A367 G373 M401 P404 T405 K408Y333-M369 HydrophobicContact CD1-CB 4.42Å; L337-M369 HydrophobicContact CD2-SD 4.01Å; F340-M369 HydrophobicContact CD2-CE 4.37Å; F340-M369 HydrophobicContact CD2-SD 4.1Å; F340-M369 HydrophobicContact CE2-CE 3.67Å; F340-M369 HydrophobicContact CE2-SD 3.74Å; A365-M369 WeakPolarHBondContact O-CG 3.29Å; A365-M369 PolarHBondContact O-N 3.37Å; M366-M369 WeakPolarHBondContact O-CB 3.44Å; M366-M369 PolarHBondContact O-N 2.91Å; A367-M369 VanDerWaalsContact C-N 3.34Å; A367-M369 PolarHBondContact O-N 3.02Å; M369-G373 WeakPolarHBondContact O-CA 3.28Å; M369-G373 PolarHBondContact O-N 2.96Å; M369-M401 HydrophobicContact CB-CE 4.1Å; M369-M401 HydrophobicContact CG-CE 3.83Å; M369-P404 HydrophobicContact CE-CB 4.05Å; M369-P404 HydrophobicContact CE-CG 4.34Å; M369-P404 HydrophobicContact CG-CB 4.17Å; M369-P404 HydrophobicContact CG-CG 4.11Å; M369-T405 WeakPolarHBondContact CE-OG1 3.34Å; M369-K408 HydrophobicContact CE-CD 3.86Å; M369-K408 HydrophobicContact SD-CD 4.4Å
370V97.3Very high96.9Very high13 Ų1332.1 Ų32.18%0.07919%0.185CC..Hα-helixtrans-63.1-50.2174175.50000111.2F279 V282 L283 L337 M366 A367 S368 S374F279-V370 HydrophobicContact CB-CG2 3.56Å; F279-V370 HydrophobicContact CD1-CG2 3.74Å; F279-V370 HydrophobicContact CG-CG2 3.9Å; V282-V370 HydrophobicContact CG1-CG1 4.23Å; L283-V370 HydrophobicContact CD1-CG2 4Å; L283-V370 HydrophobicContact CD2-CB 4.27Å; L283-V370 HydrophobicContact CD2-CG1 3.83Å; L283-V370 HydrophobicContact CD2-CG2 4.43Å; L283-V370 HydrophobicContact CG-CB 4.29Å; L283-V370 HydrophobicContact CG-CG1 3.97Å; L283-V370 HydrophobicContact CG-CG2 3.92Å; L337-V370 HydrophobicContact CD1-CG2 4.48Å; M366-V370 WeakPolarHBondContact O-CG2 3.48Å; M366-V370 PolarHBondContact O-N 3.37Å; A367-V370 WeakPolarHBondContact O-CB 3.36Å; A367-V370 PolarHBondContact O-N 2.89Å; A367-V370 VanDerWaalsContact O-N 3.16Å; S368-V370 VanDerWaalsContact C-N 3.3Å; S368-V370 PolarHBondContact O-N 3.38Å; V370-S374 PolarHBondContact O-N 3.34Å; V370-S374 PolarHBondContact O-OG 2.97Å
371C96Very high96.9Very high87 Ų8724.8 Ų24.859%0.58816%0.156SC*.Hα-helixtrans-65.2-53.7-178.1-650000112A367 S368 S374A367-C371 PolarHBondContact O-N 3.1Å; A367-C371 VanDerWaalsContact O-N 3.08Å; A367-C371 PolarHBondContact O-SG 3.3Å; S368-C371 PolarHBondContact O-N 3.48Å; C371-S374 PolarHBondContact O-N 3.01Å
372L95.2Very high97Very high25 Ų2524.2 Ų24.213%0.13115%0.145CC..Hα-helixtrans-66.7-40.3-177.9-68.8171.7000111.6S368 S374 V375 V376 I397 M400 M401S368-L372 VanDerWaalsContact O-CB 3.25Å; S368-L372 WeakPolarHBondContact O-CB 3.39Å; S368-L372 WeakPolarHBondContact O-CG 3.37Å; S368-L372 PolarHBondContact O-N 3.04Å; L372-S374 PolarHBondContact O-N 3.07Å; L372-S374 VanDerWaalsContact O-N 3.09Å; L372-V375 VanDerWaalsContact O-CG2 3.24Å; L372-V375 WeakPolarHBondContact O-CG2 3.24Å; L372-V375 PolarHBondContact O-N 3.47Å; L372-V376 WeakPolarHBondContact O-CG1 3.24Å; L372-V376 WeakPolarHBondContact O-CG2 3.12Å; L372-V376 PolarHBondContact O-N 3.3Å; L372-I397 HydrophobicContact CD2-CG2 3.83Å; L372-M400 HydrophobicContact CD1-CG 4.35Å; L372-M400 HydrophobicContact CD2-SD 4.26Å; L372-M401 HydrophobicContact CB-CE 4.32Å; L372-M401 HydrophobicContact CB-SD 3.16Å; L372-M401 WeakPolarHBondContact CB-SD 3.23Å; L372-M401 HydrophobicContact CD1-SD 3.73Å; L372-M401 HydrophobicContact CG-SD 4.07Å
373G93.8Very high96.8Very high0 Ų029.2 Ų29.20%017%0.169CC..Hα-helixtrans-59.1-25177.600000113.6P330 Y333 M369 V375P330-G373 WeakPolarHBondContact CD-O 3.43Å; P330-G373 WeakPolarHBondContact CG-O 3.47Å; Y333-G373 VanDerWaalsContact CE2-CA 3.49Å; M369-G373 WeakPolarHBondContact O-CA 3.28Å; M369-G373 PolarHBondContact O-N 2.96Å; G373-V375 VanDerWaalsContact C-N 3.34Å
374S93.1Very high96.7Very high16 Ų1630.3 Ų30.311%0.11218%0.177CC..THydrogen-bonded Turntrans-83.1-4.2176.7-51.90000114L286 V370 C371 L372 W377L286-S374 VanDerWaalsContact CD2-OG 3.28Å; L286-S374 WeakPolarHBondContact CD2-OG 3.04Å; V370-S374 PolarHBondContact O-N 3.34Å; V370-S374 PolarHBondContact O-OG 2.97Å; C371-S374 PolarHBondContact O-N 3.01Å; L372-S374 PolarHBondContact O-N 3.07Å; L372-S374 VanDerWaalsContact O-N 3.09Å; S374-W377 VanDerWaalsContact O-CZ3 3.3Å; S374-W377 WeakPolarHBondContact O-CZ3 3.44Å
375V95.8Very high96.5Very high60 Ų6029.6 Ų29.636%0.36418%0.183SC..SBendtrans-129.312.6-173.6-61.70000115L372 G373 I397L372-V375 VanDerWaalsContact O-CG2 3.24Å; L372-V375 WeakPolarHBondContact O-CG2 3.24Å; L372-V375 PolarHBondContact O-N 3.47Å; G373-V375 VanDerWaalsContact C-N 3.34Å; V375-I397 HydrophobicContact CG2-CG2 4.11Å
376V97.5Very high96.2Very high0 Ų032 Ų320%019%0.193CC..  trans-1172.2-174.6-670000114.5H329 L372 G378 H379 I397H329-V376 WeakPolarHBondContact CD2-CG2 3.19Å; H329-V376 WeakPolarHBondContact NE2-CG2 3.49Å; L372-V376 WeakPolarHBondContact O-CG1 3.24Å; L372-V376 WeakPolarHBondContact O-CG2 3.12Å; L372-V376 PolarHBondContact O-N 3.3Å; V376-G378 PolarHBondContact O-N 3.47Å; V376-H379 PolarHBondContact O-CE1 3.45Å; V376-H379 VanDerWaalsContact O-CE1 3.25Å; V376-H379 PolarHBondContact O-N 2.64Å; V376-H379 PolarHBondContact O-ND1 3.29Å; V376-I397 HydrophobicContact CG1-CB 4.05Å; V376-I397 HydrophobicContact CG1-CG2 3.42Å; V376-I397 VanDerWaalsContact CG1-CG2 3.42Å
377W97.4Very high96Very high55 Ų5536.2 Ų36.221%0.20822%0.216CC..G310 helixtrans-53.6-26.9-171.168.984.7000115H322 W325 F326 S374 H379 H380 F394H322-W377 AromaticContact CE1-NE1 3.99Å; H322-W377 AromaticContact ND1-CD1 3.85Å; H322-W377 AromaticContact ND1-NE1 3.25Å; H322-W377 PolarHBondContact ND1-NE1 3.46Å; W325-W377 VanDerWaalsContact C-CB 3.41Å; W325-W377 HydrophobicContact CB-CB 3.96Å; W325-W377 VanDerWaalsContact O-CB 3.25Å; W325-W377 WeakPolarHBondContact O-CB 2.97Å; F326-W377 HydrophobicContact CD2-CD2 4.21Å; F326-W377 AromaticContact CD2-CE3 3.71Å; F326-W377 HydrophobicContact CD2-CE3 3.71Å; F326-W377 AromaticContact CD2-CZ3 3.86Å; F326-W377 HydrophobicContact CD2-CZ3 3.86Å; F326-W377 HydrophobicContact CE2-CE3 4.3Å; F326-W377 HydrophobicContact CE2-CZ3 4.1Å; S374-W377 VanDerWaalsContact O-CZ3 3.3Å; S374-W377 WeakPolarHBondContact O-CZ3 3.44Å; W377-H379 PolarHBondContact O-N 3.3Å; W377-H380 PolarHBondContact O-N 3.12Å; W377-H380 VanDerWaalsContact O-N 3.16Å; W377-F394 HydrophobicContact CD2-CE1 4.4Å; W377-F394 HydrophobicContact CZ2-CE1 4.45Å; W377-F394 HydrophobicContact CZ2-CZ 4.05Å
378G97.4Very high95.8Very high0 Ų039.7 Ų39.70%024%0.239CC..G310 helixtrans-61.3-22-177.400000114.7V376 H380 M381 F386V376-G378 PolarHBondContact O-N 3.47Å; G378-H380 PolarHBondContact O-N 3.29Å; G378-H380 VanDerWaalsContact O-N 3.17Å; G378-M381 WeakPolarHBondContact O-CA 3.38Å; G378-M381 WeakPolarHBondContact O-CB 2.92Å; G378-M381 PolarHBondContact O-N 2.86Å; G378-F386 WeakPolarHBondContact O-CE2 3.17Å
379H97.5Very high95.8Very high21 Ų2144 Ų4410%0.09726%0.258CS..G310 helixtrans-63.2-22.3175.661.6-119000113.5H329 V376 W377 M381 F382 T398H329-H379 AromaticContact CE1-CE1 3.17Å; H329-H379 PolarHBondContact CE1-CE1 3.39Å; H329-H379 AromaticContact CE1-NE2 3.44Å; H329-H379 PolarHBondContact CE1-NE2 3.4Å; H329-H379 AromaticContact CG-CE1 3.72Å; H329-H379 AromaticContact CG-NE2 3.82Å; H329-H379 AromaticContact ND1-CE1 3.06Å; H329-H379 PolarHBondContact ND1-CE1 3.25Å; H329-H379 AromaticContact ND1-NE2 2.96Å; H329-H379 PolarHBondContact ND1-NE2 3.38Å; H329-H379 AromaticContact NE2-CE1 3.81Å; V376-H379 PolarHBondContact O-CE1 3.45Å; V376-H379 VanDerWaalsContact O-CE1 3.25Å; V376-H379 PolarHBondContact O-N 2.64Å; V376-H379 PolarHBondContact O-ND1 3.29Å; W377-H379 PolarHBondContact O-N 3.3Å; H379-M381 PolarHBondContact O-N 3.48Å; H379-F382 HydrophobicContact CB-CD2 4.23Å; H379-F382 HydrophobicContact CB-CE1 4.4Å; H379-F382 HydrophobicContact CB-CE2 3.5Å; H379-F382 HydrophobicContact CB-CZ 3.61Å; H379-F382 WeakPolarHBondContact O-CD2 3.3Å; H379-T398 HydrophobicContact CB-CG2 4.34Å; H379-T398 WeakPolarHBondContact ND1-CG2 3.11Å; H379-T398 PolarHBondContact ND1-OG1 3.39Å
380H97.7Very high95.7Very high46 Ų4645.9 Ų45.921%0.21327%0.269CS..G310 helixtrans-77.70.1174.8-65.1-69.2000113.3W325 H329 W377 G378 H458W325-H380 HydrophobicContact CB-CB 4.25Å; W325-H380 HydrophobicContact CD2-CB 3.36Å; W325-H380 AromaticContact CD2-CD2 3.65Å; W325-H380 AromaticContact CD2-CG 3.52Å; W325-H380 AromaticContact CE2-CG 3.85Å; W325-H380 HydrophobicContact CE3-CB 3.93Å; W325-H380 AromaticContact CE3-CD2 3.36Å; W325-H380 AromaticContact CE3-CG 3.52Å; W325-H380 AromaticContact CE3-ND1 3.95Å; W325-H380 AromaticContact CE3-NE2 3.68Å; W325-H380 HydrophobicContact CG-CB 3.51Å; W325-H380 HydrophobicContact CH2-CB 4.49Å; W325-H380 AromaticContact CH2-ND1 3.97Å; W325-H380 HydrophobicContact CZ2-CB 3.98Å; W325-H380 HydrophobicContact CZ3-CB 4.46Å; W325-H380 AromaticContact CZ3-CD2 3.96Å; W325-H380 AromaticContact CZ3-CE1 3.83Å; W325-H380 AromaticContact CZ3-CG 3.88Å; W325-H380 AromaticContact CZ3-ND1 3.81Å; W325-H380 AromaticContact CZ3-NE2 3.9Å; H329-H380 AromaticContact CG-NE2 3.89Å; H329-H380 AromaticContact ND1-NE2 3.38Å; H329-H380 PolarHBondContact ND1-NE2 3.29Å; W377-H380 PolarHBondContact O-N 3.12Å; W377-H380 VanDerWaalsContact O-N 3.16Å; G378-H380 PolarHBondContact O-N 3.29Å; G378-H380 VanDerWaalsContact O-N 3.17Å; H380-H458 PolarHBondContact O-CE1 2.71Å
381M97.3Very high95.6Very high0 Ų045.6 Ų45.60%027%0.269CS..G310 helixtrans-129.118-170.5-58.7175.560.100111.4I318 Q321 H322 G378 H379 M383 V384 F386I318-M381 HydrophobicContact CG2-CE 3.77Å; Q321-M381 HydrophobicContact CB-CE 3.57Å; Q321-M381 HydrophobicContact CB-CG 4.24Å; Q321-M381 HydrophobicContact CB-SD 3.97Å; H322-M381 HydrophobicContact CB-CE 4.41Å; H322-M381 VanDerWaalsContact CD2-CE 3.48Å; H322-M381 WeakPolarHBondContact CD2-CE 3.44Å; H322-M381 WeakPolarHBondContact NE2-CE 2.96Å; G378-M381 WeakPolarHBondContact O-CA 3.38Å; G378-M381 WeakPolarHBondContact O-CB 2.92Å; G378-M381 PolarHBondContact O-N 2.86Å; H379-M381 PolarHBondContact O-N 3.48Å; M381-M383 PolarHBondContact O-N 2.9Å; M381-V384 HydrophobicContact CB-CG1 3.86Å; M381-V384 HydrophobicContact CB-CG2 4.16Å; M381-V384 HydrophobicContact CE-CG1 4.19Å; M381-V384 HydrophobicContact CE-CG2 4.3Å; M381-V384 WeakPolarHBondContact O-CG1 3.35Å; M381-V384 WeakPolarHBondContact O-CG2 3.39Å; M381-V384 PolarHBondContact O-N 2.98Å; M381-F386 HydrophobicContact CB-CE2 4.08Å; M381-F386 HydrophobicContact CB-CZ 3.93Å; M381-F386 HydrophobicContact CE-CZ 4.47Å
382F97Very high95.6Very high18 Ų1845.5 Ų45.58%0.07927%0.266CS..G310 helixtrans-58.2-26.7-175.9-73.8-43.1000113.7H379 F386 F394 S395 D454H379-F382 HydrophobicContact CB-CD2 4.23Å; H379-F382 HydrophobicContact CB-CE1 4.4Å; H379-F382 HydrophobicContact CB-CE2 3.5Å; H379-F382 HydrophobicContact CB-CZ 3.61Å; H379-F382 WeakPolarHBondContact O-CD2 3.3Å; F382-F386 HydrophobicContact CD1-CD2 4.34Å; F382-F394 HydrophobicContact CE1-CB 3.91Å; F382-F394 HydrophobicContact CZ-CB 4.31Å; F382-S395 WeakPolarHBondContact CZ-OG 3.43Å; F382-D454 HydrophobicContact CD2-CB 3.66Å; F382-D454 WeakPolarHBondContact CD2-OD2 3.43Å; F382-D454 HydrophobicContact CE2-CB 4.33Å
383M95.2Very high95.7Very high105 Ų10549.1 Ų49.152%0.51728%0.281SS..G310 helixtrans-86.14.1177.6-64.6-59.2-73.700115.2M381 G385 M455 H458M381-M383 PolarHBondContact O-N 2.9Å; M383-G385 PolarHBondContact O-N 3.37Å; M383-M455 HydrophobicContact SD-CB 4.29Å; M383-M455 HydrophobicContact SD-CG 4.09Å; M383-H458 HydrophobicContact CG-CB 3.5Å; M383-H458 VanDerWaalsContact CG-CB 3.5Å; M383-H458 WeakPolarHBondContact CG-CD2 3.4Å; M383-H458 HydrophobicContact SD-CB 4.5Å
384V94.9Very high95.9Very high37 Ų3749.8 Ų49.822%0.22428%0.284CS..G310 helixtrans-79.7-3.9176.5-51.40000113.6I318 Q321 M381 F386I318-V384 HydrophobicContact CD1-CB 4.34Å; I318-V384 HydrophobicContact CG2-CB 4.21Å; I318-V384 HydrophobicContact CG2-CG1 4.39Å; I318-V384 HydrophobicContact CG2-CG2 4.19Å; Q321-V384 VanDerWaalsContact OE1-CG1 3.3Å; M381-V384 HydrophobicContact CB-CG1 3.86Å; M381-V384 HydrophobicContact CB-CG2 4.16Å; M381-V384 HydrophobicContact CE-CG1 4.19Å; M381-V384 HydrophobicContact CE-CG2 4.3Å; M381-V384 WeakPolarHBondContact O-CG1 3.35Å; M381-V384 WeakPolarHBondContact O-CG2 3.39Å; M381-V384 PolarHBondContact O-N 2.98Å; V384-F386 HydrophobicContact CG2-CD1 3.86Å; V384-F386 HydrophobicContact CG2-CE1 3.68Å; V384-F386 HydrophobicContact CG2-CG 4.38Å; V384-F386 HydrophobicContact CG2-CZ 4.08Å
385G93.2Very high96.1Very high68 Ų6849.4 Ų49.470%0.70128%0.281SS*.THydrogen-bonded Turntrans89.641.3-179.800000114.1M383M383-G385 PolarHBondContact O-N 3.37Å
386F92Very high96.1Very high51 Ų5149.5 Ų49.522%0.22428%0.284CS..  trans-58.4146.9170.1-72.5-29.6000112H322 G378 M381 F382 V384 T390 F394H322-F386 AromaticContact CE1-CE1 4Å; H322-F386 AromaticContact CE1-CZ 3.96Å; G378-F386 WeakPolarHBondContact O-CE2 3.17Å; M381-F386 HydrophobicContact CB-CE2 4.08Å; M381-F386 HydrophobicContact CB-CZ 3.93Å; M381-F386 HydrophobicContact CE-CZ 4.47Å; F382-F386 HydrophobicContact CD1-CD2 4.34Å; V384-F386 HydrophobicContact CG2-CD1 3.86Å; V384-F386 HydrophobicContact CG2-CE1 3.68Å; V384-F386 HydrophobicContact CG2-CG 4.38Å; V384-F386 HydrophobicContact CG2-CZ 4.08Å; F386-T390 HydrophobicContact CB-CG2 4.19Å; F386-T390 HydrophobicContact CD1-CG2 3.94Å; F386-T390 HydrophobicContact CD2-CG2 4.07Å; F386-T390 HydrophobicContact CE1-CG2 4.33Å; F386-T390 HydrophobicContact CE2-CG2 4.43Å; F386-T390 HydrophobicContact CG-CG2 3.82Å; F386-F394 HydrophobicContact CE2-CD2 4.06Å; F386-F394 HydrophobicContact CE2-CE2 4.33Å; F386-F394 HydrophobicContact CZ-CE2 4.41Å
387D95.2Very high96.1Very high89 Ų8951.1 Ų51.148%0.47629%0.293SS..  trans-64.2156.7164.868.5-82.3000110.5L389 T390 G391D387-L389 VanDerWaalsContact C-N 3.25Å; D387-L389 PolarHBondContact O-N 2.96Å; D387-L389 WeakPolarHBondContact OD2-CB 3.45Å; D387-L389 PolarHBondContact OD2-N 3.23Å; D387-L389 VanDerWaalsContact OD2-N 3.12Å; D387-T390 VanDerWaalsContact CG-OG1 3.32Å; D387-T390 PolarHBondContact O-N 3.44Å; D387-T390 WeakPolarHBondContact OD1-CB 3.25Å; D387-T390 PolarHBondContact OD1-OG1 3.32Å; D387-T390 PolarHBondContact OD2-N 3.41Å; D387-T390 PolarHBondContact OD2-OG1 2.96Å; D387-G391 PolarHBondContact O-N 2.75Å
388S93.5Very high96.1Very high106 Ų10649.3 Ų49.374%0.74129%0.287SS*.Hα-helixtrans-56.5-36.1-175.262.20000113.8G391 V392S388-G391 PolarHBondContact O-N 3.25Å; S388-V392 WeakPolarHBondContact O-CB 3.16Å; S388-V392 VanDerWaalsContact O-CG2 3.26Å; S388-V392 WeakPolarHBondContact O-CG2 3.34Å; S388-V392 PolarHBondContact O-N 3.38Å
389L96.6Very high96.1Very high127 Ų12753.2 Ų53.267%0.66531%0.307SS*.Hα-helixtrans-70.7-46-178.8-173.9157.2000110.4D387 G391 V392 F393D387-L389 VanDerWaalsContact C-N 3.25Å; D387-L389 PolarHBondContact O-N 2.96Å; D387-L389 WeakPolarHBondContact OD2-CB 3.45Å; D387-L389 PolarHBondContact OD2-N 3.23Å; D387-L389 VanDerWaalsContact OD2-N 3.12Å; L389-G391 VanDerWaalsContact C-N 3.32Å; L389-G391 PolarHBondContact O-N 3.13Å; L389-V392 PolarHBondContact O-N 2.92Å; L389-F393 WeakPolarHBondContact O-CB 3.47Å; L389-F393 PolarHBondContact O-N 3.3Å
390T95.8Very high96Very high39 Ų3957.3 Ų57.324%0.23933%0.327CS..Hα-helixtrans-60.3-42.1175-60.80000111.5F386 D387 F393 F394F386-T390 HydrophobicContact CB-CG2 4.19Å; F386-T390 HydrophobicContact CD1-CG2 3.94Å; F386-T390 HydrophobicContact CD2-CG2 4.07Å; F386-T390 HydrophobicContact CE1-CG2 4.33Å; F386-T390 HydrophobicContact CE2-CG2 4.43Å; F386-T390 HydrophobicContact CG-CG2 3.82Å; D387-T390 VanDerWaalsContact CG-OG1 3.32Å; D387-T390 PolarHBondContact O-N 3.44Å; D387-T390 WeakPolarHBondContact OD1-CB 3.25Å; D387-T390 PolarHBondContact OD1-OG1 3.32Å; D387-T390 PolarHBondContact OD2-N 3.41Å; D387-T390 PolarHBondContact OD2-OG1 2.96Å; T390-F393 PolarHBondContact O-N 2.66Å; T390-F394 HydrophobicContact CG2-CD2 3.8Å; T390-F394 HydrophobicContact CG2-CE2 3.76Å; T390-F394 WeakPolarHBondContact O-CD2 3.21Å; T390-F394 PolarHBondContact O-N 2.78Å; T390-F394 VanDerWaalsContact O-N 3.07Å
391G95.8Very high95.9Very high7 Ų755.8 Ų55.87%0.07232%0.32CS..Hα-helixtrans-61.1-45.6175.300000113.1D387 S388 L389 S395D387-G391 PolarHBondContact O-N 2.75Å; S388-G391 PolarHBondContact O-N 3.25Å; L389-G391 VanDerWaalsContact C-N 3.32Å; L389-G391 PolarHBondContact O-N 3.13Å; G391-S395 WeakPolarHBondContact O-CB 3.25Å; G391-S395 PolarHBondContact O-N 3.3Å; G391-S395 PolarHBondContact O-OG 3.23Å
392V96Very high95.9Very high86 Ų8657.6 Ų57.652%0.52134%0.339SS..Hα-helixtrans-66.3-39177.31700000111.7S388 L389 S395 S396S388-V392 WeakPolarHBondContact O-CB 3.16Å; S388-V392 VanDerWaalsContact O-CG2 3.26Å; S388-V392 WeakPolarHBondContact O-CG2 3.34Å; S388-V392 PolarHBondContact O-N 3.38Å; L389-V392 PolarHBondContact O-N 2.92Å; V392-S395 PolarHBondContact O-N 3.1Å; V392-S396 WeakPolarHBondContact O-CB 3.22Å; V392-S396 PolarHBondContact O-N 3.38Å; V392-S396 PolarHBondContact O-OG 2.87Å
393F96.7Very high95.8Very high100 Ų10060.9 Ų60.944%0.43936%0.36SS..Hα-helixtrans-58.8-55.2176170.4-95.3000111.4L389 T390 S395 S396 I397L389-F393 WeakPolarHBondContact O-CB 3.47Å; L389-F393 PolarHBondContact O-N 3.3Å; T390-F393 PolarHBondContact O-N 2.66Å; F393-S395 VanDerWaalsContact C-N 3.27Å; F393-S395 PolarHBondContact O-N 3.14Å; F393-S396 PolarHBondContact O-N 3.4Å; F393-I397 HydrophobicContact CD1-CD1 4.46Å; F393-I397 HydrophobicContact CD2-CD1 3.99Å; F393-I397 HydrophobicContact CE1-CD1 3.84Å; F393-I397 HydrophobicContact CE2-CD1 3.31Å; F393-I397 HydrophobicContact CE2-CG1 4.33Å; F393-I397 HydrophobicContact CZ-CD1 3.23Å; F393-I397 HydrophobicContact CZ-CG1 4.46Å; F393-I397 PolarHBondContact O-N 3.09Å; F393-I397 VanDerWaalsContact O-N 3.13Å
394F97.7Very high95.9Very high15 Ų1556.1 Ų56.17%0.06634%0.337CS..Hα-helixtrans-64.5-33.7179.4-80.7-65.4000112.1W377 F382 F386 T390 T398W377-F394 HydrophobicContact CD2-CE1 4.4Å; W377-F394 HydrophobicContact CZ2-CE1 4.45Å; W377-F394 HydrophobicContact CZ2-CZ 4.05Å; F382-F394 HydrophobicContact CE1-CB 3.91Å; F382-F394 HydrophobicContact CZ-CB 4.31Å; F386-F394 HydrophobicContact CE2-CD2 4.06Å; F386-F394 HydrophobicContact CE2-CE2 4.33Å; F386-F394 HydrophobicContact CZ-CE2 4.41Å; T390-F394 HydrophobicContact CG2-CD2 3.8Å; T390-F394 HydrophobicContact CG2-CE2 3.76Å; T390-F394 WeakPolarHBondContact O-CD2 3.21Å; T390-F394 PolarHBondContact O-N 2.78Å; T390-F394 VanDerWaalsContact O-N 3.07Å; F394-T398 WeakPolarHBondContact O-CB 3.16Å; F394-T398 PolarHBondContact O-N 3.34Å; F394-T398 VanDerWaalsContact O-N 3.1Å; F394-T398 PolarHBondContact O-OG1 3.21Å
395S97.8Very high95.9Very high7 Ų755.7 Ų55.75%0.04934%0.335CS..Hα-helixtrans-62.3-48174-58.40000111.9F382 G391 V392 F393 T398 M399 S449 S451F382-S395 WeakPolarHBondContact CZ-OG 3.43Å; G391-S395 WeakPolarHBondContact O-CB 3.25Å; G391-S395 PolarHBondContact O-N 3.3Å; G391-S395 PolarHBondContact O-OG 3.23Å; V392-S395 PolarHBondContact O-N 3.1Å; F393-S395 VanDerWaalsContact C-N 3.27Å; F393-S395 PolarHBondContact O-N 3.14Å; S395-T398 PolarHBondContact O-N 3.15Å; S395-M399 WeakPolarHBondContact O-CG 3.05Å; S395-M399 PolarHBondContact O-N 2.63Å; S395-S449 WeakPolarHBondContact CA-O 3.15Å; S395-S449 WeakPolarHBondContact CB-O 3.12Å; S395-S449 PolarHBondContact OG-O 3.09Å; S395-S451 VanDerWaalsContact OG-CB 3.29Å; S395-S451 WeakPolarHBondContact OG-CB 3.45Å; S395-S451 PolarHBondContact OG-N 3.17Å; S395-S451 VanDerWaalsContact OG-N 3.08Å; S395-S451 PolarHBondContact OG-OG 3.48Å
396S96.6Very high96.1Very high62 Ų6253.5 Ų53.543%0.43431%0.312SS..Hα-helixtrans-64.6-46.7-175.2-57.40000112.5V392 F393 M399 M400V392-S396 WeakPolarHBondContact O-CB 3.22Å; V392-S396 PolarHBondContact O-N 3.38Å; V392-S396 PolarHBondContact O-OG 2.87Å; F393-S396 PolarHBondContact O-N 3.4Å; S396-M399 PolarHBondContact O-N 3.3Å; S396-M400 PolarHBondContact O-N 2.98Å
397I96.6Very high96.3Very high35 Ų3554.6 Ų54.618%0.17932%0.319CS..Hα-helixtrans-71-36.3-180-58.6-176000110.8L372 V375 V376 F393 M399 M400L372-I397 HydrophobicContact CD2-CG2 3.83Å; V375-I397 HydrophobicContact CG2-CG2 4.11Å; V376-I397 HydrophobicContact CG1-CB 4.05Å; V376-I397 HydrophobicContact CG1-CG2 3.42Å; V376-I397 VanDerWaalsContact CG1-CG2 3.42Å; F393-I397 HydrophobicContact CD1-CD1 4.46Å; F393-I397 HydrophobicContact CD2-CD1 3.99Å; F393-I397 HydrophobicContact CE1-CD1 3.84Å; F393-I397 HydrophobicContact CE2-CD1 3.31Å; F393-I397 HydrophobicContact CE2-CG1 4.33Å; F393-I397 HydrophobicContact CZ-CD1 3.23Å; F393-I397 HydrophobicContact CZ-CG1 4.46Å; F393-I397 PolarHBondContact O-N 3.09Å; F393-I397 VanDerWaalsContact O-N 3.13Å; I397-M399 PolarHBondContact O-N 3.14Å; I397-M400 VanDerWaalsContact O-CB 3.3Å; I397-M400 WeakPolarHBondContact O-CB 3.36Å; I397-M400 PolarHBondContact O-N 2.82Å; I397-M400 VanDerWaalsContact O-N 3.14Å
398T97.5Very high96.4Very high16 Ų1650.4 Ų50.410%0.09830%0.297CS..Hα-helixtrans-63.6-42.1176-56.10000111.1H379 F394 S395 M400 M401 S449H379-T398 HydrophobicContact CB-CG2 4.34Å; H379-T398 WeakPolarHBondContact ND1-CG2 3.11Å; H379-T398 PolarHBondContact ND1-OG1 3.39Å; F394-T398 WeakPolarHBondContact O-CB 3.16Å; F394-T398 PolarHBondContact O-N 3.34Å; F394-T398 VanDerWaalsContact O-N 3.1Å; F394-T398 PolarHBondContact O-OG1 3.21Å; S395-T398 PolarHBondContact O-N 3.15Å; T398-M400 PolarHBondContact O-N 3.33Å; T398-M401 VanDerWaalsContact O-CB 3.25Å; T398-M401 WeakPolarHBondContact O-CB 3.45Å; T398-M401 WeakPolarHBondContact O-CG 3.37Å; T398-M401 PolarHBondContact O-N 3.08Å; T398-M401 VanDerWaalsContact O-N 3.14Å; T398-S449 VanDerWaalsContact CG2-CB 3.44Å
399M96.9Very high96.6Very high83 Ų8346 Ų4641%0.40927%0.265SS..Hα-helixtrans-58.9-35.5173.4-77.9-172.4-80.300112.7S395 S396 I397 M401 G402 S449S395-M399 WeakPolarHBondContact O-CG 3.05Å; S395-M399 PolarHBondContact O-N 2.63Å; S396-M399 PolarHBondContact O-N 3.3Å; I397-M399 PolarHBondContact O-N 3.14Å; M399-M401 PolarHBondContact O-N 3.48Å; M399-M401 VanDerWaalsContact O-N 3.15Å; M399-G402 PolarHBondContact O-N 3.47Å; M399-S449 WeakPolarHBondContact CG-OG 3.42Å
400M96.3Very high96.5Very high107 Ų10747 Ų4753%0.52727%0.265SS..Hα-helixtrans-61.5-22.3179.1-167.3177.3174.100113.1L372 S396 I397 T398 G402 V403 P404L372-M400 HydrophobicContact CD1-CG 4.35Å; L372-M400 HydrophobicContact CD2-SD 4.26Å; S396-M400 PolarHBondContact O-N 2.98Å; I397-M400 VanDerWaalsContact O-CB 3.3Å; I397-M400 WeakPolarHBondContact O-CB 3.36Å; I397-M400 PolarHBondContact O-N 2.82Å; I397-M400 VanDerWaalsContact O-N 3.14Å; T398-M400 PolarHBondContact O-N 3.33Å; M400-G402 PolarHBondContact O-N 3.16Å; M400-G402 VanDerWaalsContact O-N 3.16Å; M400-V403 WeakPolarHBondContact O-CB 3.07Å; M400-V403 PolarHBondContact O-N 3.5Å; M400-P404 VanDerWaalsContact O-CD 3.26Å; M400-P404 WeakPolarHBondContact O-CD 3.48Å
401M96.1Very high96.6Very high13 Ų1345.5 Ų45.56%0.06426%0.256CS..THydrogen-bonded Turntrans-58.7-23.3172.4-67.7-55.9-52.500113.7Y333 M369 L372 T398 M399 V403 P404 T405Y333-M401 HydrophobicContact CD1-CE 4.49Å; Y333-M401 HydrophobicContact CE1-CE 3.52Å; Y333-M401 HydrophobicContact CE2-CE 3.96Å; Y333-M401 WeakPolarHBondContact OH-CE 3.44Å; Y333-M401 WeakPolarHBondContact OH-CG 3.38Å; M369-M401 HydrophobicContact CB-CE 4.1Å; M369-M401 HydrophobicContact CG-CE 3.83Å; L372-M401 HydrophobicContact CB-CE 4.32Å; L372-M401 HydrophobicContact CB-SD 3.16Å; L372-M401 WeakPolarHBondContact CB-SD 3.23Å; L372-M401 HydrophobicContact CD1-SD 3.73Å; L372-M401 HydrophobicContact CG-SD 4.07Å; T398-M401 VanDerWaalsContact O-CB 3.25Å; T398-M401 WeakPolarHBondContact O-CB 3.45Å; T398-M401 WeakPolarHBondContact O-CG 3.37Å; T398-M401 PolarHBondContact O-N 3.08Å; T398-M401 VanDerWaalsContact O-N 3.14Å; M399-M401 PolarHBondContact O-N 3.48Å; M399-M401 VanDerWaalsContact O-N 3.15Å; M401-V403 PolarHBondContact O-N 3.5Å; M401-P404 VanDerWaalsContact O-CD 3.32Å; M401-P404 WeakPolarHBondContact O-CD 3.36Å; M401-P404 WeakPolarHBondContact O-CG 3.46Å; M401-T405 PolarHBondContact O-OG1 2.99Å
402G95.6Very high96.5Very high38 Ų3845.2 Ų45.239%0.39225%0.253SS..Hα-helixtrans-61.1-31.3174.100000112.9M399 M400 G406M399-G402 PolarHBondContact O-N 3.47Å; M400-G402 PolarHBondContact O-N 3.16Å; M400-G402 VanDerWaalsContact O-N 3.16Å; G402-G406 PolarHBondContact O-N 2.92Å
403V96.3Very high96.4Very high87 Ų8744.9 Ų44.953%0.52725%0.247SC..Hα-helixtrans-65.5-58.5-177.1179.40000112.7M400 M401 T405 G406 I407M400-V403 WeakPolarHBondContact O-CB 3.07Å; M400-V403 PolarHBondContact O-N 3.5Å; M401-V403 PolarHBondContact O-N 3.5Å; V403-T405 PolarHBondContact O-N 3.32Å; V403-G406 PolarHBondContact O-N 3.19Å; V403-I407 HydrophobicContact CG1-CD1 4.26Å; V403-I407 WeakPolarHBondContact O-CG1 3.19Å; V403-I407 PolarHBondContact O-N 2.96Å
404P97.2Very high96.3Very high5 Ų546 Ų463%0.03225%0.25CC..Hα-helixtrans-64.2-30.5179.526.2-35.4000112.7A365 S368 M369 M400 M401 K408A365-P404 HydrophobicContact CB-CB 3.92Å; S368-P404 WeakPolarHBondContact OG-CB 3.24Å; M369-P404 HydrophobicContact CE-CB 4.05Å; M369-P404 HydrophobicContact CE-CG 4.34Å; M369-P404 HydrophobicContact CG-CB 4.17Å; M369-P404 HydrophobicContact CG-CG 4.11Å; M400-P404 VanDerWaalsContact O-CD 3.26Å; M400-P404 WeakPolarHBondContact O-CD 3.48Å; M401-P404 VanDerWaalsContact O-CD 3.32Å; M401-P404 WeakPolarHBondContact O-CD 3.36Å; M401-P404 WeakPolarHBondContact O-CG 3.46Å; P404-K408 WeakPolarHBondContact O-CG 3.13Å; P404-K408 PolarHBondContact O-N 3.25Å
405T95.2Very high96.1Very high29 Ų2945.6 Ų45.618%0.17825%0.248CC..Hα-helixtrans-64.4-47.8173.6-56.60000111.3M369 M401 V403 I407 K408 V409 F438M369-T405 WeakPolarHBondContact CE-OG1 3.34Å; M401-T405 PolarHBondContact O-OG1 2.99Å; V403-T405 PolarHBondContact O-N 3.32Å; T405-I407 PolarHBondContact O-N 3.17Å; T405-K408 PolarHBondContact O-N 2.9Å; T405-K408 VanDerWaalsContact O-N 3.15Å; T405-V409 PolarHBondContact O-N 3.38Å; T405-F438 HydrophobicContact CG2-CD1 4.38Å; T405-F438 HydrophobicContact CG2-CE1 3.62Å
406G96Very high95.7Very high21 Ų2145.7 Ų45.722%0.21625%0.248CC..Hα-helixtrans-59.3-44.8177.200000112.7G402 V403 K408 V409 F410G402-G406 PolarHBondContact O-N 2.92Å; V403-G406 PolarHBondContact O-N 3.19Å; G406-K408 PolarHBondContact O-N 3.44Å; G406-V409 PolarHBondContact O-N 2.88Å; G406-F410 WeakPolarHBondContact O-CD2 3.22Å; G406-F410 PolarHBondContact O-N 2.83Å
407I97.6Very high95.3Very high74 Ų7449.4 Ų49.438%0.37926%0.263SS..Hα-helixtrans-52.1-43.1175.6-69169.3000110.8A365 V403 T405 S411A365-I407 HydrophobicContact CB-CG2 4.39Å; V403-I407 HydrophobicContact CG1-CD1 4.26Å; V403-I407 WeakPolarHBondContact O-CG1 3.19Å; V403-I407 PolarHBondContact O-N 2.96Å; T405-I407 PolarHBondContact O-N 3.17Å; I407-S411 WeakPolarHBondContact O-CB 3.48Å; I407-S411 PolarHBondContact O-N 2.92Å; I407-S411 VanDerWaalsContact O-N 3.11Å; I407-S411 PolarHBondContact O-OG 3.06Å
408K97.1Very high94.1Very high1 Ų150.7 Ų50.70%0.00428%0.275CS..Hα-helixtrans-71.1-47.7-179.4-63.2-18070.3690112.2F340 L362 A365 M369 P404 T405 G406 F410 S411 W412F340-K408 VanDerWaalsContact CB-CE 3.43Å; F340-K408 HydrophobicContact CD2-CD 3.92Å; F340-K408 HydrophobicContact CE2-CD 4.25Å; F340-K408 HydrophobicContact CG-CD 4.46Å; L362-K408 HydrophobicContact CD2-CB 4.1Å; L362-K408 HydrophobicContact CD2-CG 3.75Å; A365-K408 HydrophobicContact CB-CD 4.14Å; A365-K408 HydrophobicContact CB-CG 3.9Å; M369-K408 HydrophobicContact CE-CD 3.86Å; M369-K408 HydrophobicContact SD-CD 4.4Å; P404-K408 WeakPolarHBondContact O-CG 3.13Å; P404-K408 PolarHBondContact O-N 3.25Å; T405-K408 PolarHBondContact O-N 2.9Å; T405-K408 VanDerWaalsContact O-N 3.15Å; G406-K408 PolarHBondContact O-N 3.44Å; K408-F410 PolarHBondContact O-N 3.41Å; K408-S411 PolarHBondContact O-N 3.38Å; K408-W412 HydrophobicContact CB-CH2 3.87Å; K408-W412 HydrophobicContact CB-CZ2 3.84Å; K408-W412 HydrophobicContact CB-CZ3 4.32Å; K408-W412 VanDerWaalsContact O-CD2 3.22Å; K408-W412 VanDerWaalsContact O-CG 3.27Å; K408-W412 PolarHBondContact O-N 3.07Å
409V96.4Very high92.5Very high13 Ų1351.5 Ų51.58%0.07928%0.281CS..Hα-helixtrans-58.7-48178.9174.90000111.1T405 G406 S411 W412 L413T405-V409 PolarHBondContact O-N 3.38Å; G406-V409 PolarHBondContact O-N 2.88Å; V409-S411 VanDerWaalsContact C-N 3.33Å; V409-S411 PolarHBondContact O-N 2.67Å; V409-W412 HydrophobicContact CG2-CE3 4.25Å; V409-W412 HydrophobicContact CG2-CZ3 3.99Å; V409-W412 PolarHBondContact O-N 2.97Å; V409-L413 HydrophobicContact CG1-CD1 4.07Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 WeakPolarHBondContact O-CG 3.5Å; V409-L413 PolarHBondContact O-N 3.24Å
410F96.4Very high91.2Very high148 Ų14851.7 Ų51.765%0.64931%0.305SS*.Hα-helixtrans-64.8-35.9177.9-72-61.2000112.9G406 K408 L413 Y414G406-F410 WeakPolarHBondContact O-CD2 3.22Å; G406-F410 PolarHBondContact O-N 2.83Å; K408-F410 PolarHBondContact O-N 3.41Å; F410-L413 HydrophobicContact CD1-CD1 4.36Å; F410-L413 PolarHBondContact O-N 3.23Å; F410-Y414 WeakPolarHBondContact O-CB 3.31Å; F410-Y414 PolarHBondContact O-N 3Å
411S96Very high90Very high8 Ų849.2 Ų49.26%0.05629%0.292CS..Hα-helixtrans-65.2-39.6175.7-60.80000112.2I407 K408 V409 Y414 M415I407-S411 WeakPolarHBondContact O-CB 3.48Å; I407-S411 PolarHBondContact O-N 2.92Å; I407-S411 VanDerWaalsContact O-N 3.11Å; I407-S411 PolarHBondContact O-OG 3.06Å; K408-S411 PolarHBondContact O-N 3.38Å; V409-S411 VanDerWaalsContact C-N 3.33Å; V409-S411 PolarHBondContact O-N 2.67Å; S411-Y414 PolarHBondContact O-N 3.47Å; S411-M415 WeakPolarHBondContact O-CG 3.45Å; S411-M415 PolarHBondContact O-N 3.08Å; S411-M415 VanDerWaalsContact O-N 3.1Å
412W95.4Very high89.3Confident1 Ų156.9 Ų56.90%0.00432%0.321CS..Hα-helixtrans-66.6-45.6175-59.2-34.4000111.9F340 V343 S344 K408 V409 Y414 M415 L416 F434 M435F340-W412 HydrophobicContact CB-CH2 4.37Å; F340-W412 HydrophobicContact CB-CZ2 4.11Å; F340-W412 AromaticContact CD1-CH2 3.39Å; F340-W412 HydrophobicContact CD1-CH2 3.39Å; F340-W412 AromaticContact CD1-CZ2 3.99Å; F340-W412 HydrophobicContact CD1-CZ2 3.99Å; F340-W412 HydrophobicContact CD1-CZ3 4.42Å; F340-W412 AromaticContact CE1-CH2 3.69Å; F340-W412 HydrophobicContact CE1-CH2 3.69Å; F340-W412 HydrophobicContact CE1-CZ3 4.41Å; F340-W412 AromaticContact CG-CH2 3.94Å; F340-W412 HydrophobicContact CG-CH2 3.94Å; F340-W412 HydrophobicContact CG-CZ2 4.17Å; F340-W412 HydrophobicContact CZ-CH2 4.49Å; V343-W412 HydrophobicContact CB-CZ2 4.22Å; V343-W412 HydrophobicContact CG1-CD2 3.56Å; V343-W412 HydrophobicContact CG1-CE3 3.92Å; V343-W412 HydrophobicContact CG1-CG 3.91Å; V343-W412 HydrophobicContact CG1-CH2 4.41Å; V343-W412 HydrophobicContact CG1-CZ2 4.04Å; V343-W412 HydrophobicContact CG1-CZ3 4.35Å; S344-W412 PolarHBondContact OG-NE1 3.08Å; K408-W412 HydrophobicContact CB-CH2 3.87Å; K408-W412 HydrophobicContact CB-CZ2 3.84Å; K408-W412 HydrophobicContact CB-CZ3 4.32Å; K408-W412 VanDerWaalsContact O-CD2 3.22Å; K408-W412 VanDerWaalsContact O-CG 3.27Å; K408-W412 PolarHBondContact O-N 3.07Å; V409-W412 HydrophobicContact CG2-CE3 4.25Å; V409-W412 HydrophobicContact CG2-CZ3 3.99Å; V409-W412 PolarHBondContact O-N 2.97Å; W412-Y414 VanDerWaalsContact C-N 3.28Å; W412-Y414 PolarHBondContact O-N 2.87Å; W412-M415 PolarHBondContact O-N 3.44Å; W412-L416 WeakPolarHBondContact O-CG 3.24Å; W412-L416 PolarHBondContact O-N 3.1Å; W412-F434 HydrophobicContact CE3-CE1 4.33Å; W412-F434 HydrophobicContact CH2-CE1 4.08Å; W412-F434 AromaticContact CZ3-CE1 3.69Å; W412-F434 HydrophobicContact CZ3-CE1 3.69Å; W412-F434 HydrophobicContact CZ3-CZ 4.48Å; W412-M435 HydrophobicContact CB-SD 3.72Å; W412-M435 HydrophobicContact CE3-CG 4.1Å; W412-M435 HydrophobicContact CE3-SD 4.45Å
413L94Very high88.8Confident79 Ų7960.1 Ų60.141%0.41433%0.332SS..Hα-helixtrans-58-41.4176-71.2172.6000111.8V409 F410 L416 N417 M435V409-L413 HydrophobicContact CG1-CD1 4.07Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 WeakPolarHBondContact O-CG 3.5Å; V409-L413 PolarHBondContact O-N 3.24Å; F410-L413 HydrophobicContact CD1-CD1 4.36Å; F410-L413 PolarHBondContact O-N 3.23Å; L413-L416 PolarHBondContact O-N 2.82Å; L413-N417 WeakPolarHBondContact O-CB 3.31Å; L413-N417 PolarHBondContact O-N 2.59Å; L413-M435 HydrophobicContact CD2-CE 3.92Å; L413-M435 HydrophobicContact CD2-SD 3.87Å; L413-M435 HydrophobicContact CG-SD 4.11Å
414Y93.4Very high88.5Confident124 Ų12461.4 Ų61.449%0.48634%0.336SS..Hα-helixtrans-63.9-45176.6-179-91.8000112.7F357 F410 S411 W412 L416 N417 S418F357-Y414 HydrophobicContact CB-CD1 3.78Å; F357-Y414 HydrophobicContact CB-CE1 4.28Å; F357-Y414 AromaticContact CD1-CD1 3.72Å; F357-Y414 HydrophobicContact CD1-CD1 3.72Å; F357-Y414 HydrophobicContact CD1-CE1 4.44Å; F357-Y414 HydrophobicContact CD1-CG 4.1Å; F357-Y414 AromaticContact CD2-CD1 3.35Å; F357-Y414 HydrophobicContact CD2-CD1 3.35Å; F357-Y414 AromaticContact CD2-CE1 3.24Å; F357-Y414 HydrophobicContact CD2-CE1 3.24Å; F357-Y414 HydrophobicContact CD2-CG 4.3Å; F357-Y414 HydrophobicContact CE1-CD1 4.09Å; F357-Y414 HydrophobicContact CE1-CG 4.16Å; F357-Y414 AromaticContact CE2-CD1 3.76Å; F357-Y414 HydrophobicContact CE2-CD1 3.76Å; F357-Y414 AromaticContact CE2-CE1 3.54Å; F357-Y414 HydrophobicContact CE2-CE1 3.54Å; F357-Y414 HydrophobicContact CE2-CG 4.36Å; F357-Y414 AromaticContact CE2-CZ 3.97Å; F357-Y414 AromaticContact CG-CD1 3.31Å; F357-Y414 HydrophobicContact CG-CD1 3.31Å; F357-Y414 AromaticContact CG-CE1 3.74Å; F357-Y414 HydrophobicContact CG-CE1 3.74Å; F357-Y414 HydrophobicContact CG-CG 4.15Å; F357-Y414 HydrophobicContact CZ-CD1 4.1Å; F357-Y414 HydrophobicContact CZ-CE1 4.26Å; F357-Y414 HydrophobicContact CZ-CG 4.28Å; F410-Y414 WeakPolarHBondContact O-CB 3.31Å; F410-Y414 PolarHBondContact O-N 3Å; S411-Y414 PolarHBondContact O-N 3.47Å; W412-Y414 VanDerWaalsContact C-N 3.28Å; W412-Y414 PolarHBondContact O-N 2.87Å; Y414-L416 VanDerWaalsContact C-N 3.27Å; Y414-L416 PolarHBondContact O-N 2.98Å; Y414-N417 PolarHBondContact O-N 3.12Å; Y414-S418 PolarHBondContact O-N 3.17Å; Y414-S418 PolarHBondContact O-OG 3.42Å
415M93.2Very high88.3Confident6 Ų663.3 Ų63.33%0.0335%0.346CS..Hα-helixtrans-60.7-38.1176.5-74.3-171.5-72.100111.9C347 M348 S351 F357 S411 W412 C419C347-M415 HydrophobicContact CB-CB 4.12Å; C347-M415 HydrophobicContact CB-CE 3.63Å; C347-M415 HydrophobicContact CB-SD 4.26Å; M348-M415 HydrophobicContact CB-SD 4.19Å; S351-M415 WeakPolarHBondContact CB-O 3.31Å; F357-M415 HydrophobicContact CB-CG 3.64Å; F357-M415 HydrophobicContact CB-SD 4.3Å; F357-M415 PolarHBondContact N-SD 3.35Å; F357-M415 VanDerWaalsContact N-SD 3.41Å; S411-M415 WeakPolarHBondContact O-CG 3.45Å; S411-M415 PolarHBondContact O-N 3.08Å; S411-M415 VanDerWaalsContact O-N 3.1Å; W412-M415 PolarHBondContact O-N 3.44Å; M415-C419 PolarHBondContact O-SG 3.46Å; M415-C419 VanDerWaalsContact O-SG 3.35Å
416L90.3Very high88.2Confident10 Ų1062.2 Ų62.25%0.05234%0.339CS..Hα-helixtrans-75.3-37.2179.2-65.6173.8000112.7C347 L350 W412 L413 Y414 S418 M421 L431 M435C347-L416 HydrophobicContact CB-CD2 4.35Å; L350-L416 HydrophobicContact CD1-CD2 4.37Å; W412-L416 WeakPolarHBondContact O-CG 3.24Å; W412-L416 PolarHBondContact O-N 3.1Å; L413-L416 PolarHBondContact O-N 2.82Å; Y414-L416 VanDerWaalsContact C-N 3.27Å; Y414-L416 PolarHBondContact O-N 2.98Å; L416-S418 VanDerWaalsContact C-N 3.27Å; L416-S418 PolarHBondContact O-N 3.01Å; L416-M421 HydrophobicContact CB-CE 4.28Å; L416-M421 HydrophobicContact CB-SD 3.79Å; L416-M421 HydrophobicContact CD2-CE 3.73Å; L416-M421 HydrophobicContact CD2-SD 4.19Å; L416-M421 HydrophobicContact CG-CE 4.42Å; L416-L431 HydrophobicContact CD2-CD1 4.19Å; L416-M435 HydrophobicContact CD1-CE 3.34Å; L416-M435 HydrophobicContact CD1-SD 4.13Å
417N87.1Confident88.2Confident139 Ų13961.5 Ų61.574%0.74333%0.33SS*.Hα-helixtrans-62.6-34.9179.1-174-68.7000112.6L413 Y414 C419L413-N417 WeakPolarHBondContact O-CB 3.31Å; L413-N417 PolarHBondContact O-N 2.59Å; Y414-N417 PolarHBondContact O-N 3.12Å; N417-C419 PolarHBondContact O-N 2.7Å
418S72.3Confident88Confident63 Ų6358.5 Ų58.544%0.44132%0.315SS..THydrogen-bonded Turntrans-72.77.7-171.8-58.70000114.7Y414 L416Y414-S418 PolarHBondContact O-N 3.17Å; Y414-S418 PolarHBondContact O-OG 3.42Å; L416-S418 VanDerWaalsContact C-N 3.27Å; L416-S418 PolarHBondContact O-N 3.01Å
419C64.2Low87.9Confident32 Ų3261.3 Ų61.322%0.21633%0.326CS..SBendtrans-138.2148.3-158.9-590000114.4S351 M415 N417 M421S351-C419 WeakPolarHBondContact CA-SG 3.47Å; S351-C419 WeakPolarHBondContact CB-SG 3.38Å; S351-C419 PolarHBondContact O-SG 3.43Å; M415-C419 PolarHBondContact O-SG 3.46Å; M415-C419 VanDerWaalsContact O-SG 3.35Å; N417-C419 PolarHBondContact O-N 2.7Å; C419-M421 HydrophobicContact CB-CG 4.33Å; C419-M421 PolarHBondContact O-N 2.93Å
420G69.4Low87.9Confident88 Ų8860.7 Ų60.791%0.90732%0.322SS*.  trans-72.366.617000000111.5R422G420-R422 PolarHBondContact O-N 3.37Å
421M70.8Confident87.9Confident55 Ų5553.6 Ų53.627%0.27129%0.291SS..  trans-60.8133-176.3-64.3-177.768.200110.8L416 C419 V423 V428L416-M421 HydrophobicContact CB-CE 4.28Å; L416-M421 HydrophobicContact CB-SD 3.79Å; L416-M421 HydrophobicContact CD2-CE 3.73Å; L416-M421 HydrophobicContact CD2-SD 4.19Å; L416-M421 HydrophobicContact CG-CE 4.42Å; C419-M421 HydrophobicContact CB-CG 4.33Å; C419-M421 PolarHBondContact O-N 2.93Å; M421-V423 VanDerWaalsContact C-N 3.3Å; M421-V423 PolarHBondContact O-N 3.06Å; M421-V428 HydrophobicContact CE-CB 3.92Å; M421-V428 HydrophobicContact CE-CG1 3.31Å; M421-V428 HydrophobicContact CE-CG2 3.44Å; M421-V428 VanDerWaalsContact CE-CG2 3.44Å
422R81.7Confident87.8Confident174 Ų17456.9 Ų56.966%0.65731%0.311SS*.  trans-72.988.9167.3-66.4-179.4-177.1172.92.6107.9G420 L424 D425G420-R422 PolarHBondContact O-N 3.37Å; R422-L424 PolarHBondContact O-N 3.43Å; R422-D425 HydrophobicContact CB-CB 4.12Å; R422-D425 WeakPolarHBondContact O-CB 3.37Å; R422-D425 PolarHBondContact O-N 3.47Å
423V84.7Confident87.8Confident105 Ų10557.1 Ų57.164%0.63631%0.314SS*.THydrogen-bonded Turntrans-53.5-27.8-175.9179.80000113M421 D425 W429M421-V423 VanDerWaalsContact C-N 3.3Å; M421-V423 PolarHBondContact O-N 3.06Å; V423-D425 VanDerWaalsContact C-N 3.32Å; V423-W429 PolarHBondContact O-NE1 3.42Å
424L90.1Very high87.9Confident115 Ų11553.4 Ų53.460%0.60229%0.294SS*.THydrogen-bonded Turntrans-81.4-6.4177.8-62.3177.3000114R422 K497 Q501R422-L424 PolarHBondContact O-N 3.43Å; L424-K497 WeakPolarHBondContact O-CE 3.5Å; L424-K497 PolarHBondContact O-NZ 3.03Å; L424-Q501 PolarHBondContact O-NE2 2.76Å
425D92.2Very high88Confident44 Ų4447.9 Ų47.924%0.23527%0.273CS..  trans-70120.8177.7-167.8-24.6000110R422 V423 M427 V428R422-D425 HydrophobicContact CB-CB 4.12Å; R422-D425 WeakPolarHBondContact O-CB 3.37Å; R422-D425 PolarHBondContact O-N 3.47Å; V423-D425 VanDerWaalsContact C-N 3.32Å; D425-M427 PolarHBondContact O-N 3.22Å; D425-M427 VanDerWaalsContact O-N 3.07Å; D425-M427 PolarHBondContact OD1-N 3.36Å; D425-V428 HydrophobicContact CB-CG2 4.18Å; D425-V428 WeakPolarHBondContact O-CB 3.2Å; D425-V428 PolarHBondContact O-N 2.9Å
426P95Very high88Confident6 Ų653.8 Ų53.84%0.03930%0.298CS..Hα-helixtrans-55.4-27178.123-35.2000112.8V428 W429 W430 K497 L500 Q501P426-V428 VanDerWaalsContact C-N 3.33Å; P426-V428 PolarHBondContact O-N 2.96Å; P426-W429 WeakPolarHBondContact O-CB 3.21Å; P426-W429 PolarHBondContact O-N 3.46Å; P426-W430 VanDerWaalsContact O-CD1 3.24Å; P426-W430 PolarHBondContact O-N 3.24Å; P426-K497 HydrophobicContact CG-CG 4.11Å; P426-L500 HydrophobicContact CB-CB 3.73Å; P426-L500 HydrophobicContact CG-CB 3.83Å; P426-L500 HydrophobicContact CG-CD1 4.01Å; P426-Q501 HydrophobicContact CB-CG 4.24Å
427M94.8Very high88.3Confident6 Ų653.4 Ų53.43%0.0330%0.296CS..Hα-helixtrans-64.5-38.2177.1-102.5-61-167.700113.7I346 D425 W429 W430 L431 M481 V484 W485I346-M427 HydrophobicContact CD1-CE 3.83Å; I346-M427 HydrophobicContact CD1-SD 4.31Å; D425-M427 PolarHBondContact O-N 3.22Å; D425-M427 VanDerWaalsContact O-N 3.07Å; D425-M427 PolarHBondContact OD1-N 3.36Å; M427-W429 VanDerWaalsContact C-N 3.25Å; M427-W429 PolarHBondContact O-N 2.71Å; M427-W430 PolarHBondContact O-N 3.3Å; M427-L431 WeakPolarHBondContact O-CG 3.44Å; M427-L431 PolarHBondContact O-N 2.85Å; M427-M481 VanDerWaalsContact CE-C 3.5Å; M427-M481 VanDerWaalsContact CE-CA 3.49Å; M427-M481 HydrophobicContact CE-CB 3.83Å; M427-M481 HydrophobicContact CE-CG 4.28Å; M427-M481 WeakPolarHBondContact CE-O 3.46Å; M427-M481 HydrophobicContact SD-CB 4.18Å; M427-M481 HydrophobicContact SD-CG 4.01Å; M427-V484 HydrophobicContact CE-CB 3.9Å; M427-V484 HydrophobicContact CE-CG1 3.94Å; M427-V484 HydrophobicContact CG-CG1 4.13Å; M427-W485 HydrophobicContact CE-CB 3.46Å; M427-W485 VanDerWaalsContact CE-CB 3.46Å; M427-W485 HydrophobicContact CE-CE3 4.09Å; M427-W485 HydrophobicContact CE-CG 4.36Å; M427-W485 VanDerWaalsContact CE-N 3.32Å; M427-W485 HydrophobicContact CG-CE3 4.09Å
428V94Very high88.7Confident12 Ų1247.5 Ų47.57%0.07326%0.264CS..Hα-helixtrans-60.9-40.3173.81670000110.4L350 M421 D425 P426 L431 V432L350-V428 HydrophobicContact CD1-CG2 4.32Å; M421-V428 HydrophobicContact CE-CB 3.92Å; M421-V428 HydrophobicContact CE-CG1 3.31Å; M421-V428 HydrophobicContact CE-CG2 3.44Å; M421-V428 VanDerWaalsContact CE-CG2 3.44Å; D425-V428 HydrophobicContact CB-CG2 4.18Å; D425-V428 WeakPolarHBondContact O-CB 3.2Å; D425-V428 PolarHBondContact O-N 2.9Å; P426-V428 VanDerWaalsContact C-N 3.33Å; P426-V428 PolarHBondContact O-N 2.96Å; V428-L431 PolarHBondContact O-N 3.3Å; V428-V432 HydrophobicContact CG1-CG2 4.44Å; V428-V432 WeakPolarHBondContact O-CG2 3.42Å; V428-V432 PolarHBondContact O-N 3.46Å
429W95.3Very high89.8Confident59 Ų5947.4 Ų47.422%0.22326%0.261CS..Hα-helixtrans-64.2-44.6179.2-63.510.7000111.1V423 P426 M427 V432 G433 Q501 W504 L505V423-W429 PolarHBondContact O-NE1 3.42Å; P426-W429 WeakPolarHBondContact O-CB 3.21Å; P426-W429 PolarHBondContact O-N 3.46Å; M427-W429 VanDerWaalsContact C-N 3.25Å; M427-W429 PolarHBondContact O-N 2.71Å; W429-V432 PolarHBondContact O-N 3.41Å; W429-G433 PolarHBondContact O-N 3.14Å; W429-Q501 HydrophobicContact CE3-CB 4.29Å; W429-Q501 HydrophobicContact CE3-CG 4.18Å; W429-Q501 HydrophobicContact CH2-CB 4.05Å; W429-Q501 HydrophobicContact CH2-CG 3.87Å; W429-Q501 HydrophobicContact CZ2-CG 4.38Å; W429-Q501 HydrophobicContact CZ3-CB 3.64Å; W429-Q501 HydrophobicContact CZ3-CG 3.75Å; W429-W504 HydrophobicContact CB-CD2 3.86Å; W429-W504 HydrophobicContact CB-CG 3.92Å; W429-W504 HydrophobicContact CB-CZ2 4.27Å; W429-W504 HydrophobicContact CD2-CD2 4.44Å; W429-W504 HydrophobicContact CD2-CE3 4.34Å; W429-W504 HydrophobicContact CE3-CB 4.27Å; W429-W504 AromaticContact CE3-CD2 3.79Å; W429-W504 HydrophobicContact CE3-CD2 3.79Å; W429-W504 AromaticContact CE3-CE3 3.48Å; W429-W504 HydrophobicContact CE3-CE3 3.48Å; W429-W504 VanDerWaalsContact CE3-CE3 3.48Å; W429-W504 HydrophobicContact CE3-CG 4.13Å; W429-W504 HydrophobicContact CE3-CZ3 4.09Å; W429-W504 HydrophobicContact CZ3-CE3 4.02Å; W429-W504 PolarHBondContact O-NE1 3.01Å; W429-L505 HydrophobicContact CZ3-CG 4.46Å
430W96.3Very high91.3Very high0 Ų047.6 Ų47.60%026%0.261CS..Hα-helixtrans-62.3-42.1176.6-81.2101.6000112.6P426 M427 G433 F434 V480 M481 H503 W504 S507 M508P426-W430 VanDerWaalsContact O-CD1 3.24Å; P426-W430 PolarHBondContact O-N 3.24Å; M427-W430 PolarHBondContact O-N 3.3Å; W430-G433 PolarHBondContact O-N 2.92Å; W430-F434 WeakPolarHBondContact O-CB 3.32Å; W430-F434 PolarHBondContact O-N 3.09Å; W430-V480 HydrophobicContact CD2-CG1 4.12Å; W430-V480 HydrophobicContact CE3-CG1 4.37Å; W430-V480 HydrophobicContact CH2-CB 4.35Å; W430-V480 HydrophobicContact CH2-CG1 4Å; W430-V480 HydrophobicContact CH2-CG2 4.37Å; W430-V480 HydrophobicContact CZ2-CG1 3.75Å; W430-V480 HydrophobicContact CZ3-CB 4.32Å; W430-V480 HydrophobicContact CZ3-CG1 4.31Å; W430-M481 HydrophobicContact CB-CG 3.54Å; W430-M481 HydrophobicContact CB-SD 3.87Å; W430-M481 HydrophobicContact CG-CG 4.23Å; W430-H503 AromaticContact CH2-CE1 3.94Å; W430-H503 AromaticContact CZ2-CE1 3.55Å; W430-H503 AromaticContact CZ2-ND1 3.42Å; W430-H503 WeakPolarHBondContact CZ2-ND1 3.42Å; W430-W504 AromaticContact CD1-CD1 3.88Å; W430-W504 AromaticContact CD2-CD1 3.7Å; W430-W504 AromaticContact CE2-CD1 3.75Å; W430-W504 AromaticContact CG-CD1 3.77Å; W430-W504 HydrophobicContact CZ2-CB 4.21Å; W430-W504 AromaticContact NE1-CD1 3.85Å; W430-S507 WeakPolarHBondContact CH2-OG 3.38Å; W430-M508 HydrophobicContact CE3-CE 3.9Å; W430-M508 HydrophobicContact CZ3-CE 3.85Å
431L95.4Very high92.5Very high0 Ų043.4 Ų43.40%022%0.218CC..Hα-helixtrans-62-47.5176.2-71.8168000112.2V343 I346 L350 L416 M427 V428 F434 M435 M481V343-L431 HydrophobicContact CB-CD2 4.49Å; V343-L431 HydrophobicContact CG1-CD2 3.94Å; V343-L431 HydrophobicContact CG2-CD2 4.38Å; I346-L431 HydrophobicContact CB-CD2 4.47Å; I346-L431 HydrophobicContact CG2-CD1 3.81Å; I346-L431 HydrophobicContact CG2-CD2 4.29Å; I346-L431 HydrophobicContact CG2-CG 4.43Å; L350-L431 HydrophobicContact CD1-CD1 3.51Å; L416-L431 HydrophobicContact CD2-CD1 4.19Å; M427-L431 WeakPolarHBondContact O-CG 3.44Å; M427-L431 PolarHBondContact O-N 2.85Å; V428-L431 PolarHBondContact O-N 3.3Å; L431-F434 PolarHBondContact O-N 3.13Å; L431-M435 WeakPolarHBondContact O-CE 3.41Å; L431-M435 WeakPolarHBondContact O-CG 3.26Å; L431-M435 PolarHBondContact O-N 3.31Å; L431-M481 HydrophobicContact CD2-SD 3.72Å; L431-M481 HydrophobicContact CG-SD 4.05Å
432V93.9Very high93.7Very high77 Ų7742.4 Ų42.447%0.46722%0.221SC..Hα-helixtrans-65-45.3179.3173.50000110.8V428 W429 F434 M435 F436V428-V432 HydrophobicContact CG1-CG2 4.44Å; V428-V432 WeakPolarHBondContact O-CG2 3.42Å; V428-V432 PolarHBondContact O-N 3.46Å; W429-V432 PolarHBondContact O-N 3.41Å; V432-F434 PolarHBondContact O-N 2.99Å; V432-M435 HydrophobicContact CG2-CE 4.32Å; V432-M435 PolarHBondContact O-N 3.38Å; V432-F436 WeakPolarHBondContact O-CB 3.09Å; V432-F436 PolarHBondContact O-N 3Å
433G95.1Very high94.3Very high6 Ų638.7 Ų38.76%0.06222%0.218CC..Hα-helixtrans-60.9-44.4176.400000112.4W429 W430 F436 L437W429-G433 PolarHBondContact O-N 3.14Å; W430-G433 PolarHBondContact O-N 2.92Å; G433-F436 PolarHBondContact O-N 3.46Å; G433-L437 WeakPolarHBondContact O-CB 3.48Å; G433-L437 WeakPolarHBondContact O-CG 3.48Å; G433-L437 PolarHBondContact O-N 3.38Å
434F96.2Very high94.9Very high0 Ų034.6 Ų34.60%019%0.193CC..Hα-helixtrans-57.7-54.7173.7169.1-93.9000111.2I336 F340 V343 W412 W430 L431 V432 F436 L437 F438 G474 M481I336-F434 HydrophobicContact CD1-CE2 4.18Å; I336-F434 HydrophobicContact CD1-CZ 4.46Å; F340-F434 AromaticContact CD1-CZ 3.96Å; F340-F434 HydrophobicContact CD1-CZ 3.96Å; F340-F434 AromaticContact CE1-CZ 3.88Å; F340-F434 HydrophobicContact CE1-CZ 3.88Å; V343-F434 HydrophobicContact CB-CE1 4.42Å; V343-F434 HydrophobicContact CG1-CD1 4.36Å; V343-F434 HydrophobicContact CG1-CE1 4.2Å; V343-F434 HydrophobicContact CG2-CD1 3.97Å; V343-F434 HydrophobicContact CG2-CE1 3.78Å; V343-F434 HydrophobicContact CG2-CZ 4.15Å; W412-F434 HydrophobicContact CE3-CE1 4.33Å; W412-F434 HydrophobicContact CH2-CE1 4.08Å; W412-F434 AromaticContact CZ3-CE1 3.69Å; W412-F434 HydrophobicContact CZ3-CE1 3.69Å; W412-F434 HydrophobicContact CZ3-CZ 4.48Å; W430-F434 WeakPolarHBondContact O-CB 3.32Å; W430-F434 PolarHBondContact O-N 3.09Å; L431-F434 PolarHBondContact O-N 3.13Å; V432-F434 PolarHBondContact O-N 2.99Å; F434-F436 VanDerWaalsContact C-N 3.3Å; F434-F436 PolarHBondContact O-N 2.67Å; F434-L437 PolarHBondContact O-N 3.24Å; F434-F438 HydrophobicContact CE2-CD2 4.43Å; F434-F438 HydrophobicContact CZ-CG 4.34Å; F434-F438 WeakPolarHBondContact O-CB 3.27Å; F434-F438 PolarHBondContact O-N 3.43Å; F434-G474 WeakPolarHBondContact CE2-O 3.5Å; F434-M481 HydrophobicContact CB-CE 3.81Å; F434-M481 HydrophobicContact CD1-CE 4.4Å; F434-M481 HydrophobicContact CD2-CE 3.97Å; F434-M481 HydrophobicContact CG-CE 3.8Å
435M95.7Very high95.2Very high8 Ų830 Ų304%0.03917%0.173CC..Hα-helixtrans-60.5-41.2-177.7-70.5-177.4-66.100111.8W412 L413 L416 L431 V432 T439W412-M435 HydrophobicContact CB-SD 3.72Å; W412-M435 HydrophobicContact CE3-CG 4.1Å; W412-M435 HydrophobicContact CE3-SD 4.45Å; L413-M435 HydrophobicContact CD2-CE 3.92Å; L413-M435 HydrophobicContact CD2-SD 3.87Å; L413-M435 HydrophobicContact CG-SD 4.11Å; L416-M435 HydrophobicContact CD1-CE 3.34Å; L416-M435 HydrophobicContact CD1-SD 4.13Å; L431-M435 WeakPolarHBondContact O-CE 3.41Å; L431-M435 WeakPolarHBondContact O-CG 3.26Å; L431-M435 PolarHBondContact O-N 3.31Å; V432-M435 HydrophobicContact CG2-CE 4.32Å; V432-M435 PolarHBondContact O-N 3.38Å; M435-T439 VanDerWaalsContact O-CB 3.26Å; M435-T439 WeakPolarHBondContact O-CB 3.48Å; M435-T439 PolarHBondContact O-N 3.39Å; M435-T439 VanDerWaalsContact O-N 3.09Å; M435-T439 PolarHBondContact O-OG1 2.96Å
436F94.4Very high95.4Very high131 Ų13131.2 Ų31.258%0.57518%0.182SC*.Hα-helixtrans-65.3-55.6178.9175.7-105.2000111.7V432 G433 F434 T439 V440V432-F436 WeakPolarHBondContact O-CB 3.09Å; V432-F436 PolarHBondContact O-N 3Å; G433-F436 PolarHBondContact O-N 3.46Å; F434-F436 VanDerWaalsContact C-N 3.3Å; F434-F436 PolarHBondContact O-N 2.67Å; F436-T439 WeakPolarHBondContact O-CB 3.32Å; F436-T439 PolarHBondContact O-N 2.89Å; F436-T439 VanDerWaalsContact O-N 3.16Å; F436-V440 HydrophobicContact CE1-CG2 4.27Å; F436-V440 HydrophobicContact CE2-CG2 4.38Å; F436-V440 HydrophobicContact CZ-CG2 4.13Å; F436-V440 WeakPolarHBondContact O-CG2 3.49Å; F436-V440 PolarHBondContact O-N 2.91Å
437L94.8Very high95.5Very high2 Ų232.2 Ų32.21%0.0119%0.191CC..Hα-helixtrans-70.7-37.1-174.4-63.2174.2000112.3G433 F434 T439 V440 G441 Y469 L473 M508 N512G433-L437 WeakPolarHBondContact O-CB 3.48Å; G433-L437 WeakPolarHBondContact O-CG 3.48Å; G433-L437 PolarHBondContact O-N 3.38Å; F434-L437 PolarHBondContact O-N 3.24Å; L437-T439 VanDerWaalsContact C-N 3.26Å; L437-T439 PolarHBondContact O-N 3.4Å; L437-V440 PolarHBondContact O-N 3.48Å; L437-G441 PolarHBondContact O-N 2.89Å; L437-Y469 HydrophobicContact CB-CD1 4.37Å; L437-Y469 HydrophobicContact CD2-CD1 4.47Å; L437-Y469 HydrophobicContact CD2-CE1 3.79Å; L437-L473 HydrophobicContact CB-CB 3.93Å; L437-L473 HydrophobicContact CB-CD1 4.1Å; L437-L473 HydrophobicContact CB-CG 4.43Å; L437-L473 HydrophobicContact CD1-CB 4.3Å; L437-L473 HydrophobicContact CD1-CD1 3.91Å; L437-L473 HydrophobicContact CD1-CD2 3.48Å; L437-L473 VanDerWaalsContact CD1-CD2 3.48Å; L437-L473 HydrophobicContact CD1-CG 4.09Å; L437-L473 HydrophobicContact CD2-CD1 4.32Å; L437-L473 HydrophobicContact CG-CD1 4.33Å; L437-M508 HydrophobicContact CD1-CE 4.45Å; L437-M508 HydrophobicContact CD1-SD 3.4Å; L437-M508 WeakPolarHBondContact CD1-SD 3.09Å; L437-N512 WeakPolarHBondContact CD2-ND2 3.36Å; L437-N512 WeakPolarHBondContact CD2-OD1 3.19Å
438F95.7Very high95.6Very high14 Ų1432.8 Ų32.86%0.06119%0.194CC..Hα-helixtrans-61.9-37.5172.3-169.1-98.4000111.5I336 F340 T405 F434 G441 G442 V470I336-F438 HydrophobicContact CD1-CD2 4.29Å; I336-F438 HydrophobicContact CD1-CE2 3.83Å; I336-F438 HydrophobicContact CG1-CE2 3.79Å; I336-F438 HydrophobicContact CG1-CZ 4.1Å; F340-F438 HydrophobicContact CE1-CD1 4.31Å; F340-F438 AromaticContact CE1-CE1 3.76Å; F340-F438 HydrophobicContact CE1-CE1 3.76Å; F340-F438 HydrophobicContact CE1-CE2 4.23Å; F340-F438 AromaticContact CE1-CZ 3.73Å; F340-F438 HydrophobicContact CE1-CZ 3.73Å; F340-F438 HydrophobicContact CZ-CD1 4.47Å; F340-F438 AromaticContact CZ-CE1 3.51Å; F340-F438 HydrophobicContact CZ-CE1 3.51Å; F340-F438 HydrophobicContact CZ-CE2 4.23Å; F340-F438 AromaticContact CZ-CZ 3.38Å; F340-F438 HydrophobicContact CZ-CZ 3.38Å; T405-F438 HydrophobicContact CG2-CD1 4.38Å; T405-F438 HydrophobicContact CG2-CE1 3.62Å; F434-F438 HydrophobicContact CE2-CD2 4.43Å; F434-F438 HydrophobicContact CZ-CG 4.34Å; F434-F438 WeakPolarHBondContact O-CB 3.27Å; F434-F438 PolarHBondContact O-N 3.43Å; F438-G441 PolarHBondContact O-N 3.14Å; F438-G442 PolarHBondContact O-N 3.13Å; F438-V470 HydrophobicContact CE2-CG1 4.04Å
439T95.3Very high95.8Very high61 Ų6132.3 Ų32.337%0.37419%0.191SC..Hα-helixtrans-66.2-41.2174-59.20000111.9M435 F436 L437 G441 G442 V443M435-T439 VanDerWaalsContact O-CB 3.26Å; M435-T439 WeakPolarHBondContact O-CB 3.48Å; M435-T439 PolarHBondContact O-N 3.39Å; M435-T439 VanDerWaalsContact O-N 3.09Å; M435-T439 PolarHBondContact O-OG1 2.96Å; F436-T439 WeakPolarHBondContact O-CB 3.32Å; F436-T439 PolarHBondContact O-N 2.89Å; F436-T439 VanDerWaalsContact O-N 3.16Å; L437-T439 VanDerWaalsContact C-N 3.26Å; L437-T439 PolarHBondContact O-N 3.4Å; T439-G441 VanDerWaalsContact C-N 3.32Å; T439-G441 PolarHBondContact O-N 2.96Å; T439-G442 WeakPolarHBondContact O-CA 3.34Å; T439-G442 PolarHBondContact O-N 3.44Å; T439-G442 VanDerWaalsContact O-N 3.09Å; T439-V443 WeakPolarHBondContact O-CG2 3.3Å; T439-V443 PolarHBondContact O-N 3.03Å
440V95.7Very high95.8Very high37 Ų3730.7 Ų30.722%0.22419%0.191CC..Hα-helixtrans-59.8-43.8173.3174.20000111F436 L437 G442 V443 T444 Y469F436-V440 HydrophobicContact CE1-CG2 4.27Å; F436-V440 HydrophobicContact CE2-CG2 4.38Å; F436-V440 HydrophobicContact CZ-CG2 4.13Å; F436-V440 WeakPolarHBondContact O-CG2 3.49Å; F436-V440 PolarHBondContact O-N 2.91Å; L437-V440 PolarHBondContact O-N 3.48Å; V440-G442 VanDerWaalsContact C-N 3.32Å; V440-G442 PolarHBondContact O-N 2.93Å; V440-V443 PolarHBondContact O-N 2.88Å; V440-T444 WeakPolarHBondContact O-CG2 3.36Å; V440-T444 PolarHBondContact O-N 3.08Å; V440-T444 VanDerWaalsContact O-N 3.09Å; V440-T444 PolarHBondContact O-OG1 3.45Å; V440-Y469 HydrophobicContact CB-CD1 4.08Å; V440-Y469 HydrophobicContact CB-CE1 4.16Å; V440-Y469 HydrophobicContact CG1-CD1 3.88Å; V440-Y469 HydrophobicContact CG1-CE1 3.75Å
441G96.1Very high95.8Very high0 Ų032.3 Ų32.30%020%0.202CC..Hα-helixtrans-59-41.3171.400000112.7L437 F438 T439 T444 G445 H466L437-G441 PolarHBondContact O-N 2.89Å; F438-G441 PolarHBondContact O-N 3.14Å; T439-G441 VanDerWaalsContact C-N 3.32Å; T439-G441 PolarHBondContact O-N 2.96Å; G441-T444 WeakPolarHBondContact CA-OG1 3.36Å; G441-T444 PolarHBondContact O-N 2.87Å; G441-T444 PolarHBondContact O-OG1 3.2Å; G441-G445 PolarHBondContact O-N 2.75Å; G441-H466 PolarHBondContact O-CE1 3.22Å; G441-H466 PolarHBondContact O-ND1 2.91Å
442G95Very high95.7Very high33 Ų3335.5 Ų35.534%0.3423%0.228SC..Hα-helixtrans-61.9-44.9175.100000113.3F438 T439 V440 G445 V446F438-G442 PolarHBondContact O-N 3.13Å; T439-G442 WeakPolarHBondContact O-CA 3.34Å; T439-G442 PolarHBondContact O-N 3.44Å; T439-G442 VanDerWaalsContact O-N 3.09Å; V440-G442 VanDerWaalsContact C-N 3.32Å; V440-G442 PolarHBondContact O-N 2.93Å; G442-G445 WeakPolarHBondContact O-CA 3.35Å; G442-G445 PolarHBondContact O-N 2.93Å; G442-G445 VanDerWaalsContact O-N 3.14Å; G442-V446 PolarHBondContact O-N 3.25Å
443V95.7Very high95.8Very high97 Ų9735.5 Ų35.559%0.58823%0.225SC*.Hα-helixtrans-63.3-43178.5172.50000111.4T439 V440 G445 V446 A447T439-V443 WeakPolarHBondContact O-CG2 3.3Å; T439-V443 PolarHBondContact O-N 3.03Å; V440-V443 PolarHBondContact O-N 2.88Å; V443-G445 VanDerWaalsContact C-N 3.26Å; V443-G445 PolarHBondContact O-N 3.26Å; V443-V446 WeakPolarHBondContact O-CB 3.47Å; V443-V446 PolarHBondContact O-N 3.37Å; V443-V446 VanDerWaalsContact O-N 3.14Å; V443-A447 PolarHBondContact O-N 2.99Å
444T96.7Very high95.9Very high18 Ų1835.5 Ų35.511%0.1122%0.224CC..Hα-helixtrans-67-29.7175.455.10000112V440 G441 V446 A447 L448 F462 H466 H519V440-T444 WeakPolarHBondContact O-CG2 3.36Å; V440-T444 PolarHBondContact O-N 3.08Å; V440-T444 VanDerWaalsContact O-N 3.09Å; V440-T444 PolarHBondContact O-OG1 3.45Å; G441-T444 WeakPolarHBondContact CA-OG1 3.36Å; G441-T444 PolarHBondContact O-N 2.87Å; G441-T444 PolarHBondContact O-OG1 3.2Å; T444-V446 VanDerWaalsContact C-N 3.34Å; T444-A447 WeakPolarHBondContact O-CB 3.37Å; T444-A447 PolarHBondContact O-N 3.36Å; T444-L448 PolarHBondContact O-N 2.64Å; T444-L448 VanDerWaalsContact O-N 3.09Å; T444-F462 HydrophobicContact CG2-CZ 4.28Å; T444-H466 PolarHBondContact OG1-ND1 2.73Å; T444-H519 WeakPolarHBondContact CG2-NE2 3.28Å
445G96.5Very high95.8Very high18 Ų1841.3 Ų41.319%0.18625%0.252CS..Hα-helixtrans-65.1-34.1170.800000113.5G441 G442 V443 A447 L448 S449 H466G441-G445 PolarHBondContact O-N 2.75Å; G442-G445 WeakPolarHBondContact O-CA 3.35Å; G442-G445 PolarHBondContact O-N 2.93Å; G442-G445 VanDerWaalsContact O-N 3.14Å; V443-G445 VanDerWaalsContact C-N 3.26Å; V443-G445 PolarHBondContact O-N 3.26Å; G445-A447 VanDerWaalsContact C-N 3.32Å; G445-L448 PolarHBondContact O-N 3.1Å; G445-S449 WeakPolarHBondContact O-CB 3.46Å; G445-S449 PolarHBondContact O-N 2.86Å; G445-H466 WeakPolarHBondContact CA-CE1 3.42Å; G445-H466 PolarHBondContact N-CE1 3.44Å; G445-H466 PolarHBondContact N-ND1 2.91Å
446V96.1Very high95.8Very high71 Ų7146.5 Ų46.543%0.4328%0.279SS..Hα-helixtrans-64.1-40172.3178.20000110.5G442 V443 T444 S449 A450G442-V446 PolarHBondContact O-N 3.25Å; V443-V446 WeakPolarHBondContact O-CB 3.47Å; V443-V446 PolarHBondContact O-N 3.37Å; V443-V446 VanDerWaalsContact O-N 3.14Å; T444-V446 VanDerWaalsContact C-N 3.34Å; V446-S449 WeakPolarHBondContact CA-OG 3.28Å; V446-S449 PolarHBondContact O-N 3.47Å; V446-S449 PolarHBondContact O-OG 3.41Å; V446-A450 PolarHBondContact O-N 3.27Å
447A96.7Very high95.9Very high26 Ų2641.3 Ų41.322%0.21526%0.257CS..Hα-helixtrans-62.6-46.2175.400000112V443 T444 G445 S449 A450 L453 F457 F462V443-A447 PolarHBondContact O-N 2.99Å; T444-A447 WeakPolarHBondContact O-CB 3.37Å; T444-A447 PolarHBondContact O-N 3.36Å; G445-A447 VanDerWaalsContact C-N 3.32Å; A447-S449 VanDerWaalsContact C-N 3.28Å; A447-S449 PolarHBondContact O-N 2.92Å; A447-A450 PolarHBondContact O-N 3.01Å; A447-L453 HydrophobicContact CB-CD1 4.48Å; A447-F457 HydrophobicContact CB-CE2 4.34Å; A447-F462 HydrophobicContact CB-CZ 4.31Å
448L97.6Very high96.1Very high18 Ų1842.7 Ų42.79%0.09426%0.263CS..Hα-helixtrans-67.8-25.8176.8-70.5172.3000113.5T444 G445 A450 D454 F457 F462 V463 H466T444-L448 PolarHBondContact O-N 2.64Å; T444-L448 VanDerWaalsContact O-N 3.09Å; G445-L448 PolarHBondContact O-N 3.1Å; L448-A450 PolarHBondContact O-N 2.7Å; L448-D454 VanDerWaalsContact CD2-OD1 3.22Å; L448-D454 WeakPolarHBondContact CD2-OD1 3.24Å; L448-F457 HydrophobicContact CD2-CB 3.71Å; L448-F457 HydrophobicContact CD2-CD2 4.28Å; L448-F457 HydrophobicContact CD2-CG 4.49Å; L448-F462 HydrophobicContact CD1-CD1 4.11Å; L448-F462 HydrophobicContact CD1-CE1 4.2Å; L448-F462 HydrophobicContact CD2-CD1 3.71Å; L448-F462 HydrophobicContact CD2-CE1 4.05Å; L448-F462 HydrophobicContact CG-CD1 3.9Å; L448-F462 HydrophobicContact CG-CE1 3.82Å; L448-V463 HydrophobicContact CD1-CG2 4.26Å; L448-V463 HydrophobicContact CD2-CG2 3.77Å; L448-H466 HydrophobicContact CD1-CB 3.6Å; L448-H466 VanDerWaalsContact CD1-CD2 3.44Å; L448-H466 WeakPolarHBondContact CD1-CD2 3.5Å; L448-H466 VanDerWaalsContact CD1-CG 3.44Å
449S97.2Very high96.1Very high3 Ų345 Ų452%0.02128%0.276CS..Hα-helixtrans-70.2-20.5175.973.20000113S395 T398 M399 G445 V446 A447 S451S395-S449 WeakPolarHBondContact CA-O 3.15Å; S395-S449 WeakPolarHBondContact CB-O 3.12Å; S395-S449 PolarHBondContact OG-O 3.09Å; T398-S449 VanDerWaalsContact CG2-CB 3.44Å; M399-S449 WeakPolarHBondContact CG-OG 3.42Å; G445-S449 WeakPolarHBondContact O-CB 3.46Å; G445-S449 PolarHBondContact O-N 2.86Å; V446-S449 WeakPolarHBondContact CA-OG 3.28Å; V446-S449 PolarHBondContact O-N 3.47Å; V446-S449 PolarHBondContact O-OG 3.41Å; A447-S449 VanDerWaalsContact C-N 3.28Å; A447-S449 PolarHBondContact O-N 2.92Å; S449-S451 PolarHBondContact O-N 3.16Å
450A96.6Very high96.2Very high25 Ų2542.5 Ų42.521%0.20726%0.261CS..SBendtrans-83107.5177.200000109.9V446 A447 L448 A452 L453 D454V446-A450 PolarHBondContact O-N 3.27Å; A447-A450 PolarHBondContact O-N 3.01Å; L448-A450 PolarHBondContact O-N 2.7Å; A450-A452 PolarHBondContact O-N 3.19Å; A450-L453 HydrophobicContact CB-CB 4.27Å; A450-L453 HydrophobicContact CB-CD1 4.21Å; A450-L453 HydrophobicContact CB-CG 4.3Å; A450-L453 PolarHBondContact O-N 3.23Å; A450-D454 PolarHBondContact O-N 2.76Å
451S95.4Very high96.3Very high33 Ų3341.4 Ų41.423%0.23125%0.253CS..Hα-helixtrans-51.8-34-17960.90000113.8S395 S449 M455S395-S451 VanDerWaalsContact OG-CB 3.29Å; S395-S451 WeakPolarHBondContact OG-CB 3.45Å; S395-S451 PolarHBondContact OG-N 3.17Å; S395-S451 VanDerWaalsContact OG-N 3.08Å; S395-S451 PolarHBondContact OG-OG 3.48Å; S449-S451 PolarHBondContact O-N 3.16Å; S451-M455 WeakPolarHBondContact O-CG 3.47Å; S451-M455 PolarHBondContact O-N 3.26Å
452A94.1Very high96.4Very high67 Ų6742 Ų4255%0.55426%0.255SS*.Hα-helixtrans-66.9-36.8177.900000113.8A450 M455A450-A452 PolarHBondContact O-N 3.19Å; A452-M455 HydrophobicContact CB-CE 4.5Å; A452-M455 WeakPolarHBondContact O-CE 3.29Å
453L95.9Very high96.5Very high77 Ų7741.6 Ų41.640%0.40325%0.246SC..Hα-helixtrans-81.9-36.9175.8-69.1177.6000111A447 A450 M455 L456 F457A447-L453 HydrophobicContact CB-CD1 4.48Å; A450-L453 HydrophobicContact CB-CB 4.27Å; A450-L453 HydrophobicContact CB-CD1 4.21Å; A450-L453 HydrophobicContact CB-CG 4.3Å; A450-L453 PolarHBondContact O-N 3.23Å; L453-M455 PolarHBondContact O-N 2.83Å; L453-L456 WeakPolarHBondContact O-CB 3.17Å; L453-L456 PolarHBondContact O-N 2.92Å; L453-F457 HydrophobicContact CB-CD2 4.27Å; L453-F457 HydrophobicContact CB-CE2 3.97Å; L453-F457 PolarHBondContact O-N 2.99Å
454D96.5Very high96.5Very high6 Ų638.7 Ų38.73%0.03223%0.229CC..Hα-helixtrans-61.3-27.7-180-163.458.7000111.6F382 L448 A450 L456 F457 H458F382-D454 HydrophobicContact CD2-CB 3.66Å; F382-D454 WeakPolarHBondContact CD2-OD2 3.43Å; F382-D454 HydrophobicContact CE2-CB 4.33Å; L448-D454 VanDerWaalsContact CD2-OD1 3.22Å; L448-D454 WeakPolarHBondContact CD2-OD1 3.24Å; A450-D454 PolarHBondContact O-N 2.76Å; D454-L456 PolarHBondContact O-N 3.28Å; D454-F457 CarbonylContact O-C 3.24Å; D454-F457 PolarHBondContact O-N 3.45Å; D454-H458 WeakPolarHBondContact O-CA 3.38Å; D454-H458 WeakPolarHBondContact O-CB 3.37Å; D454-H458 PolarHBondContact O-N 3.39Å; D454-H458 IonicContact OD2-CE1 2.9Å; D454-H458 IonicContact OD2-CG 3.82Å; D454-H458 IonicContact OD2-ND1 2.76Å; D454-H458 PolarHBondContact OD2-ND1 3.28Å
455M94Very high96.6Very high122 Ų12237.9 Ų37.960%0.60122%0.223SC*.Hα-helixtrans-51.7-30170.1-70.8-170.1-72.100114.3M383 S451 A452 L453M383-M455 HydrophobicContact SD-CB 4.29Å; M383-M455 HydrophobicContact SD-CG 4.09Å; S451-M455 WeakPolarHBondContact O-CG 3.47Å; S451-M455 PolarHBondContact O-N 3.26Å; A452-M455 HydrophobicContact CB-CE 4.5Å; A452-M455 WeakPolarHBondContact O-CE 3.29Å; L453-M455 PolarHBondContact O-N 2.83Å
456L95.7Very high96.6Very high117 Ų11738.8 Ų38.861%0.61322%0.223SC*.Hα-helixtrans-90.3-30.6176.7-60.1173.7000112.5L453 D454L453-L456 WeakPolarHBondContact O-CB 3.17Å; L453-L456 PolarHBondContact O-N 2.92Å; D454-L456 PolarHBondContact O-N 3.28Å
457F97.5Very high96.6Very high22 Ų2237.9 Ų37.910%0.09621%0.213CC..Hα-helixtrans-98.1-15.7-172.8-56-26.7000113.5A447 L448 L453 D454 D459 T460 F462 V463 M523A447-F457 HydrophobicContact CB-CE2 4.34Å; L448-F457 HydrophobicContact CD2-CB 3.71Å; L448-F457 HydrophobicContact CD2-CD2 4.28Å; L448-F457 HydrophobicContact CD2-CG 4.49Å; L453-F457 HydrophobicContact CB-CD2 4.27Å; L453-F457 HydrophobicContact CB-CE2 3.97Å; L453-F457 PolarHBondContact O-N 2.99Å; D454-F457 CarbonylContact O-C 3.24Å; D454-F457 PolarHBondContact O-N 3.45Å; F457-D459 PolarHBondContact O-N 2.9Å; F457-T460 WeakPolarHBondContact O-CB 3.3Å; F457-T460 WeakPolarHBondContact O-CG2 3.41Å; F457-T460 PolarHBondContact O-N 2.75Å; F457-T460 PolarHBondContact O-OG1 3.48Å; F457-F462 HydrophobicContact CB-CB 4.13Å; F457-F462 HydrophobicContact CB-CD1 4.21Å; F457-F462 HydrophobicContact CB-CG 4.18Å; F457-F462 HydrophobicContact CD1-CD2 4.3Å; F457-F462 HydrophobicContact CD1-CG 4.36Å; F457-F462 HydrophobicContact CD2-CD1 4.22Å; F457-F462 HydrophobicContact CD2-CE1 4.19Å; F457-F462 HydrophobicContact CD2-CE2 4.49Å; F457-F462 HydrophobicContact CD2-CG 4.39Å; F457-F462 HydrophobicContact CD2-CZ 4.32Å; F457-F462 HydrophobicContact CE2-CE2 4.35Å; F457-F462 HydrophobicContact CE2-CZ 4.28Å; F457-F462 HydrophobicContact CG-CB 4.4Å; F457-F462 HydrophobicContact CG-CD1 4.23Å; F457-F462 HydrophobicContact CG-CD2 4.33Å; F457-F462 HydrophobicContact CG-CG 4.06Å; F457-F462 HydrophobicContact CZ-CE2 4.45Å; F457-V463 WeakPolarHBondContact O-CG2 3.42Å; F457-M523 HydrophobicContact CD1-CG 4.41Å; F457-M523 HydrophobicContact CE1-CB 4.34Å; F457-M523 HydrophobicContact CE1-CG 3.72Å; F457-M523 HydrophobicContact CZ-CG 4.23Å
458H97.4Very high96.6Very high31 Ų3138.4 Ų38.414%0.14421%0.211CC..THydrogen-bonded Turntrans-57.5134.9-174.4-158.782.4000110.5H380 M383 D454 T460H380-H458 PolarHBondContact O-CE1 2.71Å; M383-H458 HydrophobicContact CG-CB 3.5Å; M383-H458 VanDerWaalsContact CG-CB 3.5Å; M383-H458 WeakPolarHBondContact CG-CD2 3.4Å; M383-H458 HydrophobicContact SD-CB 4.5Å; D454-H458 WeakPolarHBondContact O-CA 3.38Å; D454-H458 WeakPolarHBondContact O-CB 3.37Å; D454-H458 PolarHBondContact O-N 3.39Å; D454-H458 IonicContact OD2-CE1 2.9Å; D454-H458 IonicContact OD2-CG 3.82Å; D454-H458 IonicContact OD2-ND1 2.76Å; D454-H458 PolarHBondContact OD2-ND1 3.28Å; H458-T460 WeakPolarHBondContact O-CG2 3.28Å; H458-T460 PolarHBondContact O-N 3.14Å
459D96.1Very high96.5Very high64 Ų6437.5 Ų37.534%0.34221%0.207SC..THydrogen-bonded Turntrans55.516.1-178.7-75.9-45.5000115.6F457 R528F457-D459 PolarHBondContact O-N 2.9Å; D459-R528 WeakPolarHBondContact O-CG 3.16Å; D459-R528 PolarHBondContact O-N 2.62Å; D459-R528 IonicContact OD1-CZ 3.71Å; D459-R528 IonicContact OD1-NE 2.94Å; D459-R528 PolarHBondContact OD1-NE 3Å; D459-R528 IonicContact OD1-NH2 3.79Å; D459-R528 PolarHBondContact OD1-NH2 3.47Å
460T97.7Very high96.4Very high8 Ų838.4 Ų38.45%0.04921%0.212CC..BIsolated β-bridgetrans-95.8176.7176.273.50000112.5F457 H458 F462 V463 G522 L526F457-T460 WeakPolarHBondContact O-CB 3.3Å; F457-T460 WeakPolarHBondContact O-CG2 3.41Å; F457-T460 PolarHBondContact O-N 2.75Å; F457-T460 PolarHBondContact O-OG1 3.48Å; H458-T460 WeakPolarHBondContact O-CG2 3.28Å; H458-T460 PolarHBondContact O-N 3.14Å; T460-F462 PolarHBondContact O-N 3.25Å; T460-F462 VanDerWaalsContact OG1-CB 3.28Å; T460-F462 WeakPolarHBondContact OG1-CB 3.03Å; T460-F462 PolarHBondContact OG1-N 2.98Å; T460-F462 VanDerWaalsContact OG1-N 3.11Å; T460-V463 PolarHBondContact O-N 2.96Å; T460-G522 PolarHBondContact OG1-O 2.97Å; T460-L526 CarbonylContact C-O 3.59Å; T460-L526 VanDerWaalsContact CA-O 3.23Å; T460-L526 WeakPolarHBondContact CA-O 3.21Å; T460-L526 WeakPolarHBondContact CB-O 3.4Å
461W97.2Very high95.9Very high14 Ų1437.7 Ų37.75%0.05321%0.205CC..Hα-helixtrans-62.1-15.7170.8-73.229000113.3L138 V463 V464 A465 M518 L521 L526 P527 N541L138-W461 HydrophobicContact CD1-CH2 4.03Å; L138-W461 HydrophobicContact CD1-CZ2 4.04Å; W461-V463 VanDerWaalsContact C-N 3.32Å; W461-V463 PolarHBondContact O-N 3.46Å; W461-V464 WeakPolarHBondContact O-CB 3.37Å; W461-V464 PolarHBondContact O-N 3.08Å; W461-A465 WeakPolarHBondContact O-CB 3.41Å; W461-A465 PolarHBondContact O-N 2.92Å; W461-M518 CarbonylContact C-O 3.52Å; W461-M518 HydrophobicContact CB-CB 4.37Å; W461-M518 HydrophobicContact CE3-CB 4.39Å; W461-M518 HydrophobicContact CE3-CG 3.96Å; W461-L521 HydrophobicContact CB-CB 4.44Å; W461-L521 HydrophobicContact CD2-CB 4.43Å; W461-L521 HydrophobicContact CE3-CB 3.78Å; W461-L521 HydrophobicContact CE3-CD1 3.46Å; W461-L521 VanDerWaalsContact CE3-CD1 3.46Å; W461-L521 HydrophobicContact CE3-CG 4.25Å; W461-L521 HydrophobicContact CH2-CD1 4.43Å; W461-L521 HydrophobicContact CZ3-CB 4.42Å; W461-L521 HydrophobicContact CZ3-CD1 3.31Å; W461-L521 HydrophobicContact CZ3-CG 4.46Å; W461-L526 HydrophobicContact CD2-CB 4.25Å; W461-L526 HydrophobicContact CD2-CD2 4.49Å; W461-L526 HydrophobicContact CG-CB 4.11Å; W461-L526 HydrophobicContact CH2-CD2 4.4Å; W461-L526 HydrophobicContact CZ2-CD2 4.34Å; W461-L526 PolarHBondContact N-O 3.21Å; W461-P527 PolarHBondContact NE1-O 3.06Å; W461-N541 VanDerWaalsContact CH2-OD1 3.32Å; W461-N541 WeakPolarHBondContact CH2-OD1 3.25Å; W461-N541 VanDerWaalsContact CZ3-OD1 3.23Å; W461-N541 WeakPolarHBondContact CZ3-OD1 3.39Å
462F98.3Very high94.6Very high12 Ų1237 Ų375%0.05320%0.2CC..Hα-helixtrans-62.6-44.8174.8-167.8-78.6000110T444 A447 L448 F457 T460 V464 A465 H466 H519 G522 M523T444-F462 HydrophobicContact CG2-CZ 4.28Å; A447-F462 HydrophobicContact CB-CZ 4.31Å; L448-F462 HydrophobicContact CD1-CD1 4.11Å; L448-F462 HydrophobicContact CD1-CE1 4.2Å; L448-F462 HydrophobicContact CD2-CD1 3.71Å; L448-F462 HydrophobicContact CD2-CE1 4.05Å; L448-F462 HydrophobicContact CG-CD1 3.9Å; L448-F462 HydrophobicContact CG-CE1 3.82Å; F457-F462 HydrophobicContact CB-CB 4.13Å; F457-F462 HydrophobicContact CB-CD1 4.21Å; F457-F462 HydrophobicContact CB-CG 4.18Å; F457-F462 HydrophobicContact CD1-CD2 4.3Å; F457-F462 HydrophobicContact CD1-CG 4.36Å; F457-F462 HydrophobicContact CD2-CD1 4.22Å; F457-F462 HydrophobicContact CD2-CE1 4.19Å; F457-F462 HydrophobicContact CD2-CE2 4.49Å; F457-F462 HydrophobicContact CD2-CG 4.39Å; F457-F462 HydrophobicContact CD2-CZ 4.32Å; F457-F462 HydrophobicContact CE2-CE2 4.35Å; F457-F462 HydrophobicContact CE2-CZ 4.28Å; F457-F462 HydrophobicContact CG-CB 4.4Å; F457-F462 HydrophobicContact CG-CD1 4.23Å; F457-F462 HydrophobicContact CG-CD2 4.33Å; F457-F462 HydrophobicContact CG-CG 4.06Å; F457-F462 HydrophobicContact CZ-CE2 4.45Å; T460-F462 PolarHBondContact O-N 3.25Å; T460-F462 VanDerWaalsContact OG1-CB 3.28Å; T460-F462 WeakPolarHBondContact OG1-CB 3.03Å; T460-F462 PolarHBondContact OG1-N 2.98Å; T460-F462 VanDerWaalsContact OG1-N 3.11Å; F462-V464 VanDerWaalsContact C-N 3.32Å; F462-V464 PolarHBondContact O-N 3.42Å; F462-A465 WeakPolarHBondContact O-CB 3.5Å; F462-A465 PolarHBondContact O-N 3.26Å; F462-H466 WeakPolarHBondContact O-CB 3.32Å; F462-H466 PolarHBondContact O-N 3.16Å; F462-H519 HydrophobicContact CD2-CB 4.18Å; F462-H519 HydrophobicContact CE2-CB 4.23Å; F462-H519 AromaticContact CE2-CD2 3.94Å; F462-G522 VanDerWaalsContact N-CA 3.31Å; F462-M523 HydrophobicContact CD2-CG 3.82Å; F462-M523 HydrophobicContact CE2-CG 4.05Å; F462-M523 HydrophobicContact CE2-SD 4.45Å
463V97.6Very high93.9Very high24 Ų2433.9 Ų33.915%0.14517%0.174CC..Hα-helixtrans-65.9-37.2176.4179.90000110.7L448 F457 T460 W461 F467L448-V463 HydrophobicContact CD1-CG2 4.26Å; L448-V463 HydrophobicContact CD2-CG2 3.77Å; F457-V463 WeakPolarHBondContact O-CG2 3.42Å; T460-V463 PolarHBondContact O-N 2.96Å; W461-V463 VanDerWaalsContact C-N 3.32Å; W461-V463 PolarHBondContact O-N 3.46Å; V463-F467 WeakPolarHBondContact O-CB 3.39Å; V463-F467 PolarHBondContact O-N 2.79Å
464V96.8Very high93.5Very high37 Ų3730.2 Ų30.222%0.22415%0.154CC..Hα-helixtrans-61.1-46.6175.2-179.10000110.4W461 F462 F467 H468 M518 R528W461-V464 WeakPolarHBondContact O-CB 3.37Å; W461-V464 PolarHBondContact O-N 3.08Å; F462-V464 VanDerWaalsContact C-N 3.32Å; F462-V464 PolarHBondContact O-N 3.42Å; V464-F467 PolarHBondContact O-N 2.73Å; V464-H468 PolarHBondContact O-N 3.35Å; V464-H468 VanDerWaalsContact O-N 3.1Å; V464-H468 PolarHBondContact O-ND1 2.89Å; V464-M518 HydrophobicContact CG1-SD 4Å; V464-R528 HydrophobicContact CG2-CB 3.86Å
465A97.9Very high93.4Very high0 Ų029.9 Ų29.90%015%0.153CC..Hα-helixtrans-61.9-54.3178.600000111.4W461 F462 F467 H468 Y469 F515 M518 H519W461-A465 WeakPolarHBondContact O-CB 3.41Å; W461-A465 PolarHBondContact O-N 2.92Å; F462-A465 WeakPolarHBondContact O-CB 3.5Å; F462-A465 PolarHBondContact O-N 3.26Å; A465-F467 VanDerWaalsContact C-N 3.31Å; A465-F467 PolarHBondContact O-N 2.82Å; A465-H468 PolarHBondContact O-N 3.24Å; A465-H468 VanDerWaalsContact O-N 3.16Å; A465-Y469 WeakPolarHBondContact O-CD2 3.23Å; A465-Y469 PolarHBondContact O-N 3.38Å; A465-F515 WeakPolarHBondContact CB-O 2.95Å; A465-M518 HydrophobicContact CB-CB 3.7Å; A465-H519 WeakPolarHBondContact CB-CE1 3.24Å; A465-H519 WeakPolarHBondContact CB-NE2 3.32Å
466H97.4Very high93.4Very high37 Ų3725 Ų2517%0.17113%0.128CC..Hα-helixtrans-51-50.7176.5168.568.8000111.6G441 T444 G445 L448 F462 H468 Y469 V470G441-H466 PolarHBondContact O-CE1 3.22Å; G441-H466 PolarHBondContact O-ND1 2.91Å; T444-H466 PolarHBondContact OG1-ND1 2.73Å; G445-H466 WeakPolarHBondContact CA-CE1 3.42Å; G445-H466 PolarHBondContact N-CE1 3.44Å; G445-H466 PolarHBondContact N-ND1 2.91Å; L448-H466 HydrophobicContact CD1-CB 3.6Å; L448-H466 VanDerWaalsContact CD1-CD2 3.44Å; L448-H466 WeakPolarHBondContact CD1-CD2 3.5Å; L448-H466 VanDerWaalsContact CD1-CG 3.44Å; F462-H466 WeakPolarHBondContact O-CB 3.32Å; F462-H466 PolarHBondContact O-N 3.16Å; H466-H468 VanDerWaalsContact C-N 3.33Å; H466-H468 PolarHBondContact O-N 2.92Å; H466-Y469 PolarHBondContact O-N 3.3Å; H466-V470 PolarHBondContact O-N 2.99Å
467F96Very high93.4Very high52 Ų5219.5 Ų19.523%0.22810%0.099CC..Hα-helixtrans-61.6-39.7-177.8-170.1-117.1000112.5I163 W221 V332 V463 V464 A465 V470 L471I163-F467 HydrophobicContact CD1-CZ 4.21Å; W221-F467 HydrophobicContact CZ2-CZ 4.46Å; V332-F467 HydrophobicContact CG1-CE2 3.71Å; V463-F467 WeakPolarHBondContact O-CB 3.39Å; V463-F467 PolarHBondContact O-N 2.79Å; V464-F467 PolarHBondContact O-N 2.73Å; A465-F467 VanDerWaalsContact C-N 3.31Å; A465-F467 PolarHBondContact O-N 2.82Å; F467-V470 PolarHBondContact O-N 3.38Å; F467-L471 HydrophobicContact CD1-CD1 4.26Å; F467-L471 HydrophobicContact CD2-CD1 4.16Å; F467-L471 HydrophobicContact CD2-CG 4.4Å; F467-L471 HydrophobicContact CE1-CD1 3.57Å; F467-L471 HydrophobicContact CE2-CD1 3.45Å; F467-L471 VanDerWaalsContact CE2-CD1 3.45Å; F467-L471 HydrophobicContact CE2-CG 4.07Å; F467-L471 HydrophobicContact CZ-CD1 3.12Å; F467-L471 HydrophobicContact CZ-CG 4.18Å; F467-L471 PolarHBondContact O-N 3.01Å
468H96.8Very high93.3Very high37 Ų3718.4 Ų18.417%0.1719%0.094CC..Hα-helixtrans-74.7-29.9177.1-72.983.9000112.9H158 V464 A465 H466 V470 S472 L473 F515H158-H468 AromaticContact NE2-NE2 3.87Å; V464-H468 PolarHBondContact O-N 3.35Å; V464-H468 VanDerWaalsContact O-N 3.1Å; V464-H468 PolarHBondContact O-ND1 2.89Å; A465-H468 PolarHBondContact O-N 3.24Å; A465-H468 VanDerWaalsContact O-N 3.16Å; H466-H468 VanDerWaalsContact C-N 3.33Å; H466-H468 PolarHBondContact O-N 2.92Å; H468-V470 VanDerWaalsContact C-N 3.28Å; H468-V470 PolarHBondContact O-N 3.31Å; H468-S472 CarbonylContact O-C 3.27Å; H468-S472 VanDerWaalsContact O-CA 3.31Å; H468-S472 WeakPolarHBondContact O-CA 3.43Å; H468-S472 WeakPolarHBondContact O-CB 3.44Å; H468-S472 PolarHBondContact O-N 3.15Å; H468-L473 PolarHBondContact O-N 3Å; H468-F515 HydrophobicContact CB-CB 4.44Å; H468-F515 HydrophobicContact CB-CD1 3.49Å; H468-F515 VanDerWaalsContact CB-CD1 3.49Å; H468-F515 HydrophobicContact CB-CD2 3.85Å; H468-F515 HydrophobicContact CB-CE1 3.55Å; H468-F515 HydrophobicContact CB-CE2 3.9Å; H468-F515 HydrophobicContact CB-CG 3.66Å; H468-F515 HydrophobicContact CB-CZ 3.76Å; H468-F515 AromaticContact CD2-CE1 3.31Å; H468-F515 WeakPolarHBondContact CD2-CE1 3.39Å; H468-F515 AromaticContact CD2-CZ 3.29Å; H468-F515 WeakPolarHBondContact CD2-CZ 3.39Å; H468-F515 AromaticContact CG-CD1 3.68Å; H468-F515 AromaticContact CG-CE1 3.28Å; H468-F515 AromaticContact CG-CZ 3.62Å; H468-F515 AromaticContact ND1-CE1 3.87Å; H468-F515 AromaticContact NE2-CE1 3.91Å
469Y95.5Very high93.2Very high0 Ų017.2 Ų17.20%09%0.089CC..Hα-helixtrans-64.4-34.2169.3-91.1-100.2000112.5L437 V440 A465 H466 L473 G474 N512 F515 F516 H519L437-Y469 HydrophobicContact CB-CD1 4.37Å; L437-Y469 HydrophobicContact CD2-CD1 4.47Å; L437-Y469 HydrophobicContact CD2-CE1 3.79Å; V440-Y469 HydrophobicContact CB-CD1 4.08Å; V440-Y469 HydrophobicContact CB-CE1 4.16Å; V440-Y469 HydrophobicContact CG1-CD1 3.88Å; V440-Y469 HydrophobicContact CG1-CE1 3.75Å; A465-Y469 WeakPolarHBondContact O-CD2 3.23Å; A465-Y469 PolarHBondContact O-N 3.38Å; H466-Y469 PolarHBondContact O-N 3.3Å; Y469-L473 HydrophobicContact CD1-CD1 3.52Å; Y469-L473 HydrophobicContact CD2-CD1 4.11Å; Y469-L473 HydrophobicContact CE1-CD1 3.6Å; Y469-L473 HydrophobicContact CE2-CD1 4.19Å; Y469-L473 HydrophobicContact CG-CD1 3.79Å; Y469-L473 VanDerWaalsContact O-CB 3.28Å; Y469-L473 WeakPolarHBondContact O-CB 3.23Å; Y469-G474 PolarHBondContact O-N 3.21Å; Y469-N512 PolarHBondContact OH-OD1 3.41Å; Y469-F515 HydrophobicContact CD2-CB 4Å; Y469-F515 HydrophobicContact CE2-CB 3.68Å; Y469-F516 VanDerWaalsContact OH-CB 3.27Å; Y469-F516 WeakPolarHBondContact OH-CB 3.15Å; Y469-F516 WeakPolarHBondContact OH-CD2 3.47Å; Y469-H519 AromaticContact CD2-CE1 3.7Å; Y469-H519 AromaticContact CE2-CE1 3.68Å
470V93.6Very high93.2Very high22 Ų2214.1 Ų14.113%0.1337%0.072CC..Hα-helixtrans-81-49.7177.8178.40000111.8F438 H466 F467 H468 G474 S475F438-V470 HydrophobicContact CE2-CG1 4.04Å; H466-V470 PolarHBondContact O-N 2.99Å; F467-V470 PolarHBondContact O-N 3.38Å; H468-V470 VanDerWaalsContact C-N 3.28Å; H468-V470 PolarHBondContact O-N 3.31Å; V470-G474 WeakPolarHBondContact O-CA 3.41Å; V470-G474 PolarHBondContact O-N 3.48Å; V470-G474 VanDerWaalsContact O-N 3.12Å; V470-S475 PolarHBondContact O-N 3Å
471L85.8Confident93.2Very high10 Ų1013.8 Ų13.85%0.0527%0.07CC..Iπ-helixtrans-88.7-44.5-175.1-69.8-170.2000114.6L167 V332 L335 F467 S475 Y476L167-L471 HydrophobicContact CD1-CB 4.3Å; V332-L471 HydrophobicContact CB-CD2 4.37Å; V332-L471 HydrophobicContact CG1-CD1 4.47Å; V332-L471 HydrophobicContact CG1-CD2 4.36Å; L335-L471 HydrophobicContact CB-CD2 3.94Å; L335-L471 HydrophobicContact CD1-CD1 4.01Å; L335-L471 HydrophobicContact CD1-CD2 3.73Å; F467-L471 HydrophobicContact CD1-CD1 4.26Å; F467-L471 HydrophobicContact CD2-CD1 4.16Å; F467-L471 HydrophobicContact CD2-CG 4.4Å; F467-L471 HydrophobicContact CE1-CD1 3.57Å; F467-L471 HydrophobicContact CE2-CD1 3.45Å; F467-L471 VanDerWaalsContact CE2-CD1 3.45Å; F467-L471 HydrophobicContact CE2-CG 4.07Å; F467-L471 HydrophobicContact CZ-CD1 3.12Å; F467-L471 HydrophobicContact CZ-CG 4.18Å; F467-L471 PolarHBondContact O-N 3.01Å; L471-S475 CarbonylContact O-C 3.47Å; L471-S475 WeakPolarHBondContact O-CA 3.37Å; L471-S475 WeakPolarHBondContact O-CB 3.32Å; L471-S475 PolarHBondContact O-N 3.48Å; L471-Y476 PolarHBondContact O-N 2.94Å
472S69.5Low93.1Very high19 Ų1913.1 Ų13.113%0.1337%0.067CC..Iπ-helixtrans-73.8-53.5176.7-178.40000109.6H468 Y476 S477H468-S472 CarbonylContact O-C 3.27Å; H468-S472 VanDerWaalsContact O-CA 3.31Å; H468-S472 WeakPolarHBondContact O-CA 3.43Å; H468-S472 WeakPolarHBondContact O-CB 3.44Å; H468-S472 PolarHBondContact O-N 3.15Å; S472-Y476 WeakPolarHBondContact O-CA 3.26Å; S472-Y476 WeakPolarHBondContact O-CB 3.44Å; S472-Y476 PolarHBondContact O-N 3.2Å; S472-S477 PolarHBondContact O-N 2.99Å
473L79.7Confident92.9Very high0 Ų013.2 Ų13.20%07%0.069CC..Iπ-helixtrans-79.2-25.2-175.8-68.6170.4000114L437 H468 Y469 S477 F511L437-L473 HydrophobicContact CB-CB 3.93Å; L437-L473 HydrophobicContact CB-CD1 4.1Å; L437-L473 HydrophobicContact CB-CG 4.43Å; L437-L473 HydrophobicContact CD1-CB 4.3Å; L437-L473 HydrophobicContact CD1-CD1 3.91Å; L437-L473 HydrophobicContact CD1-CD2 3.48Å; L437-L473 VanDerWaalsContact CD1-CD2 3.48Å; L437-L473 HydrophobicContact CD1-CG 4.09Å; L437-L473 HydrophobicContact CD2-CD1 4.32Å; L437-L473 HydrophobicContact CG-CD1 4.33Å; H468-L473 PolarHBondContact O-N 3Å; Y469-L473 HydrophobicContact CD1-CD1 3.52Å; Y469-L473 HydrophobicContact CD2-CD1 4.11Å; Y469-L473 HydrophobicContact CE1-CD1 3.6Å; Y469-L473 HydrophobicContact CE2-CD1 4.19Å; Y469-L473 HydrophobicContact CG-CD1 3.79Å; Y469-L473 VanDerWaalsContact O-CB 3.28Å; Y469-L473 WeakPolarHBondContact O-CB 3.23Å; L473-S477 WeakPolarHBondContact O-CB 3.16Å; L473-S477 PolarHBondContact O-OG 3.26Å; L473-F511 HydrophobicContact CD1-CB 4.11Å; L473-F511 HydrophobicContact CD2-CB 3.36Å; L473-F511 HydrophobicContact CD2-CD2 3.16Å; L473-F511 HydrophobicContact CD2-CE2 4.08Å; L473-F511 HydrophobicContact CD2-CG 3.51Å; L473-F511 HydrophobicContact CG-CB 4Å; L473-F511 HydrophobicContact CG-CD2 4.37Å; L473-F511 HydrophobicContact CG-CG 4.36Å
474G87.3Confident92.8Very high0 Ų012.8 Ų12.80%07%0.066CC..Iπ-helixtrans-86-73.8169.400000112.4F434 Y469 V470 S477 S478F434-G474 WeakPolarHBondContact CE2-O 3.5Å; Y469-G474 PolarHBondContact O-N 3.21Å; V470-G474 WeakPolarHBondContact O-CA 3.41Å; V470-G474 PolarHBondContact O-N 3.48Å; V470-G474 VanDerWaalsContact O-N 3.12Å; G474-S477 PolarHBondContact O-N 3.45Å; G474-S478 WeakPolarHBondContact O-CB 3.49Å; G474-S478 PolarHBondContact O-N 3.25Å
475S92.7Very high92.7Very high0 Ų014.3 Ų14.30%07%0.068CC..Iπ-helixtrans-65.7-43.1-171.4-60.30000113.7L335 V470 L471 S478 M479L335-S475 WeakPolarHBondContact O-CB 3.24Å; L335-S475 PolarHBondContact O-OG 2.99Å; V470-S475 PolarHBondContact O-N 3Å; L471-S475 CarbonylContact O-C 3.47Å; L471-S475 WeakPolarHBondContact O-CA 3.37Å; L471-S475 WeakPolarHBondContact O-CB 3.32Å; L471-S475 PolarHBondContact O-N 3.48Å; S475-S478 WeakPolarHBondContact O-CB 3.22Å; S475-S478 PolarHBondContact O-N 3.17Å; S475-S478 PolarHBondContact O-OG 3.38Å; S475-M479 PolarHBondContact O-N 3.07Å
476Y94.9Very high92.5Very high20 Ų2015.3 Ų15.38%0.0787%0.071CC..Iπ-helixtrans-68.4-42.5176.4159.1-80.8000112.6F166 L471 S472 S478 M479 V480 F511F166-Y476 HydrophobicContact CE1-CD2 4.03Å; F166-Y476 AromaticContact CZ-CD2 3.78Å; F166-Y476 HydrophobicContact CZ-CD2 3.78Å; F166-Y476 HydrophobicContact CZ-CE2 4.33Å; L471-Y476 PolarHBondContact O-N 2.94Å; S472-Y476 WeakPolarHBondContact O-CA 3.26Å; S472-Y476 WeakPolarHBondContact O-CB 3.44Å; S472-Y476 PolarHBondContact O-N 3.2Å; Y476-S478 PolarHBondContact O-N 2.97Å; Y476-M479 HydrophobicContact CD2-CE 3.52Å; Y476-M479 HydrophobicContact CE2-CE 3.53Å; Y476-M479 HydrophobicContact CG-CE 4.5Å; Y476-M479 WeakPolarHBondContact O-CA 3.44Å; Y476-M479 VanDerWaalsContact O-CB 3.3Å; Y476-M479 WeakPolarHBondContact O-CB 3.29Å; Y476-M479 PolarHBondContact O-N 2.77Å; Y476-V480 HydrophobicContact CD1-CG2 4.25Å; Y476-V480 HydrophobicContact CD2-CG2 4.46Å; Y476-V480 HydrophobicContact CE1-CG2 3.67Å; Y476-V480 HydrophobicContact CE2-CG2 3.95Å; Y476-V480 WeakPolarHBondContact O-CG2 3.44Å; Y476-V480 PolarHBondContact O-N 3.44Å; Y476-F511 AromaticContact CD1-CE2 3.94Å; Y476-F511 HydrophobicContact CD1-CE2 3.94Å; Y476-F511 AromaticContact CD1-CZ 3.72Å; Y476-F511 HydrophobicContact CD1-CZ 3.72Å; Y476-F511 AromaticContact CE1-CE2 3.68Å; Y476-F511 HydrophobicContact CE1-CE2 3.68Å; Y476-F511 AromaticContact CE1-CZ 3.37Å; Y476-F511 HydrophobicContact CE1-CZ 3.37Å
477S95.8Very high92.3Very high0 Ų014.6 Ų14.60%07%0.067CC..Hα-helixtrans-58.7-37.5173-58.90000111.4S472 L473 G474 V480 M481S472-S477 PolarHBondContact O-N 2.99Å; L473-S477 WeakPolarHBondContact O-CB 3.16Å; L473-S477 PolarHBondContact O-OG 3.26Å; G474-S477 PolarHBondContact O-N 3.45Å; S477-V480 PolarHBondContact O-N 3.36Å; S477-M481 WeakPolarHBondContact O-CG 3.26Å; S477-M481 PolarHBondContact O-N 3.39Å
478S95.1Very high92.1Very high0 Ų013.5 Ų13.50%07%0.065CC..Hα-helixtrans-61.3-49.7173.387.40000110.9G339 M342 G474 S475 Y476 V480 M481 M482G339-S478 WeakPolarHBondContact CA-OG 3.39Å; M342-S478 VanDerWaalsContact CE-C 3.4Å; M342-S478 WeakPolarHBondContact CE-O 3.49Å; G474-S478 WeakPolarHBondContact O-CB 3.49Å; G474-S478 PolarHBondContact O-N 3.25Å; S475-S478 WeakPolarHBondContact O-CB 3.22Å; S475-S478 PolarHBondContact O-N 3.17Å; S475-S478 PolarHBondContact O-OG 3.38Å; Y476-S478 PolarHBondContact O-N 2.97Å; S478-V480 VanDerWaalsContact C-N 3.28Å; S478-V480 PolarHBondContact O-N 2.88Å; S478-M481 PolarHBondContact O-N 3.05Å; S478-M481 VanDerWaalsContact O-N 3.08Å; S478-M482 WeakPolarHBondContact O-CB 3.41Å; S478-M482 PolarHBondContact O-N 3.39Å
479M95.4Very high91.8Very high5 Ų516.5 Ų16.53%0.0258%0.078CC..Hα-helixtrans-52.7-45175.2-178.6-155.872.800112.4F166 I170 L171 F175 S475 Y476 M482 L483 L558F166-M479 HydrophobicContact CE2-CE 4.22Å; F166-M479 HydrophobicContact CE2-SD 3.53Å; F166-M479 VanDerWaalsContact CE2-SD 3.53Å; F166-M479 HydrophobicContact CZ-CE 3.86Å; F166-M479 HydrophobicContact CZ-SD 3.54Å; F166-M479 VanDerWaalsContact CZ-SD 3.54Å; I170-M479 HydrophobicContact CB-CG 4.43Å; I170-M479 HydrophobicContact CB-SD 4.39Å; I170-M479 HydrophobicContact CD1-SD 3.55Å; I170-M479 VanDerWaalsContact CD1-SD 3.55Å; I170-M479 HydrophobicContact CG2-CG 3.55Å; I170-M479 HydrophobicContact CG2-SD 3.95Å; L171-M479 HydrophobicContact CD2-CB 3.97Å; F175-M479 HydrophobicContact CE2-CG 4.37Å; S475-M479 PolarHBondContact O-N 3.07Å; Y476-M479 HydrophobicContact CD2-CE 3.52Å; Y476-M479 HydrophobicContact CE2-CE 3.53Å; Y476-M479 HydrophobicContact CG-CE 4.5Å; Y476-M479 WeakPolarHBondContact O-CA 3.44Å; Y476-M479 VanDerWaalsContact O-CB 3.3Å; Y476-M479 WeakPolarHBondContact O-CB 3.29Å; Y476-M479 PolarHBondContact O-N 2.77Å; M479-M482 VanDerWaalsContact O-CB 3.31Å; M479-M482 WeakPolarHBondContact O-CB 3.29Å; M479-M482 PolarHBondContact O-N 3.29Å; M479-L483 WeakPolarHBondContact O-CB 3.39Å; M479-L483 PolarHBondContact O-N 2.96Å; M479-L558 HydrophobicContact CE-CD2 4.27Å
480V96.7Very high91.5Very high0 Ų017.9 Ų17.90%09%0.085CC..Hα-helixtrans-62.4-46.6177.7175.70000111.2W430 Y476 S477 S478 M482 L483 V484 L558W430-V480 HydrophobicContact CD2-CG1 4.12Å; W430-V480 HydrophobicContact CE3-CG1 4.37Å; W430-V480 HydrophobicContact CH2-CB 4.35Å; W430-V480 HydrophobicContact CH2-CG1 4Å; W430-V480 HydrophobicContact CH2-CG2 4.37Å; W430-V480 HydrophobicContact CZ2-CG1 3.75Å; W430-V480 HydrophobicContact CZ3-CB 4.32Å; W430-V480 HydrophobicContact CZ3-CG1 4.31Å; Y476-V480 HydrophobicContact CD1-CG2 4.25Å; Y476-V480 HydrophobicContact CD2-CG2 4.46Å; Y476-V480 HydrophobicContact CE1-CG2 3.67Å; Y476-V480 HydrophobicContact CE2-CG2 3.95Å; Y476-V480 WeakPolarHBondContact O-CG2 3.44Å; Y476-V480 PolarHBondContact O-N 3.44Å; S477-V480 PolarHBondContact O-N 3.36Å; S478-V480 VanDerWaalsContact C-N 3.28Å; S478-V480 PolarHBondContact O-N 2.88Å; V480-M482 VanDerWaalsContact C-N 3.35Å; V480-M482 PolarHBondContact O-N 3.46Å; V480-L483 PolarHBondContact O-N 2.94Å; V480-V484 HydrophobicContact CG1-CG2 4.17Å; V480-V484 WeakPolarHBondContact O-CB 3.47Å; V480-V484 VanDerWaalsContact O-CG2 3.31Å; V480-V484 WeakPolarHBondContact O-CG2 3.48Å; V480-V484 PolarHBondContact O-N 2.98Å; V480-L558 HydrophobicContact CG2-CD2 4.15Å
481M96.8Very high91.2Very high0 Ų019.2 Ų19.20%09%0.093CC..Hα-helixtrans-59.4-47.4176-72.6-175.3-69.500111.2M342 V343 I346 M427 W430 L431 F434 S477 S478 L483 V484 W485M342-M481 HydrophobicContact CE-CB 4.12Å; M342-M481 HydrophobicContact SD-CB 3.66Å; V343-M481 HydrophobicContact CG2-CE 3.58Å; V343-M481 HydrophobicContact CG2-SD 4.46Å; I346-M481 HydrophobicContact CD1-CB 4.24Å; M427-M481 VanDerWaalsContact CE-C 3.5Å; M427-M481 VanDerWaalsContact CE-CA 3.49Å; M427-M481 HydrophobicContact CE-CB 3.83Å; M427-M481 HydrophobicContact CE-CG 4.28Å; M427-M481 WeakPolarHBondContact CE-O 3.46Å; M427-M481 HydrophobicContact SD-CB 4.18Å; M427-M481 HydrophobicContact SD-CG 4.01Å; W430-M481 HydrophobicContact CB-CG 3.54Å; W430-M481 HydrophobicContact CB-SD 3.87Å; W430-M481 HydrophobicContact CG-CG 4.23Å; L431-M481 HydrophobicContact CD2-SD 3.72Å; L431-M481 HydrophobicContact CG-SD 4.05Å; F434-M481 HydrophobicContact CB-CE 3.81Å; F434-M481 HydrophobicContact CD1-CE 4.4Å; F434-M481 HydrophobicContact CD2-CE 3.97Å; F434-M481 HydrophobicContact CG-CE 3.8Å; S477-M481 WeakPolarHBondContact O-CG 3.26Å; S477-M481 PolarHBondContact O-N 3.39Å; S478-M481 PolarHBondContact O-N 3.05Å; S478-M481 VanDerWaalsContact O-N 3.08Å; M481-L483 PolarHBondContact O-N 3.25Å; M481-V484 PolarHBondContact O-N 2.85Å; M481-W485 VanDerWaalsContact O-CB 3.27Å; M481-W485 WeakPolarHBondContact O-CB 3.45Å; M481-W485 PolarHBondContact O-N 2.84Å
482M95.6Very high91.4Very high0 Ų020.3 Ų20.30%011%0.106CC..Hα-helixtrans-52.7-45.5176.6-124.7163.6-152.500111.7L171 F175 M273 P338 M342 S478 M479 V480 W486L171-M482 HydrophobicContact CD2-SD 3.66Å; F175-M482 HydrophobicContact CB-SD 3.98Å; F175-M482 HydrophobicContact CD1-CB 4.01Å; F175-M482 HydrophobicContact CD1-CG 3.6Å; F175-M482 HydrophobicContact CD1-SD 4.07Å; F175-M482 HydrophobicContact CD2-CB 4.05Å; F175-M482 HydrophobicContact CD2-CG 3.86Å; F175-M482 HydrophobicContact CD2-SD 3.41Å; F175-M482 WeakPolarHBondContact CD2-SD 3.49Å; F175-M482 HydrophobicContact CE1-CB 3.58Å; F175-M482 HydrophobicContact CE1-CG 3.72Å; F175-M482 HydrophobicContact CE2-CB 3.57Å; F175-M482 HydrophobicContact CE2-CG 3.92Å; F175-M482 HydrophobicContact CE2-SD 3.9Å; F175-M482 HydrophobicContact CG-CB 4.28Å; F175-M482 HydrophobicContact CG-CG 3.73Å; F175-M482 HydrophobicContact CG-SD 3.54Å; F175-M482 VanDerWaalsContact CG-SD 3.54Å; F175-M482 HydrophobicContact CZ-CB 3.39Å; F175-M482 HydrophobicContact CZ-CG 3.92Å; F175-M482 HydrophobicContact CZ-SD 4.5Å; M273-M482 HydrophobicContact CE-CE 3.64Å; M273-M482 HydrophobicContact SD-CE 4.31Å; P338-M482 HydrophobicContact CB-CE 4.2Å; P338-M482 VanDerWaalsContact O-CE 3.25Å; P338-M482 WeakPolarHBondContact O-CE 3.38Å; M342-M482 HydrophobicContact CB-CE 3.49Å; M342-M482 VanDerWaalsContact CB-CE 3.49Å; M342-M482 HydrophobicContact CB-CG 4.27Å; M342-M482 HydrophobicContact CE-CB 3.64Å; M342-M482 HydrophobicContact CE-CE 3.86Å; M342-M482 HydrophobicContact CE-CG 3.49Å; M342-M482 VanDerWaalsContact CE-CG 3.49Å; M342-M482 HydrophobicContact CE-SD 3.8Å; M342-M482 HydrophobicContact CG-CE 4.14Å; M342-M482 HydrophobicContact CG-CG 3.84Å; M342-M482 HydrophobicContact SD-CB 4.32Å; M342-M482 HydrophobicContact SD-CG 4.19Å; S478-M482 WeakPolarHBondContact O-CB 3.41Å; S478-M482 PolarHBondContact O-N 3.39Å; M479-M482 VanDerWaalsContact O-CB 3.31Å; M479-M482 WeakPolarHBondContact O-CB 3.29Å; M479-M482 PolarHBondContact O-N 3.29Å; V480-M482 VanDerWaalsContact C-N 3.35Å; V480-M482 PolarHBondContact O-N 3.46Å; M482-W486 HydrophobicContact CB-CZ3 4.43Å; M482-W486 HydrophobicContact CG-CE3 3.95Å; M482-W486 HydrophobicContact CG-CZ3 3.49Å; M482-W486 VanDerWaalsContact CG-CZ3 3.49Å; M482-W486 PolarHBondContact O-N 3.1Å
483L94.4Very high92.4Very high15 Ų1522.4 Ų22.48%0.07911%0.112CC..Hα-helixtrans-68.1-51.9178.4-171.662.8000111.2F175 M479 V480 M481 W485 W486 W487 M490 L558 L562F175-L483 HydrophobicContact CZ-CB 4.18Å; M479-L483 WeakPolarHBondContact O-CB 3.39Å; M479-L483 PolarHBondContact O-N 2.96Å; V480-L483 PolarHBondContact O-N 2.94Å; M481-L483 PolarHBondContact O-N 3.25Å; L483-W485 VanDerWaalsContact C-N 3.34Å; L483-W485 PolarHBondContact O-N 3.25Å; L483-W486 PolarHBondContact O-N 3.42Å; L483-W487 HydrophobicContact CD1-CE3 3.89Å; L483-W487 HydrophobicContact CD1-CZ3 4.29Å; L483-W487 HydrophobicContact CG-CE3 4.45Å; L483-W487 WeakPolarHBondContact O-CA 3.43Å; L483-W487 WeakPolarHBondContact O-CB 3.48Å; L483-W487 PolarHBondContact O-N 3.09Å; L483-M490 HydrophobicContact CD1-CE 3.89Å; L483-L558 HydrophobicContact CD2-CD1 4.36Å; L483-L562 HydrophobicContact CD1-CD2 4.49Å; L483-L562 HydrophobicContact CD2-CD1 3.69Å; L483-L562 HydrophobicContact CD2-CD2 3.65Å; L483-L562 HydrophobicContact CD2-CG 4.24Å; L483-L562 HydrophobicContact CG-CD2 4Å
484V95.3Very high93.1Very high15 Ų1524.3 Ų24.39%0.09113%0.125CC..Hα-helixtrans-62.9-39-177.41690000112M427 V480 M481 L495 L500M427-V484 HydrophobicContact CE-CB 3.9Å; M427-V484 HydrophobicContact CE-CG1 3.94Å; M427-V484 HydrophobicContact CG-CG1 4.13Å; V480-V484 HydrophobicContact CG1-CG2 4.17Å; V480-V484 WeakPolarHBondContact O-CB 3.47Å; V480-V484 VanDerWaalsContact O-CG2 3.31Å; V480-V484 WeakPolarHBondContact O-CG2 3.48Å; V480-V484 PolarHBondContact O-N 2.98Å; M481-V484 PolarHBondContact O-N 2.85Å; V484-L495 HydrophobicContact CB-CD1 4.17Å; V484-L495 HydrophobicContact CG1-CD1 4.23Å; V484-L495 HydrophobicContact CG2-CD1 3.9Å; V484-L500 HydrophobicContact CG1-CD1 3.85Å; V484-L500 HydrophobicContact CG1-CD2 4.35Å; V484-L500 HydrophobicContact CG2-CD2 3.6Å
485W94.5Very high93.4Very high69 Ų6925.5 Ų25.526%0.26113%0.131SC..Hα-helixtrans-66.5-49.2-179.7-170.1-102.9000112I346 L350 M427 M481 L483I346-W485 HydrophobicContact CB-CE3 4.48Å; I346-W485 HydrophobicContact CD1-CB 3.92Å; I346-W485 HydrophobicContact CD1-CD2 4.04Å; I346-W485 HydrophobicContact CD1-CE3 4.22Å; I346-W485 HydrophobicContact CD1-CG 3.91Å; I346-W485 HydrophobicContact CG1-CB 4.44Å; I346-W485 HydrophobicContact CG1-CD2 3.73Å; I346-W485 HydrophobicContact CG1-CE3 4.07Å; I346-W485 HydrophobicContact CG1-CG 3.89Å; I346-W485 HydrophobicContact CG2-CD2 4.24Å; I346-W485 HydrophobicContact CG2-CE3 3.73Å; I346-W485 HydrophobicContact CG2-CH2 4.11Å; I346-W485 HydrophobicContact CG2-CZ3 3.67Å; L350-W485 HydrophobicContact CD2-CH2 4.14Å; L350-W485 HydrophobicContact CD2-CZ3 4.08Å; L350-W485 HydrophobicContact CG-CH2 4.26Å; L350-W485 HydrophobicContact CG-CZ3 4.29Å; M427-W485 HydrophobicContact CE-CB 3.46Å; M427-W485 VanDerWaalsContact CE-CB 3.46Å; M427-W485 HydrophobicContact CE-CE3 4.09Å; M427-W485 HydrophobicContact CE-CG 4.36Å; M427-W485 VanDerWaalsContact CE-N 3.32Å; M427-W485 HydrophobicContact CG-CE3 4.09Å; M481-W485 VanDerWaalsContact O-CB 3.27Å; M481-W485 WeakPolarHBondContact O-CB 3.45Å; M481-W485 PolarHBondContact O-N 2.84Å; L483-W485 VanDerWaalsContact C-N 3.34Å; L483-W485 PolarHBondContact O-N 3.25Å
486W93.4Very high93.6Very high20 Ų2027.9 Ų27.98%0.07614%0.144CC..Hα-helixtrans-97.1-2-173.4-72.3-58.2000114.4F175 F179 F183 M273 M342 M482 L483 F489 M490F175-W486 HydrophobicContact CD1-CE3 4.19Å; F175-W486 HydrophobicContact CE1-CE3 4.29Å; F179-W486 HydrophobicContact CD1-CD2 4.43Å; F179-W486 HydrophobicContact CD2-CE3 4.32Å; F179-W486 HydrophobicContact CE1-CB 3.94Å; F179-W486 AromaticContact CE1-CD1 3.8Å; F179-W486 AromaticContact CE1-CD2 3.97Å; F179-W486 HydrophobicContact CE1-CD2 3.97Å; F179-W486 AromaticContact CE1-CG 3.64Å; F179-W486 HydrophobicContact CE1-CG 3.64Å; F179-W486 HydrophobicContact CE2-CB 4.21Å; F179-W486 HydrophobicContact CE2-CD2 4.18Å; F179-W486 HydrophobicContact CE2-CE3 4.02Å; F179-W486 HydrophobicContact CE2-CG 4.28Å; F179-W486 HydrophobicContact CZ-CB 3.41Å; F179-W486 VanDerWaalsContact CZ-CB 3.41Å; F179-W486 AromaticContact CZ-CD2 3.86Å; F179-W486 HydrophobicContact CZ-CD2 3.86Å; F179-W486 HydrophobicContact CZ-CE3 4.17Å; F179-W486 AromaticContact CZ-CG 3.53Å; F179-W486 HydrophobicContact CZ-CG 3.53Å; F183-W486 HydrophobicContact CE2-CZ2 4.33Å; F183-W486 HydrophobicContact CZ-CH2 4.24Å; F183-W486 AromaticContact CZ-CZ2 3.7Å; F183-W486 HydrophobicContact CZ-CZ2 3.7Å; M273-W486 HydrophobicContact CE-CH2 3.82Å; M273-W486 HydrophobicContact CE-CZ3 4.11Å; M273-W486 HydrophobicContact CG-CH2 4.42Å; M273-W486 HydrophobicContact SD-CH2 4.24Å; M342-W486 HydrophobicContact CB-CH2 4.05Å; M342-W486 HydrophobicContact CB-CZ3 4.25Å; M342-W486 HydrophobicContact CG-CH2 3.73Å; M342-W486 HydrophobicContact CG-CZ3 3.74Å; M482-W486 HydrophobicContact CB-CZ3 4.43Å; M482-W486 HydrophobicContact CG-CE3 3.95Å; M482-W486 HydrophobicContact CG-CZ3 3.49Å; M482-W486 VanDerWaalsContact CG-CZ3 3.49Å; M482-W486 PolarHBondContact O-N 3.1Å; L483-W486 PolarHBondContact O-N 3.42Å; W486-F489 WeakPolarHBondContact O-CA 3.44Å; W486-F489 WeakPolarHBondContact O-CB 3.3Å; W486-F489 PolarHBondContact O-N 3.24Å; W486-M490 HydrophobicContact CB-CE 4.28Å; W486-M490 HydrophobicContact CB-CG 4.46Å; W486-M490 WeakPolarHBondContact O-CG 3.17Å; W486-M490 PolarHBondContact O-N 3.27Å
487W93Very high93.6Very high23 Ų2331.2 Ų31.29%0.08716%0.159CC..Hα-helixtrans-52.4-47.5177.3-179.9-94.5000113.6L483 F489 M490 V491 L495 L562 S565 L566L483-W487 HydrophobicContact CD1-CE3 3.89Å; L483-W487 HydrophobicContact CD1-CZ3 4.29Å; L483-W487 HydrophobicContact CG-CE3 4.45Å; L483-W487 WeakPolarHBondContact O-CA 3.43Å; L483-W487 WeakPolarHBondContact O-CB 3.48Å; L483-W487 PolarHBondContact O-N 3.09Å; W487-F489 PolarHBondContact O-N 3.12Å; W487-M490 PolarHBondContact O-N 3.45Å; W487-V491 HydrophobicContact CD2-CB 4.47Å; W487-V491 HydrophobicContact CD2-CG2 3.97Å; W487-V491 HydrophobicContact CE3-CG2 3.92Å; W487-V491 HydrophobicContact CH2-CG2 3.93Å; W487-V491 HydrophobicContact CZ2-CB 4.41Å; W487-V491 HydrophobicContact CZ2-CG1 4.29Å; W487-V491 HydrophobicContact CZ2-CG2 3.96Å; W487-V491 HydrophobicContact CZ3-CG2 3.89Å; W487-V491 PolarHBondContact O-N 2.82Å; W487-L495 HydrophobicContact CB-CD1 4.01Å; W487-L495 HydrophobicContact CB-CG 4.21Å; W487-L495 VanDerWaalsContact CD1-CG 3.48Å; W487-L495 HydrophobicContact CD2-CD2 4.11Å; W487-L495 HydrophobicContact CG-CD1 4.09Å; W487-L495 HydrophobicContact CG-CD2 3.8Å; W487-L495 HydrophobicContact CG-CG 3.87Å; W487-L562 HydrophobicContact CD2-CD2 4.07Å; W487-L562 HydrophobicContact CE3-CD2 3.7Å; W487-L562 HydrophobicContact CH2-CB 3.86Å; W487-L562 HydrophobicContact CH2-CD2 3.89Å; W487-L562 HydrophobicContact CH2-CG 4.37Å; W487-L562 HydrophobicContact CZ2-CB 4.27Å; W487-L562 HydrophobicContact CZ2-CD2 4.25Å; W487-L562 HydrophobicContact CZ3-CB 4.35Å; W487-L562 HydrophobicContact CZ3-CD2 3.62Å; W487-L562 HydrophobicContact CZ3-CG 4.38Å; W487-S565 PolarHBondContact NE1-OG 3.28Å; W487-L566 HydrophobicContact CH2-CD1 4.47Å; W487-L566 HydrophobicContact CH2-CD2 4.47Å; W487-L566 HydrophobicContact CH2-CG 4.35Å; W487-L566 HydrophobicContact CZ2-CD2 4.13Å; W487-L566 HydrophobicContact CZ2-CG 4.03Å
488P91.9Very high93.6Very high29 Ų2939.7 Ų39.719%0.18819%0.192CC..Hα-helixtrans-55.9-36173.6-30.440.1000114.3G492 Y493 V572 L575P488-G492 WeakPolarHBondContact O-CA 3.44Å; P488-G492 PolarHBondContact O-N 3.08Å; P488-Y493 WeakPolarHBondContact CA-O 3.28Å; P488-V572 HydrophobicContact CB-CB 4.48Å; P488-V572 HydrophobicContact CB-CG2 3.92Å; P488-V572 HydrophobicContact CG-CG2 4.45Å; P488-L575 HydrophobicContact CB-CD2 4.04Å
489F90Very high93.7Very high99 Ų9942.2 Ų42.243%0.43421%0.206SC..Hα-helixtrans-77.1-38.8179.9175.8-94000112.3Y178 F179 M182 W486 W487 L575Y178-F489 HydrophobicContact CE1-CD1 4.34Å; Y178-F489 HydrophobicContact CE1-CE1 4.06Å; F179-F489 AromaticContact CE1-CD1 3.75Å; F179-F489 HydrophobicContact CE1-CD1 3.75Å; F179-F489 AromaticContact CE1-CE1 3.89Å; F179-F489 HydrophobicContact CE1-CE1 3.89Å; F179-F489 HydrophobicContact CZ-CD1 4.41Å; M182-F489 HydrophobicContact CE-CE1 3.91Å; M182-F489 HydrophobicContact CE-CZ 4.2Å; M182-F489 HydrophobicContact SD-CE1 3.47Å; M182-F489 WeakPolarHBondContact SD-CE1 3.42Å; M182-F489 HydrophobicContact SD-CZ 3.66Å; W486-F489 WeakPolarHBondContact O-CA 3.44Å; W486-F489 WeakPolarHBondContact O-CB 3.3Å; W486-F489 PolarHBondContact O-N 3.24Å; W487-F489 PolarHBondContact O-N 3.12Å; F489-L575 HydrophobicContact CD2-CD1 4.31Å
490M89.8Confident93.9Very high29 Ų2942.2 Ų42.214%0.14321%0.206CC..Hα-helixtrans-74.2-38-178-67.8-171.1-70.200113.1F117 F175 Y178 F179 L483 W486 W487F117-M490 HydrophobicContact CE2-SD 4.39Å; F175-M490 HydrophobicContact CE1-CE 4.41Å; Y178-M490 HydrophobicContact CD1-CG 4.22Å; Y178-M490 HydrophobicContact CD1-SD 4.4Å; Y178-M490 HydrophobicContact CE1-CB 4.49Å; Y178-M490 HydrophobicContact CE1-CG 3.66Å; Y178-M490 HydrophobicContact CE1-SD 4.37Å; Y178-M490 HydrophobicContact CE2-CG 4.36Å; Y178-M490 WeakPolarHBondContact OH-CA 3.44Å; F179-M490 HydrophobicContact CE2-CG 4.45Å; F179-M490 HydrophobicContact CE2-SD 3.9Å; F179-M490 HydrophobicContact CZ-CG 3.71Å; F179-M490 HydrophobicContact CZ-SD 3.75Å; L483-M490 HydrophobicContact CD1-CE 3.89Å; W486-M490 HydrophobicContact CB-CE 4.28Å; W486-M490 HydrophobicContact CB-CG 4.46Å; W486-M490 WeakPolarHBondContact O-CG 3.17Å; W486-M490 PolarHBondContact O-N 3.27Å; W487-M490 PolarHBondContact O-N 3.45Å
491V88.4Confident93.9Very high51 Ų5143.7 Ų43.731%0.30921%0.213SC..Hα-helixtrans-114.1-27.2-170.2-177.80000112.4W487 Y493 L566W487-V491 HydrophobicContact CD2-CB 4.47Å; W487-V491 HydrophobicContact CD2-CG2 3.97Å; W487-V491 HydrophobicContact CE3-CG2 3.92Å; W487-V491 HydrophobicContact CH2-CG2 3.93Å; W487-V491 HydrophobicContact CZ2-CB 4.41Å; W487-V491 HydrophobicContact CZ2-CG1 4.29Å; W487-V491 HydrophobicContact CZ2-CG2 3.96Å; W487-V491 HydrophobicContact CZ3-CG2 3.89Å; W487-V491 PolarHBondContact O-N 2.82Å; V491-Y493 HydrophobicContact CG1-CD2 3.49Å; V491-Y493 VanDerWaalsContact CG1-CD2 3.49Å; V491-Y493 HydrophobicContact CG1-CE2 4.05Å; V491-Y493 HydrophobicContact CG1-CG 4.26Å; V491-L566 HydrophobicContact CG1-CD2 3.51Å
492G88.7Confident94Very high32 Ų3245.4 Ų45.433%0.3323%0.231SC..SBendtrans89.31.3-175.500000114.7P488 V572P488-G492 WeakPolarHBondContact O-CA 3.44Å; P488-G492 PolarHBondContact O-N 3.08Å; G492-V572 PolarHBondContact O-N 3Å
493Y91.1Very high94.1Very high63 Ų6345.4 Ų45.425%0.24723%0.231CC..BIsolated β-bridgetrans-114150.7-178.6-57.2-45.3000112.8P488 V491 S565 L566 G569 N570 R571P488-Y493 WeakPolarHBondContact CA-O 3.28Å; V491-Y493 HydrophobicContact CG1-CD2 3.49Å; V491-Y493 VanDerWaalsContact CG1-CD2 3.49Å; V491-Y493 HydrophobicContact CG1-CE2 4.05Å; V491-Y493 HydrophobicContact CG1-CG 4.26Å; Y493-S565 WeakPolarHBondContact CB-OG 3.4Å; Y493-L566 HydrophobicContact CD2-CD2 4.18Å; Y493-L566 HydrophobicContact CE2-CD2 4.35Å; Y493-G569 VanDerWaalsContact CD1-C 3.48Å; Y493-G569 WeakPolarHBondContact CD1-O 3.23Å; Y493-G569 WeakPolarHBondContact CE1-O 3.41Å; Y493-N570 CarbonylContact C-O 3.53Å; Y493-N570 VanDerWaalsContact CA-O 3.25Å; Y493-N570 WeakPolarHBondContact CA-O 3.44Å; Y493-R571 HydrophobicContact CD1-CG 4.05Å; Y493-R571 HydrophobicContact CE1-CG 3.77Å
494S93.8Very high94.2Very high41 Ų4147.2 Ų47.229%0.28724%0.237SC..PPolyproline II helixtrans-83.4150.3174.163.70000111.7S565 N570S494-S565 PolarHBondContact O-OG 3.27Å; S494-N570 PolarHBondContact N-O 3.03Å; S494-N570 VanDerWaalsContact OG-CB 3.23Å; S494-N570 WeakPolarHBondContact OG-CB 3.37Å; S494-N570 PolarHBondContact OG-O 3.36Å
495L94.8Very high94.3Very high24 Ų2451 Ų5113%0.12626%0.255CS..PPolyproline II helixtrans-89.4146168.2-63.4178000110.9V484 W487 K497 L500 I561 L562V484-L495 HydrophobicContact CB-CD1 4.17Å; V484-L495 HydrophobicContact CG1-CD1 4.23Å; V484-L495 HydrophobicContact CG2-CD1 3.9Å; W487-L495 HydrophobicContact CB-CD1 4.01Å; W487-L495 HydrophobicContact CB-CG 4.21Å; W487-L495 VanDerWaalsContact CD1-CG 3.48Å; W487-L495 HydrophobicContact CD2-CD2 4.11Å; W487-L495 HydrophobicContact CG-CD1 4.09Å; W487-L495 HydrophobicContact CG-CD2 3.8Å; W487-L495 HydrophobicContact CG-CG 3.87Å; L495-K497 PolarHBondContact O-N 2.76Å; L495-L500 HydrophobicContact CB-CD1 3.68Å; L495-L500 HydrophobicContact CB-CG 4.3Å; L495-L500 HydrophobicContact CD1-CD1 4.16Å; L495-L500 HydrophobicContact CD1-CD2 4.26Å; L495-I561 HydrophobicContact CB-CG2 4.44Å; L495-I561 HydrophobicContact CD2-CG2 3.88Å; L495-L562 HydrophobicContact CD2-CD2 4.3Å
496N95.5Very high94.5Very high51 Ų5149.5 Ų49.527%0.27325%0.252SS..PPolyproline II helixtrans-67.9119176-172.7-45000111.7Y498 L499 L500N496-Y498 PolarHBondContact O-N 3.27Å; N496-Y498 PolarHBondContact OD1-N 2.8Å; N496-L499 HydrophobicContact CB-CB 4.11Å; N496-L499 HydrophobicContact CB-CD1 3.83Å; N496-L499 HydrophobicContact CB-CG 3.92Å; N496-L499 PolarHBondContact O-N 3.01Å; N496-L499 PolarHBondContact OD1-N 3.39Å; N496-L500 WeakPolarHBondContact O-CG 3.46Å; N496-L500 PolarHBondContact O-N 3.27Å
497K94.6Very high94.6Very high90 Ų9048.5 Ų48.539%0.39125%0.249SC..Hα-helixtrans-60.4-41.8-176.8-172.1179.1177.4179.80113.6L424 P426 L495 L500 Q501L424-K497 WeakPolarHBondContact O-CE 3.5Å; L424-K497 PolarHBondContact O-NZ 3.03Å; P426-K497 HydrophobicContact CG-CG 4.11Å; L495-K497 PolarHBondContact O-N 2.76Å; K497-L500 PolarHBondContact O-N 2.77Å; K497-Q501 WeakPolarHBondContact O-CG 3.47Å; K497-Q501 PolarHBondContact O-N 2.85Å
498Y96.7Very high94.8Very high177 Ų17748.2 Ų48.269%0.69425%0.248SC*.Hα-helixtrans-72.2-38-177.3-60.2-68.3000111.5N496 L500 Q501 G502N496-Y498 PolarHBondContact O-N 3.27Å; N496-Y498 PolarHBondContact OD1-N 2.8Å; Y498-L500 VanDerWaalsContact C-N 3.32Å; Y498-L500 PolarHBondContact O-N 3.1Å; Y498-Q501 PolarHBondContact O-N 2.76Å; Y498-G502 PolarHBondContact O-N 2.92Å
499L97.8Very high95Very high53 Ų5350.3 Ų50.328%0.27726%0.261SS..Hα-helixtrans-64-39.3173.4-62.3-178.9000111.3N496 G502 H503 F560 I561 E564N496-L499 HydrophobicContact CB-CB 4.11Å; N496-L499 HydrophobicContact CB-CD1 3.83Å; N496-L499 HydrophobicContact CB-CG 3.92Å; N496-L499 PolarHBondContact O-N 3.01Å; N496-L499 PolarHBondContact OD1-N 3.39Å; L499-G502 PolarHBondContact O-N 3.22Å; L499-H503 WeakPolarHBondContact O-CB 3.49Å; L499-H503 PolarHBondContact O-N 2.91Å; L499-F560 HydrophobicContact CD1-CD1 4.3Å; L499-F560 HydrophobicContact CD1-CE1 3.87Å; L499-F560 HydrophobicContact CD2-CE1 4.43Å; L499-I561 HydrophobicContact CB-CD1 3.94Å; L499-I561 HydrophobicContact CB-CG1 3.68Å; L499-I561 HydrophobicContact CD1-CG1 4.24Å; L499-I561 WeakPolarHBondContact O-CD1 3.39Å; L499-E564 HydrophobicContact CD1-CG 4.24Å
500L98.2Very high95.4Very high6 Ų645.6 Ų45.63%0.03124%0.24CC..Hα-helixtrans-64.7-37.8175.2-74.1173.9000113.3P426 V484 L495 N496 K497 Y498 H503 W504 I561P426-L500 HydrophobicContact CB-CB 3.73Å; P426-L500 HydrophobicContact CG-CB 3.83Å; P426-L500 HydrophobicContact CG-CD1 4.01Å; V484-L500 HydrophobicContact CG1-CD1 3.85Å; V484-L500 HydrophobicContact CG1-CD2 4.35Å; V484-L500 HydrophobicContact CG2-CD2 3.6Å; L495-L500 HydrophobicContact CB-CD1 3.68Å; L495-L500 HydrophobicContact CB-CG 4.3Å; L495-L500 HydrophobicContact CD1-CD1 4.16Å; L495-L500 HydrophobicContact CD1-CD2 4.26Å; N496-L500 WeakPolarHBondContact O-CG 3.46Å; N496-L500 PolarHBondContact O-N 3.27Å; K497-L500 PolarHBondContact O-N 2.77Å; Y498-L500 VanDerWaalsContact C-N 3.32Å; Y498-L500 PolarHBondContact O-N 3.1Å; L500-H503 PolarHBondContact O-N 3.25Å; L500-W504 PolarHBondContact O-N 3.45Å; L500-I561 HydrophobicContact CD2-CD1 4.25Å; L500-I561 HydrophobicContact CD2-CG2 4.04Å; L500-I561 HydrophobicContact CG-CG2 4.43Å
501Q97.7Very high95.7Very high30 Ų3044.7 Ų44.714%0.1424%0.235CC..Hα-helixtrans-63.9-43.9172.8-72.9172.7-1600111.3L424 P426 W429 K497 Y498 W504 L505L424-Q501 PolarHBondContact O-NE2 2.76Å; P426-Q501 HydrophobicContact CB-CG 4.24Å; W429-Q501 HydrophobicContact CE3-CB 4.29Å; W429-Q501 HydrophobicContact CE3-CG 4.18Å; W429-Q501 HydrophobicContact CH2-CB 4.05Å; W429-Q501 HydrophobicContact CH2-CG 3.87Å; W429-Q501 HydrophobicContact CZ2-CG 4.38Å; W429-Q501 HydrophobicContact CZ3-CB 3.64Å; W429-Q501 HydrophobicContact CZ3-CG 3.75Å; K497-Q501 WeakPolarHBondContact O-CG 3.47Å; K497-Q501 PolarHBondContact O-N 2.85Å; Y498-Q501 PolarHBondContact O-N 2.76Å; Q501-W504 PolarHBondContact O-N 3.49Å; Q501-L505 PolarHBondContact O-N 2.92Å
502G97.8Very high96.1Very high37 Ų3744.4 Ų44.438%0.38123%0.232SC..Hα-helixtrans-62.5-42.4174.300000112.8Y498 L499 W504 L505 L506Y498-G502 PolarHBondContact O-N 2.92Å; L499-G502 PolarHBondContact O-N 3.22Å; G502-W504 PolarHBondContact O-N 2.98Å; G502-L505 PolarHBondContact O-N 3.31Å; G502-L506 WeakPolarHBondContact O-CB 3.39Å; G502-L506 PolarHBondContact O-N 3.04Å
503H98Very high96.5Very high0 Ų045.5 Ų45.50%023%0.23CC..Hα-helixtrans-60-44.6175178.1-123.5000111.7W430 L499 L500 L506 S507 S554 V557 I561W430-H503 AromaticContact CH2-CE1 3.94Å; W430-H503 AromaticContact CZ2-CE1 3.55Å; W430-H503 AromaticContact CZ2-ND1 3.42Å; W430-H503 WeakPolarHBondContact CZ2-ND1 3.42Å; L499-H503 WeakPolarHBondContact O-CB 3.49Å; L499-H503 PolarHBondContact O-N 2.91Å; L500-H503 PolarHBondContact O-N 3.25Å; H503-L506 PolarHBondContact O-N 3.36Å; H503-S507 VanDerWaalsContact O-CB 3.28Å; H503-S507 WeakPolarHBondContact O-CB 3.2Å; H503-S507 PolarHBondContact O-N 3.14Å; H503-S507 PolarHBondContact O-OG 2.98Å; H503-S554 PolarHBondContact CD2-O 3.39Å; H503-S554 PolarHBondContact CD2-OG 3.49Å; H503-S554 PolarHBondContact NE2-O 2.91Å; H503-S554 PolarHBondContact NE2-OG 3.35Å; H503-V557 HydrophobicContact CB-CG1 3.99Å; H503-I561 HydrophobicContact CB-CD1 3.65Å
504W97.4Very high96.7Very high53 Ų5342.7 Ų42.720%0.20122%0.219CC..Hα-helixtrans-59.5-49175.2-179.391.6000111.9W429 W430 L500 Q501 G502 L506 S507 M508W429-W504 HydrophobicContact CB-CD2 3.86Å; W429-W504 HydrophobicContact CB-CG 3.92Å; W429-W504 HydrophobicContact CB-CZ2 4.27Å; W429-W504 HydrophobicContact CD2-CD2 4.44Å; W429-W504 HydrophobicContact CD2-CE3 4.34Å; W429-W504 HydrophobicContact CE3-CB 4.27Å; W429-W504 AromaticContact CE3-CD2 3.79Å; W429-W504 HydrophobicContact CE3-CD2 3.79Å; W429-W504 AromaticContact CE3-CE3 3.48Å; W429-W504 HydrophobicContact CE3-CE3 3.48Å; W429-W504 VanDerWaalsContact CE3-CE3 3.48Å; W429-W504 HydrophobicContact CE3-CG 4.13Å; W429-W504 HydrophobicContact CE3-CZ3 4.09Å; W429-W504 HydrophobicContact CZ3-CE3 4.02Å; W429-W504 PolarHBondContact O-NE1 3.01Å; W430-W504 AromaticContact CD1-CD1 3.88Å; W430-W504 AromaticContact CD2-CD1 3.7Å; W430-W504 AromaticContact CE2-CD1 3.75Å; W430-W504 AromaticContact CG-CD1 3.77Å; W430-W504 HydrophobicContact CZ2-CB 4.21Å; W430-W504 AromaticContact NE1-CD1 3.85Å; L500-W504 PolarHBondContact O-N 3.45Å; Q501-W504 PolarHBondContact O-N 3.49Å; G502-W504 PolarHBondContact O-N 2.98Å; W504-L506 PolarHBondContact O-N 2.7Å; W504-S507 PolarHBondContact O-N 3.46Å; W504-M508 HydrophobicContact CD2-CG 3.79Å; W504-M508 VanDerWaalsContact CE2-CG 3.44Å; W504-M508 HydrophobicContact CE3-CG 4.3Å; W504-M508 HydrophobicContact CG-CG 4.24Å; W504-M508 HydrophobicContact CH2-CG 4.21Å; W504-M508 HydrophobicContact CZ2-CG 3.69Å; W504-M508 HydrophobicContact CZ3-CG 4.49Å; W504-M508 VanDerWaalsContact NE1-CE 3.34Å; W504-M508 WeakPolarHBondContact O-CB 3.32Å; W504-M508 VanDerWaalsContact O-CG 3.24Å; W504-M508 WeakPolarHBondContact O-CG 3.17Å; W504-M508 PolarHBondContact O-N 3.26Å
505L97.3Very high96.9Very high93 Ų9341.7 Ų41.749%0.48721%0.21SC..Hα-helixtrans-58.6-47.6179.1-77.7168.7000111.5W429 Q501 G502 M508 V509W429-L505 HydrophobicContact CZ3-CG 4.46Å; Q501-L505 PolarHBondContact O-N 2.92Å; G502-L505 PolarHBondContact O-N 3.31Å; L505-M508 PolarHBondContact O-N 2.79Å; L505-V509 WeakPolarHBondContact O-CB 3.26Å; L505-V509 VanDerWaalsContact O-CG2 3.28Å; L505-V509 WeakPolarHBondContact O-CG2 3.36Å; L505-V509 PolarHBondContact O-N 2.93Å
506L97.9Very high97Very high38 Ų3846.4 Ų46.420%0.19923%0.23CC..Hα-helixtrans-63.6-44-180-178.961.1000112G502 H503 W504 G510 L550 V553 V557G502-L506 WeakPolarHBondContact O-CB 3.39Å; G502-L506 PolarHBondContact O-N 3.04Å; H503-L506 PolarHBondContact O-N 3.36Å; W504-L506 PolarHBondContact O-N 2.7Å; L506-G510 PolarHBondContact O-N 2.96Å; L506-L550 HydrophobicContact CD1-CB 4.06Å; L506-L550 HydrophobicContact CD1-CD2 3.73Å; L506-L550 HydrophobicContact CD1-CG 4.43Å; L506-V553 HydrophobicContact CD2-CB 4.37Å; L506-V553 HydrophobicContact CD2-CG1 3.93Å; L506-V557 HydrophobicContact CD2-CG2 3.86Å
507S96.6Very high97.1Very high0 Ų044.9 Ų44.90%022%0.223CC..Hα-helixtrans-58.4-54.6174-78.80000111.5W430 H503 W504 V509 G510 F511 S554W430-S507 WeakPolarHBondContact CH2-OG 3.38Å; H503-S507 VanDerWaalsContact O-CB 3.28Å; H503-S507 WeakPolarHBondContact O-CB 3.2Å; H503-S507 PolarHBondContact O-N 3.14Å; H503-S507 PolarHBondContact O-OG 2.98Å; W504-S507 PolarHBondContact O-N 3.46Å; S507-V509 PolarHBondContact O-N 2.95Å; S507-G510 PolarHBondContact O-N 3.36Å; S507-F511 WeakPolarHBondContact O-CB 3.32Å; S507-F511 WeakPolarHBondContact O-CD2 3.5Å; S507-F511 WeakPolarHBondContact O-CG 3.49Å; S507-F511 PolarHBondContact O-N 3.13Å; S507-S554 PolarHBondContact OG-OG 2.89Å
508M96.3Very high97.3Very high16 Ų1641.1 Ų41.18%0.07921%0.207CC..Hα-helixtrans-64-41.6-174.3-66.6-57.8158.400111.9W430 L437 W504 L505 N512W430-M508 HydrophobicContact CE3-CE 3.9Å; W430-M508 HydrophobicContact CZ3-CE 3.85Å; L437-M508 HydrophobicContact CD1-CE 4.45Å; L437-M508 HydrophobicContact CD1-SD 3.4Å; L437-M508 WeakPolarHBondContact CD1-SD 3.09Å; W504-M508 HydrophobicContact CD2-CG 3.79Å; W504-M508 VanDerWaalsContact CE2-CG 3.44Å; W504-M508 HydrophobicContact CE3-CG 4.3Å; W504-M508 HydrophobicContact CG-CG 4.24Å; W504-M508 HydrophobicContact CH2-CG 4.21Å; W504-M508 HydrophobicContact CZ2-CG 3.69Å; W504-M508 HydrophobicContact CZ3-CG 4.49Å; W504-M508 VanDerWaalsContact NE1-CE 3.34Å; W504-M508 WeakPolarHBondContact O-CB 3.32Å; W504-M508 VanDerWaalsContact O-CG 3.24Å; W504-M508 WeakPolarHBondContact O-CG 3.17Å; W504-M508 PolarHBondContact O-N 3.26Å; L505-M508 PolarHBondContact O-N 2.79Å; M508-N512 WeakPolarHBondContact O-CB 3.28Å; M508-N512 PolarHBondContact O-N 3.5Å; M508-N512 PolarHBondContact O-ND2 3.02Å
509V97.2Very high97.3Very high74 Ų7433.3 Ų33.345%0.44818%0.177SC..Hα-helixtrans-67.3-48.1175.6173.20000110.6L505 S507 L513 L550L505-V509 WeakPolarHBondContact O-CB 3.26Å; L505-V509 VanDerWaalsContact O-CG2 3.28Å; L505-V509 WeakPolarHBondContact O-CG2 3.36Å; L505-V509 PolarHBondContact O-N 2.93Å; S507-V509 PolarHBondContact O-N 2.95Å; V509-L513 HydrophobicContact CG1-CD1 3.63Å; V509-L513 HydrophobicContact CG1-CG 4.27Å; V509-L513 VanDerWaalsContact O-CB 3.3Å; V509-L513 WeakPolarHBondContact O-CB 3.5Å; V509-L513 VanDerWaalsContact O-CG 3.31Å; V509-L513 WeakPolarHBondContact O-CG 3.38Å; V509-L513 PolarHBondContact O-N 3.43Å; V509-L550 HydrophobicContact CG1-CD1 4.11Å
510G97.3Very high97.3Very high0 Ų035.9 Ų35.90%018%0.183CC..Hα-helixtrans-60.1-50.5-178.200000112.8L506 S507 L513 C514 G547 S551L506-G510 PolarHBondContact O-N 2.96Å; S507-G510 PolarHBondContact O-N 3.36Å; G510-L513 PolarHBondContact O-N 3.37Å; G510-C514 VanDerWaalsContact O-CB 3.26Å; G510-C514 WeakPolarHBondContact O-CB 3.34Å; G510-C514 PolarHBondContact O-N 2.8Å; G510-G547 CarbonylContact C-O 3.56Å; G510-G547 CarbonylContact O-C 3.57Å; G510-G547 VanDerWaalsContact O-CA 3.26Å; G510-G547 WeakPolarHBondContact O-CA 3.27Å; G510-G547 VanDerWaalsContact O-O 3.11Å; G510-S551 PolarHBondContact O-OG 3.47Å
511F95.8Very high97.3Very high10 Ų1035.6 Ų35.64%0.04418%0.182CC..Hα-helixtrans-65.6-43.2-177.9-60.8-38.1000112.7L473 Y476 S507 C514 F515 S551L473-F511 HydrophobicContact CD1-CB 4.11Å; L473-F511 HydrophobicContact CD2-CB 3.36Å; L473-F511 HydrophobicContact CD2-CD2 3.16Å; L473-F511 HydrophobicContact CD2-CE2 4.08Å; L473-F511 HydrophobicContact CD2-CG 3.51Å; L473-F511 HydrophobicContact CG-CB 4Å; L473-F511 HydrophobicContact CG-CD2 4.37Å; L473-F511 HydrophobicContact CG-CG 4.36Å; Y476-F511 AromaticContact CD1-CE2 3.94Å; Y476-F511 HydrophobicContact CD1-CE2 3.94Å; Y476-F511 AromaticContact CD1-CZ 3.72Å; Y476-F511 HydrophobicContact CD1-CZ 3.72Å; Y476-F511 AromaticContact CE1-CE2 3.68Å; Y476-F511 HydrophobicContact CE1-CE2 3.68Å; Y476-F511 AromaticContact CE1-CZ 3.37Å; Y476-F511 HydrophobicContact CE1-CZ 3.37Å; S507-F511 WeakPolarHBondContact O-CB 3.32Å; S507-F511 WeakPolarHBondContact O-CD2 3.5Å; S507-F511 WeakPolarHBondContact O-CG 3.49Å; S507-F511 PolarHBondContact O-N 3.13Å; F511-C514 PolarHBondContact O-N 3.29Å; F511-F515 HydrophobicContact CB-CD2 4.39Å; F511-F515 HydrophobicContact CD1-CE2 4.29Å; F511-F515 VanDerWaalsContact O-CD2 3.24Å; F511-F515 WeakPolarHBondContact O-CD2 3.47Å; F511-F515 PolarHBondContact O-N 3.2Å; F511-S551 WeakPolarHBondContact CD1-OG 3.35Å; F511-S551 PolarHBondContact N-OG 2.87Å
512N96.7Very high97.2Very high45 Ų4534.1 Ų34.124%0.24118%0.175CC..Hα-helixtrans-68.1-43.3178-78.2-80.8000111.4L437 Y469 M508 C514 F516 P517L437-N512 WeakPolarHBondContact CD2-ND2 3.36Å; L437-N512 WeakPolarHBondContact CD2-OD1 3.19Å; Y469-N512 PolarHBondContact OH-OD1 3.41Å; M508-N512 WeakPolarHBondContact O-CB 3.28Å; M508-N512 PolarHBondContact O-N 3.5Å; M508-N512 PolarHBondContact O-ND2 3.02Å; N512-C514 PolarHBondContact O-N 2.85Å; N512-F516 WeakPolarHBondContact O-CA 3.21Å; N512-F516 WeakPolarHBondContact O-CB 3.33Å; N512-F516 PolarHBondContact O-N 2.9Å; N512-P517 WeakPolarHBondContact O-CD 3.44Å
513L97.2Very high97.2Very high54 Ų5437.3 Ų37.328%0.28318%0.181SC..Hα-helixtrans-61.5-36.3175.1-75176.9000111.8V509 G510 P517 S544 L550V509-L513 HydrophobicContact CG1-CD1 3.63Å; V509-L513 HydrophobicContact CG1-CG 4.27Å; V509-L513 VanDerWaalsContact O-CB 3.3Å; V509-L513 WeakPolarHBondContact O-CB 3.5Å; V509-L513 VanDerWaalsContact O-CG 3.31Å; V509-L513 WeakPolarHBondContact O-CG 3.38Å; V509-L513 PolarHBondContact O-N 3.43Å; G510-L513 PolarHBondContact O-N 3.37Å; L513-P517 WeakPolarHBondContact O-CD 3.4Å; L513-P517 VanDerWaalsContact O-CG 3.3Å; L513-P517 WeakPolarHBondContact O-CG 3.22Å; L513-S544 VanDerWaalsContact O-CA 3.29Å; L513-S544 WeakPolarHBondContact O-CA 3.25Å; L513-L550 HydrophobicContact CD1-CD1 4Å
514C97Very high97.1Very high4 Ų441.6 Ų41.63%0.02720%0.201CC..Hα-helixtrans-67.7-58.4178.7-170.40000111.2G510 F511 N512 S544G510-C514 VanDerWaalsContact O-CB 3.26Å; G510-C514 WeakPolarHBondContact O-CB 3.34Å; G510-C514 PolarHBondContact O-N 2.8Å; F511-C514 PolarHBondContact O-N 3.29Å; N512-C514 PolarHBondContact O-N 2.85Å; C514-S544 VanDerWaalsContact O-CB 3.3Å; C514-S544 WeakPolarHBondContact O-CB 3.25Å; C514-S544 PolarHBondContact O-OG 3.29Å
515F97.4Very high97Very high20 Ų2041 Ų419%0.08821%0.212CC..Hα-helixtrans-100-27.6-162.7-58-61.2000114A465 H468 Y469 F511 M518A465-F515 WeakPolarHBondContact CB-O 2.95Å; H468-F515 HydrophobicContact CB-CB 4.44Å; H468-F515 HydrophobicContact CB-CD1 3.49Å; H468-F515 VanDerWaalsContact CB-CD1 3.49Å; H468-F515 HydrophobicContact CB-CD2 3.85Å; H468-F515 HydrophobicContact CB-CE1 3.55Å; H468-F515 HydrophobicContact CB-CE2 3.9Å; H468-F515 HydrophobicContact CB-CG 3.66Å; H468-F515 HydrophobicContact CB-CZ 3.76Å; H468-F515 AromaticContact CD2-CE1 3.31Å; H468-F515 WeakPolarHBondContact CD2-CE1 3.39Å; H468-F515 AromaticContact CD2-CZ 3.29Å; H468-F515 WeakPolarHBondContact CD2-CZ 3.39Å; H468-F515 AromaticContact CG-CD1 3.68Å; H468-F515 AromaticContact CG-CE1 3.28Å; H468-F515 AromaticContact CG-CZ 3.62Å; H468-F515 AromaticContact ND1-CE1 3.87Å; H468-F515 AromaticContact NE2-CE1 3.91Å; Y469-F515 HydrophobicContact CD2-CB 4Å; Y469-F515 HydrophobicContact CE2-CB 3.68Å; F511-F515 HydrophobicContact CB-CD2 4.39Å; F511-F515 HydrophobicContact CD1-CE2 4.29Å; F511-F515 VanDerWaalsContact O-CD2 3.24Å; F511-F515 WeakPolarHBondContact O-CD2 3.47Å; F511-F515 PolarHBondContact O-N 3.2Å; F515-M518 HydrophobicContact CD1-CE 4.24Å; F515-M518 HydrophobicContact CD1-SD 3.85Å; F515-M518 WeakPolarHBondContact O-CB 3.4Å; F515-M518 PolarHBondContact O-N 2.97Å
516F97.2Very high97Very high123 Ų12337.1 Ų37.154%0.53919%0.191SC..Hα-helixtrans-59.3-48.2179.4-168.3-106000112.2Y469 N512 M518 H519Y469-F516 VanDerWaalsContact OH-CB 3.27Å; Y469-F516 WeakPolarHBondContact OH-CB 3.15Å; Y469-F516 WeakPolarHBondContact OH-CD2 3.47Å; N512-F516 WeakPolarHBondContact O-CA 3.21Å; N512-F516 WeakPolarHBondContact O-CB 3.33Å; N512-F516 PolarHBondContact O-N 2.9Å; F516-M518 PolarHBondContact O-N 2.89Å; F516-M518 VanDerWaalsContact O-N 3.17Å; F516-H519 PolarHBondContact O-N 2.9Å; F516-H519 VanDerWaalsContact O-N 3.15Å; F516-H519 PolarHBondContact O-ND1 2.59Å
517P97.8Very high96.9Very high19 Ų1938.4 Ų38.412%0.12320%0.202CC..Hα-helixtrans-65.3-21.1-179.4-17.631.7000113.3N512 L513 H519 Y520 L521 V540N512-P517 WeakPolarHBondContact O-CD 3.44Å; L513-P517 WeakPolarHBondContact O-CD 3.4Å; L513-P517 VanDerWaalsContact O-CG 3.3Å; L513-P517 WeakPolarHBondContact O-CG 3.22Å; P517-H519 PolarHBondContact O-N 3.16Å; P517-Y520 WeakPolarHBondContact O-CB 3.45Å; P517-Y520 PolarHBondContact O-N 3.14Å; P517-Y520 VanDerWaalsContact O-N 3.14Å; P517-L521 WeakPolarHBondContact O-CG 3.36Å; P517-L521 PolarHBondContact O-N 3.2Å; P517-L521 VanDerWaalsContact O-N 3.11Å; P517-V540 HydrophobicContact CB-CG1 3.54Å
518M97.4Very high96.8Very high11 Ų1140.4 Ų40.45%0.05421%0.209CC..Hα-helixtrans-66.4-23.7177.2-65.7-178.4-179.600112.9W461 V464 A465 F515 F516 G522W461-M518 CarbonylContact C-O 3.52Å; W461-M518 HydrophobicContact CB-CB 4.37Å; W461-M518 HydrophobicContact CE3-CB 4.39Å; W461-M518 HydrophobicContact CE3-CG 3.96Å; V464-M518 HydrophobicContact CG1-SD 4Å; A465-M518 HydrophobicContact CB-CB 3.7Å; F515-M518 HydrophobicContact CD1-CE 4.24Å; F515-M518 HydrophobicContact CD1-SD 3.85Å; F515-M518 WeakPolarHBondContact O-CB 3.4Å; F515-M518 PolarHBondContact O-N 2.97Å; F516-M518 PolarHBondContact O-N 2.89Å; F516-M518 VanDerWaalsContact O-N 3.17Å; M518-G522 PolarHBondContact O-N 3.44Å
519H97.8Very high96.5Very high14 Ų1442.9 Ų42.97%0.06522%0.218CC..Hα-helixtrans-63.4-45.6170.7-64.999.6000110.9T444 F462 A465 Y469 F516 P517 G522 M523T444-H519 WeakPolarHBondContact CG2-NE2 3.28Å; F462-H519 HydrophobicContact CD2-CB 4.18Å; F462-H519 HydrophobicContact CE2-CB 4.23Å; F462-H519 AromaticContact CE2-CD2 3.94Å; A465-H519 WeakPolarHBondContact CB-CE1 3.24Å; A465-H519 WeakPolarHBondContact CB-NE2 3.32Å; Y469-H519 AromaticContact CD2-CE1 3.7Å; Y469-H519 AromaticContact CE2-CE1 3.68Å; F516-H519 PolarHBondContact O-N 2.9Å; F516-H519 VanDerWaalsContact O-N 3.15Å; F516-H519 PolarHBondContact O-ND1 2.59Å; P517-H519 PolarHBondContact O-N 3.16Å; H519-G522 PolarHBondContact O-N 2.83Å; H519-M523 WeakPolarHBondContact O-CG 3.43Å; H519-M523 PolarHBondContact O-N 2.72Å
520Y97.5Very high96.3Very high106 Ų10641.9 Ų41.942%0.41621%0.211SC..Hα-helixtrans-59.6-50.9175.6171.7-94.5000110.9P517 G522 M523 H524 Y537 V540P517-Y520 WeakPolarHBondContact O-CB 3.45Å; P517-Y520 PolarHBondContact O-N 3.14Å; P517-Y520 VanDerWaalsContact O-N 3.14Å; Y520-G522 VanDerWaalsContact C-N 3.26Å; Y520-G522 PolarHBondContact O-N 2.72Å; Y520-M523 PolarHBondContact O-N 3.48Å; Y520-M523 VanDerWaalsContact O-N 3.13Å; Y520-H524 AromaticContact CD1-CD2 3.97Å; Y520-H524 AromaticContact CD2-CD2 3.92Å; Y520-H524 AromaticContact CD2-NE2 3.88Å; Y520-H524 AromaticContact CE1-CD2 3.61Å; Y520-H524 AromaticContact CE1-NE2 3.87Å; Y520-H524 AromaticContact CE2-CD2 3.57Å; Y520-H524 AromaticContact CE2-NE2 3.15Å; Y520-H524 WeakPolarHBondContact CE2-NE2 3.46Å; Y520-H524 AromaticContact CZ-CD2 3.4Å; Y520-H524 AromaticContact CZ-NE2 3.14Å; Y520-H524 PolarHBondContact O-CD2 3.22Å; Y520-H524 VanDerWaalsContact O-CD2 3.24Å; Y520-H524 PolarHBondContact O-N 3.45Å; Y520-H524 VanDerWaalsContact O-N 3.17Å; Y520-H524 PolarHBondContact OH-NE2 2.76Å; Y520-Y537 HydrophobicContact CE1-CD1 4.21Å; Y520-Y537 HydrophobicContact CE1-CE1 4.31Å; Y520-V540 HydrophobicContact CD1-CG1 4.13Å; Y520-V540 HydrophobicContact CD1-CG2 4.34Å; Y520-V540 HydrophobicContact CE1-CG2 4.17Å
521L97.3Very high96.1Very high0 Ų042.6 Ų42.60%022%0.217CC..Hα-helixtrans-59.6-37.7178.3-63.2176.9000112.3W461 P517 H524 G525 L526 Y537 V540 N541W461-L521 HydrophobicContact CB-CB 4.44Å; W461-L521 HydrophobicContact CD2-CB 4.43Å; W461-L521 HydrophobicContact CE3-CB 3.78Å; W461-L521 HydrophobicContact CE3-CD1 3.46Å; W461-L521 VanDerWaalsContact CE3-CD1 3.46Å; W461-L521 HydrophobicContact CE3-CG 4.25Å; W461-L521 HydrophobicContact CH2-CD1 4.43Å; W461-L521 HydrophobicContact CZ3-CB 4.42Å; W461-L521 HydrophobicContact CZ3-CD1 3.31Å; W461-L521 HydrophobicContact CZ3-CG 4.46Å; P517-L521 WeakPolarHBondContact O-CG 3.36Å; P517-L521 PolarHBondContact O-N 3.2Å; P517-L521 VanDerWaalsContact O-N 3.11Å; L521-H524 PolarHBondContact O-N 3.12Å; L521-G525 PolarHBondContact O-N 3.35Å; L521-L526 HydrophobicContact CB-CD1 4.42Å; L521-L526 HydrophobicContact CB-CD2 4.24Å; L521-L526 HydrophobicContact CD2-CD2 4.31Å; L521-L526 WeakPolarHBondContact O-CB 3.23Å; L521-L526 VanDerWaalsContact O-CD1 3.23Å; L521-L526 WeakPolarHBondContact O-CD1 3.39Å; L521-L526 PolarHBondContact O-N 3.33Å; L521-Y537 HydrophobicContact CD2-CD1 3.41Å; L521-Y537 VanDerWaalsContact CD2-CD1 3.41Å; L521-Y537 HydrophobicContact CD2-CE1 4.36Å; L521-Y537 HydrophobicContact CD2-CG 3.71Å; L521-V540 HydrophobicContact CD1-CG1 4.04Å; L521-V540 HydrophobicContact CD2-CB 4.13Å; L521-V540 HydrophobicContact CD2-CG1 3.94Å; L521-V540 HydrophobicContact CG-CG1 3.92Å; L521-N541 HydrophobicContact CD1-CB 4.31Å
522G97.5Very high96Very high0 Ų044.3 Ų44.30%023%0.23CC..Hα-helixtrans-66-40.8174.600000114.2T460 F462 M518 H519 Y520 H524 G525T460-G522 PolarHBondContact OG1-O 2.97Å; F462-G522 VanDerWaalsContact N-CA 3.31Å; M518-G522 PolarHBondContact O-N 3.44Å; H519-G522 PolarHBondContact O-N 2.83Å; Y520-G522 VanDerWaalsContact C-N 3.26Å; Y520-G522 PolarHBondContact O-N 2.72Å; G522-H524 PolarHBondContact O-N 3.19Å; G522-G525 PolarHBondContact O-N 3.35Å
523M96.9Very high95.9Very high104 Ų10442.6 Ų42.651%0.51222%0.22SC..Hα-helixtrans-63.3-25.7174.5-69.4-173.9-66.900112.4F457 F462 H519 Y520 G525F457-M523 HydrophobicContact CD1-CG 4.41Å; F457-M523 HydrophobicContact CE1-CB 4.34Å; F457-M523 HydrophobicContact CE1-CG 3.72Å; F457-M523 HydrophobicContact CZ-CG 4.23Å; F462-M523 HydrophobicContact CD2-CG 3.82Å; F462-M523 HydrophobicContact CE2-CG 4.05Å; F462-M523 HydrophobicContact CE2-SD 4.45Å; H519-M523 WeakPolarHBondContact O-CG 3.43Å; H519-M523 PolarHBondContact O-N 2.72Å; Y520-M523 PolarHBondContact O-N 3.48Å; Y520-M523 VanDerWaalsContact O-N 3.13Å; M523-G525 PolarHBondContact O-N 3.3Å
524H96.4Very high95.8Very high90 Ų9044 Ų4442%0.41723%0.227SC..THydrogen-bonded Turntrans-83.86.6172.1-77.8-74.2000114Y520 L521 G522 L526 Y537Y520-H524 AromaticContact CD1-CD2 3.97Å; Y520-H524 AromaticContact CD2-CD2 3.92Å; Y520-H524 AromaticContact CD2-NE2 3.88Å; Y520-H524 AromaticContact CE1-CD2 3.61Å; Y520-H524 AromaticContact CE1-NE2 3.87Å; Y520-H524 AromaticContact CE2-CD2 3.57Å; Y520-H524 AromaticContact CE2-NE2 3.15Å; Y520-H524 WeakPolarHBondContact CE2-NE2 3.46Å; Y520-H524 AromaticContact CZ-CD2 3.4Å; Y520-H524 AromaticContact CZ-NE2 3.14Å; Y520-H524 PolarHBondContact O-CD2 3.22Å; Y520-H524 VanDerWaalsContact O-CD2 3.24Å; Y520-H524 PolarHBondContact O-N 3.45Å; Y520-H524 VanDerWaalsContact O-N 3.17Å; Y520-H524 PolarHBondContact OH-NE2 2.76Å; L521-H524 PolarHBondContact O-N 3.12Å; G522-H524 PolarHBondContact O-N 3.19Å; H524-L526 HydrophobicContact CB-CD1 4.09Å; H524-Y537 HydrophobicContact CB-CE1 3.64Å; H524-Y537 WeakPolarHBondContact CB-OH 3.41Å; H524-Y537 AromaticContact CG-CE1 3.65Å; H524-Y537 AromaticContact CG-CZ 3.98Å
525G95Very high95.7Very high41 Ų4148.9 Ų48.942%0.42325%0.25SC..THydrogen-bonded Turntrans82.114.1172.600000114.8L521 G522 M523 P527L521-G525 PolarHBondContact O-N 3.35Å; G522-G525 PolarHBondContact O-N 3.35Å; M523-G525 PolarHBondContact O-N 3.3Å; G525-P527 WeakPolarHBondContact O-CD 3.34Å; G525-P527 VanDerWaalsContact O-N 3.12Å
526L96.2Very high95.6Very high11 Ų1153.6 Ų53.66%0.05827%0.272CS..PPolyproline II helixtrans-63.5116.4176.8-84.677.4000109.7T460 W461 L521 H524 Y537T460-L526 CarbonylContact C-O 3.59Å; T460-L526 VanDerWaalsContact CA-O 3.23Å; T460-L526 WeakPolarHBondContact CA-O 3.21Å; T460-L526 WeakPolarHBondContact CB-O 3.4Å; W461-L526 HydrophobicContact CD2-CB 4.25Å; W461-L526 HydrophobicContact CD2-CD2 4.49Å; W461-L526 HydrophobicContact CG-CB 4.11Å; W461-L526 HydrophobicContact CH2-CD2 4.4Å; W461-L526 HydrophobicContact CZ2-CD2 4.34Å; W461-L526 PolarHBondContact N-O 3.21Å; L521-L526 HydrophobicContact CB-CD1 4.42Å; L521-L526 HydrophobicContact CB-CD2 4.24Å; L521-L526 HydrophobicContact CD2-CD2 4.31Å; L521-L526 WeakPolarHBondContact O-CB 3.23Å; L521-L526 VanDerWaalsContact O-CD1 3.23Å; L521-L526 WeakPolarHBondContact O-CD1 3.39Å; L521-L526 PolarHBondContact O-N 3.33Å; H524-L526 HydrophobicContact CB-CD1 4.09Å; L526-Y537 HydrophobicContact CD1-CD1 4.27Å; L526-Y537 HydrophobicContact CD1-CD2 3.67Å; L526-Y537 HydrophobicContact CD1-CE1 4.17Å; L526-Y537 HydrophobicContact CD1-CE2 3.57Å; L526-Y537 HydrophobicContact CD1-CG 4.04Å; L526-Y537 HydrophobicContact CD2-CD2 4.23Å; L526-Y537 HydrophobicContact CD2-CG 4.38Å; L526-Y537 HydrophobicContact CG-CD2 4.41Å
527P96Very high95.5Very high64 Ų6448.7 Ų48.742%0.41625%0.25SS..BIsolated β-bridgetrans-74.2144.9-175.929.8-35.2000111.5W461 G525 V530W461-P527 PolarHBondContact NE1-O 3.06Å; G525-P527 WeakPolarHBondContact O-CD 3.34Å; G525-P527 VanDerWaalsContact O-N 3.12Å; P527-V530 HydrophobicContact CB-CG2 4.03Å; P527-V530 HydrophobicContact CG-CB 4.15Å; P527-V530 HydrophobicContact CG-CG2 3.53Å
528R94.4Very high95.4Very high43 Ų4351.8 Ų51.816%0.16226%0.26CS..THydrogen-bonded Turntrans-71.7155.9167.874.7-165.1-178.2173.2-4.6109.8D459 V464 V530D459-R528 WeakPolarHBondContact O-CG 3.16Å; D459-R528 PolarHBondContact O-N 2.62Å; D459-R528 IonicContact OD1-CZ 3.71Å; D459-R528 IonicContact OD1-NE 2.94Å; D459-R528 PolarHBondContact OD1-NE 3Å; D459-R528 IonicContact OD1-NH2 3.79Å; D459-R528 PolarHBondContact OD1-NH2 3.47Å; V464-R528 HydrophobicContact CG2-CB 3.86Å; R528-V530 VanDerWaalsContact C-N 3.31Å; R528-V530 PolarHBondContact O-N 3.29Å
529R90.9Very high95.3Very high67 Ų6759.9 Ų59.925%0.25329%0.29SS..THydrogen-bonded Turntrans66.325.3-179.6-50.3166.1-173.7-170.40.6114.7N152 V155 T222N152-R529 PolarHBondContact OD1-O 2.61Å; V155-R529 HydrophobicContact CG1-CG 4.13Å; T222-R529 PolarHBondContact OG1-NH2 2.81Å
530V93.4Very high95.2Very high53 Ų5360.7 Ų60.732%0.32130%0.296SS..  trans-113.4137.1169.8-1770000109Y151 P527 R528 C532Y151-V530 VanDerWaalsContact CE1-C 3.42Å; Y151-V530 VanDerWaalsContact CE1-O 3.28Å; Y151-V530 WeakPolarHBondContact CE1-O 3.25Å; Y151-V530 VanDerWaalsContact CZ-O 3.27Å; Y151-V530 PolarHBondContact OH-O 2.86Å; P527-V530 HydrophobicContact CB-CG2 4.03Å; P527-V530 HydrophobicContact CG-CB 4.15Å; P527-V530 HydrophobicContact CG-CG2 3.53Å; R528-V530 VanDerWaalsContact C-N 3.31Å; R528-V530 PolarHBondContact O-N 3.29Å; V530-C532 WeakPolarHBondContact CG1-O 3.44Å
531S93.3Very high95.1Very high16 Ų1655.6 Ų55.611%0.11228%0.276CS..SBendtrans-87.8-4.6-173.859.30000114.1N137N137-S531 PolarHBondContact ND2-O 3.36Å; N137-S531 VanDerWaalsContact ND2-O 3.13Å
532C93.5Very high95Very high46 Ų4657.5 Ų57.531%0.31129%0.287SS..  trans-134.5166.4177.758.20000110.6Y142 V530Y142-C532 HydrophobicContact CD1-CB 3.67Å; Y142-C532 HydrophobicContact CE1-CB 4.21Å; Y142-C532 HydrophobicContact CG-CB 4.37Å; V530-C532 WeakPolarHBondContact CG1-O 3.44Å
533Y94.3Very high95Very high9 Ų962.4 Ų62.44%0.03531%0.312CS..  trans-153.8165.1179.662.5-80.9000108.6L138 P141 N541L138-Y533 HydrophobicContact CB-CE1 4.39Å; L138-Y533 HydrophobicContact CD2-CD1 4Å; L138-Y533 HydrophobicContact CD2-CE1 4.32Å; L138-Y533 WeakPolarHBondContact O-CE1 3.4Å; L138-Y533 PolarHBondContact O-OH 3.5Å; P141-Y533 HydrophobicContact CB-CD2 4.49Å; P141-Y533 HydrophobicContact CB-CE2 4.13Å; P141-Y533 WeakPolarHBondContact CB-O 2.9Å; P141-Y533 HydrophobicContact CG-CD2 4.47Å; P141-Y533 HydrophobicContact CG-CE2 3.71Å; Y533-N541 WeakPolarHBondContact CE1-ND2 3.3Å; Y533-N541 HydrophobicContact CE2-CB 3.88Å; Y533-N541 PolarHBondContact OH-ND2 3.39Å
534D94.2Very high95Very high82 Ų8257.5 Ų57.544%0.43929%0.287SS..  trans-76.1147.5-175.4-60.6-35.7000112.7Y142 E536 Y537Y142-D534 PolarHBondContact OH-OD1 3.2Å; D534-E536 HydrophobicContact CB-CG 4.25Å; D534-E536 PolarHBondContact O-N 3.26Å; D534-E536 VanDerWaalsContact O-N 3.11Å; D534-Y537 HydrophobicContact CB-CD2 4.11Å; D534-Y537 HydrophobicContact CB-CE2 4.24Å; D534-Y537 PolarHBondContact O-N 2.86Å; D534-Y537 VanDerWaalsContact O-N 3.13Å
535Q94.5Very high95Very high107 Ų10753.4 Ų53.450%0.527%0.269SS..G310 helixtrans-57.5-29.9-174.4-16972.625.700113.4P141 Y537 Y538P141-Q535 VanDerWaalsContact CB-OE1 3.29Å; Q535-Y537 PolarHBondContact O-N 2.88Å; Q535-Y537 VanDerWaalsContact O-N 3.15Å; Q535-Y538 VanDerWaalsContact O-CB 3.24Å; Q535-Y538 WeakPolarHBondContact O-CB 3.15Å; Q535-Y538 PolarHBondContact O-N 3.32Å; Q535-Y538 VanDerWaalsContact O-N 3.09Å
536E96Very high95.1Very high119 Ų11955.8 Ų55.856%0.55627%0.271SS*.G310 helixtrans-60.8-24.3-178.864.8-177.5-17900113.4D534 W539D534-E536 HydrophobicContact CB-CG 4.25Å; D534-E536 PolarHBondContact O-N 3.26Å; D534-E536 VanDerWaalsContact O-N 3.11Å; E536-W539 PolarHBondContact O-NE1 2.85Å
537Y95.6Very high95.2Very high20 Ų2055.3 Ų55.38%0.07827%0.268CS..G310 helixtrans-94.23.3-180-57.7-68.5000114.1Y520 L521 H524 L526 D534 Q535 W539 V540 N541Y520-Y537 HydrophobicContact CE1-CD1 4.21Å; Y520-Y537 HydrophobicContact CE1-CE1 4.31Å; L521-Y537 HydrophobicContact CD2-CD1 3.41Å; L521-Y537 VanDerWaalsContact CD2-CD1 3.41Å; L521-Y537 HydrophobicContact CD2-CE1 4.36Å; L521-Y537 HydrophobicContact CD2-CG 3.71Å; H524-Y537 HydrophobicContact CB-CE1 3.64Å; H524-Y537 WeakPolarHBondContact CB-OH 3.41Å; H524-Y537 AromaticContact CG-CE1 3.65Å; H524-Y537 AromaticContact CG-CZ 3.98Å; L526-Y537 HydrophobicContact CD1-CD1 4.27Å; L526-Y537 HydrophobicContact CD1-CD2 3.67Å; L526-Y537 HydrophobicContact CD1-CE1 4.17Å; L526-Y537 HydrophobicContact CD1-CE2 3.57Å; L526-Y537 HydrophobicContact CD1-CG 4.04Å; L526-Y537 HydrophobicContact CD2-CD2 4.23Å; L526-Y537 HydrophobicContact CD2-CG 4.38Å; L526-Y537 HydrophobicContact CG-CD2 4.41Å; D534-Y537 HydrophobicContact CB-CD2 4.11Å; D534-Y537 HydrophobicContact CB-CE2 4.24Å; D534-Y537 PolarHBondContact O-N 2.86Å; D534-Y537 VanDerWaalsContact O-N 3.13Å; Q535-Y537 PolarHBondContact O-N 2.88Å; Q535-Y537 VanDerWaalsContact O-N 3.15Å; Y537-W539 PolarHBondContact O-N 3.12Å; Y537-V540 PolarHBondContact O-N 3.3Å; Y537-N541 WeakPolarHBondContact O-CB 3.5Å; Y537-N541 PolarHBondContact O-N 3.31Å
538Y95.7Very high95.2Very high84 Ų8452.5 Ų52.533%0.32925%0.252SS..Hα-helixtrans-49.1-57.2-174.5175.9-115.1000113.5C139 D140 P141 Q535 V540 N541 V542C139-Y538 WeakPolarHBondContact O-CE2 3.36Å; D140-Y538 HydrophobicContact CB-CE2 4.34Å; D140-Y538 WeakPolarHBondContact OD1-CE2 3.17Å; P141-Y538 VanDerWaalsContact CD-CD2 3.49Å; P141-Y538 HydrophobicContact CG-CD2 3.79Å; P141-Y538 HydrophobicContact CG-CG 4.31Å; Q535-Y538 VanDerWaalsContact O-CB 3.24Å; Q535-Y538 WeakPolarHBondContact O-CB 3.15Å; Q535-Y538 PolarHBondContact O-N 3.32Å; Q535-Y538 VanDerWaalsContact O-N 3.09Å; Y538-V540 VanDerWaalsContact C-N 3.34Å; Y538-V540 PolarHBondContact O-N 3.38Å; Y538-N541 PolarHBondContact O-N 3.24Å; Y538-N541 VanDerWaalsContact O-N 3.14Å; Y538-V542 HydrophobicContact CD1-CG2 4.45Å; Y538-V542 HydrophobicContact CD2-CG2 3.92Å; Y538-V542 HydrophobicContact CE1-CG2 4.09Å; Y538-V542 HydrophobicContact CE2-CG2 3.57Å; Y538-V542 HydrophobicContact CG-CG2 4.39Å; Y538-V542 WeakPolarHBondContact O-CG2 3.36Å; Y538-V542 PolarHBondContact O-N 3.46Å
539W94.5Very high95.3Very high181 Ų18153.5 Ų53.569%0.68626%0.262SS*.Hα-helixtrans-57.2-44.7-176.6-068.6000112.5E536 Y537 N541 V542 M543E536-W539 PolarHBondContact O-NE1 2.85Å; Y537-W539 PolarHBondContact O-N 3.12Å; W539-N541 VanDerWaalsContact C-N 3.34Å; W539-V542 PolarHBondContact O-N 2.94Å; W539-M543 WeakPolarHBondContact O-CG 3.35Å; W539-M543 PolarHBondContact O-N 3.32Å
540V96.3Very high95.6Very high31 Ų3152.7 Ų52.719%0.18826%0.263CS..Hα-helixtrans-66.5-41.6-179.7-177.50000110.1P517 Y520 L521 Y537 Y538 M543 S544P517-V540 HydrophobicContact CB-CG1 3.54Å; Y520-V540 HydrophobicContact CD1-CG1 4.13Å; Y520-V540 HydrophobicContact CD1-CG2 4.34Å; Y520-V540 HydrophobicContact CE1-CG2 4.17Å; L521-V540 HydrophobicContact CD1-CG1 4.04Å; L521-V540 HydrophobicContact CD2-CB 4.13Å; L521-V540 HydrophobicContact CD2-CG1 3.94Å; L521-V540 HydrophobicContact CG-CG1 3.92Å; Y537-V540 PolarHBondContact O-N 3.3Å; Y538-V540 VanDerWaalsContact C-N 3.34Å; Y538-V540 PolarHBondContact O-N 3.38Å; V540-M543 WeakPolarHBondContact O-CB 3.28Å; V540-M543 PolarHBondContact O-N 3.45Å; V540-S544 PolarHBondContact O-N 2.92Å
541N95.3Very high95.7Very high0 Ų050.8 Ų50.80%025%0.251CS..Hα-helixtrans-73.9-29.5-179.1-16947.8000112.9R135 L138 W461 L521 Y533 Y537 Y538 W539 M543 S544 S545R135-N541 PolarHBondContact NH1-OD1 3.41Å; R135-N541 VanDerWaalsContact NH1-OD1 3.14Å; R135-N541 PolarHBondContact NH2-O 2.94Å; R135-N541 PolarHBondContact NH2-OD1 2.98Å; L138-N541 PolarHBondContact O-ND2 3Å; W461-N541 VanDerWaalsContact CH2-OD1 3.32Å; W461-N541 WeakPolarHBondContact CH2-OD1 3.25Å; W461-N541 VanDerWaalsContact CZ3-OD1 3.23Å; W461-N541 WeakPolarHBondContact CZ3-OD1 3.39Å; L521-N541 HydrophobicContact CD1-CB 4.31Å; Y533-N541 WeakPolarHBondContact CE1-ND2 3.3Å; Y533-N541 HydrophobicContact CE2-CB 3.88Å; Y533-N541 PolarHBondContact OH-ND2 3.39Å; Y537-N541 WeakPolarHBondContact O-CB 3.5Å; Y537-N541 PolarHBondContact O-N 3.31Å; Y538-N541 PolarHBondContact O-N 3.24Å; Y538-N541 VanDerWaalsContact O-N 3.14Å; W539-N541 VanDerWaalsContact C-N 3.34Å; N541-M543 VanDerWaalsContact C-N 3.32Å; N541-M543 PolarHBondContact O-N 2.76Å; N541-S544 WeakPolarHBondContact O-CB 3.23Å; N541-S544 PolarHBondContact O-N 3.26Å; N541-S545 PolarHBondContact O-N 2.88Å
542V95.3Very high95.7Very high40 Ų4050.6 Ų50.624%0.24225%0.25CC..Hα-helixtrans-60.4-41.6168.7169.30000110.8Y538 W539 S544 S545 I546Y538-V542 HydrophobicContact CD1-CG2 4.45Å; Y538-V542 HydrophobicContact CD2-CG2 3.92Å; Y538-V542 HydrophobicContact CE1-CG2 4.09Å; Y538-V542 HydrophobicContact CE2-CG2 3.57Å; Y538-V542 HydrophobicContact CG-CG2 4.39Å; Y538-V542 WeakPolarHBondContact O-CG2 3.36Å; Y538-V542 PolarHBondContact O-N 3.46Å; W539-V542 PolarHBondContact O-N 2.94Å; V542-S544 VanDerWaalsContact C-N 3.33Å; V542-S544 PolarHBondContact O-N 3.33Å; V542-S545 PolarHBondContact O-N 2.89Å; V542-S545 VanDerWaalsContact O-N 3.13Å; V542-I546 HydrophobicContact CG1-CD1 4.02Å; V542-I546 HydrophobicContact CG1-CG1 4.5Å; V542-I546 WeakPolarHBondContact O-CG1 3.3Å; V542-I546 PolarHBondContact O-N 3.35Å
543M96.4Very high95.9Very high103 Ų10351.7 Ų51.751%0.50726%0.255SS..Hα-helixtrans-59.6-44.3173.5-60.1178.897.300111.5W539 V540 N541 S545 I546 G547W539-M543 WeakPolarHBondContact O-CG 3.35Å; W539-M543 PolarHBondContact O-N 3.32Å; V540-M543 WeakPolarHBondContact O-CB 3.28Å; V540-M543 PolarHBondContact O-N 3.45Å; N541-M543 VanDerWaalsContact C-N 3.32Å; N541-M543 PolarHBondContact O-N 2.76Å; M543-S545 VanDerWaalsContact C-N 3.31Å; M543-S545 PolarHBondContact O-N 3.42Å; M543-I546 PolarHBondContact O-N 3.43Å; M543-G547 PolarHBondContact O-N 3.19Å
544S97.3Very high96Very high0 Ų051.2 Ų51.20%025%0.253CS..Hα-helixtrans-59.5-39.1173.4-69.60000113L513 C514 V540 N541 V542 G547 G548L513-S544 VanDerWaalsContact O-CA 3.29Å; L513-S544 WeakPolarHBondContact O-CA 3.25Å; C514-S544 VanDerWaalsContact O-CB 3.3Å; C514-S544 WeakPolarHBondContact O-CB 3.25Å; C514-S544 PolarHBondContact O-OG 3.29Å; V540-S544 PolarHBondContact O-N 2.92Å; N541-S544 WeakPolarHBondContact O-CB 3.23Å; N541-S544 PolarHBondContact O-N 3.26Å; V542-S544 VanDerWaalsContact C-N 3.33Å; V542-S544 PolarHBondContact O-N 3.33Å; S544-G547 PolarHBondContact O-N 2.97Å; S544-G548 PolarHBondContact O-N 3.24Å
545S96.5Very high95.9Very high5 Ų547.6 Ų47.64%0.03524%0.235CC..Hα-helixtrans-67.5-42.4176.9-76.90000112.7R135 C139 N541 V542 M543 G547 G548 V549R135-S545 PolarHBondContact NE-OG 3.39Å; R135-S545 VanDerWaalsContact NH2-N 3.16Å; R135-S545 PolarHBondContact NH2-OG 3.42Å; R135-S545 PolarHBondContact O-OG 3.11Å; C139-S545 PolarHBondContact SG-OG 3.24Å; N541-S545 PolarHBondContact O-N 2.88Å; V542-S545 PolarHBondContact O-N 2.89Å; V542-S545 VanDerWaalsContact O-N 3.13Å; M543-S545 VanDerWaalsContact C-N 3.31Å; M543-S545 PolarHBondContact O-N 3.42Å; S545-G547 VanDerWaalsContact C-N 3.33Å; S545-G547 PolarHBondContact O-N 3.05Å; S545-G548 WeakPolarHBondContact O-CA 3.42Å; S545-G548 PolarHBondContact O-N 3.29Å; S545-G548 VanDerWaalsContact O-N 3.15Å; S545-V549 PolarHBondContact O-N 2.99Å
546I97.6Very high95.8Very high91 Ų9148 Ų4847%0.46724%0.235SC..Hα-helixtrans-60-46.7174.6-66.8166.8000109.8V542 M543 G548 V549 L550V542-I546 HydrophobicContact CG1-CD1 4.02Å; V542-I546 HydrophobicContact CG1-CG1 4.5Å; V542-I546 WeakPolarHBondContact O-CG1 3.3Å; V542-I546 PolarHBondContact O-N 3.35Å; M543-I546 PolarHBondContact O-N 3.43Å; I546-G548 VanDerWaalsContact C-N 3.28Å; I546-G548 PolarHBondContact O-N 3.42Å; I546-V549 PolarHBondContact O-N 3.37Å; I546-L550 HydrophobicContact CG2-CD1 4.13Å; I546-L550 HydrophobicContact CG2-CG 4.47Å; I546-L550 WeakPolarHBondContact O-CG 3.37Å; I546-L550 PolarHBondContact O-N 3.14Å
547G97.6Very high95.8Very high0 Ų044.2 Ų44.20%022%0.22CC..Hα-helixtrans-59-39.2174.600000113G510 M543 S544 S545 L550 S551G510-G547 CarbonylContact C-O 3.56Å; G510-G547 CarbonylContact O-C 3.57Å; G510-G547 VanDerWaalsContact O-CA 3.26Å; G510-G547 WeakPolarHBondContact O-CA 3.27Å; G510-G547 VanDerWaalsContact O-O 3.11Å; M543-G547 PolarHBondContact O-N 3.19Å; S544-G547 PolarHBondContact O-N 2.97Å; S545-G547 VanDerWaalsContact C-N 3.33Å; S545-G547 PolarHBondContact O-N 3.05Å; G547-L550 PolarHBondContact O-N 3.42Å; G547-S551 WeakPolarHBondContact O-CB 3.22Å; G547-S551 PolarHBondContact O-N 3.37Å; G547-S551 PolarHBondContact O-OG 3.33Å
548G96.2Very high95.8Very high6 Ų643.7 Ų43.76%0.06222%0.219CC..Hα-helixtrans-59.1-48173.900000112.7S544 S545 I546 S551 V552S544-G548 PolarHBondContact O-N 3.24Å; S545-G548 WeakPolarHBondContact O-CA 3.42Å; S545-G548 PolarHBondContact O-N 3.29Å; S545-G548 VanDerWaalsContact O-N 3.15Å; I546-G548 VanDerWaalsContact C-N 3.28Å; I546-G548 PolarHBondContact O-N 3.42Å; G548-S551 WeakPolarHBondContact O-CB 3.28Å; G548-S551 PolarHBondContact O-N 2.8Å; G548-V552 WeakPolarHBondContact O-CG2 3.27Å; G548-V552 PolarHBondContact O-N 2.81Å; G548-V552 VanDerWaalsContact O-N 3.09Å
549V96.6Very high95.5Very high63 Ų6342.8 Ų42.838%0.38222%0.219SC..Hα-helixtrans-62-46.9176.1174.70000111L132 S545 I546 S551 V552 V553L132-V549 HydrophobicContact CD1-CG2 4.07Å; S545-V549 PolarHBondContact O-N 2.99Å; I546-V549 PolarHBondContact O-N 3.37Å; V549-S551 VanDerWaalsContact C-N 3.28Å; V549-S551 PolarHBondContact O-N 2.85Å; V549-V552 PolarHBondContact O-N 3.36Å; V549-V553 HydrophobicContact CG1-CG2 4.41Å; V549-V553 WeakPolarHBondContact O-CG2 3.17Å; V549-V553 PolarHBondContact O-N 2.78Å
550L97.7Very high95.5Very high51 Ų5139 Ų3927%0.26721%0.208SC..Hα-helixtrans-59.4-39177.5-69.1174.9000112.2L506 V509 L513 I546 G547 V553 S554L506-L550 HydrophobicContact CD1-CB 4.06Å; L506-L550 HydrophobicContact CD1-CD2 3.73Å; L506-L550 HydrophobicContact CD1-CG 4.43Å; V509-L550 HydrophobicContact CG1-CD1 4.11Å; L513-L550 HydrophobicContact CD1-CD1 4Å; I546-L550 HydrophobicContact CG2-CD1 4.13Å; I546-L550 HydrophobicContact CG2-CG 4.47Å; I546-L550 WeakPolarHBondContact O-CG 3.37Å; I546-L550 PolarHBondContact O-N 3.14Å; G547-L550 PolarHBondContact O-N 3.42Å; L550-V553 PolarHBondContact O-N 3.41Å; L550-S554 PolarHBondContact O-N 2.86Å
551S95.5Very high95.5Very high12 Ų1237.5 Ų37.58%0.08420%0.199CC..Hα-helixtrans-63.9-41.6177-58.40000111.9G510 F511 G547 G548 V549 S554 G555G510-S551 PolarHBondContact O-OG 3.47Å; F511-S551 WeakPolarHBondContact CD1-OG 3.35Å; F511-S551 PolarHBondContact N-OG 2.87Å; G547-S551 WeakPolarHBondContact O-CB 3.22Å; G547-S551 PolarHBondContact O-N 3.37Å; G547-S551 PolarHBondContact O-OG 3.33Å; G548-S551 WeakPolarHBondContact O-CB 3.28Å; G548-S551 PolarHBondContact O-N 2.8Å; V549-S551 VanDerWaalsContact C-N 3.28Å; V549-S551 PolarHBondContact O-N 2.85Å; S551-S554 WeakPolarHBondContact O-CB 3.39Å; S551-S554 PolarHBondContact O-N 3.46Å; S551-G555 PolarHBondContact O-N 3.1Å
552V93.6Very high95.3Very high13 Ų1338.2 Ų38.28%0.07920%0.203CC..Hα-helixtrans-65.6-45.5175.6172.40000110.9L132 G548 V549 S554 G555 F556L132-V552 HydrophobicContact CB-CG2 4.16Å; L132-V552 HydrophobicContact CD1-CG2 4.36Å; L132-V552 HydrophobicContact CD2-CG1 4.46Å; G548-V552 WeakPolarHBondContact O-CG2 3.27Å; G548-V552 PolarHBondContact O-N 2.81Å; G548-V552 VanDerWaalsContact O-N 3.09Å; V549-V552 PolarHBondContact O-N 3.36Å; V552-S554 PolarHBondContact O-N 2.8Å; V552-G555 PolarHBondContact O-N 2.78Å; V552-F556 HydrophobicContact CG1-CD2 4.11Å; V552-F556 HydrophobicContact CG1-CE2 3.76Å; V552-F556 WeakPolarHBondContact O-CD2 3.39Å; V552-F556 PolarHBondContact O-N 2.62Å
553V96.4Very high95.1Very high68 Ų6843.4 Ų43.441%0.41222%0.218SC..Hα-helixtrans-58.6-39175.31780000110.5L506 V549 L550 G555 F556 V557L506-V553 HydrophobicContact CD2-CB 4.37Å; L506-V553 HydrophobicContact CD2-CG1 3.93Å; V549-V553 HydrophobicContact CG1-CG2 4.41Å; V549-V553 WeakPolarHBondContact O-CG2 3.17Å; V549-V553 PolarHBondContact O-N 2.78Å; L550-V553 PolarHBondContact O-N 3.41Å; V553-G555 VanDerWaalsContact C-N 3.29Å; V553-G555 PolarHBondContact O-N 3.47Å; V553-F556 PolarHBondContact O-N 2.82Å; V553-F556 VanDerWaalsContact O-N 3.11Å; V553-V557 HydrophobicContact CG1-CG2 4.34Å; V553-V557 WeakPolarHBondContact O-CG2 3.16Å; V553-V557 PolarHBondContact O-N 3.02Å
554S96.5Very high95Very high0 Ų039.8 Ų39.80%020%0.2CC..Hα-helixtrans-58-40.3174.6-161.80000112.8H503 S507 L550 S551 V552 F556 V557 L558H503-S554 PolarHBondContact CD2-O 3.39Å; H503-S554 PolarHBondContact CD2-OG 3.49Å; H503-S554 PolarHBondContact NE2-O 2.91Å; H503-S554 PolarHBondContact NE2-OG 3.35Å; S507-S554 PolarHBondContact OG-OG 2.89Å; L550-S554 PolarHBondContact O-N 2.86Å; S551-S554 WeakPolarHBondContact O-CB 3.39Å; S551-S554 PolarHBondContact O-N 3.46Å; V552-S554 PolarHBondContact O-N 2.8Å; S554-F556 VanDerWaalsContact C-N 3.34Å; S554-F556 PolarHBondContact O-N 3.47Å; S554-V557 PolarHBondContact O-N 3.31Å; S554-L558 PolarHBondContact O-N 2.94Å
555G92.4Very high94.8Very high6 Ų639.8 Ų39.86%0.06220%0.2CC..Hα-helixtrans-59.1-42.7174.200000112.8S551 V552 V553 L558 L559S551-G555 PolarHBondContact O-N 3.1Å; V552-G555 PolarHBondContact O-N 2.78Å; V553-G555 VanDerWaalsContact C-N 3.29Å; V553-G555 PolarHBondContact O-N 3.47Å; G555-L558 WeakPolarHBondContact O-CB 3.14Å; G555-L558 PolarHBondContact O-N 3.41Å; G555-L559 PolarHBondContact O-N 2.91Å
556F93.4Very high94.6Very high115 Ų11543.9 Ų43.950%0.50422%0.221SC..Hα-helixtrans-69.2-35.9175.1-72.9-75.1000113F125 V552 V553 S554 L558 L559 F560F125-F556 HydrophobicContact CD1-CE1 4.09Å; F125-F556 HydrophobicContact CD1-CZ 4.03Å; F125-F556 AromaticContact CE1-CD1 3.83Å; F125-F556 HydrophobicContact CE1-CD1 3.83Å; F125-F556 HydrophobicContact CE1-CD2 4.33Å; F125-F556 AromaticContact CE1-CE1 3.63Å; F125-F556 HydrophobicContact CE1-CE1 3.63Å; F125-F556 HydrophobicContact CE1-CE2 4.16Å; F125-F556 HydrophobicContact CE1-CG 4.18Å; F125-F556 AromaticContact CE1-CZ 3.81Å; F125-F556 HydrophobicContact CE1-CZ 3.81Å; F125-F556 HydrophobicContact CZ-CD1 4.47Å; V552-F556 HydrophobicContact CG1-CD2 4.11Å; V552-F556 HydrophobicContact CG1-CE2 3.76Å; V552-F556 WeakPolarHBondContact O-CD2 3.39Å; V552-F556 PolarHBondContact O-N 2.62Å; V553-F556 PolarHBondContact O-N 2.82Å; V553-F556 VanDerWaalsContact O-N 3.11Å; S554-F556 VanDerWaalsContact C-N 3.34Å; S554-F556 PolarHBondContact O-N 3.47Å; F556-L558 VanDerWaalsContact C-N 3.3Å; F556-L558 PolarHBondContact O-N 3.1Å; F556-L559 PolarHBondContact O-N 2.84Å; F556-F560 PolarHBondContact O-N 3.3Å
557V96.6Very high94.3Very high40 Ų4044 Ų4424%0.24223%0.225CC..Hα-helixtrans-61.8-39.11741710000111H503 L506 V553 S554 L559 F560 I561H503-V557 HydrophobicContact CB-CG1 3.99Å; L506-V557 HydrophobicContact CD2-CG2 3.86Å; V553-V557 HydrophobicContact CG1-CG2 4.34Å; V553-V557 WeakPolarHBondContact O-CG2 3.16Å; V553-V557 PolarHBondContact O-N 3.02Å; S554-V557 PolarHBondContact O-N 3.31Å; V557-L559 PolarHBondContact O-N 2.87Å; V557-F560 WeakPolarHBondContact O-CB 3.41Å; V557-F560 PolarHBondContact O-N 3.07Å; V557-I561 HydrophobicContact CG1-CD1 3.92Å; V557-I561 HydrophobicContact CG1-CG1 4.47Å; V557-I561 VanDerWaalsContact O-CG1 3.3Å; V557-I561 WeakPolarHBondContact O-CG1 3.4Å; V557-I561 PolarHBondContact O-N 3.02Å
558L94.5Very high94.1Very high8 Ų847.4 Ų47.44%0.04225%0.246CC..Hα-helixtrans-58.9-47.8173.2-178.461.8000111.4M479 V480 L483 S554 G555 F556 F560 I561 L562M479-L558 HydrophobicContact CE-CD2 4.27Å; V480-L558 HydrophobicContact CG2-CD2 4.15Å; L483-L558 HydrophobicContact CD2-CD1 4.36Å; S554-L558 PolarHBondContact O-N 2.94Å; G555-L558 WeakPolarHBondContact O-CB 3.14Å; G555-L558 PolarHBondContact O-N 3.41Å; F556-L558 VanDerWaalsContact C-N 3.3Å; F556-L558 PolarHBondContact O-N 3.1Å; L558-F560 VanDerWaalsContact C-N 3.3Å; L558-F560 PolarHBondContact O-N 3.22Å; L558-I561 WeakPolarHBondContact O-CB 3.48Å; L558-I561 PolarHBondContact O-N 2.83Å; L558-L562 HydrophobicContact CG-CD1 4.46Å; L558-L562 WeakPolarHBondContact O-CG 3.19Å; L558-L562 PolarHBondContact O-N 3.27Å; L558-L562 VanDerWaalsContact O-N 3.11Å
559L90.5Very high93.9Very high65 Ų6548.1 Ų48.134%0.3425%0.254SS..Hα-helixtrans-59.8-41.7176.4-70.8-174.1000112.3F125 G555 F556 V557 I561 L562 W563F125-L559 HydrophobicContact CD2-CD1 4.27Å; F125-L559 HydrophobicContact CE1-CD1 3.99Å; F125-L559 HydrophobicContact CE2-CD1 3.38Å; F125-L559 HydrophobicContact CE2-CD2 3.98Å; F125-L559 HydrophobicContact CE2-CG 3.68Å; F125-L559 HydrophobicContact CZ-CD1 3.21Å; F125-L559 HydrophobicContact CZ-CD2 4.36Å; F125-L559 HydrophobicContact CZ-CG 3.56Å; G555-L559 PolarHBondContact O-N 2.91Å; F556-L559 PolarHBondContact O-N 2.84Å; V557-L559 PolarHBondContact O-N 2.87Å; L559-I561 VanDerWaalsContact C-N 3.32Å; L559-I561 PolarHBondContact O-N 3.18Å; L559-L562 PolarHBondContact O-N 2.99Å; L559-W563 WeakPolarHBondContact O-CB 3.39Å; L559-W563 PolarHBondContact O-N 3.35Å
560F94Very high93.6Very high101 Ų10149.4 Ų49.444%0.44326%0.258SS..Hα-helixtrans-60.3-41.6176.5176.5-100.7000111.8L499 F556 V557 L558 W563 E564L499-F560 HydrophobicContact CD1-CD1 4.3Å; L499-F560 HydrophobicContact CD1-CE1 3.87Å; L499-F560 HydrophobicContact CD2-CE1 4.43Å; F556-F560 PolarHBondContact O-N 3.3Å; V557-F560 WeakPolarHBondContact O-CB 3.41Å; V557-F560 PolarHBondContact O-N 3.07Å; L558-F560 VanDerWaalsContact C-N 3.3Å; L558-F560 PolarHBondContact O-N 3.22Å; F560-W563 AromaticContact CD2-CE3 3.9Å; F560-W563 HydrophobicContact CD2-CE3 3.9Å; F560-W563 HydrophobicContact CD2-CZ3 4.13Å; F560-W563 AromaticContact CE2-CE3 3.87Å; F560-W563 HydrophobicContact CE2-CE3 3.87Å; F560-W563 AromaticContact CE2-CZ3 3.65Å; F560-W563 HydrophobicContact CE2-CZ3 3.65Å; F560-W563 HydrophobicContact CZ-CZ3 4.46Å; F560-W563 PolarHBondContact O-N 2.75Å; F560-E564 VanDerWaalsContact O-CB 3.28Å; F560-E564 WeakPolarHBondContact O-CB 3.23Å; F560-E564 PolarHBondContact O-N 3.26Å
561I96.1Very high93.3Very high0 Ų056 Ų560%028%0.28CS..Hα-helixtrans-62.7-43.4177.3-72166.4000111.8L495 L499 L500 H503 V557 L558 L559 S565L495-I561 HydrophobicContact CB-CG2 4.44Å; L495-I561 HydrophobicContact CD2-CG2 3.88Å; L499-I561 HydrophobicContact CB-CD1 3.94Å; L499-I561 HydrophobicContact CB-CG1 3.68Å; L499-I561 HydrophobicContact CD1-CG1 4.24Å; L499-I561 WeakPolarHBondContact O-CD1 3.39Å; L500-I561 HydrophobicContact CD2-CD1 4.25Å; L500-I561 HydrophobicContact CD2-CG2 4.04Å; L500-I561 HydrophobicContact CG-CG2 4.43Å; H503-I561 HydrophobicContact CB-CD1 3.65Å; V557-I561 HydrophobicContact CG1-CD1 3.92Å; V557-I561 HydrophobicContact CG1-CG1 4.47Å; V557-I561 VanDerWaalsContact O-CG1 3.3Å; V557-I561 WeakPolarHBondContact O-CG1 3.4Å; V557-I561 PolarHBondContact O-N 3.02Å; L558-I561 WeakPolarHBondContact O-CB 3.48Å; L558-I561 PolarHBondContact O-N 2.83Å; L559-I561 VanDerWaalsContact C-N 3.32Å; L559-I561 PolarHBondContact O-N 3.18Å; I561-S565 PolarHBondContact O-N 2.6Å; I561-S565 VanDerWaalsContact O-N 3.11Å
562L90.9Very high92.9Very high16 Ų1657.8 Ų57.88%0.08429%0.29CS..Hα-helixtrans-66.8-42.2178.1-57.8172.2000111.1L483 W487 L495 L558 L559 S565 L566L483-L562 HydrophobicContact CD1-CD2 4.49Å; L483-L562 HydrophobicContact CD2-CD1 3.69Å; L483-L562 HydrophobicContact CD2-CD2 3.65Å; L483-L562 HydrophobicContact CD2-CG 4.24Å; L483-L562 HydrophobicContact CG-CD2 4Å; W487-L562 HydrophobicContact CD2-CD2 4.07Å; W487-L562 HydrophobicContact CE3-CD2 3.7Å; W487-L562 HydrophobicContact CH2-CB 3.86Å; W487-L562 HydrophobicContact CH2-CD2 3.89Å; W487-L562 HydrophobicContact CH2-CG 4.37Å; W487-L562 HydrophobicContact CZ2-CB 4.27Å; W487-L562 HydrophobicContact CZ2-CD2 4.25Å; W487-L562 HydrophobicContact CZ3-CB 4.35Å; W487-L562 HydrophobicContact CZ3-CD2 3.62Å; W487-L562 HydrophobicContact CZ3-CG 4.38Å; L495-L562 HydrophobicContact CD2-CD2 4.3Å; L558-L562 HydrophobicContact CG-CD1 4.46Å; L558-L562 WeakPolarHBondContact O-CG 3.19Å; L558-L562 PolarHBondContact O-N 3.27Å; L558-L562 VanDerWaalsContact O-N 3.11Å; L559-L562 PolarHBondContact O-N 2.99Å; L562-S565 PolarHBondContact O-N 3.08Å; L562-L566 WeakPolarHBondContact O-CG 3.23Å; L562-L566 PolarHBondContact O-N 3.44Å
563W91.4Very high92.1Very high148 Ų14865.9 Ų65.956%0.56133%0.329SS*.Hα-helixtrans-63.6-45.7175.8172.481.8000112L559 F560 S565 L566 V567L559-W563 WeakPolarHBondContact O-CB 3.39Å; L559-W563 PolarHBondContact O-N 3.35Å; F560-W563 AromaticContact CD2-CE3 3.9Å; F560-W563 HydrophobicContact CD2-CE3 3.9Å; F560-W563 HydrophobicContact CD2-CZ3 4.13Å; F560-W563 AromaticContact CE2-CE3 3.87Å; F560-W563 HydrophobicContact CE2-CE3 3.87Å; F560-W563 AromaticContact CE2-CZ3 3.65Å; F560-W563 HydrophobicContact CE2-CZ3 3.65Å; F560-W563 HydrophobicContact CZ-CZ3 4.46Å; F560-W563 PolarHBondContact O-N 2.75Å; W563-S565 VanDerWaalsContact C-N 3.3Å; W563-S565 PolarHBondContact O-N 3.1Å; W563-L566 WeakPolarHBondContact O-CB 3.39Å; W563-L566 PolarHBondContact O-N 3.45Å; W563-L566 VanDerWaalsContact O-N 3.12Å; W563-V567 HydrophobicContact CD2-CG2 4.04Å; W563-V567 HydrophobicContact CG-CG2 4.41Å; W563-V567 HydrophobicContact CH2-CG2 4.44Å; W563-V567 HydrophobicContact CZ2-CG2 3.78Å; W563-V567 WeakPolarHBondContact O-CG2 3.36Å; W563-V567 PolarHBondContact O-N 3.22Å
564E94.8Very high90.9Very high27 Ų2765.3 Ų65.313%0.12634%0.337CS..Hα-helixtrans-58-43.4177.8-176.5-90.8-178.200111.1L499 F560 L566 V567 V568L499-E564 HydrophobicContact CD1-CG 4.24Å; F560-E564 VanDerWaalsContact O-CB 3.28Å; F560-E564 WeakPolarHBondContact O-CB 3.23Å; F560-E564 PolarHBondContact O-N 3.26Å; E564-L566 VanDerWaalsContact C-N 3.31Å; E564-L566 PolarHBondContact O-N 2.86Å; E564-V567 PolarHBondContact O-N 3.21Å; E564-V568 HydrophobicContact CG-CG2 4Å; E564-V568 WeakPolarHBondContact O-CB 3.4Å; E564-V568 WeakPolarHBondContact O-CG2 3.39Å; E564-V568 PolarHBondContact O-N 2.9Å
565S92.9Very high89.2Confident1 Ų170.8 Ų70.81%0.00737%0.366CS..Hα-helixtrans-60.6-39.4176.7-173.80000113W487 Y493 S494 I561 L562 W563 G569W487-S565 PolarHBondContact NE1-OG 3.28Å; Y493-S565 WeakPolarHBondContact CB-OG 3.4Å; S494-S565 PolarHBondContact O-OG 3.27Å; I561-S565 PolarHBondContact O-N 2.6Å; I561-S565 VanDerWaalsContact O-N 3.11Å; L562-S565 PolarHBondContact O-N 3.08Å; W563-S565 VanDerWaalsContact C-N 3.3Å; W563-S565 PolarHBondContact O-N 3.1Å; S565-G569 PolarHBondContact O-N 3.46Å
566L91.3Very high87.1Confident91 Ų9184.1 Ų84.148%0.47641%0.414SS..Hα-helixtrans-70-36.7176.8-66.9172000112.7W487 V491 Y493 L562 W563 E564W487-L566 HydrophobicContact CH2-CD1 4.47Å; W487-L566 HydrophobicContact CH2-CD2 4.47Å; W487-L566 HydrophobicContact CH2-CG 4.35Å; W487-L566 HydrophobicContact CZ2-CD2 4.13Å; W487-L566 HydrophobicContact CZ2-CG 4.03Å; V491-L566 HydrophobicContact CG1-CD2 3.51Å; Y493-L566 HydrophobicContact CD2-CD2 4.18Å; Y493-L566 HydrophobicContact CE2-CD2 4.35Å; L562-L566 WeakPolarHBondContact O-CG 3.23Å; L562-L566 PolarHBondContact O-N 3.44Å; W563-L566 WeakPolarHBondContact O-CB 3.39Å; W563-L566 PolarHBondContact O-N 3.45Å; W563-L566 VanDerWaalsContact O-N 3.12Å; E564-L566 VanDerWaalsContact C-N 3.31Å; E564-L566 PolarHBondContact O-N 2.86Å
567V91.1Very high86.8Confident92 Ų9282.6 Ų82.656%0.55841%0.41SS*.Hα-helixtrans-77.4-45.8-178.4171.60000111.7W563 E564 G569W563-V567 HydrophobicContact CD2-CG2 4.04Å; W563-V567 HydrophobicContact CG-CG2 4.41Å; W563-V567 HydrophobicContact CH2-CG2 4.44Å; W563-V567 HydrophobicContact CZ2-CG2 3.78Å; W563-V567 WeakPolarHBondContact O-CG2 3.36Å; W563-V567 PolarHBondContact O-N 3.22Å; E564-V567 PolarHBondContact O-N 3.21Å; V567-G569 VanDerWaalsContact C-N 3.34Å
568V93.8Very high86.3Confident72 Ų7284.8 Ų84.844%0.43642%0.419SS..Hα-helixtrans-70.6-35.5179177.60000110.4E564 N570E564-V568 HydrophobicContact CG-CG2 4Å; E564-V568 WeakPolarHBondContact O-CB 3.4Å; E564-V568 WeakPolarHBondContact O-CG2 3.39Å; E564-V568 PolarHBondContact O-N 2.9Å; V568-N570 VanDerWaalsContact C-N 3.29Å; V568-N570 HydrophobicContact CG1-CB 4.47Å; V568-N570 WeakPolarHBondContact CG1-ND2 3.2Å; V568-N570 PolarHBondContact O-N 3.32Å
569G91.3Very high85.8Confident22 Ų2289.1 Ų89.123%0.22744%0.44CS..  trans65.730.4172.100000113.8Y493 S565 V567 R571Y493-G569 VanDerWaalsContact CD1-C 3.48Å; Y493-G569 WeakPolarHBondContact CD1-O 3.23Å; Y493-G569 WeakPolarHBondContact CE1-O 3.41Å; S565-G569 PolarHBondContact O-N 3.46Å; V567-G569 VanDerWaalsContact C-N 3.34Å; G569-R571 PolarHBondContact O-N 3.43Å
570N92Very high85.5Confident89 Ų8990.5 Ų90.548%0.47645%0.446SS..  trans-63.195.9177.4-79.9-22.8000110.3Y493 S494 V568 V572Y493-N570 CarbonylContact C-O 3.53Å; Y493-N570 VanDerWaalsContact CA-O 3.25Å; Y493-N570 WeakPolarHBondContact CA-O 3.44Å; S494-N570 PolarHBondContact N-O 3.03Å; S494-N570 VanDerWaalsContact OG-CB 3.23Å; S494-N570 WeakPolarHBondContact OG-CB 3.37Å; S494-N570 PolarHBondContact OG-O 3.36Å; V568-N570 VanDerWaalsContact C-N 3.29Å; V568-N570 HydrophobicContact CG1-CB 4.47Å; V568-N570 WeakPolarHBondContact CG1-ND2 3.2Å; V568-N570 PolarHBondContact O-N 3.32Å; N570-V572 PolarHBondContact O-N 3.27Å
571R90.4Very high85Confident191 Ų19189.9 Ų89.972%0.72145%0.446SS*.BIsolated β-bridgetrans-66.3132.6-177.5-69.1-177.3-173.8-177.22.3111.2Y493 G569 M573Y493-R571 HydrophobicContact CD1-CG 4.05Å; Y493-R571 HydrophobicContact CE1-CG 3.77Å; G569-R571 PolarHBondContact O-N 3.43Å; R571-M573 PolarHBondContact O-N 3.02Å
572V86.4Confident84.3Confident49 Ų4995.9 Ų95.930%0.29748%0.475SS..  trans-80.5109.3172-179.20000108.6P488 G492 N570 G574 L575P488-V572 HydrophobicContact CB-CB 4.48Å; P488-V572 HydrophobicContact CB-CG2 3.92Å; P488-V572 HydrophobicContact CG-CG2 4.45Å; G492-V572 PolarHBondContact O-N 3Å; N570-V572 PolarHBondContact O-N 3.27Å; V572-G574 VanDerWaalsContact C-N 3.32Å; V572-G574 VanDerWaalsContact CG1-O 3.27Å; V572-G574 WeakPolarHBondContact CG1-O 3.25Å; V572-L575 HydrophobicContact CG1-CD2 4.41Å; V572-L575 HydrophobicContact CG1-CG 4.48Å
573M77.9Confident83.8Confident182 Ų182101.6 Ų101.690%0.89750%0.503SS*.SBendtrans-77.9-17.2-177.3-65.7-64.8-68.400113.2R571R571-M573 PolarHBondContact O-N 3.02Å
574G71.3Confident83.2Confident56 Ų5698 Ų9858%0.57750%0.499SS*.  trans-162.7137175.900000110.7V572V572-G574 VanDerWaalsContact C-N 3.32Å; V572-G574 VanDerWaalsContact CG1-O 3.27Å; V572-G574 WeakPolarHBondContact CG1-O 3.25Å
575L61.1Low82.3Confident115 Ų115103.9 Ų103.960%0.60253%0.53SS*.  trans-89.6132.4165.8-73.2160.9000107P488 F489 V572P488-L575 HydrophobicContact CB-CD2 4.04Å; F489-L575 HydrophobicContact CD2-CD1 4.31Å; V572-L575 HydrophobicContact CG1-CD2 4.41Å; V572-L575 HydrophobicContact CG1-CG 4.48Å
576W47.9Very low81.3Confident287 Ų287113.3 Ų113.3100%1.08758%0.578SS**  trans-64.50168.9-108.674.4000110.5

Retrieved 576 of 576 residues in 1066.6 ms (Link to these results)