A0A060WWE8_ONCMY Loading...

Monocarboxylate transporter 9

Extracellular pH-and Na(+)-sensitive low-affinity creatine transporter. Also functions as a pH-independent carnitine efflux transporter.

AlphaFold DB , UniProt , Accession A0A060WWE8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110502533, Length 495 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
1M31.6Very low44.6Very low252 Ų252127.9 Ų127.9100%1.24169%0.689SS**  084.70-157.8157.8176.400106.6
2S25.2Very low47.3Very low104 Ų104119.4 Ų119.473%0.72765%0.654SS**  trans-93.9136.7176.549.70000108.7H4S2-H4 PolarHBondContact O-N 2.66Å
3P36.4Very low50.2Low115 Ų115114.8 Ų114.875%0.74765%0.65SS**  trans-69.8123.7-179.329.3-31.6000108.1T5P3-T5 VanDerWaalsContact C-N 3.34Å; P3-T5 PolarHBondContact O-N 3.25Å
4H35Very low52.7Low187 Ų187115.9 Ų115.987%0.86664%0.639SS**  trans-59.9100.5165.4-75.6-69.8000107.7S2 S6S2-H4 PolarHBondContact O-N 2.66Å; H4-S6 PolarHBondContact O-N 3.44Å
5T34.1Very low55Low129 Ų129108.2 Ų108.279%0.79160%0.597SS**  trans-64.788165.443.30000107.6P3 K7P3-T5 VanDerWaalsContact C-N 3.34Å; P3-T5 PolarHBondContact O-N 3.25Å; T5-K7 PolarHBondContact O-N 3.45Å
6S39.1Very low57.2Low97 Ų97107.1 Ų107.168%0.67858%0.581SS**  trans-56.6108.5163.3-176.90000106.5H4 K8H4-S6 PolarHBondContact O-N 3.44Å; S6-K8 PolarHBondContact O-N 3.32Å
7K48.8Very low59.2Low160 Ų160104 Ų10470%0.69657%0.566SS**PPolyproline II helixtrans-58.4117.6173-87.6-178.1174.6-179.90106.8T5 A9T5-K7 PolarHBondContact O-N 3.45Å; K7-A9 PolarHBondContact O-N 3.14Å
8K51.5Low61Low192 Ų19298.3 Ų98.384%0.83554%0.535SS*.PPolyproline II helixtrans-50.3128178.4-158.2173.3-174.6177.50108.8S6 L10S6-K8 PolarHBondContact O-N 3.32Å; K8-L10 PolarHBondContact O-N 3Å
9A57.6Low62.6Low31 Ų3193.2 Ų93.226%0.25651%0.507SS..PPolyproline II helixtrans-51.2131178.300000109.8K7 D11 D136K7-A9 PolarHBondContact O-N 3.14Å; A9-D11 PolarHBondContact O-N 3.34Å; A9-D136 HydrophobicContact CB-CB 3.95Å
10L62.9Low64.2Low89 Ų8993.5 Ų93.547%0.46651%0.512SS..  trans-87.988.3-176.8-74.2147.8000107.5K8 G12 Y134 L194K8-L10 PolarHBondContact O-N 3Å; L10-G12 PolarHBondContact O-N 3.43Å; L10-Y134 CarbonylContact C-O 3.6Å; L10-Y134 PolarHBondContact N-O 3.46Å; L10-Y134 VanDerWaalsContact N-O 3.15Å; L10-L194 HydrophobicContact CD1-CD2 4.15Å
11D69Low65.7Low51 Ų5189.4 Ų89.427%0.27349%0.49SS..SBendtrans-64.525.1171.4-72.3-42.5000113A9 D136 K137A9-D11 PolarHBondContact O-N 3.34Å; D11-D136 PolarHBondContact OD1-N 3.02Å; D11-K137 PolarHBondContact OD1-N 2.94Å; D11-K137 VanDerWaalsContact OD1-N 3.07Å; D11-K137 WeakPolarHBondContact OD2-CB 3.36Å; D11-K137 WeakPolarHBondContact OD2-CG 3.37Å
12G76.3Confident68.7Low26 Ų2677.4 Ų77.427%0.26843%0.431SS..SBendtrans-176.9179.1-177.500000113.6L10 W14L10-G12 PolarHBondContact O-N 3.43Å; G12-W14 PolarHBondContact O-N 3.5Å
13G85.1Confident72Confident59 Ų5974.9 Ų74.961%0.60841%0.408SS*.THydrogen-bonded Turntrans67.9-123.7179.400000113.1G15 W16G13-G15 PolarHBondContact O-N 3.33Å; G13-G15 VanDerWaalsContact O-N 3.12Å; G13-W16 PolarHBondContact O-N 2.92Å; G13-W16 VanDerWaalsContact O-N 3.12Å
14W86Confident74.8Confident131 Ų13173.4 Ų73.450%0.49639%0.392SS..Hα-helixtrans-60.1-22.7-176.8-162.7-98.8000113.8G12 W16 V17 V18 F190G12-W14 PolarHBondContact O-N 3.5Å; W14-W16 PolarHBondContact O-N 3.22Å; W14-V17 HydrophobicContact CD2-CB 4.38Å; W14-V17 HydrophobicContact CE3-CG2 4.21Å; W14-V17 HydrophobicContact CH2-CG1 4.4Å; W14-V17 HydrophobicContact CZ2-CG1 4.29Å; W14-V17 HydrophobicContact CZ3-CG2 4.46Å; W14-V17 WeakPolarHBondContact O-CB 3.41Å; W14-V17 PolarHBondContact O-N 3.3Å; W14-V17 VanDerWaalsContact O-N 3.12Å; W14-V18 PolarHBondContact O-N 2.99Å; W14-V18 VanDerWaalsContact O-N 3.09Å; W14-F190 HydrophobicContact CZ2-CD1 4.47Å
15G86.5Confident77.7Confident0 Ų064.5 Ų64.50%035%0.35CS..Hα-helixtrans-56.5-35.5174.400000113.1G13 V18 I19 F135G13-G15 PolarHBondContact O-N 3.33Å; G13-G15 VanDerWaalsContact O-N 3.12Å; G15-V18 PolarHBondContact O-N 2.99Å; G15-I19 WeakPolarHBondContact O-CG1 3.46Å; G15-I19 PolarHBondContact O-N 3.41Å; G15-F135 WeakPolarHBondContact O-CE2 3.37Å
16W90.5Very high80.6Confident90 Ų9058.6 Ų58.634%0.34131%0.314SS..Hα-helixtrans-70-35.2177.3-70.7107000112.9G13 W14 V18 I19 V20 F135 L141 I145G13-W16 PolarHBondContact O-N 2.92Å; G13-W16 VanDerWaalsContact O-N 3.12Å; W14-W16 PolarHBondContact O-N 3.22Å; W16-V18 VanDerWaalsContact C-N 3.3Å; W16-I19 HydrophobicContact CD2-CD1 4.36Å; W16-I19 HydrophobicContact CE3-CD1 3.73Å; W16-I19 HydrophobicContact CZ3-CD1 3.87Å; W16-I19 PolarHBondContact O-N 2.92Å; W16-V20 WeakPolarHBondContact O-CG2 3.35Å; W16-V20 PolarHBondContact O-N 2.95Å; W16-F135 HydrophobicContact CD2-CZ 4.32Å; W16-F135 HydrophobicContact CZ2-CE1 4.42Å; W16-L141 HydrophobicContact CH2-CD2 4.11Å; W16-I145 HydrophobicContact CH2-CD1 4.41Å; W16-I145 HydrophobicContact CZ3-CD1 3.76Å
17V91.6Very high83.3Confident55 Ų5555.4 Ų55.433%0.33329%0.288SS..Hα-helixtrans-63.7-41.2173.1-178.10000110.1W14 V20 A21 F190W14-V17 HydrophobicContact CD2-CB 4.38Å; W14-V17 HydrophobicContact CE3-CG2 4.21Å; W14-V17 HydrophobicContact CH2-CG1 4.4Å; W14-V17 HydrophobicContact CZ2-CG1 4.29Å; W14-V17 HydrophobicContact CZ3-CG2 4.46Å; W14-V17 WeakPolarHBondContact O-CB 3.41Å; W14-V17 PolarHBondContact O-N 3.3Å; W14-V17 VanDerWaalsContact O-N 3.12Å; V17-V20 PolarHBondContact O-N 3.31Å; V17-A21 PolarHBondContact O-N 3.47Å; V17-F190 HydrophobicContact CG1-CD1 4.1Å
18V91.1Very high85.5Confident1 Ų148.4 Ų48.41%0.00626%0.258CS..Hα-helixtrans-63.5-42.6174.7176.60000111.1W14 G15 W16 V20 A21 C22 I130 Y134W14-V18 PolarHBondContact O-N 2.99Å; W14-V18 VanDerWaalsContact O-N 3.09Å; G15-V18 PolarHBondContact O-N 2.99Å; W16-V18 VanDerWaalsContact C-N 3.3Å; V18-V20 PolarHBondContact O-N 3.45Å; V18-A21 PolarHBondContact O-N 2.9Å; V18-C22 WeakPolarHBondContact O-CB 3.5Å; V18-C22 PolarHBondContact O-N 3.5Å; V18-C22 PolarHBondContact O-SG 3.36Å; V18-I130 HydrophobicContact CG1-CG1 3.99Å; V18-I130 HydrophobicContact CG1-CG2 4.14Å; V18-Y134 HydrophobicContact CG1-CD2 4.25Å; V18-Y134 HydrophobicContact CG1-CE2 4.4Å; V18-Y134 HydrophobicContact CG2-CD1 4.41Å; V18-Y134 HydrophobicContact CG2-CD2 4.4Å; V18-Y134 HydrophobicContact CG2-CE1 4.01Å; V18-Y134 HydrophobicContact CG2-CE2 4.01Å
19I92.1Very high87.6Confident2 Ų239.2 Ų39.21%0.0122%0.218CC..Hα-helixtrans-57.9-47174.8-74.2172000111.1G15 W16 A21 C22 F23 F135 A142 I145 V146G15-I19 WeakPolarHBondContact O-CG1 3.46Å; G15-I19 PolarHBondContact O-N 3.41Å; W16-I19 HydrophobicContact CD2-CD1 4.36Å; W16-I19 HydrophobicContact CE3-CD1 3.73Å; W16-I19 HydrophobicContact CZ3-CD1 3.87Å; W16-I19 PolarHBondContact O-N 2.92Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.36Å; I19-C22 PolarHBondContact O-N 2.9Å; I19-F23 WeakPolarHBondContact O-CB 3.36Å; I19-F23 PolarHBondContact O-N 3.05Å; I19-F135 HydrophobicContact CD1-CD2 3.94Å; I19-F135 HydrophobicContact CD1-CE1 4.17Å; I19-F135 HydrophobicContact CD1-CE2 3.21Å; I19-F135 HydrophobicContact CD1-CZ 3.33Å; I19-F135 HydrophobicContact CG1-CD2 4.33Å; I19-F135 HydrophobicContact CG1-CE2 3.62Å; I19-F135 HydrophobicContact CG1-CZ 4.17Å; I19-A142 HydrophobicContact CD1-CB 3.51Å; I19-A142 HydrophobicContact CG1-CB 4.16Å; I19-I145 HydrophobicContact CG2-CB 4.06Å; I19-I145 HydrophobicContact CG2-CG2 3.56Å; I19-V146 HydrophobicContact CG2-CG2 4.09Å
20V94.4Very high89.3Confident98 Ų9839 Ų3959%0.59421%0.21SC*.Hα-helixtrans-62.7-40.8179.1173.10000111W16 V17 V18 F23 M24W16-V20 WeakPolarHBondContact O-CG2 3.35Å; W16-V20 PolarHBondContact O-N 2.95Å; V17-V20 PolarHBondContact O-N 3.31Å; V18-V20 PolarHBondContact O-N 3.45Å; V20-F23 WeakPolarHBondContact O-CB 3.28Å; V20-F23 PolarHBondContact O-N 2.86Å; V20-M24 PolarHBondContact O-N 3.49Å
21A94.8Very high90.7Very high8 Ų834.7 Ų34.77%0.06619%0.188CC..Hα-helixtrans-65.6-39.517500000112.6V17 V18 I19 M24 A25 F190V17-A21 PolarHBondContact O-N 3.47Å; V18-A21 PolarHBondContact O-N 2.9Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.36Å; A21-M24 PolarHBondContact O-N 3.3Å; A21-A25 WeakPolarHBondContact O-CB 3.32Å; A21-A25 PolarHBondContact O-N 2.92Å; A21-F190 HydrophobicContact CB-CB 3.76Å; A21-F190 HydrophobicContact CB-CG 4.41Å
22C93.9Very high91.8Very high0 Ų032.4 Ų32.40%018%0.176CC..Hα-helixtrans-67.8-39.3175.3-710000112.1V18 I19 A25 Q26 T127 I130 V146 M191V18-C22 WeakPolarHBondContact O-CB 3.5Å; V18-C22 PolarHBondContact O-N 3.5Å; V18-C22 PolarHBondContact O-SG 3.36Å; I19-C22 PolarHBondContact O-N 2.9Å; C22-A25 PolarHBondContact O-N 3.37Å; C22-Q26 WeakPolarHBondContact O-CG 3.43Å; C22-Q26 PolarHBondContact O-N 3.36Å; C22-T127 HydrophobicContact CB-CG2 3.94Å; C22-I130 WeakPolarHBondContact SG-CG2 3.38Å; C22-V146 HydrophobicContact CB-CB 4.36Å; C22-V146 HydrophobicContact CB-CG1 3.78Å; C22-V146 HydrophobicContact CB-CG2 3.59Å; C22-M191 HydrophobicContact CB-CE 4.47Å
23F95.2Very high92.6Very high52 Ų5231.2 Ų31.223%0.22816%0.164CC..Hα-helixtrans-58-50.7172.2173.4-87.2000110.5I19 V20 A25 Q26 F27 I145 G149 V152I19-F23 WeakPolarHBondContact O-CB 3.36Å; I19-F23 PolarHBondContact O-N 3.05Å; V20-F23 WeakPolarHBondContact O-CB 3.28Å; V20-F23 PolarHBondContact O-N 2.86Å; F23-A25 VanDerWaalsContact C-N 3.34Å; F23-A25 PolarHBondContact O-N 3.4Å; F23-Q26 PolarHBondContact O-N 3.46Å; F23-F27 WeakPolarHBondContact O-CB 3.43Å; F23-F27 PolarHBondContact O-N 3.11Å; F23-I145 HydrophobicContact CD2-CG2 4.44Å; F23-I145 VanDerWaalsContact CD2-O 3.28Å; F23-I145 WeakPolarHBondContact CD2-O 3.14Å; F23-G149 VanDerWaalsContact CE2-N 3.31Å; F23-V152 HydrophobicContact CZ-CB 4.2Å; F23-V152 HydrophobicContact CZ-CG1 4.41Å; F23-V152 HydrophobicContact CZ-CG2 4.19Å
24M96Very high92.8Very high84 Ų8431 Ų3141%0.41415%0.147SC..Hα-helixtrans-65-37.6179-1716287.500111.8V20 A21 F27 L28V20-M24 PolarHBondContact O-N 3.49Å; A21-M24 PolarHBondContact O-N 3.3Å; M24-F27 WeakPolarHBondContact O-CB 3.41Å; M24-F27 PolarHBondContact O-N 3.49Å; M24-F27 HydrophobicContact SD-CB 4.5Å; M24-F27 HydrophobicContact SD-CD1 3.81Å; M24-F27 HydrophobicContact SD-CE1 4.49Å; M24-F27 HydrophobicContact SD-CG 4.37Å; M24-L28 HydrophobicContact CG-CD1 4.07Å; M24-L28 HydrophobicContact CG-CG 4.37Å; M24-L28 WeakPolarHBondContact O-CB 3.21Å; M24-L28 VanDerWaalsContact O-CG 3.3Å; M24-L28 WeakPolarHBondContact O-CG 3.46Å; M24-L28 PolarHBondContact O-N 3.4Å; M24-L28 HydrophobicContact SD-CG 4.32Å
25A95.8Very high93.1Very high0 Ų024.8 Ų24.80%012%0.123CC..Hα-helixtrans-62.7-43.8174.300000112A21 C22 F23 A29 V123 T127 L184 C187 M191A21-A25 WeakPolarHBondContact O-CB 3.32Å; A21-A25 PolarHBondContact O-N 2.92Å; C22-A25 PolarHBondContact O-N 3.37Å; F23-A25 VanDerWaalsContact C-N 3.34Å; F23-A25 PolarHBondContact O-N 3.4Å; A25-A29 VanDerWaalsContact O-CB 3.28Å; A25-A29 WeakPolarHBondContact O-CB 3.4Å; A25-A29 PolarHBondContact O-N 3.31Å; A25-V123 HydrophobicContact CB-CG1 4.18Å; A25-T127 HydrophobicContact CB-CG2 4.08Å; A25-L184 HydrophobicContact CB-CD2 3.89Å; A25-L184 WeakPolarHBondContact O-CD2 3.38Å; A25-C187 HydrophobicContact CB-CB 4.2Å; A25-M191 HydrophobicContact CB-CE 3.94Å
26Q94.6Very high93.3Very high4 Ų424.9 Ų24.92%0.01912%0.124CC..Hα-helixtrans-67.6-39.1175.6-71.1-133.216.300112.2C22 F23 Y30 T127 V146 T150C22-Q26 WeakPolarHBondContact O-CG 3.43Å; C22-Q26 PolarHBondContact O-N 3.36Å; F23-Q26 PolarHBondContact O-N 3.46Å; Q26-Y30 WeakPolarHBondContact O-CB 3.1Å; Q26-Y30 PolarHBondContact O-N 3.5Å; Q26-T127 HydrophobicContact CG-CG2 4.25Å; Q26-T127 PolarHBondContact NE2-OG1 3.45Å; Q26-V146 HydrophobicContact CG-CG1 3.93Å; Q26-T150 HydrophobicContact CB-CG2 4.1Å
27F95.7Very high93.1Very high30 Ų3020.6 Ų20.613%0.13211%0.108CC..Hα-helixtrans-56.1-50.8173.9173.5-89000112F23 M24 G31 G149 V152 G153 L156 Y157F23-F27 WeakPolarHBondContact O-CB 3.43Å; F23-F27 PolarHBondContact O-N 3.11Å; M24-F27 WeakPolarHBondContact O-CB 3.41Å; M24-F27 PolarHBondContact O-N 3.49Å; M24-F27 HydrophobicContact SD-CB 4.5Å; M24-F27 HydrophobicContact SD-CD1 3.81Å; M24-F27 HydrophobicContact SD-CE1 4.49Å; M24-F27 HydrophobicContact SD-CG 4.37Å; F27-G31 VanDerWaalsContact O-CA 3.3Å; F27-G31 WeakPolarHBondContact O-CA 3.35Å; F27-G31 PolarHBondContact O-N 3.42Å; F27-G149 WeakPolarHBondContact CA-O 3.35Å; F27-V152 HydrophobicContact CD2-CB 4.38Å; F27-V152 HydrophobicContact CD2-CG1 4.18Å; F27-V152 HydrophobicContact CE2-CG1 4.08Å; F27-G153 VanDerWaalsContact CD2-N 3.33Å; F27-L156 HydrophobicContact CE2-CB 4.05Å; F27-L156 HydrophobicContact CE2-CD1 3.68Å; F27-L156 HydrophobicContact CE2-CG 4.3Å; F27-L156 HydrophobicContact CZ-CB 4.03Å; F27-L156 HydrophobicContact CZ-CD1 3.78Å; F27-Y157 HydrophobicContact CD1-CE2 4.24Å; F27-Y157 HydrophobicContact CE1-CD2 4.41Å; F27-Y157 AromaticContact CE1-CE2 3.71Å; F27-Y157 HydrophobicContact CE1-CE2 3.71Å; F27-Y157 HydrophobicContact CZ-CD2 4.21Å; F27-Y157 AromaticContact CZ-CE2 3.97Å; F27-Y157 HydrophobicContact CZ-CE2 3.97Å
28L95.9Very high93Very high13 Ų1318.4 Ų18.47%0.0689%0.094CC..Hα-helixtrans-71.8-37.2-178.1-68.3172.4000113M24 Y157 N183 L184M24-L28 HydrophobicContact CG-CD1 4.07Å; M24-L28 HydrophobicContact CG-CG 4.37Å; M24-L28 WeakPolarHBondContact O-CB 3.21Å; M24-L28 VanDerWaalsContact O-CG 3.3Å; M24-L28 WeakPolarHBondContact O-CG 3.46Å; M24-L28 PolarHBondContact O-N 3.4Å; M24-L28 HydrophobicContact SD-CG 4.32Å; L28-Y157 WeakPolarHBondContact CD2-OH 3.39Å; L28-N183 HydrophobicContact CD1-CB 3.66Å; L28-L184 HydrophobicContact CB-CD1 4.27Å; L28-L184 HydrophobicContact CB-CG 4.05Å; L28-L184 HydrophobicContact CD1-CG 4.49Å
29A95Very high93Very high0 Ų018.3 Ų18.30%09%0.094CC..Hα-helixtrans-77.6-47-177.300000112.8A25 P33 C120 V123 L184A25-A29 VanDerWaalsContact O-CB 3.28Å; A25-A29 WeakPolarHBondContact O-CB 3.4Å; A25-A29 PolarHBondContact O-N 3.31Å; A29-P33 VanDerWaalsContact O-CD 3.27Å; A29-P33 WeakPolarHBondContact O-CD 3.47Å; A29-P33 WeakPolarHBondContact O-CG 3.12Å; A29-C120 PolarHBondContact O-SG 3.19Å; A29-V123 HydrophobicContact CB-CB 4.17Å; A29-V123 HydrophobicContact CB-CG1 4.01Å; A29-V123 HydrophobicContact CB-CG2 4.03Å; A29-L184 HydrophobicContact CB-CD1 4.05Å; A29-L184 HydrophobicContact CB-CD2 4.13Å
30Y92.4Very high93Very high25 Ų2518.2 Ų18.210%0.0989%0.093CC..Hα-helixtrans-94.8-10-174.9-81.9-93.7000113.7Q26 P33 Q34 C120 T150Q26-Y30 WeakPolarHBondContact O-CB 3.1Å; Q26-Y30 PolarHBondContact O-N 3.5Å; Y30-P33 WeakPolarHBondContact O-CD 3.22Å; Y30-Q34 VanDerWaalsContact O-CB 3.23Å; Y30-Q34 WeakPolarHBondContact O-CB 3.44Å; Y30-Q34 WeakPolarHBondContact O-CG 3.49Å; Y30-Q34 PolarHBondContact O-N 3.29Å; Y30-C120 HydrophobicContact CD2-CB 4.34Å; Y30-C120 HydrophobicContact CE1-CB 4.08Å; Y30-C120 HydrophobicContact CE2-CB 3.78Å; Y30-C120 WeakPolarHBondContact CE2-O 3.47Å; Y30-C120 PolarHBondContact OH-O 3.3Å; Y30-T150 HydrophobicContact CD2-CG2 4.28Å; Y30-T150 HydrophobicContact CG-CG2 3.99Å
31G92.7Very high92.7Very high0 Ų014 Ų140%07%0.068CC..Hα-helixtrans-54.2-60.6-179.400000112.6F27 Q34 S35F27-G31 VanDerWaalsContact O-CA 3.3Å; F27-G31 WeakPolarHBondContact O-CA 3.35Å; F27-G31 PolarHBondContact O-N 3.42Å; G31-Q34 PolarHBondContact O-N 3.48Å; G31-S35 PolarHBondContact O-N 2.87Å; G31-S35 VanDerWaalsContact O-N 3.11Å; G31-S35 PolarHBondContact O-OG 3.04Å; G31-S35 VanDerWaalsContact O-OG 3.09Å
32S92.8Very high92.5Very high2 Ų216.8 Ų16.81%0.0148%0.08CC..Hα-helixtrans-62-45.8178.2177.60000113.7Q34 S35 V36 Y112 Q161S32-Q34 VanDerWaalsContact C-N 3.29Å; S32-Q34 PolarHBondContact O-N 3.39Å; S32-S35 WeakPolarHBondContact CA-OG 3.43Å; S32-S35 CarbonylContact O-C 3.53Å; S32-S35 PolarHBondContact O-N 3.12Å; S32-S35 VanDerWaalsContact O-N 3.16Å; S32-S35 PolarHBondContact O-OG 2.93Å; S32-V36 PolarHBondContact O-N 2.97Å; S32-Y112 PolarHBondContact O-OH 3.25Å; S32-Y112 VanDerWaalsContact O-OH 3.13Å; S32-Y112 PolarHBondContact OG-OH 3.41Å; S32-Q161 PolarHBondContact OG-NE2 3.28Å
33P92Very high92.4Very high2 Ų216.8 Ų16.81%0.0138%0.08CC..Hα-helixtrans-59.1-34.3174.4-29.636.5000114.7A29 Y30 S35 V36 V61 V116A29-P33 VanDerWaalsContact O-CD 3.27Å; A29-P33 WeakPolarHBondContact O-CD 3.47Å; A29-P33 WeakPolarHBondContact O-CG 3.12Å; Y30-P33 WeakPolarHBondContact O-CD 3.22Å; P33-S35 VanDerWaalsContact C-N 3.35Å; P33-V36 WeakPolarHBondContact O-CB 3.5Å; P33-V36 WeakPolarHBondContact O-CG1 3.43Å; P33-V61 HydrophobicContact CB-CG1 4.04Å; P33-V61 HydrophobicContact CB-CG2 3.85Å; P33-V61 HydrophobicContact CG-CG2 3.78Å; P33-V116 HydrophobicContact CG-CG1 4.2Å
34Q90.2Very high92.2Very high55 Ų5515.8 Ų15.826%0.2578%0.076SC..Hα-helixtrans-75.2-25.3176.8-72.9-72.6-50.400112.5Y30 G31 S32 V330Y30-Q34 VanDerWaalsContact O-CB 3.23Å; Y30-Q34 WeakPolarHBondContact O-CB 3.44Å; Y30-Q34 WeakPolarHBondContact O-CG 3.49Å; Y30-Q34 PolarHBondContact O-N 3.29Å; G31-Q34 PolarHBondContact O-N 3.48Å; S32-Q34 VanDerWaalsContact C-N 3.29Å; S32-Q34 PolarHBondContact O-N 3.39Å; Q34-V330 WeakPolarHBondContact O-CG1 3.5Å
35S91.3Very high91.8Very high0 Ų018.1 Ų18.10%09%0.086CC..THydrogen-bonded Turntrans-96.616.7176.961.60000114G31 S32 P33 G37 V38 Y157 Q161G31-S35 PolarHBondContact O-N 2.87Å; G31-S35 VanDerWaalsContact O-N 3.11Å; G31-S35 PolarHBondContact O-OG 3.04Å; G31-S35 VanDerWaalsContact O-OG 3.09Å; S32-S35 WeakPolarHBondContact CA-OG 3.43Å; S32-S35 CarbonylContact O-C 3.53Å; S32-S35 PolarHBondContact O-N 3.12Å; S32-S35 VanDerWaalsContact O-N 3.16Å; S32-S35 PolarHBondContact O-OG 2.93Å; P33-S35 VanDerWaalsContact C-N 3.35Å; S35-G37 PolarHBondContact O-N 2.73Å; S35-V38 WeakPolarHBondContact O-CB 3.36Å; S35-V38 PolarHBondContact O-N 3Å; S35-Y157 WeakPolarHBondContact OG-CB 3.19Å; S35-Q161 VanDerWaalsContact CB-OE1 3.25Å; S35-Q161 PolarHBondContact O-OE1 2.86Å; S35-Q161 VanDerWaalsContact OG-CD 3.27Å; S35-Q161 PolarHBondContact OG-NE2 3.02Å; S35-Q161 PolarHBondContact OG-OE1 3.17Å
36V90.9Very high91.6Very high2 Ų221.9 Ų21.91%0.01211%0.109CC..Hα-helixtrans-59.2-24.3-174.867.70000114.3S32 P33 V38 L39 Y40 W43 Y112 L309S32-V36 PolarHBondContact O-N 2.97Å; P33-V36 WeakPolarHBondContact O-CB 3.5Å; P33-V36 WeakPolarHBondContact O-CG1 3.43Å; V36-V38 PolarHBondContact O-N 3.38Å; V36-L39 PolarHBondContact O-N 3.36Å; V36-Y40 WeakPolarHBondContact O-CB 3.41Å; V36-Y40 PolarHBondContact O-N 3.36Å; V36-W43 HydrophobicContact CG2-CH2 3.8Å; V36-W43 HydrophobicContact CG2-CZ3 3.48Å; V36-W43 VanDerWaalsContact CG2-CZ3 3.48Å; V36-Y112 HydrophobicContact CG2-CE1 3.97Å; V36-L309 HydrophobicContact CB-CD1 4.4Å; V36-L309 HydrophobicContact CG1-CD1 3.6Å; V36-L309 HydrophobicContact CG2-CD1 4.13Å
37G87.2Confident91.3Very high0 Ų023.8 Ų23.80%012%0.117CC..Hα-helixtrans-61-22175.200000114S35 P41S35-G37 PolarHBondContact O-N 2.73Å; G37-P41 WeakPolarHBondContact O-CD 3.26Å
38V89.9Confident90.9Very high8 Ų829.2 Ų29.25%0.04814%0.143CC..Hα-helixtrans-76.9-37.8172.8173.30000111.8S35 V36 A158 Q161 N162 I165 P328S35-V38 WeakPolarHBondContact O-CB 3.36Å; S35-V38 PolarHBondContact O-N 3Å; V36-V38 PolarHBondContact O-N 3.38Å; V38-A158 HydrophobicContact CG2-CB 3.99Å; V38-Q161 HydrophobicContact CG1-CB 3.9Å; V38-N162 HydrophobicContact CG1-CB 4.4Å; V38-N162 VanDerWaalsContact CG1-CG 3.44Å; V38-N162 WeakPolarHBondContact CG1-ND2 3.43Å; V38-N162 WeakPolarHBondContact CG1-OD1 3.47Å; V38-N162 WeakPolarHBondContact CG2-ND2 3.41Å; V38-I165 HydrophobicContact CG1-CD1 4.14Å; V38-P328 HydrophobicContact CG2-CB 4.23Å
39L91.1Very high90.6Very high0 Ų033.6 Ų33.60%016%0.163CC..Hα-helixtrans-78.3-24.3179.7-62176.9000112.4V36 E42 W43 Y112 Q161 I165 L170 L174V36-L39 PolarHBondContact O-N 3.36Å; L39-E42 PolarHBondContact O-N 3.24Å; L39-W43 HydrophobicContact CB-CD2 4.22Å; L39-W43 HydrophobicContact CB-CE3 4.23Å; L39-W43 HydrophobicContact CB-CH2 3.73Å; L39-W43 HydrophobicContact CB-CZ2 3.73Å; L39-W43 HydrophobicContact CB-CZ3 3.99Å; L39-W43 HydrophobicContact CD1-CH2 3.84Å; L39-W43 HydrophobicContact CD1-CZ2 3.75Å; L39-W43 HydrophobicContact CG-CH2 4.47Å; L39-W43 HydrophobicContact CG-CZ2 4.35Å; L39-W43 PolarHBondContact O-N 3.07Å; L39-Y112 HydrophobicContact CD1-CE2 4.23Å; L39-Q161 HydrophobicContact CD2-CG 4.31Å; L39-I165 HydrophobicContact CD2-CD1 3.83Å; L39-L170 HydrophobicContact CD2-CD1 4.01Å; L39-L174 HydrophobicContact CD1-CD2 4.1Å
40Y91.3Very high90.4Very high0 Ų035 Ų350%018%0.178CC..Hα-helixtrans-61.4-50.9-172.8175.3-91.7000113.9V36 E42 W43 L44 K51 T54 A55 L309 F310 D313V36-Y40 WeakPolarHBondContact O-CB 3.41Å; V36-Y40 PolarHBondContact O-N 3.36Å; Y40-E42 PolarHBondContact O-N 3.02Å; Y40-W43 PolarHBondContact O-N 3.34Å; Y40-L44 PolarHBondContact O-N 3.24Å; Y40-K51 VanDerWaalsContact OH-CA 3.23Å; Y40-K51 WeakPolarHBondContact OH-CA 3.43Å; Y40-K51 VanDerWaalsContact OH-CB 3.28Å; Y40-K51 WeakPolarHBondContact OH-CB 3.3Å; Y40-K51 PolarHBondContact OH-O 3.07Å; Y40-T54 HydrophobicContact CD2-CG2 4.01Å; Y40-T54 HydrophobicContact CE2-CG2 3.7Å; Y40-A55 HydrophobicContact CE2-CB 4.09Å; Y40-L309 HydrophobicContact CD2-CD1 4Å; Y40-L309 HydrophobicContact CD2-CD2 4.09Å; Y40-L309 HydrophobicContact CD2-CG 4.03Å; Y40-L309 HydrophobicContact CE2-CD2 4.26Å; Y40-L309 HydrophobicContact CG-CD1 4.07Å; Y40-L309 HydrophobicContact CG-CG 4.13Å; Y40-F310 AromaticContact CE1-CD1 3.82Å; Y40-F310 HydrophobicContact CE1-CD1 3.82Å; Y40-F310 AromaticContact CE1-CE1 3.89Å; Y40-F310 HydrophobicContact CE1-CE1 3.89Å; Y40-F310 HydrophobicContact CE2-CE1 4.28Å; Y40-F310 AromaticContact CZ-CE1 3.58Å; Y40-F310 WeakPolarHBondContact OH-CE1 3.31Å; Y40-D313 HydrophobicContact CD1-CB 4.32Å; Y40-D313 HydrophobicContact CE1-CB 4.29Å
41P88.8Confident90.2Very high10 Ų1034.9 Ų34.97%0.06518%0.178CC..Hα-helixtrans-58.8-37.1177-23.633.3000112.6G37 L44 H45 E312 D313G37-P41 WeakPolarHBondContact O-CD 3.26Å; P41-L44 WeakPolarHBondContact O-CB 3.5Å; P41-L44 PolarHBondContact O-N 3.42Å; P41-H45 PolarHBondContact O-N 3.05Å; P41-E312 HydrophobicContact CG-CB 4.35Å; P41-D313 HydrophobicContact CG-CB 4.33Å
42E89.8Confident90.1Very high65 Ų6534.9 Ų34.930%0.30418%0.178SC..Hα-helixtrans-70.6-35.4179.2-65.3-58.3171.700113.3L39 Y40 L44 H45 T46 I165 L170L39-E42 PolarHBondContact O-N 3.24Å; Y40-E42 PolarHBondContact O-N 3.02Å; E42-L44 VanDerWaalsContact C-N 3.31Å; E42-H45 PolarHBondContact O-N 3.41Å; E42-T46 VanDerWaalsContact O-CB 3.28Å; E42-T46 WeakPolarHBondContact O-CB 3.42Å; E42-T46 PolarHBondContact O-N 2.9Å; E42-T46 PolarHBondContact O-OG1 2.84Å; E42-I165 HydrophobicContact CG-CD1 4.25Å; E42-I165 HydrophobicContact CG-CG2 4.08Å; E42-L170 HydrophobicContact CB-CD1 4.22Å
43W92.2Very high90Very high1 Ų138.2 Ų38.20%0.00419%0.194CC..Hα-helixtrans-65-38.7169.8-68.4-34000112V36 L39 Y40 H45 T46 F47 T54 V57 L108 Y112 L170V36-W43 HydrophobicContact CG2-CH2 3.8Å; V36-W43 HydrophobicContact CG2-CZ3 3.48Å; V36-W43 VanDerWaalsContact CG2-CZ3 3.48Å; L39-W43 HydrophobicContact CB-CD2 4.22Å; L39-W43 HydrophobicContact CB-CE3 4.23Å; L39-W43 HydrophobicContact CB-CH2 3.73Å; L39-W43 HydrophobicContact CB-CZ2 3.73Å; L39-W43 HydrophobicContact CB-CZ3 3.99Å; L39-W43 HydrophobicContact CD1-CH2 3.84Å; L39-W43 HydrophobicContact CD1-CZ2 3.75Å; L39-W43 HydrophobicContact CG-CH2 4.47Å; L39-W43 HydrophobicContact CG-CZ2 4.35Å; L39-W43 PolarHBondContact O-N 3.07Å; Y40-W43 PolarHBondContact O-N 3.34Å; W43-H45 VanDerWaalsContact C-N 3.34Å; W43-T46 PolarHBondContact O-N 3.05Å; W43-F47 HydrophobicContact CB-CD2 4.33Å; W43-F47 WeakPolarHBondContact O-CB 3.37Å; W43-F47 WeakPolarHBondContact O-CD2 3.41Å; W43-F47 PolarHBondContact O-N 2.83Å; W43-T54 HydrophobicContact CB-CG2 3.77Å; W43-V57 HydrophobicContact CE3-CB 4.35Å; W43-V57 HydrophobicContact CE3-CG1 3.97Å; W43-V57 HydrophobicContact CH2-CG1 3.72Å; W43-V57 HydrophobicContact CZ2-CG1 4.31Å; W43-V57 HydrophobicContact CZ3-CB 4.17Å; W43-V57 HydrophobicContact CZ3-CG1 3.52Å; W43-L108 HydrophobicContact CB-CD2 4.49Å; W43-L108 HydrophobicContact CD2-CD2 3.85Å; W43-L108 HydrophobicContact CG-CD2 3.79Å; W43-L108 HydrophobicContact CZ2-CD2 4.48Å; W43-Y112 AromaticContact CH2-CD1 3.83Å; W43-Y112 HydrophobicContact CH2-CD1 3.83Å; W43-Y112 HydrophobicContact CH2-CD2 4.21Å; W43-Y112 AromaticContact CH2-CE1 3.67Å; W43-Y112 HydrophobicContact CH2-CE1 3.67Å; W43-Y112 HydrophobicContact CH2-CE2 4.07Å; W43-Y112 HydrophobicContact CH2-CG 4.1Å; W43-Y112 AromaticContact CH2-CZ 3.81Å; W43-Y112 HydrophobicContact CZ2-CD2 4.21Å; W43-Y112 HydrophobicContact CZ2-CE2 4.25Å; W43-Y112 HydrophobicContact CZ2-CG 4.36Å; W43-Y112 HydrophobicContact CZ3-CE1 4.45Å; W43-L170 VanDerWaalsContact CD1-CD2 3.46Å
44L89.7Confident90.1Very high30 Ų3038.1 Ų38.116%0.15719%0.193CC..Hα-helixtrans-62.6-45.2176.6-164.672000110.7Y40 P41 E42 Q48 E49 K51Y40-L44 PolarHBondContact O-N 3.24Å; P41-L44 WeakPolarHBondContact O-CB 3.5Å; P41-L44 PolarHBondContact O-N 3.42Å; E42-L44 VanDerWaalsContact C-N 3.31Å; L44-Q48 WeakPolarHBondContact O-CA 3.37Å; L44-Q48 PolarHBondContact O-N 3.44Å; L44-E49 WeakPolarHBondContact CD1-O 3.33Å; L44-K51 HydrophobicContact CD1-CG 3.99Å; L44-K51 HydrophobicContact CD2-CD 4.14Å; L44-K51 HydrophobicContact CD2-CG 4.01Å
45H89.2Confident90.2Very high133 Ų13335.5 Ų35.562%0.61618%0.181SC*.Hα-helixtrans-65.8-40177.1-176.2-99.5000112.7P41 E42 W43 Q48P41-H45 PolarHBondContact O-N 3.05Å; E42-H45 PolarHBondContact O-N 3.41Å; W43-H45 VanDerWaalsContact C-N 3.34Å; H45-Q48 PolarHBondContact O-NE2 3.18Å
46T90.3Very high90.4Very high79 Ų7937.8 Ų37.849%0.48519%0.19SC..Hα-helixtrans-73.5-46.1-177-57.20000112.7E42 W43E42-T46 VanDerWaalsContact O-CB 3.28Å; E42-T46 WeakPolarHBondContact O-CB 3.42Å; E42-T46 PolarHBondContact O-N 2.9Å; E42-T46 PolarHBondContact O-OG1 2.84Å; W43-T46 PolarHBondContact O-N 3.05Å
47F89.9Confident90.5Very high44 Ų4437.7 Ų37.719%0.19319%0.189CC..Hα-helixtrans-93.9-17.7-173.5-68.5-75.6000113.9W43 E49 A102 V105 L108W43-F47 HydrophobicContact CB-CD2 4.33Å; W43-F47 WeakPolarHBondContact O-CB 3.37Å; W43-F47 WeakPolarHBondContact O-CD2 3.41Å; W43-F47 PolarHBondContact O-N 2.83Å; F47-E49 HydrophobicContact CB-CG 4.44Å; F47-E49 PolarHBondContact O-N 3.36Å; F47-E49 VanDerWaalsContact O-N 3.1Å; F47-A102 HydrophobicContact CZ-CB 4.21Å; F47-V105 HydrophobicContact CB-CG2 3.36Å; F47-V105 HydrophobicContact CD1-CG2 3.84Å; F47-V105 HydrophobicContact CD2-CG2 4.01Å; F47-V105 HydrophobicContact CG-CG2 3.46Å; F47-V105 VanDerWaalsContact CG-CG2 3.46Å; F47-L108 HydrophobicContact CD2-CD2 4.37Å; F47-L108 HydrophobicContact CE2-CD2 3.76Å; F47-L108 HydrophobicContact CZ-CD2 4.42Å
48Q87.3Confident90.6Very high145 Ų14537.7 Ų37.768%0.67819%0.189SC*.  trans5331.1178.2-63-71.7-3700113.6L44 H45L44-Q48 WeakPolarHBondContact O-CA 3.37Å; L44-Q48 PolarHBondContact O-N 3.44Å; H45-Q48 PolarHBondContact O-NE2 3.18Å
49E89.6Confident90.7Very high104 Ų10437.3 Ų37.349%0.48619%0.187SC..  trans-93.8162.8175.5-75.4-73178.300110.9L44 F47 V105L44-E49 WeakPolarHBondContact CD1-O 3.33Å; F47-E49 HydrophobicContact CB-CG 4.44Å; F47-E49 PolarHBondContact O-N 3.36Å; F47-E49 VanDerWaalsContact O-N 3.1Å; E49-V105 HydrophobicContact CB-CG2 4.06Å; E49-V105 HydrophobicContact CG-CB 4.5Å; E49-V105 HydrophobicContact CG-CG2 3.7Å
50G89Confident90.9Very high29 Ų2938.1 Ų38.130%0.29919%0.191SC..  trans-57.8149.5178.600000113.1G52 M53 T54G50-G52 PolarHBondContact O-N 3.05Å; G50-M53 PolarHBondContact O-N 3.49Å; G50-T54 PolarHBondContact O-N 3.45Å; G50-T54 VanDerWaalsContact O-N 3.08Å; G50-T54 PolarHBondContact O-OG1 3.02Å
51K89.6Confident91Very high24 Ų2438.2 Ų38.210%0.10419%0.192CC..Hα-helixtrans-60.2-37.4-175.3-63.2-153.6-172.5178.70111.7Y40 L44 A55 D313 F438 D439 Y444Y40-K51 VanDerWaalsContact OH-CA 3.23Å; Y40-K51 WeakPolarHBondContact OH-CA 3.43Å; Y40-K51 VanDerWaalsContact OH-CB 3.28Å; Y40-K51 WeakPolarHBondContact OH-CB 3.3Å; Y40-K51 PolarHBondContact OH-O 3.07Å; L44-K51 HydrophobicContact CD1-CG 3.99Å; L44-K51 HydrophobicContact CD2-CD 4.14Å; L44-K51 HydrophobicContact CD2-CG 4.01Å; K51-A55 WeakPolarHBondContact O-CB 3.32Å; K51-A55 PolarHBondContact O-N 3.47Å; K51-D313 IonicContact NZ-OD2 2.69Å; K51-D313 PolarHBondContact NZ-OD2 3.41Å; K51-F438 HydrophobicContact CD-CD1 3.4Å; K51-F438 HydrophobicContact CD-CE1 3.73Å; K51-F438 HydrophobicContact CD-CG 3.96Å; K51-F438 HydrophobicContact CD-CZ 4.5Å; K51-F438 VanDerWaalsContact CE-CD1 3.46Å; K51-F438 HydrophobicContact CG-CD1 3.99Å; K51-F438 HydrophobicContact CG-CE1 4.46Å; K51-D439 WeakPolarHBondContact CB-OD1 2.94Å; K51-D439 PolarHBondContact N-OD1 3.46Å; K51-D439 PolarHBondContact N-OD2 3.41Å; K51-Y444 WeakPolarHBondContact CD-OH 2.84Å; K51-Y444 PolarHBondContact NZ-OH 3.08Å
52G89.7Confident91.1Very high0 Ų038.3 Ų38.30%019%0.193CC..Hα-helixtrans-64.5-38.2175.300000113.7G50 D439G50-G52 PolarHBondContact O-N 3.05Å; G52-D439 PolarHBondContact N-OD2 2.93Å
53M91.9Very high91.2Very high71 Ų7135.2 Ų35.235%0.3518%0.178SC..Hα-helixtrans-69.9-44.3178.2-75.8-56.1-60.900111.9G50 A55 W56G50-M53 PolarHBondContact O-N 3.49Å; M53-A55 VanDerWaalsContact C-N 3.3Å; M53-A55 PolarHBondContact O-N 3.24Å; M53-W56 WeakPolarHBondContact O-CB 3.39Å; M53-W56 PolarHBondContact O-N 3.43Å
54T92.6Very high91.3Very high0 Ų036.3 Ų36.30%019%0.185CC..Hα-helixtrans-67-33.3176.9-54.40000111.6Y40 W43 G50 W56 V57Y40-T54 HydrophobicContact CD2-CG2 4.01Å; Y40-T54 HydrophobicContact CE2-CG2 3.7Å; W43-T54 HydrophobicContact CB-CG2 3.77Å; G50-T54 PolarHBondContact O-N 3.45Å; G50-T54 VanDerWaalsContact O-N 3.08Å; G50-T54 PolarHBondContact O-OG1 3.02Å; T54-W56 PolarHBondContact O-N 3.27Å; T54-V57 WeakPolarHBondContact O-CB 3.49Å; T54-V57 WeakPolarHBondContact O-CG2 3.24Å; T54-V57 PolarHBondContact O-N 3.48Å
55A93.3Very high91.2Very high0 Ų035 Ų350%018%0.178CC..Hα-helixtrans-65-22.9-178.400000113.6Y40 K51 M53 V57 G58 S59 L309 F310 P431Y40-A55 HydrophobicContact CE2-CB 4.09Å; K51-A55 WeakPolarHBondContact O-CB 3.32Å; K51-A55 PolarHBondContact O-N 3.47Å; M53-A55 VanDerWaalsContact C-N 3.3Å; M53-A55 PolarHBondContact O-N 3.24Å; A55-V57 PolarHBondContact O-N 2.82Å; A55-G58 PolarHBondContact O-N 2.65Å; A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.11Å; A55-S59 PolarHBondContact O-OG 2.87Å; A55-L309 HydrophobicContact CB-CD2 3.83Å; A55-F310 HydrophobicContact CB-CE1 4.27Å; A55-F310 HydrophobicContact CB-CZ 3.7Å; A55-P431 HydrophobicContact CB-CB 3.99Å
56W94.3Very high91.2Very high48 Ų4829.5 Ų29.518%0.18215%0.154CC..Hα-helixtrans-58.1-32.1172.2-80.5102.8000112.9M53 T54 S59 L60 I109 M428 L429 P432 W436M53-W56 WeakPolarHBondContact O-CB 3.39Å; M53-W56 PolarHBondContact O-N 3.43Å; T54-W56 PolarHBondContact O-N 3.27Å; W56-S59 WeakPolarHBondContact CA-OG 3.29Å; W56-S59 PolarHBondContact O-OG 3.41Å; W56-L60 HydrophobicContact CB-CD1 4.26Å; W56-L60 HydrophobicContact CE3-CD1 3.85Å; W56-L60 HydrophobicContact CE3-CD2 4.26Å; W56-L60 HydrophobicContact CE3-CG 3.86Å; W56-L60 HydrophobicContact CZ3-CD2 4.37Å; W56-L60 HydrophobicContact CZ3-CG 4.45Å; W56-L60 WeakPolarHBondContact O-CB 3.31Å; W56-L60 WeakPolarHBondContact O-CD1 3.5Å; W56-L60 VanDerWaalsContact O-CG 3.27Å; W56-L60 WeakPolarHBondContact O-CG 3.26Å; W56-L60 PolarHBondContact O-N 3.41Å; W56-I109 HydrophobicContact CB-CD1 3.76Å; W56-I109 HydrophobicContact CB-CG1 4.06Å; W56-M428 HydrophobicContact CE3-CG 4.33Å; W56-M428 HydrophobicContact CZ3-CE 4.48Å; W56-M428 HydrophobicContact CZ3-CG 3.62Å; W56-M428 HydrophobicContact CZ3-SD 4.21Å; W56-L429 HydrophobicContact CH2-CD2 3.95Å; W56-P432 HydrophobicContact CB-CG 4.46Å; W56-P432 HydrophobicContact CD2-CB 4.01Å; W56-P432 HydrophobicContact CD2-CG 3.43Å; W56-P432 VanDerWaalsContact CD2-CG 3.43Å; W56-P432 VanDerWaalsContact CE2-CG 3.47Å; W56-P432 HydrophobicContact CE3-CG 3.89Å; W56-P432 HydrophobicContact CG-CB 4.23Å; W56-P432 HydrophobicContact CG-CG 3.7Å; W56-P432 HydrophobicContact CH2-CG 4.39Å; W56-P432 HydrophobicContact CZ2-CB 3.88Å; W56-P432 HydrophobicContact CZ2-CG 3.96Å; W56-P432 HydrophobicContact CZ3-CG 4.36Å; W56-W436 HydrophobicContact CZ2-CH2 4.26Å; W56-W436 AromaticContact NE1-CZ2 3.84Å
57V93.3Very high91.3Very high0 Ų027.7 Ų27.70%014%0.141CC..Hα-helixtrans-61.2-50.8-179.5179.30000110.6W43 T54 A55 V105 L108 I109 Y112W43-V57 HydrophobicContact CE3-CB 4.35Å; W43-V57 HydrophobicContact CE3-CG1 3.97Å; W43-V57 HydrophobicContact CH2-CG1 3.72Å; W43-V57 HydrophobicContact CZ2-CG1 4.31Å; W43-V57 HydrophobicContact CZ3-CB 4.17Å; W43-V57 HydrophobicContact CZ3-CG1 3.52Å; T54-V57 WeakPolarHBondContact O-CB 3.49Å; T54-V57 WeakPolarHBondContact O-CG2 3.24Å; T54-V57 PolarHBondContact O-N 3.48Å; A55-V57 PolarHBondContact O-N 2.82Å; V57-V105 HydrophobicContact CG2-CG1 4.15Å; V57-L108 HydrophobicContact CG1-CD2 4.02Å; V57-L108 HydrophobicContact CG1-CG 3.81Å; V57-L108 HydrophobicContact CG2-CB 4.34Å; V57-L108 HydrophobicContact CG2-CD2 3.91Å; V57-L108 HydrophobicContact CG2-CG 3.98Å; V57-I109 HydrophobicContact CG2-CG1 3.61Å; V57-Y112 HydrophobicContact CG1-CD1 3.65Å; V57-Y112 HydrophobicContact CG1-CG 4.06Å
58G89Confident91.2Very high0 Ų026.3 Ų26.30%014%0.137CC..Hα-helixtrans-77.6-29.6-178.900000114.3A55 V61A55-G58 PolarHBondContact O-N 2.65Å; G58-V61 VanDerWaalsContact O-CG1 3.27Å; G58-V61 WeakPolarHBondContact O-CG1 3.19Å
59S93.4Very high91Very high0 Ų020.3 Ų20.30%011%0.111CC..Hα-helixtrans-75.4-38.6177.676.80000112.5A55 W56 S62 G63 I427 M428A55-S59 WeakPolarHBondContact O-CB 3.47Å; A55-S59 PolarHBondContact O-N 3.11Å; A55-S59 PolarHBondContact O-OG 2.87Å; W56-S59 WeakPolarHBondContact CA-OG 3.29Å; W56-S59 PolarHBondContact O-OG 3.41Å; S59-S62 PolarHBondContact O-N 3.31Å; S59-G63 PolarHBondContact O-N 3.17Å; S59-I427 WeakPolarHBondContact CB-O 3.13Å; S59-M428 VanDerWaalsContact CB-O 3.31Å; S59-M428 WeakPolarHBondContact CB-O 3.25Å; S59-M428 PolarHBondContact OG-O 3.23Å
60L94.6Very high90.5Very high18 Ų1817.9 Ų17.99%0.09411%0.105CC..Hα-helixtrans-68.2-39-178-79.9165.5000112.8W56 S62 G63 V64 I109 M428W56-L60 HydrophobicContact CB-CD1 4.26Å; W56-L60 HydrophobicContact CE3-CD1 3.85Å; W56-L60 HydrophobicContact CE3-CD2 4.26Å; W56-L60 HydrophobicContact CE3-CG 3.86Å; W56-L60 HydrophobicContact CZ3-CD2 4.37Å; W56-L60 HydrophobicContact CZ3-CG 4.45Å; W56-L60 WeakPolarHBondContact O-CB 3.31Å; W56-L60 WeakPolarHBondContact O-CD1 3.5Å; W56-L60 VanDerWaalsContact O-CG 3.27Å; W56-L60 WeakPolarHBondContact O-CG 3.26Å; W56-L60 PolarHBondContact O-N 3.41Å; L60-S62 PolarHBondContact O-N 3.33Å; L60-G63 PolarHBondContact O-N 2.87Å; L60-V64 HydrophobicContact CB-CG2 4.27Å; L60-V64 HydrophobicContact CD2-CG2 3.78Å; L60-V64 VanDerWaalsContact O-CB 3.23Å; L60-V64 WeakPolarHBondContact O-CB 3.48Å; L60-V64 WeakPolarHBondContact O-CG2 3.5Å; L60-V64 PolarHBondContact O-N 3.07Å; L60-I109 HydrophobicContact CD1-CG2 3.42Å; L60-I109 VanDerWaalsContact CD1-CG2 3.42Å; L60-M428 HydrophobicContact CD2-CG 3.67Å; L60-M428 HydrophobicContact CD2-SD 3.55Å; L60-M428 VanDerWaalsContact CD2-SD 3.55Å; L60-M428 HydrophobicContact CG-CG 4.34Å
61V94.3Very high90.3Very high1 Ų121.1 Ų21.11%0.00612%0.118CC..Hα-helixtrans-58.3-39.2-179.766.50000111.9P33 G58 Y112 G113 V116 G117P33-V61 HydrophobicContact CB-CG1 4.04Å; P33-V61 HydrophobicContact CB-CG2 3.85Å; P33-V61 HydrophobicContact CG-CG2 3.78Å; G58-V61 VanDerWaalsContact O-CG1 3.27Å; G58-V61 WeakPolarHBondContact O-CG1 3.19Å; V61-Y112 HydrophobicContact CB-CD1 4.23Å; V61-Y112 HydrophobicContact CB-CE1 4.18Å; V61-Y112 WeakPolarHBondContact CB-O 3.34Å; V61-Y112 HydrophobicContact CG1-CD1 4.29Å; V61-Y112 HydrophobicContact CG1-CE1 3.83Å; V61-Y112 HydrophobicContact CG2-CE1 4.39Å; V61-Y112 WeakPolarHBondContact CG2-O 3.3Å; V61-G113 VanDerWaalsContact CA-O 3.27Å; V61-G113 WeakPolarHBondContact CA-O 3.44Å; V61-G113 PolarHBondContact N-O 3.4Å; V61-V116 HydrophobicContact CG2-CB 4.07Å; V61-V116 HydrophobicContact CG2-CG1 3.84Å; V61-G117 WeakPolarHBondContact O-CA 3.3Å
62S90.3Very high90.1Very high13 Ų1320.1 Ų20.19%0.09111%0.114CC..Hα-helixtrans-82.6-38.5178.1-64.60000112.2S59 L60 L66 F305S59-S62 PolarHBondContact O-N 3.31Å; L60-S62 PolarHBondContact O-N 3.33Å; S62-L66 WeakPolarHBondContact O-CG 3.37Å; S62-F305 WeakPolarHBondContact OG-CZ 3.09Å
63G92.1Very high89.6Confident0 Ų021.6 Ų21.60%012%0.124CC..Hα-helixtrans-70.7-45.5-178.400000113.8S59 L60 G65 L66 I67 G424S59-G63 PolarHBondContact O-N 3.17Å; L60-G63 PolarHBondContact O-N 2.87Å; G63-G65 PolarHBondContact O-N 3.46Å; G63-L66 PolarHBondContact O-N 2.87Å; G63-I67 WeakPolarHBondContact O-CG1 3.29Å; G63-I67 PolarHBondContact O-N 2.75Å; G63-G424 WeakPolarHBondContact CA-O 3.36Å
64V93.7Very high88.8Confident23 Ų2320.3 Ų20.314%0.13913%0.125CC..Hα-helixtrans-62.7-42-176.4171.20000111.4L60 L66 I67 A68 L118L60-V64 HydrophobicContact CB-CG2 4.27Å; L60-V64 HydrophobicContact CD2-CG2 3.78Å; L60-V64 VanDerWaalsContact O-CB 3.23Å; L60-V64 WeakPolarHBondContact O-CB 3.48Å; L60-V64 WeakPolarHBondContact O-CG2 3.5Å; L60-V64 PolarHBondContact O-N 3.07Å; V64-L66 VanDerWaalsContact C-N 3.27Å; V64-L66 PolarHBondContact O-N 3.23Å; V64-I67 PolarHBondContact O-N 3.25Å; V64-A68 WeakPolarHBondContact O-CB 3.49Å; V64-A68 PolarHBondContact O-N 3Å; V64-L118 HydrophobicContact CG1-CD2 3.65Å; V64-L118 HydrophobicContact CG1-CG 3.66Å
65G87.9Confident88.3Confident2 Ų222 Ų222%0.02114%0.137CC..Hα-helixtrans-60.1-38.3177.200000112.6G63 S69 G117G63-G65 PolarHBondContact O-N 3.46Å; G65-S69 PolarHBondContact O-N 3.4Å; G65-S69 PolarHBondContact O-OG 3.47Å; G65-S69 VanDerWaalsContact O-OG 3.1Å; G65-G117 VanDerWaalsContact CA-O 3.26Å; G65-G117 WeakPolarHBondContact CA-O 3.47Å
66L89.7Confident87.8Confident19 Ų1922.4 Ų22.410%0.09914%0.139CC..Hα-helixtrans-73.3-46.3177.5-66.6178.6000112.2S62 G63 V64 A68 S69 W396 M420 I427S62-L66 WeakPolarHBondContact O-CG 3.37Å; G63-L66 PolarHBondContact O-N 2.87Å; V64-L66 VanDerWaalsContact C-N 3.27Å; V64-L66 PolarHBondContact O-N 3.23Å; L66-A68 VanDerWaalsContact C-N 3.29Å; L66-A68 PolarHBondContact O-N 3.26Å; L66-S69 WeakPolarHBondContact CA-OG 3.21Å; L66-S69 WeakPolarHBondContact O-CB 3.1Å; L66-S69 PolarHBondContact O-N 3.06Å; L66-S69 VanDerWaalsContact O-N 3.08Å; L66-S69 PolarHBondContact O-OG 2.85Å; L66-W396 HydrophobicContact CD1-CH2 4.33Å; L66-W396 HydrophobicContact CD1-CZ2 3.83Å; L66-M420 HydrophobicContact CD2-SD 3.71Å; L66-I427 HydrophobicContact CD1-CD1 3.51Å
67I91.8Very high86.8Confident41 Ų4124.9 Ų24.921%0.2116%0.156CC..Hα-helixtrans-60.9-40.6177.6-67167.9000110.9G63 V64 S69 F421 F425 M428G63-I67 WeakPolarHBondContact O-CG1 3.29Å; G63-I67 PolarHBondContact O-N 2.75Å; V64-I67 PolarHBondContact O-N 3.25Å; I67-S69 VanDerWaalsContact C-N 3.25Å; I67-S69 PolarHBondContact O-N 3.25Å; I67-F421 HydrophobicContact CG2-CD2 3.97Å; I67-F421 HydrophobicContact CG2-CE2 3.92Å; I67-F425 HydrophobicContact CD1-CD2 3.87Å; I67-F425 HydrophobicContact CD1-CE2 3.95Å; I67-F425 HydrophobicContact CD1-CG 4.24Å; I67-F425 HydrophobicContact CD1-CZ 4.44Å; I67-F425 HydrophobicContact CG1-CD2 4Å; I67-F425 HydrophobicContact CG1-CE2 4.2Å; I67-F425 HydrophobicContact CG2-CE2 4.36Å; I67-M428 HydrophobicContact CD1-SD 4.13Å
68A87.7Confident86Confident14 Ų1429.7 Ų29.712%0.11618%0.181CC..THydrogen-bonded Turntrans-79.1-0.817900000113.8V64 L66 P70 V71 C72 L118V64-A68 WeakPolarHBondContact O-CB 3.49Å; V64-A68 PolarHBondContact O-N 3Å; L66-A68 VanDerWaalsContact C-N 3.29Å; L66-A68 PolarHBondContact O-N 3.26Å; A68-P70 VanDerWaalsContact C-CD 3.5Å; A68-V71 WeakPolarHBondContact O-CA 3.49Å; A68-V71 WeakPolarHBondContact O-CB 3.49Å; A68-V71 PolarHBondContact O-N 3.48Å; A68-C72 PolarHBondContact O-N 2.96Å; A68-C72 PolarHBondContact O-SG 3.24Å; A68-L118 HydrophobicContact CB-CD2 3.6Å
69S83.3Confident85.6Confident20 Ų2035.4 Ų35.414%0.1421%0.207CC..Hα-helixtrans-51.5-43.6-174.8-71.10000114.8G65 L66 I67 V71 C72 S73G65-S69 PolarHBondContact O-N 3.4Å; G65-S69 PolarHBondContact O-OG 3.47Å; G65-S69 VanDerWaalsContact O-OG 3.1Å; L66-S69 WeakPolarHBondContact CA-OG 3.21Å; L66-S69 WeakPolarHBondContact O-CB 3.1Å; L66-S69 PolarHBondContact O-N 3.06Å; L66-S69 VanDerWaalsContact O-N 3.08Å; L66-S69 PolarHBondContact O-OG 2.85Å; I67-S69 VanDerWaalsContact C-N 3.25Å; I67-S69 PolarHBondContact O-N 3.25Å; S69-V71 VanDerWaalsContact C-N 3.31Å; S69-V71 PolarHBondContact O-N 2.82Å; S69-C72 PolarHBondContact O-N 3.47Å; S69-S73 PolarHBondContact O-N 3.48Å
70P79.5Confident85Confident53 Ų5335.8 Ų35.834%0.34421%0.211SC..Hα-helixtrans-63-37.2176.8-2334.9000112.9A68 A74A68-P70 VanDerWaalsContact C-CD 3.5Å; P70-A74 WeakPolarHBondContact O-CB 3.16Å; P70-A74 PolarHBondContact O-N 3.06Å; P70-A74 VanDerWaalsContact O-N 3.08Å
71V84.9Confident84.6Confident96 Ų9635.3 Ų35.358%0.58221%0.209SC*.Hα-helixtrans-69.6-45177.2-177.10000109.8A68 S69 S73 A74 C75A68-V71 WeakPolarHBondContact O-CA 3.49Å; A68-V71 WeakPolarHBondContact O-CB 3.49Å; A68-V71 PolarHBondContact O-N 3.48Å; S69-V71 VanDerWaalsContact C-N 3.31Å; S69-V71 PolarHBondContact O-N 2.82Å; V71-S73 PolarHBondContact O-N 2.58Å; V71-A74 PolarHBondContact O-N 3.3Å; V71-C75 PolarHBondContact O-N 3.32Å; V71-C75 PolarHBondContact O-SG 3.04Å; V71-C75 VanDerWaalsContact O-SG 3.34Å
72C84.9Confident84.4Confident4 Ų440.9 Ų40.93%0.02723%0.23CC..Hα-helixtrans-58.8-44.7176.5-64.40000111.8A68 S69 C75 V76 G121 L122 A125A68-C72 PolarHBondContact O-N 2.96Å; A68-C72 PolarHBondContact O-SG 3.24Å; S69-C72 PolarHBondContact O-N 3.47Å; C72-C75 WeakPolarHBondContact O-CB 3.37Å; C72-C75 PolarHBondContact O-N 3.2Å; C72-V76 WeakPolarHBondContact O-CG2 3.4Å; C72-V76 PolarHBondContact O-N 3.05Å; C72-V76 VanDerWaalsContact O-N 3.12Å; C72-G121 VanDerWaalsContact SG-C 3.59Å; C72-L122 HydrophobicContact CB-CD2 3.91Å; C72-L122 HydrophobicContact CB-CG 4.46Å; C72-A125 HydrophobicContact CB-CB 3.84Å
73S78.7Confident84.4Confident30 Ų3043.6 Ų43.621%0.2125%0.247CC..Hα-helixtrans-61.7-45.8175.8-167.70000111.9S69 V71 C75 V76 D77S69-S73 PolarHBondContact O-N 3.48Å; V71-S73 PolarHBondContact O-N 2.58Å; S73-C75 VanDerWaalsContact C-N 3.28Å; S73-C75 PolarHBondContact O-N 2.9Å; S73-V76 PolarHBondContact O-N 3.19Å; S73-V76 VanDerWaalsContact O-N 3.11Å; S73-D77 PolarHBondContact O-N 3.43Å
74A76.1Confident84.4Confident44 Ų4444 Ų4436%0.36425%0.25SC..Hα-helixtrans-62.1-35.4177.700000112.3P70 V71 N78P70-A74 WeakPolarHBondContact O-CB 3.16Å; P70-A74 PolarHBondContact O-N 3.06Å; P70-A74 VanDerWaalsContact O-N 3.08Å; V71-A74 PolarHBondContact O-N 3.3Å; A74-N78 WeakPolarHBondContact O-CB 3.43Å; A74-N78 PolarHBondContact O-N 2.91Å; A74-N78 PolarHBondContact O-ND2 3.02Å
75C81.3Confident84.4Confident37 Ų3742.9 Ų42.925%0.2524%0.243CC..Hα-helixtrans-62.3-45.3173-72.30000111.5V71 C72 S73 N78 F79 L122V71-C75 PolarHBondContact O-N 3.32Å; V71-C75 PolarHBondContact O-SG 3.04Å; V71-C75 VanDerWaalsContact O-SG 3.34Å; C72-C75 WeakPolarHBondContact O-CB 3.37Å; C72-C75 PolarHBondContact O-N 3.2Å; S73-C75 VanDerWaalsContact C-N 3.28Å; S73-C75 PolarHBondContact O-N 2.9Å; C75-N78 PolarHBondContact O-N 2.68Å; C75-F79 HydrophobicContact CB-CD2 4.35Å; C75-F79 WeakPolarHBondContact O-CB 3.34Å; C75-F79 VanDerWaalsContact O-CD2 3.24Å; C75-F79 WeakPolarHBondContact O-CD2 3.41Å; C75-F79 PolarHBondContact O-N 3.19Å; C75-L122 HydrophobicContact CB-CD2 4.1Å
76V83Confident84.7Confident7 Ų745.9 Ų45.94%0.04226%0.258CS..Hα-helixtrans-65.4-40.7179.7178.40000112.2C72 S73 N78 G80 A81 V84 A125 A126 T129C72-V76 WeakPolarHBondContact O-CG2 3.4Å; C72-V76 PolarHBondContact O-N 3.05Å; C72-V76 VanDerWaalsContact O-N 3.12Å; S73-V76 PolarHBondContact O-N 3.19Å; S73-V76 VanDerWaalsContact O-N 3.11Å; V76-N78 VanDerWaalsContact C-N 3.28Å; V76-N78 PolarHBondContact O-N 3.19Å; V76-G80 CarbonylContact O-C 3.52Å; V76-G80 WeakPolarHBondContact O-CA 3.5Å; V76-G80 PolarHBondContact O-N 3.06Å; V76-A81 HydrophobicContact CG1-CB 4.28Å; V76-V84 HydrophobicContact CG2-CB 4.12Å; V76-V84 HydrophobicContact CG2-CG1 3.71Å; V76-V84 HydrophobicContact CG2-CG2 4.25Å; V76-A125 HydrophobicContact CG2-CB 3.99Å; V76-A126 HydrophobicContact CG2-CB 3.98Å; V76-T129 HydrophobicContact CG1-CG2 4.08Å; V76-T129 WeakPolarHBondContact CG1-OG1 3.3Å
77D74Confident85Confident101 Ų10150.9 Ų50.954%0.5428%0.279SS..Hα-helixtrans-64.4-34.5178.1-68.9-28.9000112.3S73S73-D77 PolarHBondContact O-N 3.43Å
78N76.7Confident85.1Confident100 Ų10049 Ų4954%0.53527%0.269SS..Hα-helixtrans-83.1-45.1-178.1-73.4-50.7000113.2A74 C75 V76A74-N78 WeakPolarHBondContact O-CB 3.43Å; A74-N78 PolarHBondContact O-N 2.91Å; A74-N78 PolarHBondContact O-ND2 3.02Å; C75-N78 PolarHBondContact O-N 2.68Å; V76-N78 VanDerWaalsContact C-N 3.28Å; V76-N78 PolarHBondContact O-N 3.19Å
79F79.4Confident85.5Confident121 Ų12148.3 Ų48.353%0.53126%0.264SS..Hα-helixtrans-99-17-172.9-61.5-69.2000113.5C75 V84C75-F79 HydrophobicContact CB-CD2 4.35Å; C75-F79 WeakPolarHBondContact O-CB 3.34Å; C75-F79 VanDerWaalsContact O-CD2 3.24Å; C75-F79 WeakPolarHBondContact O-CD2 3.41Å; C75-F79 PolarHBondContact O-N 3.19Å; F79-V84 HydrophobicContact CB-CG2 3.93Å
80G82.1Confident86.2Confident8 Ų851.1 Ų51.18%0.08228%0.28CS..  trans87.8159.1-173.700000113.1V76 R82 V84V76-G80 CarbonylContact O-C 3.52Å; V76-G80 WeakPolarHBondContact O-CA 3.5Å; V76-G80 PolarHBondContact O-N 3.06Å; G80-R82 PolarHBondContact O-N 3.45Å; G80-V84 VanDerWaalsContact O-CG2 3.25Å; G80-V84 WeakPolarHBondContact O-CG2 3.11Å
81A85.3Confident87Confident8 Ų850.2 Ų50.27%0.06627%0.272CS..Hα-helixtrans-61.6-46.8-176.900000112.9V76 V84 T85 A126 I130V76-A81 HydrophobicContact CG1-CB 4.28Å; A81-V84 PolarHBondContact O-N 3.5Å; A81-T85 PolarHBondContact O-N 3.39Å; A81-T85 PolarHBondContact O-OG1 3.19Å; A81-A126 HydrophobicContact CB-CB 4.31Å; A81-I130 HydrophobicContact CB-CB 4.07Å; A81-I130 HydrophobicContact CB-CD1 4.33Å
82R90Very high87.6Confident117 Ų11745.7 Ų45.744%0.44224%0.244SC..Hα-helixtrans-62-52.8-173.1175171.6-176.1-165.83.9114.7G80 V84 T85 I86 A188G80-R82 PolarHBondContact O-N 3.45Å; R82-V84 VanDerWaalsContact C-N 3.27Å; R82-V84 PolarHBondContact O-N 3.3Å; R82-T85 PolarHBondContact O-N 3.47Å; R82-I86 HydrophobicContact CG-CD1 4.26Å; R82-I86 WeakPolarHBondContact O-CG1 3.49Å; R82-I86 PolarHBondContact O-N 3Å; R82-I86 VanDerWaalsContact O-N 3.12Å; R82-A188 WeakPolarHBondContact CD-O 3.27Å; R82-A188 WeakPolarHBondContact CG-O 3.44Å
83P90.3Very high88.1Confident70 Ų7045.5 Ų45.546%0.45524%0.243SC..Hα-helixtrans-62.3-36.3177.3-23.535.5000112.6I86 F87P83-I86 PolarHBondContact O-N 2.63Å; P83-F87 WeakPolarHBondContact O-CB 3.24Å; P83-F87 PolarHBondContact O-N 3.5Å
84V91.7Very high89Confident8 Ų845.4 Ų45.45%0.04825%0.246CC..Hα-helixtrans-65.9-42.8177.8174.50000111.2V76 F79 G80 A81 R82 I86 F87 S88 L122 A126V76-V84 HydrophobicContact CG2-CB 4.12Å; V76-V84 HydrophobicContact CG2-CG1 3.71Å; V76-V84 HydrophobicContact CG2-CG2 4.25Å; F79-V84 HydrophobicContact CB-CG2 3.93Å; G80-V84 VanDerWaalsContact O-CG2 3.25Å; G80-V84 WeakPolarHBondContact O-CG2 3.11Å; A81-V84 PolarHBondContact O-N 3.5Å; R82-V84 VanDerWaalsContact C-N 3.27Å; R82-V84 PolarHBondContact O-N 3.3Å; V84-I86 VanDerWaalsContact C-N 3.33Å; V84-I86 PolarHBondContact O-N 3.12Å; V84-F87 PolarHBondContact O-N 2.94Å; V84-S88 WeakPolarHBondContact O-CB 3.19Å; V84-S88 PolarHBondContact O-N 2.83Å; V84-S88 PolarHBondContact O-OG 3.15Å; V84-S88 VanDerWaalsContact O-OG 3.12Å; V84-L122 HydrophobicContact CG1-CB 3.97Å; V84-L122 HydrophobicContact CG1-CD2 3.84Å; V84-L122 HydrophobicContact CG1-CG 4.41Å; V84-A126 HydrophobicContact CG1-CB 4.42Å
85T93.6Very high90Very high0 Ų043.3 Ų43.30%023%0.229CC..Hα-helixtrans-65-34.8176.4-50.80000112.7A81 R82 S88 G89 A126 A188 M191A81-T85 PolarHBondContact O-N 3.39Å; A81-T85 PolarHBondContact O-OG1 3.19Å; R82-T85 PolarHBondContact O-N 3.47Å; T85-S88 VanDerWaalsContact C-OG 3.31Å; T85-S88 VanDerWaalsContact CA-OG 3.23Å; T85-S88 WeakPolarHBondContact CA-OG 3.21Å; T85-S88 PolarHBondContact O-OG 3.27Å; T85-G89 PolarHBondContact O-N 3.31Å; T85-A126 VanDerWaalsContact OG1-CB 3.3Å; T85-A126 WeakPolarHBondContact OG1-CB 3.45Å; T85-A188 HydrophobicContact CG2-CB 3.77Å; T85-M191 HydrophobicContact CG2-CE 4.14Å; T85-M191 HydrophobicContact CG2-SD 4.25Å
86I95.3Very high90.7Very high65 Ų6541.6 Ų41.633%0.33322%0.218SC..Hα-helixtrans-65.6-50.2174.3-66.1168.3000109.9R82 P83 V84 S88 G89 V90 M185 A188R82-I86 HydrophobicContact CG-CD1 4.26Å; R82-I86 WeakPolarHBondContact O-CG1 3.49Å; R82-I86 PolarHBondContact O-N 3Å; R82-I86 VanDerWaalsContact O-N 3.12Å; P83-I86 PolarHBondContact O-N 2.63Å; V84-I86 VanDerWaalsContact C-N 3.33Å; V84-I86 PolarHBondContact O-N 3.12Å; I86-S88 VanDerWaalsContact C-N 3.32Å; I86-S88 PolarHBondContact O-N 3.5Å; I86-G89 PolarHBondContact O-N 2.85Å; I86-G89 VanDerWaalsContact O-N 3.13Å; I86-V90 PolarHBondContact O-N 2.48Å; I86-V90 VanDerWaalsContact O-N 3.13Å; I86-M185 HydrophobicContact CG2-CG 4.28Å; I86-A188 HydrophobicContact CD1-CB 4.44Å; I86-A188 HydrophobicContact CG1-CB 3.59Å
87F95.2Very high91.3Very high125 Ų12544.6 Ų44.655%0.54823%0.232SC..Hα-helixtrans-59.6-43.4179178.3-108.7000111.8P83 V84 G89 V90 M91 L122P83-F87 WeakPolarHBondContact O-CB 3.24Å; P83-F87 PolarHBondContact O-N 3.5Å; V84-F87 PolarHBondContact O-N 2.94Å; F87-G89 VanDerWaalsContact C-N 3.33Å; F87-G89 PolarHBondContact O-N 3.01Å; F87-V90 PolarHBondContact O-N 2.97Å; F87-M91 HydrophobicContact CD1-CG 4.45Å; F87-M91 HydrophobicContact CD1-SD 3.89Å; F87-M91 HydrophobicContact CE1-CG 4.07Å; F87-M91 HydrophobicContact CE1-SD 3.25Å; F87-M91 WeakPolarHBondContact CE1-SD 3.28Å; F87-M91 HydrophobicContact CZ-CG 4.09Å; F87-M91 HydrophobicContact CZ-SD 3.67Å; F87-M91 WeakPolarHBondContact O-CG 3.33Å; F87-M91 PolarHBondContact O-N 3.11Å; F87-L122 HydrophobicContact CD1-CD1 3.9Å; F87-L122 HydrophobicContact CE1-CD1 4.04Å
88S95.1Very high92.4Very high0 Ų043.9 Ų43.90%023%0.228CC..Hα-helixtrans-65.7-35.1176.163.50000112.9V84 T85 I86 V90 M91 V92 G119 V123V84-S88 WeakPolarHBondContact O-CB 3.19Å; V84-S88 PolarHBondContact O-N 2.83Å; V84-S88 PolarHBondContact O-OG 3.15Å; V84-S88 VanDerWaalsContact O-OG 3.12Å; T85-S88 VanDerWaalsContact C-OG 3.31Å; T85-S88 VanDerWaalsContact CA-OG 3.23Å; T85-S88 WeakPolarHBondContact CA-OG 3.21Å; T85-S88 PolarHBondContact O-OG 3.27Å; I86-S88 VanDerWaalsContact C-N 3.32Å; I86-S88 PolarHBondContact O-N 3.5Å; S88-V90 VanDerWaalsContact C-N 3.32Å; S88-V90 PolarHBondContact O-N 2.72Å; S88-M91 PolarHBondContact O-N 2.98Å; S88-V92 WeakPolarHBondContact O-CG2 3.33Å; S88-V92 PolarHBondContact O-N 3.28Å; S88-G119 WeakPolarHBondContact CB-O 3.16Å; S88-V123 WeakPolarHBondContact OG-CG2 3.21Å
89G95.9Very high93.3Very high0 Ų039.4 Ų39.40%020%0.204CC..Hα-helixtrans-60.2-42173.700000112.2T85 I86 F87 A93T85-G89 PolarHBondContact O-N 3.31Å; I86-G89 PolarHBondContact O-N 2.85Å; I86-G89 VanDerWaalsContact O-N 3.13Å; F87-G89 VanDerWaalsContact C-N 3.33Å; F87-G89 PolarHBondContact O-N 3.01Å; G89-A93 VanDerWaalsContact O-CB 3.24Å; G89-A93 WeakPolarHBondContact O-CB 3.42Å; G89-A93 PolarHBondContact O-N 2.87Å
90V96.7Very high94Very high79 Ų7933.8 Ų33.848%0.47918%0.18SC..Hα-helixtrans-65.1-41.1173.8178.10000111.3I86 F87 S88 G94 M185I86-V90 PolarHBondContact O-N 2.48Å; I86-V90 VanDerWaalsContact O-N 3.13Å; F87-V90 PolarHBondContact O-N 2.97Å; S88-V90 VanDerWaalsContact C-N 3.32Å; S88-V90 PolarHBondContact O-N 2.72Å; V90-G94 WeakPolarHBondContact O-CA 3.42Å; V90-G94 PolarHBondContact O-N 3.46Å; V90-M185 HydrophobicContact CG2-SD 4.01Å
91M96.5Very high94.6Very high35 Ų3540 Ų4017%0.17221%0.205CC..Hα-helixtrans-64.4-46176.6-70.4-174.972.100112.6F87 S88 G95 V115 L118 L122F87-M91 HydrophobicContact CD1-CG 4.45Å; F87-M91 HydrophobicContact CD1-SD 3.89Å; F87-M91 HydrophobicContact CE1-CG 4.07Å; F87-M91 HydrophobicContact CE1-SD 3.25Å; F87-M91 WeakPolarHBondContact CE1-SD 3.28Å; F87-M91 HydrophobicContact CZ-CG 4.09Å; F87-M91 HydrophobicContact CZ-SD 3.67Å; F87-M91 WeakPolarHBondContact O-CG 3.33Å; F87-M91 PolarHBondContact O-N 3.11Å; S88-M91 PolarHBondContact O-N 2.98Å; M91-G95 WeakPolarHBondContact O-CA 3.06Å; M91-G95 PolarHBondContact O-N 3.05Å; M91-V115 HydrophobicContact CB-CG1 4.42Å; M91-V115 HydrophobicContact CE-CG1 4.35Å; M91-L118 HydrophobicContact CE-CB 3.7Å; M91-L118 HydrophobicContact CE-CD1 4.35Å; M91-L122 HydrophobicContact SD-CD1 3.92Å
92V97Very high94.9Very high0 Ų040.4 Ų40.40%021%0.209CC..Hα-helixtrans-66-52.1-180171.60000110.4S88 G95 L96 V116 A181 L184S88-V92 WeakPolarHBondContact O-CG2 3.33Å; S88-V92 PolarHBondContact O-N 3.28Å; V92-G95 PolarHBondContact O-N 3.28Å; V92-L96 HydrophobicContact CG1-CD1 3.82Å; V92-L96 WeakPolarHBondContact O-CB 3.13Å; V92-L96 WeakPolarHBondContact O-CD1 3.49Å; V92-L96 VanDerWaalsContact O-CG 3.27Å; V92-L96 WeakPolarHBondContact O-CG 3.26Å; V92-L96 PolarHBondContact O-N 2.86Å; V92-V116 HydrophobicContact CG1-CG1 4.22Å; V92-V116 HydrophobicContact CG2-CG1 4.45Å; V92-A181 HydrophobicContact CG1-CB 3.91Å; V92-L184 HydrophobicContact CB-CD1 4.23Å; V92-L184 HydrophobicContact CG1-CD1 4.17Å
93A97Very high95Very high0 Ų039.9 Ų39.90%022%0.22CC..Hα-helixtrans-63-47.2179.400000111.9G89 G95 L96 M97 G178 A181 L182G89-A93 VanDerWaalsContact O-CB 3.24Å; G89-A93 WeakPolarHBondContact O-CB 3.42Å; G89-A93 PolarHBondContact O-N 2.87Å; A93-G95 PolarHBondContact O-N 3.39Å; A93-L96 PolarHBondContact O-N 3.21Å; A93-M97 WeakPolarHBondContact O-CB 3.24Å; A93-M97 VanDerWaalsContact O-CG 3.22Å; A93-M97 WeakPolarHBondContact O-CG 3.44Å; A93-M97 PolarHBondContact O-N 3.39Å; A93-G178 VanDerWaalsContact CB-O 3.24Å; A93-G178 WeakPolarHBondContact CB-O 3.46Å; A93-A181 HydrophobicContact CB-CB 4.1Å; A93-L182 HydrophobicContact CB-CD2 3.36Å; A93-L182 HydrophobicContact CB-CG 3.7Å
94G96.6Very high95.1Very high28 Ų2840 Ų4029%0.28922%0.217SC..Hα-helixtrans-62.3-42.7177.800000112.3V90 M97 L98V90-G94 WeakPolarHBondContact O-CA 3.42Å; V90-G94 PolarHBondContact O-N 3.46Å; G94-M97 PolarHBondContact O-N 3.36Å; G94-L98 VanDerWaalsContact O-CB 3.24Å; G94-L98 WeakPolarHBondContact O-CB 3.28Å; G94-L98 WeakPolarHBondContact O-CD1 3.22Å; G94-L98 WeakPolarHBondContact O-CG 3.01Å; G94-L98 PolarHBondContact O-N 3.17Å
95G96.9Very high95.2Very high0 Ų040 Ų400%022%0.217CC..Hα-helixtrans-60.2-49.4175.900000112.1M91 V92 A93 L98 S99M91-G95 WeakPolarHBondContact O-CA 3.06Å; M91-G95 PolarHBondContact O-N 3.05Å; V92-G95 PolarHBondContact O-N 3.28Å; A93-G95 PolarHBondContact O-N 3.39Å; G95-L98 PolarHBondContact O-N 3.37Å; G95-S99 PolarHBondContact O-N 3.21Å; G95-S99 PolarHBondContact O-OG 2.73Å
96L96.2Very high95.2Very high2 Ų246.6 Ų46.61%0.0125%0.248CC..Hα-helixtrans-61.3-44.5177.3-71.2164.2000112.6V92 A93 S99 A100 Y112 V116 I177 A181V92-L96 HydrophobicContact CG1-CD1 3.82Å; V92-L96 WeakPolarHBondContact O-CB 3.13Å; V92-L96 WeakPolarHBondContact O-CD1 3.49Å; V92-L96 VanDerWaalsContact O-CG 3.27Å; V92-L96 WeakPolarHBondContact O-CG 3.26Å; V92-L96 PolarHBondContact O-N 2.86Å; A93-L96 PolarHBondContact O-N 3.21Å; L96-S99 WeakPolarHBondContact O-CB 3.4Å; L96-S99 PolarHBondContact O-N 2.88Å; L96-A100 PolarHBondContact O-N 2.76Å; L96-Y112 HydrophobicContact CD2-CD2 3.8Å; L96-Y112 HydrophobicContact CD2-CE2 3.44Å; L96-Y112 VanDerWaalsContact CD2-CE2 3.44Å; L96-V116 HydrophobicContact CD2-CG2 4.37Å; L96-V116 HydrophobicContact CG-CG2 4.01Å; L96-I177 HydrophobicContact CD1-CG2 3.98Å; L96-I177 HydrophobicContact CD2-CG2 4.39Å; L96-A181 HydrophobicContact CD1-CB 4.03Å
97M96.8Very high95.2Very high69 Ų6946.9 Ų46.934%0.3425%0.247SC..Hα-helixtrans-68.8-37.3178.3-67.3175.577.200112.1A93 G94 S99 A100 F101 L175A93-M97 WeakPolarHBondContact O-CB 3.24Å; A93-M97 VanDerWaalsContact O-CG 3.22Å; A93-M97 WeakPolarHBondContact O-CG 3.44Å; A93-M97 PolarHBondContact O-N 3.39Å; G94-M97 PolarHBondContact O-N 3.36Å; M97-S99 VanDerWaalsContact C-N 3.29Å; M97-S99 PolarHBondContact O-N 3.25Å; M97-A100 WeakPolarHBondContact O-CB 3.32Å; M97-A100 PolarHBondContact O-N 3.35Å; M97-F101 WeakPolarHBondContact O-CD2 3.46Å; M97-L175 HydrophobicContact CB-CD2 4.09Å; M97-L175 HydrophobicContact CE-CD2 4.27Å; M97-L175 HydrophobicContact CG-CD2 4.23Å
98L95.9Very high95.2Very high87 Ų8741 Ų4146%0.45522%0.221SC..Hα-helixtrans-64.3-36.7174.2-75.7170.2000111.3G94 G95 A100 F101G94-L98 VanDerWaalsContact O-CB 3.24Å; G94-L98 WeakPolarHBondContact O-CB 3.28Å; G94-L98 WeakPolarHBondContact O-CD1 3.22Å; G94-L98 WeakPolarHBondContact O-CG 3.01Å; G94-L98 PolarHBondContact O-N 3.17Å; G95-L98 PolarHBondContact O-N 3.37Å; L98-A100 PolarHBondContact O-N 2.87Å; L98-F101 PolarHBondContact O-N 3.31Å
99S95.9Very high95.2Very high5 Ų542.3 Ų42.34%0.03523%0.228CC..Hα-helixtrans-61.2-26.5177-610000113.6G95 L96 M97 F101 A102 S111 Y112G95-S99 PolarHBondContact O-N 3.21Å; G95-S99 PolarHBondContact O-OG 2.73Å; L96-S99 WeakPolarHBondContact O-CB 3.4Å; L96-S99 PolarHBondContact O-N 2.88Å; M97-S99 VanDerWaalsContact C-N 3.29Å; M97-S99 PolarHBondContact O-N 3.25Å; S99-F101 PolarHBondContact O-N 3.4Å; S99-A102 VanDerWaalsContact O-CB 3.31Å; S99-A102 WeakPolarHBondContact O-CB 3.27Å; S99-A102 PolarHBondContact O-N 3.06Å; S99-S111 WeakPolarHBondContact OG-CB 3.13Å; S99-S111 PolarHBondContact OG-OG 2.88Å; S99-Y112 WeakPolarHBondContact OG-CB 3.37Å; S99-Y112 PolarHBondContact OG-N 3.46Å
100A94.8Very high95.2Very high4 Ų447.6 Ų47.63%0.03325%0.251CS..THydrogen-bonded Turntrans-66.1-23.617500000113.3L96 M97 L98 E171 L174 L175L96-A100 PolarHBondContact O-N 2.76Å; M97-A100 WeakPolarHBondContact O-CB 3.32Å; M97-A100 PolarHBondContact O-N 3.35Å; L98-A100 PolarHBondContact O-N 2.87Å; A100-E171 HydrophobicContact CB-CB 4.36Å; A100-E171 WeakPolarHBondContact CB-O 3.47Å; A100-E171 WeakPolarHBondContact O-CG 3.35Å; A100-L174 HydrophobicContact CB-CB 3.95Å; A100-L175 HydrophobicContact CB-CD1 4.35Å; A100-L175 HydrophobicContact CB-CD2 3.93Å; A100-L175 HydrophobicContact CB-CG 3.64Å
101F94.2Very high95.2Very high138 Ų13843.9 Ų43.961%0.60523%0.229SC*.THydrogen-bonded Turntrans-106.823.1179.9-58-72.7000112.2M97 L98 S99 P103 L175M97-F101 WeakPolarHBondContact O-CD2 3.46Å; L98-F101 PolarHBondContact O-N 3.31Å; S99-F101 PolarHBondContact O-N 3.4Å; F101-P103 VanDerWaalsContact O-CD 3.28Å; F101-P103 WeakPolarHBondContact O-CD 3.24Å; F101-L175 HydrophobicContact CE2-CD2 3.84Å; F101-L175 HydrophobicContact CZ-CD1 4.23Å; F101-L175 HydrophobicContact CZ-CD2 4.18Å
102A92.4Very high95.2Very high17 Ų1742.2 Ų42.214%0.1422%0.221CC..  trans-72.8117.8-174.700000111.7F47 S99 N104 F107 L108F47-A102 HydrophobicContact CZ-CB 4.21Å; S99-A102 VanDerWaalsContact O-CB 3.31Å; S99-A102 WeakPolarHBondContact O-CB 3.27Å; S99-A102 PolarHBondContact O-N 3.06Å; A102-N104 VanDerWaalsContact C-N 3.35Å; A102-F107 HydrophobicContact CB-CD1 3.66Å; A102-F107 HydrophobicContact CB-CE1 4.36Å; A102-L108 HydrophobicContact CB-CB 4.15Å; A102-L108 HydrophobicContact CB-CD1 4.19Å
103P91.3Very high95.1Very high105 Ų10542.2 Ų42.268%0.68222%0.221SC*.SBendtrans-79.7-17.7179.131.7-34.6000113.2F101F101-P103 VanDerWaalsContact O-CD 3.28Å; F101-P103 WeakPolarHBondContact O-CD 3.24Å
104N93.3Very high95Very high72 Ų7245.2 Ų45.239%0.38524%0.236SC..SBendtrans-154.9159.1-176.553.35.7000111.8A102 Q106 F107 L108A102-N104 VanDerWaalsContact C-N 3.35Å; N104-Q106 PolarHBondContact O-N 3.35Å; N104-F107 PolarHBondContact O-N 3.38Å; N104-F107 VanDerWaalsContact O-N 3.11Å; N104-F107 WeakPolarHBondContact OD1-CB 3.49Å; N104-F107 PolarHBondContact OD1-N 2.97Å; N104-L108 PolarHBondContact O-N 3.36Å; N104-L108 VanDerWaalsContact O-N 3.13Å
105V92.4Very high95Very high9 Ų945.2 Ų45.26%0.05523%0.23CC..Hα-helixtrans-60.6-32.9-177.7-179.50000112.2F47 E49 V57 F107 L108 I109F47-V105 HydrophobicContact CB-CG2 3.36Å; F47-V105 HydrophobicContact CD1-CG2 3.84Å; F47-V105 HydrophobicContact CD2-CG2 4.01Å; F47-V105 HydrophobicContact CG-CG2 3.46Å; F47-V105 VanDerWaalsContact CG-CG2 3.46Å; E49-V105 HydrophobicContact CB-CG2 4.06Å; E49-V105 HydrophobicContact CG-CB 4.5Å; E49-V105 HydrophobicContact CG-CG2 3.7Å; V57-V105 HydrophobicContact CG2-CG1 4.15Å; V105-F107 PolarHBondContact O-N 3.41Å; V105-L108 CarbonylContact O-C 3.57Å; V105-L108 WeakPolarHBondContact O-CB 3.42Å; V105-L108 PolarHBondContact O-N 3.16Å; V105-L108 VanDerWaalsContact O-N 3.16Å; V105-I109 HydrophobicContact CG1-CD1 4.07Å; V105-I109 HydrophobicContact CG1-CG1 4.29Å; V105-I109 VanDerWaalsContact O-CG1 3.32Å; V105-I109 WeakPolarHBondContact O-CG1 3.3Å; V105-I109 PolarHBondContact O-N 2.95Å
106Q93.8Very high95Very high139 Ų13945.2 Ų45.265%0.6523%0.23SC*.Hα-helixtrans-64.1-40177.1-66.6-177.6-13.900112.5N104 L108 I109 F110N104-Q106 PolarHBondContact O-N 3.35Å; Q106-L108 VanDerWaalsContact C-N 3.31Å; Q106-I109 PolarHBondContact O-N 3.1Å; Q106-F110 PolarHBondContact O-N 2.86Å
107F95.3Very high95Very high71 Ų7145.1 Ų45.131%0.31123%0.23SC..Hα-helixtrans-68.6-34.1174-174.9-88000111.5A102 N104 V105 F110 S111A102-F107 HydrophobicContact CB-CD1 3.66Å; A102-F107 HydrophobicContact CB-CE1 4.36Å; N104-F107 PolarHBondContact O-N 3.38Å; N104-F107 VanDerWaalsContact O-N 3.11Å; N104-F107 WeakPolarHBondContact OD1-CB 3.49Å; N104-F107 PolarHBondContact OD1-N 2.97Å; V105-F107 PolarHBondContact O-N 3.41Å; F107-F110 PolarHBondContact O-N 3.21Å; F107-S111 WeakPolarHBondContact O-CB 3.34Å; F107-S111 PolarHBondContact O-N 3.5Å; F107-S111 PolarHBondContact O-OG 3.39Å
108L94.6Very high94.9Very high1 Ų144.6 Ų44.61%0.00523%0.228CC..Hα-helixtrans-65.8-42.4173.5-170.864.9000111.9W43 F47 V57 A102 N104 V105 Q106 F110 S111 Y112 G113W43-L108 HydrophobicContact CB-CD2 4.49Å; W43-L108 HydrophobicContact CD2-CD2 3.85Å; W43-L108 HydrophobicContact CG-CD2 3.79Å; W43-L108 HydrophobicContact CZ2-CD2 4.48Å; F47-L108 HydrophobicContact CD2-CD2 4.37Å; F47-L108 HydrophobicContact CE2-CD2 3.76Å; F47-L108 HydrophobicContact CZ-CD2 4.42Å; V57-L108 HydrophobicContact CG1-CD2 4.02Å; V57-L108 HydrophobicContact CG1-CG 3.81Å; V57-L108 HydrophobicContact CG2-CB 4.34Å; V57-L108 HydrophobicContact CG2-CD2 3.91Å; V57-L108 HydrophobicContact CG2-CG 3.98Å; A102-L108 HydrophobicContact CB-CB 4.15Å; A102-L108 HydrophobicContact CB-CD1 4.19Å; N104-L108 PolarHBondContact O-N 3.36Å; N104-L108 VanDerWaalsContact O-N 3.13Å; V105-L108 CarbonylContact O-C 3.57Å; V105-L108 WeakPolarHBondContact O-CB 3.42Å; V105-L108 PolarHBondContact O-N 3.16Å; V105-L108 VanDerWaalsContact O-N 3.16Å; Q106-L108 VanDerWaalsContact C-N 3.31Å; L108-F110 VanDerWaalsContact C-N 3.29Å; L108-F110 PolarHBondContact O-N 3.07Å; L108-S111 PolarHBondContact O-N 3.46Å; L108-S111 PolarHBondContact O-OG 3.21Å; L108-Y112 WeakPolarHBondContact O-CA 3.06Å; L108-Y112 WeakPolarHBondContact O-CB 3.5Å; L108-Y112 PolarHBondContact O-N 3.09Å; L108-G113 PolarHBondContact O-N 3.01Å
109I95.5Very high94.9Very high27 Ų2740.5 Ų40.514%0.13821%0.206CC..Iπ-helixtrans-57.6-43.5172.4-74.9169000110.7W56 V57 L60 V105 Q106 G113 I114W56-I109 HydrophobicContact CB-CD1 3.76Å; W56-I109 HydrophobicContact CB-CG1 4.06Å; V57-I109 HydrophobicContact CG2-CG1 3.61Å; L60-I109 HydrophobicContact CD1-CG2 3.42Å; L60-I109 VanDerWaalsContact CD1-CG2 3.42Å; V105-I109 HydrophobicContact CG1-CD1 4.07Å; V105-I109 HydrophobicContact CG1-CG1 4.29Å; V105-I109 VanDerWaalsContact O-CG1 3.32Å; V105-I109 WeakPolarHBondContact O-CG1 3.3Å; V105-I109 PolarHBondContact O-N 2.95Å; Q106-I109 PolarHBondContact O-N 3.1Å; I109-G113 CarbonylContact O-C 3.54Å; I109-G113 WeakPolarHBondContact O-CA 3.48Å; I109-G113 PolarHBondContact O-N 2.79Å; I109-I114 PolarHBondContact O-N 2.92Å
110F96.4Very high94.8Very high112 Ų11240.2 Ų40.249%0.49121%0.205SC..Iπ-helixtrans-66.7-52.2177.9174.1-102.8000112.2Q106 F107 L108 I114 V115Q106-F110 PolarHBondContact O-N 2.86Å; F107-F110 PolarHBondContact O-N 3.21Å; L108-F110 VanDerWaalsContact C-N 3.29Å; L108-F110 PolarHBondContact O-N 3.07Å; F110-I114 WeakPolarHBondContact O-CB 3.4Å; F110-I114 PolarHBondContact O-N 3.29Å; F110-V115 HydrophobicContact CE1-CG2 4.15Å; F110-V115 HydrophobicContact CE2-CG2 4.47Å; F110-V115 HydrophobicContact CZ-CG2 4.1Å; F110-V115 WeakPolarHBondContact O-CG2 3.3Å; F110-V115 PolarHBondContact O-N 2.9Å
111S96.6Very high94.7Very high1 Ų140.1 Ų40.11%0.00720%0.204CC..Iπ-helixtrans-71.5-60-175.955.30000112.5S99 F107 L108 V115 V116S99-S111 WeakPolarHBondContact OG-CB 3.13Å; S99-S111 PolarHBondContact OG-OG 2.88Å; F107-S111 WeakPolarHBondContact O-CB 3.34Å; F107-S111 PolarHBondContact O-N 3.5Å; F107-S111 PolarHBondContact O-OG 3.39Å; L108-S111 PolarHBondContact O-N 3.46Å; L108-S111 PolarHBondContact O-OG 3.21Å; S111-V115 WeakPolarHBondContact O-CB 3.44Å; S111-V116 PolarHBondContact O-N 3.3Å
112Y95.6Very high94.6Very high0 Ų034.2 Ų34.20%018%0.179CC..Iπ-helixtrans-76.1-41.2-178.3-166.4-89.1000112.1S32 V36 L39 W43 V57 V61 L96 S99 L108 V116 L174S32-Y112 PolarHBondContact O-OH 3.25Å; S32-Y112 VanDerWaalsContact O-OH 3.13Å; S32-Y112 PolarHBondContact OG-OH 3.41Å; V36-Y112 HydrophobicContact CG2-CE1 3.97Å; L39-Y112 HydrophobicContact CD1-CE2 4.23Å; W43-Y112 AromaticContact CH2-CD1 3.83Å; W43-Y112 HydrophobicContact CH2-CD1 3.83Å; W43-Y112 HydrophobicContact CH2-CD2 4.21Å; W43-Y112 AromaticContact CH2-CE1 3.67Å; W43-Y112 HydrophobicContact CH2-CE1 3.67Å; W43-Y112 HydrophobicContact CH2-CE2 4.07Å; W43-Y112 HydrophobicContact CH2-CG 4.1Å; W43-Y112 AromaticContact CH2-CZ 3.81Å; W43-Y112 HydrophobicContact CZ2-CD2 4.21Å; W43-Y112 HydrophobicContact CZ2-CE2 4.25Å; W43-Y112 HydrophobicContact CZ2-CG 4.36Å; W43-Y112 HydrophobicContact CZ3-CE1 4.45Å; V57-Y112 HydrophobicContact CG1-CD1 3.65Å; V57-Y112 HydrophobicContact CG1-CG 4.06Å; V61-Y112 HydrophobicContact CB-CD1 4.23Å; V61-Y112 HydrophobicContact CB-CE1 4.18Å; V61-Y112 WeakPolarHBondContact CB-O 3.34Å; V61-Y112 HydrophobicContact CG1-CD1 4.29Å; V61-Y112 HydrophobicContact CG1-CE1 3.83Å; V61-Y112 HydrophobicContact CG2-CE1 4.39Å; V61-Y112 WeakPolarHBondContact CG2-O 3.3Å; L96-Y112 HydrophobicContact CD2-CD2 3.8Å; L96-Y112 HydrophobicContact CD2-CE2 3.44Å; L96-Y112 VanDerWaalsContact CD2-CE2 3.44Å; S99-Y112 WeakPolarHBondContact OG-CB 3.37Å; S99-Y112 PolarHBondContact OG-N 3.46Å; L108-Y112 WeakPolarHBondContact O-CA 3.06Å; L108-Y112 WeakPolarHBondContact O-CB 3.5Å; L108-Y112 PolarHBondContact O-N 3.09Å; Y112-V116 VanDerWaalsContact O-CB 3.31Å; Y112-V116 WeakPolarHBondContact O-CB 3.4Å; Y112-L174 HydrophobicContact CE2-CD2 4.36Å
113G94.9Very high94.7Very high0 Ų033.4 Ų33.40%017%0.172CC..Iπ-helixtrans-72.9-64.8-178.100000112.1V61 L108 I109 G117V61-G113 VanDerWaalsContact CA-O 3.27Å; V61-G113 WeakPolarHBondContact CA-O 3.44Å; V61-G113 PolarHBondContact N-O 3.4Å; L108-G113 PolarHBondContact O-N 3.01Å; I109-G113 CarbonylContact O-C 3.54Å; I109-G113 WeakPolarHBondContact O-CA 3.48Å; I109-G113 PolarHBondContact O-N 2.79Å; G113-G117 WeakPolarHBondContact O-CA 3.36Å; G113-G117 PolarHBondContact O-N 3.13Å
114I96Very high94.7Very high62 Ų6230.6 Ų30.632%0.31815%0.148SC..Iπ-helixtrans-80.5-51.3-169.7-58.4174.7000111.8I109 F110 G117 L118I109-I114 PolarHBondContact O-N 2.92Å; F110-I114 WeakPolarHBondContact O-CB 3.4Å; F110-I114 PolarHBondContact O-N 3.29Å; I114-G117 PolarHBondContact O-N 2.88Å; I114-L118 HydrophobicContact CG2-CD1 4.07Å; I114-L118 WeakPolarHBondContact O-CB 3.37Å; I114-L118 WeakPolarHBondContact O-CG 3.46Å; I114-L118 PolarHBondContact O-N 2.96Å
115V96.8Very high94.4Very high29 Ų2927.7 Ų27.718%0.17613%0.134CC..Iπ-helixtrans-68-49.3-173.41770000111.3M91 F110 S111 G119M91-V115 HydrophobicContact CB-CG1 4.42Å; M91-V115 HydrophobicContact CE-CG1 4.35Å; F110-V115 HydrophobicContact CE1-CG2 4.15Å; F110-V115 HydrophobicContact CE2-CG2 4.47Å; F110-V115 HydrophobicContact CZ-CG2 4.1Å; F110-V115 WeakPolarHBondContact O-CG2 3.3Å; F110-V115 PolarHBondContact O-N 2.9Å; S111-V115 WeakPolarHBondContact O-CB 3.44Å; V115-G119 PolarHBondContact O-N 3.13Å; V115-G119 VanDerWaalsContact O-N 3.11Å
116V96.9Very high94.3Very high0 Ų027.2 Ų27.20%013%0.131CC..Hα-helixtrans-65.8-39.2175.6-179.50000111P33 V61 V92 L96 S111 Y112 L118 G119 C120P33-V116 HydrophobicContact CG-CG1 4.2Å; V61-V116 HydrophobicContact CG2-CB 4.07Å; V61-V116 HydrophobicContact CG2-CG1 3.84Å; V92-V116 HydrophobicContact CG1-CG1 4.22Å; V92-V116 HydrophobicContact CG2-CG1 4.45Å; L96-V116 HydrophobicContact CD2-CG2 4.37Å; L96-V116 HydrophobicContact CG-CG2 4.01Å; S111-V116 PolarHBondContact O-N 3.3Å; Y112-V116 VanDerWaalsContact O-CB 3.31Å; Y112-V116 WeakPolarHBondContact O-CB 3.4Å; V116-L118 PolarHBondContact O-N 3.46Å; V116-G119 CarbonylContact O-C 3.6Å; V116-G119 WeakPolarHBondContact O-CA 3.41Å; V116-G119 PolarHBondContact O-N 3.24Å; V116-G119 VanDerWaalsContact O-N 3.16Å; V116-C120 PolarHBondContact O-N 3.17Å; V116-C120 PolarHBondContact O-SG 3.39Å
117G95.3Very high94.2Very high0 Ų020.6 Ų20.60%010%0.1CC..Hα-helixtrans-61.8-44.1179.500000113.5V61 G65 G113 I114 G119 C120 G121V61-G117 WeakPolarHBondContact O-CA 3.3Å; G65-G117 VanDerWaalsContact CA-O 3.26Å; G65-G117 WeakPolarHBondContact CA-O 3.47Å; G113-G117 WeakPolarHBondContact O-CA 3.36Å; G113-G117 PolarHBondContact O-N 3.13Å; I114-G117 PolarHBondContact O-N 2.88Å; G117-G119 VanDerWaalsContact C-N 3.35Å; G117-C120 PolarHBondContact O-N 3.44Å; G117-G121 PolarHBondContact O-N 2.88Å
118L95.4Very high93.6Very high58 Ų5820 Ų2030%0.30410%0.1SC..Hα-helixtrans-63-41172.3-74174.2000112V64 A68 M91 I114 V116 G121 L122V64-L118 HydrophobicContact CG1-CD2 3.65Å; V64-L118 HydrophobicContact CG1-CG 3.66Å; A68-L118 HydrophobicContact CB-CD2 3.6Å; M91-L118 HydrophobicContact CE-CB 3.7Å; M91-L118 HydrophobicContact CE-CD1 4.35Å; I114-L118 HydrophobicContact CG2-CD1 4.07Å; I114-L118 WeakPolarHBondContact O-CB 3.37Å; I114-L118 WeakPolarHBondContact O-CG 3.46Å; I114-L118 PolarHBondContact O-N 2.96Å; V116-L118 PolarHBondContact O-N 3.46Å; L118-G121 PolarHBondContact O-N 2.93Å; L118-L122 WeakPolarHBondContact O-CG 3.45Å; L118-L122 PolarHBondContact O-N 3.23Å
119G95.6Very high93Very high0 Ų020.9 Ų20.90%011%0.105CC..Hα-helixtrans-58.7-46.9174.400000112.1S88 V115 V116 G117 G121 L122 V123S88-G119 WeakPolarHBondContact CB-O 3.16Å; V115-G119 PolarHBondContact O-N 3.13Å; V115-G119 VanDerWaalsContact O-N 3.11Å; V116-G119 CarbonylContact O-C 3.6Å; V116-G119 WeakPolarHBondContact O-CA 3.41Å; V116-G119 PolarHBondContact O-N 3.24Å; V116-G119 VanDerWaalsContact O-N 3.16Å; G117-G119 VanDerWaalsContact C-N 3.35Å; G119-G121 PolarHBondContact O-N 2.97Å; G119-L122 PolarHBondContact O-N 3.28Å; G119-V123 WeakPolarHBondContact O-CG2 3.46Å; G119-V123 PolarHBondContact O-N 2.99Å
120C94.6Very high92.6Very high0 Ų019.7 Ų19.70%010%0.099CC..Hα-helixtrans-60.8-45177-67.30000111.9A29 Y30 V116 G117 L122 V123 Y124A29-C120 PolarHBondContact O-SG 3.19Å; Y30-C120 HydrophobicContact CD2-CB 4.34Å; Y30-C120 HydrophobicContact CE1-CB 4.08Å; Y30-C120 HydrophobicContact CE2-CB 3.78Å; Y30-C120 WeakPolarHBondContact CE2-O 3.47Å; Y30-C120 PolarHBondContact OH-O 3.3Å; V116-C120 PolarHBondContact O-N 3.17Å; V116-C120 PolarHBondContact O-SG 3.39Å; G117-C120 PolarHBondContact O-N 3.44Å; C120-L122 VanDerWaalsContact C-N 3.32Å; C120-L122 PolarHBondContact O-N 2.88Å; C120-V123 PolarHBondContact O-N 2.88Å; C120-Y124 WeakPolarHBondContact O-CB 3.3Å; C120-Y124 PolarHBondContact O-N 3.4Å
121G92.2Very high92.1Very high1 Ų114.4 Ų14.41%0.018%0.076CC..Hα-helixtrans-59.6-39.2175.900000113.4C72 G117 L118 G119 Y124 A125C72-G121 VanDerWaalsContact SG-C 3.59Å; G117-G121 PolarHBondContact O-N 2.88Å; L118-G121 PolarHBondContact O-N 2.93Å; G119-G121 PolarHBondContact O-N 2.97Å; G121-Y124 PolarHBondContact O-N 3.02Å; G121-A125 PolarHBondContact O-N 3.05Å
122L92.8Very high91.3Very high15 Ų1516.1 Ų16.18%0.0799%0.088CC..Hα-helixtrans-67.2-42.9175.4-72.3170000112.5C72 C75 V84 F87 M91 L118 G119 C120 Y124 A125 A126C72-L122 HydrophobicContact CB-CD2 3.91Å; C72-L122 HydrophobicContact CB-CG 4.46Å; C75-L122 HydrophobicContact CB-CD2 4.1Å; V84-L122 HydrophobicContact CG1-CB 3.97Å; V84-L122 HydrophobicContact CG1-CD2 3.84Å; V84-L122 HydrophobicContact CG1-CG 4.41Å; F87-L122 HydrophobicContact CD1-CD1 3.9Å; F87-L122 HydrophobicContact CE1-CD1 4.04Å; M91-L122 HydrophobicContact SD-CD1 3.92Å; L118-L122 WeakPolarHBondContact O-CG 3.45Å; L118-L122 PolarHBondContact O-N 3.23Å; G119-L122 PolarHBondContact O-N 3.28Å; C120-L122 VanDerWaalsContact C-N 3.32Å; C120-L122 PolarHBondContact O-N 2.88Å; L122-Y124 VanDerWaalsContact C-N 3.33Å; L122-A125 PolarHBondContact O-N 3.37Å; L122-A126 VanDerWaalsContact O-CB 3.31Å; L122-A126 WeakPolarHBondContact O-CB 3.47Å; L122-A126 PolarHBondContact O-N 3.33Å
123V94.3Very high90.6Very high0 Ų019.6 Ų19.60%010%0.104CC..Hα-helixtrans-61-44.3174.2174.10000110.5A25 A29 S88 G119 C120 A126 T127 L184A25-V123 HydrophobicContact CB-CG1 4.18Å; A29-V123 HydrophobicContact CB-CB 4.17Å; A29-V123 HydrophobicContact CB-CG1 4.01Å; A29-V123 HydrophobicContact CB-CG2 4.03Å; S88-V123 WeakPolarHBondContact OG-CG2 3.21Å; G119-V123 WeakPolarHBondContact O-CG2 3.46Å; G119-V123 PolarHBondContact O-N 2.99Å; C120-V123 PolarHBondContact O-N 2.88Å; V123-A126 PolarHBondContact O-N 3.45Å; V123-T127 HydrophobicContact CG1-CG2 4.06Å; V123-T127 WeakPolarHBondContact O-CB 3.43Å; V123-T127 VanDerWaalsContact O-CG2 3.31Å; V123-T127 WeakPolarHBondContact O-CG2 3.36Å; V123-T127 PolarHBondContact O-N 3.12Å; V123-T127 PolarHBondContact O-OG1 3.27Å; V123-L184 HydrophobicContact CG1-CD2 4.22Å; V123-L184 HydrophobicContact CG2-CD2 3.89Å
124Y90.8Very high90Very high46 Ų4619.9 Ų19.918%0.1811%0.105CC..Hα-helixtrans-60.1-49.9179.2-176.9-99.8000111.4C120 G121 L122 A126 T127 L128C120-Y124 WeakPolarHBondContact O-CB 3.3Å; C120-Y124 PolarHBondContact O-N 3.4Å; G121-Y124 PolarHBondContact O-N 3.02Å; L122-Y124 VanDerWaalsContact C-N 3.33Å; Y124-A126 PolarHBondContact O-N 3.12Å; Y124-T127 PolarHBondContact O-N 3.24Å; Y124-T127 PolarHBondContact O-OG1 3Å; Y124-T127 VanDerWaalsContact O-OG1 3.07Å; Y124-L128 HydrophobicContact CE1-CD1 4.04Å; Y124-L128 VanDerWaalsContact O-CB 3.26Å; Y124-L128 WeakPolarHBondContact O-CB 3.28Å; Y124-L128 PolarHBondContact O-N 2.96Å
125A86.9Confident89.2Confident10 Ų1017 Ų178%0.0839%0.09CC..Hα-helixtrans-61-42.4176.800000112.5C72 V76 G121 L122 T129C72-A125 HydrophobicContact CB-CB 3.84Å; V76-A125 HydrophobicContact CG2-CB 3.99Å; G121-A125 PolarHBondContact O-N 3.05Å; L122-A125 PolarHBondContact O-N 3.37Å; A125-T129 WeakPolarHBondContact O-CB 3.37Å; A125-T129 VanDerWaalsContact O-CG2 3.23Å; A125-T129 WeakPolarHBondContact O-CG2 3.32Å; A125-T129 PolarHBondContact O-N 3.45Å; A125-T129 PolarHBondContact O-OG1 3.41Å
126A90.3Very high88.1Confident0 Ų019.9 Ų19.90%011%0.105CC..Hα-helixtrans-66.9-44-179.700000112.6V76 A81 V84 T85 L122 V123 Y124 T129 I130V76-A126 HydrophobicContact CG2-CB 3.98Å; A81-A126 HydrophobicContact CB-CB 4.31Å; V84-A126 HydrophobicContact CG1-CB 4.42Å; T85-A126 VanDerWaalsContact OG1-CB 3.3Å; T85-A126 WeakPolarHBondContact OG1-CB 3.45Å; L122-A126 VanDerWaalsContact O-CB 3.31Å; L122-A126 WeakPolarHBondContact O-CB 3.47Å; L122-A126 PolarHBondContact O-N 3.33Å; V123-A126 PolarHBondContact O-N 3.45Å; Y124-A126 PolarHBondContact O-N 3.12Å; A126-T129 PolarHBondContact O-OG1 3.12Å; A126-I130 VanDerWaalsContact O-CG2 3.28Å; A126-I130 WeakPolarHBondContact O-CG2 3.14Å; A126-I130 PolarHBondContact O-N 3.37Å; A126-I130 VanDerWaalsContact O-N 3.13Å
127T90.7Very high86.9Confident0 Ų028.7 Ų28.70%014%0.143CC..Hα-helixtrans-68.7-38.2178.853.70000112.1C22 A25 Q26 V123 Y124 I130 T131 M191C22-T127 HydrophobicContact CB-CG2 3.94Å; A25-T127 HydrophobicContact CB-CG2 4.08Å; Q26-T127 HydrophobicContact CG-CG2 4.25Å; Q26-T127 PolarHBondContact NE2-OG1 3.45Å; V123-T127 HydrophobicContact CG1-CG2 4.06Å; V123-T127 WeakPolarHBondContact O-CB 3.43Å; V123-T127 VanDerWaalsContact O-CG2 3.31Å; V123-T127 WeakPolarHBondContact O-CG2 3.36Å; V123-T127 PolarHBondContact O-N 3.12Å; V123-T127 PolarHBondContact O-OG1 3.27Å; Y124-T127 PolarHBondContact O-N 3.24Å; Y124-T127 PolarHBondContact O-OG1 3Å; Y124-T127 VanDerWaalsContact O-OG1 3.07Å; T127-I130 WeakPolarHBondContact O-CG2 3.48Å; T127-T131 VanDerWaalsContact O-CB 3.28Å; T127-T131 WeakPolarHBondContact O-CB 3.28Å; T127-T131 PolarHBondContact O-N 2.78Å; T127-T131 VanDerWaalsContact O-N 3.16Å; T127-T131 PolarHBondContact O-OG1 2.98Å; T127-M191 HydrophobicContact CG2-CE 3.92Å
128L84.1Confident85.9Confident58 Ų5835.3 Ų35.330%0.30417%0.168SC..Hα-helixtrans-65.9-49.4176.8-175.2145000111.6Y124 T131 C132 L143Y124-L128 HydrophobicContact CE1-CD1 4.04Å; Y124-L128 VanDerWaalsContact O-CB 3.26Å; Y124-L128 WeakPolarHBondContact O-CB 3.28Å; Y124-L128 PolarHBondContact O-N 2.96Å; L128-T131 PolarHBondContact O-N 2.85Å; L128-C132 PolarHBondContact O-N 3Å; L128-C132 VanDerWaalsContact O-N 3.07Å; L128-C132 PolarHBondContact O-SG 3.48Å; L128-C132 VanDerWaalsContact O-SG 3.34Å; L128-L143 HydrophobicContact CG-CD2 4.17Å
129T82.3Confident84.8Confident20 Ų2037.5 Ų37.512%0.12317%0.172CC..Hα-helixtrans-63.4-45.6-178.851.10000112.6V76 A125 A126 T131 C132 Q133V76-T129 HydrophobicContact CG1-CG2 4.08Å; V76-T129 WeakPolarHBondContact CG1-OG1 3.3Å; A125-T129 WeakPolarHBondContact O-CB 3.37Å; A125-T129 VanDerWaalsContact O-CG2 3.23Å; A125-T129 WeakPolarHBondContact O-CG2 3.32Å; A125-T129 PolarHBondContact O-N 3.45Å; A125-T129 PolarHBondContact O-OG1 3.41Å; A126-T129 PolarHBondContact O-OG1 3.12Å; T129-T131 VanDerWaalsContact C-N 3.34Å; T129-T131 PolarHBondContact O-N 3.26Å; T129-C132 PolarHBondContact O-N 2.9Å; T129-Q133 WeakPolarHBondContact O-CG 3.23Å; T129-Q133 PolarHBondContact O-N 3.16Å; T129-Q133 VanDerWaalsContact O-N 3.08Å
130I85.9Confident83.7Confident1 Ų140.4 Ų40.41%0.00520%0.202CC..Hα-helixtrans-66.4-37.7179.7-162.965.6000111.4V18 C22 A81 A126 T127 C132 Q133 Y134 M191V18-I130 HydrophobicContact CG1-CG1 3.99Å; V18-I130 HydrophobicContact CG1-CG2 4.14Å; C22-I130 WeakPolarHBondContact SG-CG2 3.38Å; A81-I130 HydrophobicContact CB-CB 4.07Å; A81-I130 HydrophobicContact CB-CD1 4.33Å; A126-I130 VanDerWaalsContact O-CG2 3.28Å; A126-I130 WeakPolarHBondContact O-CG2 3.14Å; A126-I130 PolarHBondContact O-N 3.37Å; A126-I130 VanDerWaalsContact O-N 3.13Å; T127-I130 WeakPolarHBondContact O-CG2 3.48Å; I130-C132 PolarHBondContact O-N 2.92Å; I130-Q133 PolarHBondContact O-N 2.73Å; I130-Y134 HydrophobicContact CD1-CD2 4.1Å; I130-Y134 HydrophobicContact CD1-CE2 3.8Å; I130-Y134 HydrophobicContact CG1-CD2 4.01Å; I130-Y134 HydrophobicContact CG1-CE2 3.97Å; I130-Y134 WeakPolarHBondContact O-CD2 3.43Å; I130-Y134 PolarHBondContact O-N 3.16Å; I130-Y134 VanDerWaalsContact O-N 3.1Å; I130-M191 HydrophobicContact CG1-CB 4.49Å; I130-M191 HydrophobicContact CG2-SD 4.34Å
131T85.5Confident82.9Confident1 Ų145.1 Ų45.11%0.00623%0.226CC..Hα-helixtrans-62.5-44.6176.9-59.10000111T127 L128 T129 Q133 Y134 F135 A142 L143T127-T131 VanDerWaalsContact O-CB 3.28Å; T127-T131 WeakPolarHBondContact O-CB 3.28Å; T127-T131 PolarHBondContact O-N 2.78Å; T127-T131 VanDerWaalsContact O-N 3.16Å; T127-T131 PolarHBondContact O-OG1 2.98Å; L128-T131 PolarHBondContact O-N 2.85Å; T129-T131 VanDerWaalsContact C-N 3.34Å; T129-T131 PolarHBondContact O-N 3.26Å; T131-Q133 VanDerWaalsContact C-N 3.27Å; T131-Q133 PolarHBondContact O-N 2.99Å; T131-Y134 PolarHBondContact O-N 3.35Å; T131-F135 PolarHBondContact O-N 3.13Å; T131-A142 HydrophobicContact CG2-CB 3.59Å; T131-L143 HydrophobicContact CG2-CD2 3.89Å; T131-L143 HydrophobicContact CG2-CG 4.15Å
132C80.3Confident82.4Confident38 Ų3845.1 Ų45.126%0.25723%0.226SC..Hα-helixtrans-66.6-24.9176.7-70.50000113.9L128 T129 I130 R139L128-C132 PolarHBondContact O-N 3Å; L128-C132 VanDerWaalsContact O-N 3.07Å; L128-C132 PolarHBondContact O-SG 3.48Å; L128-C132 VanDerWaalsContact O-SG 3.34Å; T129-C132 PolarHBondContact O-N 2.9Å; I130-C132 PolarHBondContact O-N 2.92Å; C132-R139 PolarHBondContact O-NE 3.14Å; C132-R139 PolarHBondContact O-NH2 3.09Å
133Q81.4Confident81.9Confident73 Ų7346.6 Ų46.634%0.34123%0.234SC..Hα-helixtrans-76.9-36174.2-73.6178.57.100112.6T129 I130 T131 L194T129-Q133 WeakPolarHBondContact O-CG 3.23Å; T129-Q133 PolarHBondContact O-N 3.16Å; T129-Q133 VanDerWaalsContact O-N 3.08Å; I130-Q133 PolarHBondContact O-N 2.73Å; T131-Q133 VanDerWaalsContact C-N 3.27Å; T131-Q133 PolarHBondContact O-N 2.99Å; Q133-L194 WeakPolarHBondContact O-CD1 3.31Å
134Y82.4Confident81.2Confident5 Ų547.6 Ų47.62%0.0225%0.245CC..Hα-helixtrans-79.7-37.5-178.6-89.9-95.6000112.9L10 V18 I130 T131 R192 L194L10-Y134 CarbonylContact C-O 3.6Å; L10-Y134 PolarHBondContact N-O 3.46Å; L10-Y134 VanDerWaalsContact N-O 3.15Å; V18-Y134 HydrophobicContact CG1-CD2 4.25Å; V18-Y134 HydrophobicContact CG1-CE2 4.4Å; V18-Y134 HydrophobicContact CG2-CD1 4.41Å; V18-Y134 HydrophobicContact CG2-CD2 4.4Å; V18-Y134 HydrophobicContact CG2-CE1 4.01Å; V18-Y134 HydrophobicContact CG2-CE2 4.01Å; I130-Y134 HydrophobicContact CD1-CD2 4.1Å; I130-Y134 HydrophobicContact CD1-CE2 3.8Å; I130-Y134 HydrophobicContact CG1-CD2 4.01Å; I130-Y134 HydrophobicContact CG1-CE2 3.97Å; I130-Y134 WeakPolarHBondContact O-CD2 3.43Å; I130-Y134 PolarHBondContact O-N 3.16Å; I130-Y134 VanDerWaalsContact O-N 3.1Å; T131-Y134 PolarHBondContact O-N 3.35Å; Y134-R192 VanDerWaalsContact CE2-O 3.31Å; Y134-R192 WeakPolarHBondContact CE2-O 3.38Å; Y134-R192 PolarHBondContact OH-O 3.13Å; Y134-L194 HydrophobicContact CD1-CD1 3.77Å; Y134-L194 HydrophobicContact CD1-CG 4.39Å; Y134-L194 HydrophobicContact CD2-CD1 3.58Å; Y134-L194 HydrophobicContact CD2-CG 4.06Å; Y134-L194 HydrophobicContact CE1-CD1 3.86Å; Y134-L194 HydrophobicContact CE1-CD2 3.92Å; Y134-L194 HydrophobicContact CE1-CG 3.97Å; Y134-L194 HydrophobicContact CE2-CD1 3.67Å; Y134-L194 HydrophobicContact CE2-CD2 4.38Å; Y134-L194 HydrophobicContact CE2-CG 3.6Å; Y134-L194 HydrophobicContact CG-CD1 3.64Å; Y134-L194 HydrophobicContact CG-CG 4.44Å
135F78.9Confident81Confident1 Ų148.2 Ų48.20%0.00425%0.25CS..  trans-111.3139.2-177.9-68.3-90.5000111.2G15 W16 I19 T131 R138 R139 A142G15-F135 WeakPolarHBondContact O-CE2 3.37Å; W16-F135 HydrophobicContact CD2-CZ 4.32Å; W16-F135 HydrophobicContact CZ2-CE1 4.42Å; I19-F135 HydrophobicContact CD1-CD2 3.94Å; I19-F135 HydrophobicContact CD1-CE1 4.17Å; I19-F135 HydrophobicContact CD1-CE2 3.21Å; I19-F135 HydrophobicContact CD1-CZ 3.33Å; I19-F135 HydrophobicContact CG1-CD2 4.33Å; I19-F135 HydrophobicContact CG1-CE2 3.62Å; I19-F135 HydrophobicContact CG1-CZ 4.17Å; T131-F135 PolarHBondContact O-N 3.13Å; F135-R138 HydrophobicContact CD1-CB 4.18Å; F135-R139 HydrophobicContact CB-CG 4.26Å; F135-R139 WeakPolarHBondContact O-CD 3.47Å; F135-R139 WeakPolarHBondContact O-CG 3.4Å; F135-R139 PolarHBondContact O-NE 3.24Å; F135-A142 HydrophobicContact CB-CB 4.32Å; F135-A142 HydrophobicContact CD2-CB 3.9Å; F135-A142 HydrophobicContact CE2-CB 4.41Å; F135-A142 HydrophobicContact CG-CB 3.97Å
136D73.1Confident81.1Confident91 Ų9147.8 Ų47.849%0.48725%0.247SC..SBendtrans-119.3-53.3174.8-159.121000110.1A9 D11 R139A9-D136 HydrophobicContact CB-CB 3.95Å; D11-D136 PolarHBondContact OD1-N 3.02Å; D136-R139 IonicContact OD1-CZ 3.38Å; D136-R139 IonicContact OD1-NE 3.94Å; D136-R139 IonicContact OD1-NH1 3.77Å; D136-R139 PolarHBondContact OD1-NH1 3.11Å; D136-R139 IonicContact OD1-NH2 3.07Å; D136-R139 PolarHBondContact OD1-NH2 3.27Å
137K72.6Confident80.8Confident185 Ų18549.2 Ų49.280%0.80426%0.256SS*.THydrogen-bonded Turntrans-78.2-29.5-179.7-67-177.3179.3-174.20113.9D11D11-K137 PolarHBondContact OD1-N 2.94Å; D11-K137 VanDerWaalsContact OD1-N 3.07Å; D11-K137 WeakPolarHBondContact OD2-CB 3.36Å; D11-K137 WeakPolarHBondContact OD2-CG 3.37Å
138R73.8Confident80.7Confident139 Ų13950.4 Ų50.453%0.52526%0.263SS..THydrogen-bonded Turntrans-113.629.1-175-60.2-175.3-178.4-1671.7113.5F135 G140 L141 A142F135-R138 HydrophobicContact CD1-CB 4.18Å; R138-G140 PolarHBondContact O-N 3.02Å; R138-L141 PolarHBondContact O-N 3.01Å; R138-A142 WeakPolarHBondContact O-CB 3.36Å; R138-A142 PolarHBondContact O-N 3.22Å
139R73.4Confident81.1Confident104 Ų10447.6 Ų47.639%0.39225%0.248SC..Hα-helixtrans-56.4-45.9-177.6-76-178.8175.9151.512.7113.6C132 F135 D136 L141 A142 L143C132-R139 PolarHBondContact O-NE 3.14Å; C132-R139 PolarHBondContact O-NH2 3.09Å; F135-R139 HydrophobicContact CB-CG 4.26Å; F135-R139 WeakPolarHBondContact O-CD 3.47Å; F135-R139 WeakPolarHBondContact O-CG 3.4Å; F135-R139 PolarHBondContact O-NE 3.24Å; D136-R139 IonicContact OD1-CZ 3.38Å; D136-R139 IonicContact OD1-NE 3.94Å; D136-R139 IonicContact OD1-NH1 3.77Å; D136-R139 PolarHBondContact OD1-NH1 3.11Å; D136-R139 IonicContact OD1-NH2 3.07Å; D136-R139 PolarHBondContact OD1-NH2 3.27Å; R139-L141 PolarHBondContact O-N 2.93Å; R139-A142 PolarHBondContact O-N 2.88Å; R139-L143 WeakPolarHBondContact O-CB 3.47Å; R139-L143 WeakPolarHBondContact O-CG 3.29Å; R139-L143 PolarHBondContact O-N 3.44Å
140G70.6Confident81.5Confident60 Ų6047.2 Ų47.262%0.61925%0.246SC*.Hα-helixtrans-59.6-47.6-178.700000112.4R138 G144R138-G140 PolarHBondContact O-N 3.02Å; G140-G144 PolarHBondContact O-N 2.82Å
141L78.7Confident81.8Confident99 Ų9947.3 Ų47.352%0.51825%0.247SC..Hα-helixtrans-61.8-45.6176.2-177.569.7000111.7W16 R138 R139 G144 I145W16-L141 HydrophobicContact CH2-CD2 4.11Å; R138-L141 PolarHBondContact O-N 3.01Å; R139-L141 PolarHBondContact O-N 2.93Å; L141-G144 PolarHBondContact O-N 3.4Å; L141-I145 HydrophobicContact CD1-CD1 4.46Å; L141-I145 HydrophobicContact CG-CD1 4.18Å; L141-I145 WeakPolarHBondContact O-CG1 3.32Å; L141-I145 PolarHBondContact O-N 3.38Å
142A82.4Confident82.1Confident1 Ų149.8 Ų49.81%0.00826%0.262CS..Hα-helixtrans-62.1-47.5-179.800000112.2I19 T131 F135 R138 R139 G144 I145 V146I19-A142 HydrophobicContact CD1-CB 3.51Å; I19-A142 HydrophobicContact CG1-CB 4.16Å; T131-A142 HydrophobicContact CG2-CB 3.59Å; F135-A142 HydrophobicContact CB-CB 4.32Å; F135-A142 HydrophobicContact CD2-CB 3.9Å; F135-A142 HydrophobicContact CE2-CB 4.41Å; F135-A142 HydrophobicContact CG-CB 3.97Å; R138-A142 WeakPolarHBondContact O-CB 3.36Å; R138-A142 PolarHBondContact O-N 3.22Å; R139-A142 PolarHBondContact O-N 2.88Å; A142-G144 VanDerWaalsContact C-N 3.35Å; A142-I145 PolarHBondContact O-N 3.28Å; A142-V146 WeakPolarHBondContact O-CG2 3.34Å; A142-V146 PolarHBondContact O-N 3.07Å
143L81.9Confident82.7Confident46 Ų4648 Ų4824%0.24125%0.25CC..Hα-helixtrans-65.3-38.2176.3-70.4169.8000111.8L128 T131 R139 V146 T147L128-L143 HydrophobicContact CG-CD2 4.17Å; T131-L143 HydrophobicContact CG2-CD2 3.89Å; T131-L143 HydrophobicContact CG2-CG 4.15Å; R139-L143 WeakPolarHBondContact O-CB 3.47Å; R139-L143 WeakPolarHBondContact O-CG 3.29Å; R139-L143 PolarHBondContact O-N 3.44Å; L143-V146 PolarHBondContact O-N 3.33Å; L143-T147 WeakPolarHBondContact O-CB 3.49Å; L143-T147 VanDerWaalsContact O-CG2 3.28Å; L143-T147 WeakPolarHBondContact O-CG2 3.19Å; L143-T147 PolarHBondContact O-N 3.13Å; L143-T147 PolarHBondContact O-OG1 2.96Å
144G78.9Confident83.2Confident22 Ų2244.5 Ų44.523%0.22723%0.233CC..Hα-helixtrans-60-45.5174.900000112.1G140 L141 A142 T147 T148G140-G144 PolarHBondContact O-N 2.82Å; L141-G144 PolarHBondContact O-N 3.4Å; A142-G144 VanDerWaalsContact C-N 3.35Å; G144-T147 PolarHBondContact O-OG1 2.97Å; G144-T148 WeakPolarHBondContact O-CB 3.41Å; G144-T148 PolarHBondContact O-N 3.3Å; G144-T148 PolarHBondContact O-OG1 3.15Å
145I86.5Confident83.6Confident58 Ų5847 Ų4730%0.29724%0.244SC..Hα-helixtrans-61.4-54.3175-66.5166.4000109.9W16 I19 F23 L141 A142 T147 T148W16-I145 HydrophobicContact CH2-CD1 4.41Å; W16-I145 HydrophobicContact CZ3-CD1 3.76Å; I19-I145 HydrophobicContact CG2-CB 4.06Å; I19-I145 HydrophobicContact CG2-CG2 3.56Å; F23-I145 HydrophobicContact CD2-CG2 4.44Å; F23-I145 VanDerWaalsContact CD2-O 3.28Å; F23-I145 WeakPolarHBondContact CD2-O 3.14Å; L141-I145 HydrophobicContact CD1-CD1 4.46Å; L141-I145 HydrophobicContact CG-CD1 4.18Å; L141-I145 WeakPolarHBondContact O-CG1 3.32Å; L141-I145 PolarHBondContact O-N 3.38Å; A142-I145 PolarHBondContact O-N 3.28Å; I145-T147 VanDerWaalsContact C-N 3.33Å; I145-T147 PolarHBondContact O-N 3.02Å; I145-T148 WeakPolarHBondContact O-CB 3.28Å; I145-T148 PolarHBondContact O-N 2.89Å; I145-T148 VanDerWaalsContact O-N 3.13Å
146V89.4Confident84.3Confident1 Ų151 Ų511%0.00627%0.265CS..Hα-helixtrans-56-45.4-178170.80000112.2I19 C22 Q26 A142 L143 T148 G149I19-V146 HydrophobicContact CG2-CG2 4.09Å; C22-V146 HydrophobicContact CB-CB 4.36Å; C22-V146 HydrophobicContact CB-CG1 3.78Å; C22-V146 HydrophobicContact CB-CG2 3.59Å; Q26-V146 HydrophobicContact CG-CG1 3.93Å; A142-V146 WeakPolarHBondContact O-CG2 3.34Å; A142-V146 PolarHBondContact O-N 3.07Å; L143-V146 PolarHBondContact O-N 3.33Å; V146-T148 PolarHBondContact O-N 3.21Å; V146-G149 PolarHBondContact O-N 3.5Å
147T84.7Confident85.2Confident30 Ų3047.1 Ų47.118%0.18424%0.244CC..Hα-helixtrans-72.7-25.8-178.754.10000113.3L143 G144 I145 G149 T150L143-T147 WeakPolarHBondContact O-CB 3.49Å; L143-T147 VanDerWaalsContact O-CG2 3.28Å; L143-T147 WeakPolarHBondContact O-CG2 3.19Å; L143-T147 PolarHBondContact O-N 3.13Å; L143-T147 PolarHBondContact O-OG1 2.96Å; G144-T147 PolarHBondContact O-OG1 2.97Å; I145-T147 VanDerWaalsContact C-N 3.33Å; I145-T147 PolarHBondContact O-N 3.02Å; T147-G149 PolarHBondContact O-N 2.65Å; T147-T150 PolarHBondContact O-N 3.11Å; T147-T150 VanDerWaalsContact O-N 3.14Å; T147-T150 PolarHBondContact O-OG1 3.14Å
148T88.1Confident86.1Confident25 Ų2538.3 Ų38.315%0.15321%0.206CC..Hα-helixtrans-61.2-24.9172-59.20000111.5G144 I145 V146 T150 S151 V152G144-T148 WeakPolarHBondContact O-CB 3.41Å; G144-T148 PolarHBondContact O-N 3.3Å; G144-T148 PolarHBondContact O-OG1 3.15Å; I145-T148 WeakPolarHBondContact O-CB 3.28Å; I145-T148 PolarHBondContact O-N 2.89Å; I145-T148 VanDerWaalsContact O-N 3.13Å; V146-T148 PolarHBondContact O-N 3.21Å; T148-T150 PolarHBondContact O-N 3.39Å; T148-S151 PolarHBondContact O-N 3.03Å; T148-V152 HydrophobicContact CG2-CG2 4.1Å; T148-V152 PolarHBondContact O-N 2.89Å
149G91.4Very high86.9Confident0 Ų034 Ų340%019%0.194CC..Hα-helixtrans-54-34.6173.400000113.5F23 F27 V146 T147 G153F23-G149 VanDerWaalsContact CE2-N 3.31Å; F27-G149 WeakPolarHBondContact CA-O 3.35Å; V146-G149 PolarHBondContact O-N 3.5Å; T147-G149 PolarHBondContact O-N 2.65Å; G149-G153 WeakPolarHBondContact O-CA 3.38Å; G149-G153 PolarHBondContact O-N 3.39Å
150T91.5Very high87.8Confident11 Ų1131 Ų317%0.06719%0.193CC..Hα-helixtrans-64.6-40.8176.161.50000112.9Q26 Y30 T147 T148 G153 G154 K341Q26-T150 HydrophobicContact CB-CG2 4.1Å; Y30-T150 HydrophobicContact CD2-CG2 4.28Å; Y30-T150 HydrophobicContact CG-CG2 3.99Å; T147-T150 PolarHBondContact O-N 3.11Å; T147-T150 VanDerWaalsContact O-N 3.14Å; T147-T150 PolarHBondContact O-OG1 3.14Å; T148-T150 PolarHBondContact O-N 3.39Å; T150-G153 PolarHBondContact O-N 3.34Å; T150-G154 PolarHBondContact O-N 2.92Å; T150-K341 PolarHBondContact OG1-NZ 3.22Å; T150-K341 VanDerWaalsContact OG1-NZ 3.11Å
151S91.4Very high88.8Confident3 Ų328.2 Ų28.22%0.02116%0.163CC..Hα-helixtrans-74.1-42.5-179-69.80000111.6T148 G153 G154 F155 A334 G338 K341T148-S151 PolarHBondContact O-N 3.03Å; S151-G153 VanDerWaalsContact C-N 3.28Å; S151-G153 PolarHBondContact O-N 3.36Å; S151-G154 PolarHBondContact O-N 3.15Å; S151-F155 PolarHBondContact O-N 3.35Å; S151-A334 WeakPolarHBondContact CB-O 3.28Å; S151-G338 PolarHBondContact OG-N 3.44Å; S151-K341 PolarHBondContact OG-NZ 2.96Å
152V93.1Very high89.3Confident54 Ų5426.4 Ų26.433%0.32715%0.154SC..Hα-helixtrans-64.3-37.8172.7179.80000110.5F23 F27 T148 F155 L156F23-V152 HydrophobicContact CZ-CB 4.2Å; F23-V152 HydrophobicContact CZ-CG1 4.41Å; F23-V152 HydrophobicContact CZ-CG2 4.19Å; F27-V152 HydrophobicContact CD2-CB 4.38Å; F27-V152 HydrophobicContact CD2-CG1 4.18Å; F27-V152 HydrophobicContact CE2-CG1 4.08Å; T148-V152 HydrophobicContact CG2-CG2 4.1Å; T148-V152 PolarHBondContact O-N 2.89Å; V152-F155 PolarHBondContact O-N 3.48Å; V152-L156 HydrophobicContact CG1-CD1 4.23Å; V152-L156 PolarHBondContact O-N 3.47Å
153G93Very high89.6Confident0 Ų032 Ų320%018%0.18CC..Hα-helixtrans-57.1-56.6172.500000112F27 G149 T150 S151 F155 L156 Y157F27-G153 VanDerWaalsContact CD2-N 3.33Å; G149-G153 WeakPolarHBondContact O-CA 3.38Å; G149-G153 PolarHBondContact O-N 3.39Å; T150-G153 PolarHBondContact O-N 3.34Å; S151-G153 VanDerWaalsContact C-N 3.28Å; S151-G153 PolarHBondContact O-N 3.36Å; G153-F155 VanDerWaalsContact C-N 3.26Å; G153-F155 PolarHBondContact O-N 3.02Å; G153-L156 PolarHBondContact O-N 3.11Å; G153-Y157 VanDerWaalsContact O-CB 3.29Å; G153-Y157 WeakPolarHBondContact O-CB 3.23Å; G153-Y157 WeakPolarHBondContact O-CD2 3.17Å; G153-Y157 PolarHBondContact O-N 2.91Å
154G91.2Very high90.1Very high0 Ų031 Ų310%018%0.175CC..Hα-helixtrans-55.4-40.718000000112.9T150 S151 A158T150-G154 PolarHBondContact O-N 2.92Å; S151-G154 PolarHBondContact O-N 3.15Å; G154-A158 WeakPolarHBondContact O-CB 3.41Å; G154-A158 PolarHBondContact O-N 3.07Å
155F91.2Very high90.7Very high56 Ų5631 Ų3125%0.24617%0.17CC..Hα-helixtrans-63.9-54.3176.1173.1-105000113.1S151 V152 G153 A158 T159 A334 I335S151-F155 PolarHBondContact O-N 3.35Å; V152-F155 PolarHBondContact O-N 3.48Å; G153-F155 VanDerWaalsContact C-N 3.26Å; G153-F155 PolarHBondContact O-N 3.02Å; F155-A158 PolarHBondContact O-N 3.05Å; F155-T159 PolarHBondContact O-N 3.19Å; F155-T159 PolarHBondContact O-OG1 3.26Å; F155-A334 HydrophobicContact CB-CB 4.36Å; F155-I335 HydrophobicContact CB-CD1 4.46Å; F155-I335 HydrophobicContact CB-CG1 3.96Å; F155-I335 HydrophobicContact CD1-CD1 4.26Å; F155-I335 HydrophobicContact CD2-CD1 3.18Å; F155-I335 HydrophobicContact CD2-CG1 3.58Å; F155-I335 HydrophobicContact CE1-CD1 4.37Å; F155-I335 HydrophobicContact CE2-CD1 3.35Å; F155-I335 HydrophobicContact CE2-CG1 4.26Å; F155-I335 HydrophobicContact CG-CD1 3.71Å; F155-I335 HydrophobicContact CG-CG1 3.75Å; F155-I335 HydrophobicContact CZ-CD1 3.96Å
156L93.4Very high90.8Very high85 Ų8534 Ų3445%0.44519%0.19SC..Hα-helixtrans-68.5-39.9-176.6-73.2-177.9000111.7F27 V152 G153 T159 A160F27-L156 HydrophobicContact CE2-CB 4.05Å; F27-L156 HydrophobicContact CE2-CD1 3.68Å; F27-L156 HydrophobicContact CE2-CG 4.3Å; F27-L156 HydrophobicContact CZ-CB 4.03Å; F27-L156 HydrophobicContact CZ-CD1 3.78Å; V152-L156 HydrophobicContact CG1-CD1 4.23Å; V152-L156 PolarHBondContact O-N 3.47Å; G153-L156 PolarHBondContact O-N 3.11Å; L156-T159 PolarHBondContact O-N 3.17Å; L156-A160 VanDerWaalsContact O-CB 3.26Å; L156-A160 WeakPolarHBondContact O-CB 3.41Å; L156-A160 PolarHBondContact O-N 3.28Å
157Y93Very high90.9Very high11 Ų1139.7 Ų39.74%0.04322%0.22CC..Hα-helixtrans-69.7-36.9177.1-86.4-92.4000112.6F27 L28 S35 G153 T159 A160 Q161 I177F27-Y157 HydrophobicContact CD1-CE2 4.24Å; F27-Y157 HydrophobicContact CE1-CD2 4.41Å; F27-Y157 AromaticContact CE1-CE2 3.71Å; F27-Y157 HydrophobicContact CE1-CE2 3.71Å; F27-Y157 HydrophobicContact CZ-CD2 4.21Å; F27-Y157 AromaticContact CZ-CE2 3.97Å; F27-Y157 HydrophobicContact CZ-CE2 3.97Å; L28-Y157 WeakPolarHBondContact CD2-OH 3.39Å; S35-Y157 WeakPolarHBondContact OG-CB 3.19Å; G153-Y157 VanDerWaalsContact O-CB 3.29Å; G153-Y157 WeakPolarHBondContact O-CB 3.23Å; G153-Y157 WeakPolarHBondContact O-CD2 3.17Å; G153-Y157 PolarHBondContact O-N 2.91Å; Y157-T159 VanDerWaalsContact C-N 3.31Å; Y157-T159 PolarHBondContact O-N 3.23Å; Y157-A160 PolarHBondContact O-N 3.1Å; Y157-Q161 WeakPolarHBondContact O-CB 3.37Å; Y157-Q161 WeakPolarHBondContact O-CG 3.29Å; Y157-Q161 PolarHBondContact O-N 2.73Å; Y157-I177 HydrophobicContact CD1-CD1 4.2Å; Y157-I177 HydrophobicContact CD1-CG1 4.21Å; Y157-I177 HydrophobicContact CD1-CG2 4.21Å; Y157-I177 HydrophobicContact CE1-CB 4.34Å; Y157-I177 HydrophobicContact CE1-CD1 4.49Å; Y157-I177 HydrophobicContact CE1-CG1 4.02Å; Y157-I177 HydrophobicContact CE1-CG2 3.72Å
158A91.1Very high91.3Very high0 Ų044.3 Ų44.30%024%0.238CC..Hα-helixtrans-61.5-41.2175.800000111.9V38 G154 F155 N162 S331V38-A158 HydrophobicContact CG2-CB 3.99Å; G154-A158 WeakPolarHBondContact O-CB 3.41Å; G154-A158 PolarHBondContact O-N 3.07Å; F155-A158 PolarHBondContact O-N 3.05Å; A158-N162 PolarHBondContact O-N 3.19Å; A158-N162 PolarHBondContact O-ND2 3.01Å; A158-S331 WeakPolarHBondContact CB-OG 3.39Å
159T89.9Confident91.5Very high47 Ų4744.6 Ų44.629%0.28825%0.246SC..Hα-helixtrans-69.2-47.7175.7-50.20000110.8F155 L156 Y157 Q161 N162 E163F155-T159 PolarHBondContact O-N 3.19Å; F155-T159 PolarHBondContact O-OG1 3.26Å; L156-T159 PolarHBondContact O-N 3.17Å; Y157-T159 VanDerWaalsContact C-N 3.31Å; Y157-T159 PolarHBondContact O-N 3.23Å; T159-Q161 VanDerWaalsContact C-N 3.33Å; T159-Q161 PolarHBondContact O-N 3.07Å; T159-N162 PolarHBondContact O-N 3.42Å; T159-E163 PolarHBondContact O-N 3.37Å
160A91.9Very high91.6Very high43 Ų4345.8 Ų45.836%0.35525%0.252SS..Hα-helixtrans-63.1-37.5179.900000112.7L156 Y157 E163 L164L156-A160 VanDerWaalsContact O-CB 3.26Å; L156-A160 WeakPolarHBondContact O-CB 3.41Å; L156-A160 PolarHBondContact O-N 3.28Å; Y157-A160 PolarHBondContact O-N 3.1Å; A160-E163 PolarHBondContact O-N 3.32Å; A160-L164 VanDerWaalsContact O-CB 3.25Å; A160-L164 WeakPolarHBondContact O-CB 3.12Å; A160-L164 WeakPolarHBondContact O-CG 3.4Å; A160-L164 PolarHBondContact O-N 2.79Å
161Q92.1Very high91.7Very high0 Ų051.2 Ų51.20%028%0.276CS..Hα-helixtrans-64.2-45.3178.8-83172.6-22.300111.9S32 S35 V38 L39 Y157 T159 E163 L164 I165 I177S32-Q161 PolarHBondContact OG-NE2 3.28Å; S35-Q161 VanDerWaalsContact CB-OE1 3.25Å; S35-Q161 PolarHBondContact O-OE1 2.86Å; S35-Q161 VanDerWaalsContact OG-CD 3.27Å; S35-Q161 PolarHBondContact OG-NE2 3.02Å; S35-Q161 PolarHBondContact OG-OE1 3.17Å; V38-Q161 HydrophobicContact CG1-CB 3.9Å; L39-Q161 HydrophobicContact CD2-CG 4.31Å; Y157-Q161 WeakPolarHBondContact O-CB 3.37Å; Y157-Q161 WeakPolarHBondContact O-CG 3.29Å; Y157-Q161 PolarHBondContact O-N 2.73Å; T159-Q161 VanDerWaalsContact C-N 3.33Å; T159-Q161 PolarHBondContact O-N 3.07Å; Q161-E163 PolarHBondContact O-N 3.32Å; Q161-L164 PolarHBondContact O-N 2.92Å; Q161-I165 WeakPolarHBondContact O-CB 3.29Å; Q161-I165 VanDerWaalsContact O-CD1 3.3Å; Q161-I165 WeakPolarHBondContact O-CD1 3.32Å; Q161-I165 WeakPolarHBondContact O-CG1 3.31Å; Q161-I165 PolarHBondContact O-N 3.26Å; Q161-I177 HydrophobicContact CG-CD1 3.23Å
162N88.8Confident91.8Very high61 Ų6151.9 Ų51.933%0.32628%0.284SS..Hα-helixtrans-58.1-50.1176.8-83-68.7000111.4V38 A158 T159 L164 I165 V166 P328V38-N162 HydrophobicContact CG1-CB 4.4Å; V38-N162 VanDerWaalsContact CG1-CG 3.44Å; V38-N162 WeakPolarHBondContact CG1-ND2 3.43Å; V38-N162 WeakPolarHBondContact CG1-OD1 3.47Å; V38-N162 WeakPolarHBondContact CG2-ND2 3.41Å; A158-N162 PolarHBondContact O-N 3.19Å; A158-N162 PolarHBondContact O-ND2 3.01Å; T159-N162 PolarHBondContact O-N 3.42Å; N162-L164 PolarHBondContact O-N 3.04Å; N162-I165 PolarHBondContact O-N 3.16Å; N162-V166 WeakPolarHBondContact O-CG2 3.39Å; N162-V166 PolarHBondContact O-N 3.31Å; N162-V166 VanDerWaalsContact O-N 3.11Å; N162-P328 WeakPolarHBondContact ND2-CG 3.42Å
163E89.4Confident91.9Very high118 Ų11849.3 Ų49.355%0.55127%0.268SS*.Hα-helixtrans-63.2-42179.2-67.6-65.8155.500112.4T159 A160 Q161 I165 V166 L167T159-E163 PolarHBondContact O-N 3.37Å; A160-E163 PolarHBondContact O-N 3.32Å; Q161-E163 PolarHBondContact O-N 3.32Å; E163-I165 VanDerWaalsContact C-N 3.35Å; E163-I165 PolarHBondContact O-N 2.97Å; E163-V166 PolarHBondContact O-N 3.45Å; E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 2.77Å
164L91.9Very high92Very high27 Ų2749.3 Ų49.314%0.14127%0.268CS..Hα-helixtrans-67.7-34.5178.5-73174000112.6A160 Q161 N162 F168 C173 I176 I177A160-L164 VanDerWaalsContact O-CB 3.25Å; A160-L164 WeakPolarHBondContact O-CB 3.12Å; A160-L164 WeakPolarHBondContact O-CG 3.4Å; A160-L164 PolarHBondContact O-N 2.79Å; Q161-L164 PolarHBondContact O-N 2.92Å; N162-L164 PolarHBondContact O-N 3.04Å; L164-F168 HydrophobicContact CD2-CD2 3.8Å; L164-F168 HydrophobicContact CD2-CE2 4Å; L164-F168 WeakPolarHBondContact O-CA 3.37Å; L164-F168 WeakPolarHBondContact O-CB 3.35Å; L164-F168 PolarHBondContact O-N 3.21Å; L164-C173 HydrophobicContact CB-CB 3.87Å; L164-I176 HydrophobicContact CD1-CB 4.39Å; L164-I176 HydrophobicContact CD1-CG2 3.98Å; L164-I176 HydrophobicContact CD2-CD1 3.82Å; L164-I176 HydrophobicContact CD2-CG2 4.35Å; L164-I177 HydrophobicContact CD1-CD1 4.45Å; L164-I177 HydrophobicContact CD1-CG1 4.24Å
165I91.1Very high92.3Very high21 Ų2151.9 Ų51.911%0.10828%0.282CS..Hα-helixtrans-65-44.4175-71.6162.6000109.9V38 L39 E42 Q161 N162 E163 L167 G169 C173V38-I165 HydrophobicContact CG1-CD1 4.14Å; L39-I165 HydrophobicContact CD2-CD1 3.83Å; E42-I165 HydrophobicContact CG-CD1 4.25Å; E42-I165 HydrophobicContact CG-CG2 4.08Å; Q161-I165 WeakPolarHBondContact O-CB 3.29Å; Q161-I165 VanDerWaalsContact O-CD1 3.3Å; Q161-I165 WeakPolarHBondContact O-CD1 3.32Å; Q161-I165 WeakPolarHBondContact O-CG1 3.31Å; Q161-I165 PolarHBondContact O-N 3.26Å; N162-I165 PolarHBondContact O-N 3.16Å; E163-I165 VanDerWaalsContact C-N 3.35Å; E163-I165 PolarHBondContact O-N 2.97Å; I165-L167 PolarHBondContact O-N 3.33Å; I165-G169 WeakPolarHBondContact O-CA 3.44Å; I165-G169 PolarHBondContact O-N 3.28Å; I165-C173 HydrophobicContact CG1-CB 3.94Å
166V89.4Confident92.6Very high121 Ų12152 Ų5273%0.73328%0.284SS*.Hα-helixtrans-64-40.1178.4173.80000111.8N162 E163N162-V166 WeakPolarHBondContact O-CG2 3.39Å; N162-V166 PolarHBondContact O-N 3.31Å; N162-V166 VanDerWaalsContact O-N 3.11Å; E163-V166 PolarHBondContact O-N 3.45Å
167L92Very high92.7Very high121 Ų12148 Ų4863%0.63426%0.264SS*.Hα-helixtrans-83.9-38.9-175.7-68.7173.4000114.5E163 I165E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 2.77Å; I165-L167 PolarHBondContact O-N 3.33Å
168F92.6Very high92.8Very high127 Ų12747.5 Ų47.556%0.55726%0.262SS*.Hα-helixtrans-125.40.1-169-59.9-76.2000113.8L164 I176L164-F168 HydrophobicContact CD2-CD2 3.8Å; L164-F168 HydrophobicContact CD2-CE2 4Å; L164-F168 WeakPolarHBondContact O-CA 3.37Å; L164-F168 WeakPolarHBondContact O-CB 3.35Å; L164-F168 PolarHBondContact O-N 3.21Å; F168-I176 HydrophobicContact CD2-CD1 3.86Å; F168-I176 HydrophobicContact CE2-CD1 4.17Å; F168-I176 HydrophobicContact CG-CD1 4.18Å
169G92.6Very high93Very high31 Ų3149.8 Ų49.832%0.3228%0.281SS..Hα-helixtrans73.1176.7-172.700000113.4I165 E171 C173I165-G169 WeakPolarHBondContact O-CA 3.44Å; I165-G169 PolarHBondContact O-N 3.28Å; G169-E171 PolarHBondContact O-N 2.65Å; G169-C173 VanDerWaalsContact O-CB 3.31Å; G169-C173 WeakPolarHBondContact O-CB 3.46Å; G169-C173 PolarHBondContact O-N 2.99Å
170L92.4Very high93.3Very high25 Ų2551.3 Ų51.313%0.13129%0.286CS..Hα-helixtrans-60.3-44.6-179.4178.867.9000112.5L39 E42 W43 C173 L174L39-L170 HydrophobicContact CD2-CD1 4.01Å; E42-L170 HydrophobicContact CB-CD1 4.22Å; W43-L170 VanDerWaalsContact CD1-CD2 3.46Å; L170-C173 WeakPolarHBondContact O-CB 3.32Å; L170-C173 PolarHBondContact O-N 3.28Å; L170-L174 HydrophobicContact CD1-CD1 4.41Å; L170-L174 HydrophobicContact CG-CD1 4.33Å; L170-L174 WeakPolarHBondContact O-CG 3.34Å; L170-L174 PolarHBondContact O-N 3.01Å
171E94.1Very high93.4Very high124 Ų12449.2 Ų49.258%0.57927%0.269SS*.Hα-helixtrans-65-46.8-178.4-56.6-175.5172.400111.5A100 G169 C173 L174 L175A100-E171 HydrophobicContact CB-CB 4.36Å; A100-E171 WeakPolarHBondContact CB-O 3.47Å; A100-E171 WeakPolarHBondContact O-CG 3.35Å; G169-E171 PolarHBondContact O-N 2.65Å; E171-C173 VanDerWaalsContact C-N 3.34Å; E171-C173 PolarHBondContact O-N 3.04Å; E171-L174 PolarHBondContact O-N 3.26Å; E171-L175 WeakPolarHBondContact O-CG 3.41Å; E171-L175 PolarHBondContact O-N 3.2Å
172G93.9Very high93.5Very high17 Ų1752.5 Ų52.518%0.17529%0.286CS..Hα-helixtrans-61.9-41176.700000112.2L175 I176G172-L175 PolarHBondContact O-N 2.94Å; G172-I176 WeakPolarHBondContact O-CB 3.46Å; G172-I176 WeakPolarHBondContact O-CD1 3.41Å; G172-I176 VanDerWaalsContact O-CG1 3.24Å; G172-I176 WeakPolarHBondContact O-CG1 3.35Å; G172-I176 PolarHBondContact O-N 3.04Å
173C95.4Very high93.9Very high0 Ų053.5 Ų53.50%029%0.292CS..Hα-helixtrans-58.2-50.1174.7-178.70000112L164 I165 G169 L170 E171 L175 I176 I177L164-C173 HydrophobicContact CB-CB 3.87Å; I165-C173 HydrophobicContact CG1-CB 3.94Å; G169-C173 VanDerWaalsContact O-CB 3.31Å; G169-C173 WeakPolarHBondContact O-CB 3.46Å; G169-C173 PolarHBondContact O-N 2.99Å; L170-C173 WeakPolarHBondContact O-CB 3.32Å; L170-C173 PolarHBondContact O-N 3.28Å; E171-C173 VanDerWaalsContact C-N 3.34Å; E171-C173 PolarHBondContact O-N 3.04Å; C173-L175 PolarHBondContact O-N 2.66Å; C173-I176 PolarHBondContact O-N 3.49Å; C173-I177 WeakPolarHBondContact O-CB 3.32Å; C173-I177 VanDerWaalsContact O-CG1 3.3Å; C173-I177 WeakPolarHBondContact O-CG1 3.43Å; C173-I177 PolarHBondContact O-N 3.38Å; C173-I177 VanDerWaalsContact SG-CD1 3.53Å
174L95.2Very high94Very high1 Ų147.9 Ų47.91%0.00527%0.265CS..Hα-helixtrans-63.7-38.9179.2-72173.1000112.7L39 A100 Y112 L170 E171 G178L39-L174 HydrophobicContact CD1-CD2 4.1Å; A100-L174 HydrophobicContact CB-CB 3.95Å; Y112-L174 HydrophobicContact CE2-CD2 4.36Å; L170-L174 HydrophobicContact CD1-CD1 4.41Å; L170-L174 HydrophobicContact CG-CD1 4.33Å; L170-L174 WeakPolarHBondContact O-CG 3.34Å; L170-L174 PolarHBondContact O-N 3.01Å; E171-L174 PolarHBondContact O-N 3.26Å; L174-G178 PolarHBondContact O-N 3.07Å
175L96.8Very high94.1Very high53 Ų5349.9 Ų49.928%0.27728%0.275SS..Hα-helixtrans-64.8-46175.8-74171.8000112.4M97 A100 F101 E171 G172 C173 G178 A179M97-L175 HydrophobicContact CB-CD2 4.09Å; M97-L175 HydrophobicContact CE-CD2 4.27Å; M97-L175 HydrophobicContact CG-CD2 4.23Å; A100-L175 HydrophobicContact CB-CD1 4.35Å; A100-L175 HydrophobicContact CB-CD2 3.93Å; A100-L175 HydrophobicContact CB-CG 3.64Å; F101-L175 HydrophobicContact CE2-CD2 3.84Å; F101-L175 HydrophobicContact CZ-CD1 4.23Å; F101-L175 HydrophobicContact CZ-CD2 4.18Å; E171-L175 WeakPolarHBondContact O-CG 3.41Å; E171-L175 PolarHBondContact O-N 3.2Å; G172-L175 PolarHBondContact O-N 2.94Å; C173-L175 PolarHBondContact O-N 2.66Å; L175-G178 PolarHBondContact O-N 3.26Å; L175-A179 WeakPolarHBondContact O-CB 3.44Å; L175-A179 PolarHBondContact O-N 3.13Å
176I96.7Very high94.2Very high59 Ų5951.6 Ų51.630%0.30329%0.292SS..Hα-helixtrans-64.7-43.8179.6-68.7167.2000110.2L164 F168 G172 C173 A179 L180L164-I176 HydrophobicContact CD1-CB 4.39Å; L164-I176 HydrophobicContact CD1-CG2 3.98Å; L164-I176 HydrophobicContact CD2-CD1 3.82Å; L164-I176 HydrophobicContact CD2-CG2 4.35Å; F168-I176 HydrophobicContact CD2-CD1 3.86Å; F168-I176 HydrophobicContact CE2-CD1 4.17Å; F168-I176 HydrophobicContact CG-CD1 4.18Å; G172-I176 WeakPolarHBondContact O-CB 3.46Å; G172-I176 WeakPolarHBondContact O-CD1 3.41Å; G172-I176 VanDerWaalsContact O-CG1 3.24Å; G172-I176 WeakPolarHBondContact O-CG1 3.35Å; G172-I176 PolarHBondContact O-N 3.04Å; C173-I176 PolarHBondContact O-N 3.49Å; I176-A179 WeakPolarHBondContact O-CB 3.27Å; I176-A179 PolarHBondContact O-N 2.94Å; I176-L180 HydrophobicContact CG2-CD1 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 3.36Å
177I95.4Very high94.2Very high2 Ų246.4 Ų46.41%0.0126%0.261CS..Hα-helixtrans-66.2-39.9178.1-72.8171.4000111.6L96 Y157 Q161 L164 C173 A179 L180 A181L96-I177 HydrophobicContact CD1-CG2 3.98Å; L96-I177 HydrophobicContact CD2-CG2 4.39Å; Y157-I177 HydrophobicContact CD1-CD1 4.2Å; Y157-I177 HydrophobicContact CD1-CG1 4.21Å; Y157-I177 HydrophobicContact CD1-CG2 4.21Å; Y157-I177 HydrophobicContact CE1-CB 4.34Å; Y157-I177 HydrophobicContact CE1-CD1 4.49Å; Y157-I177 HydrophobicContact CE1-CG1 4.02Å; Y157-I177 HydrophobicContact CE1-CG2 3.72Å; Q161-I177 HydrophobicContact CG-CD1 3.23Å; L164-I177 HydrophobicContact CD1-CD1 4.45Å; L164-I177 HydrophobicContact CD1-CG1 4.24Å; C173-I177 WeakPolarHBondContact O-CB 3.32Å; C173-I177 VanDerWaalsContact O-CG1 3.3Å; C173-I177 WeakPolarHBondContact O-CG1 3.43Å; C173-I177 PolarHBondContact O-N 3.38Å; C173-I177 VanDerWaalsContact SG-CD1 3.53Å; I177-A179 VanDerWaalsContact C-N 3.35Å; I177-L180 PolarHBondContact O-N 2.97Å; I177-A181 PolarHBondContact O-N 3.34Å
178G95.5Very high94.1Very high0 Ų040.7 Ų40.70%023%0.231CC..Hα-helixtrans-61.5-41.2171.500000112.6A93 L174 L175 A181 L182A93-G178 VanDerWaalsContact CB-O 3.24Å; A93-G178 WeakPolarHBondContact CB-O 3.46Å; L174-G178 PolarHBondContact O-N 3.07Å; L175-G178 PolarHBondContact O-N 3.26Å; G178-A181 WeakPolarHBondContact O-CB 3.49Å; G178-A181 PolarHBondContact O-N 2.92Å; G178-L182 PolarHBondContact O-N 2.85Å
179A96.1Very high93.9Very high48 Ų4836.3 Ų36.340%0.39722%0.222SC..Hα-helixtrans-64.4-40.6174.500000112.1L175 I176 I177 A181 L182L175-A179 WeakPolarHBondContact O-CB 3.44Å; L175-A179 PolarHBondContact O-N 3.13Å; I176-A179 WeakPolarHBondContact O-CB 3.27Å; I176-A179 PolarHBondContact O-N 2.94Å; I177-A179 VanDerWaalsContact C-N 3.35Å; A179-A181 VanDerWaalsContact C-N 3.29Å; A179-A181 PolarHBondContact O-N 3.46Å; A179-L182 WeakPolarHBondContact O-CB 3.22Å; A179-L182 PolarHBondContact O-N 3.08Å
180L95.5Very high93.6Very high78 Ų7839.8 Ų39.841%0.40823%0.229SC..Hα-helixtrans-61.5-38.8172.6-71.5173.5000111.6I176 I177 L182 N183I176-L180 HydrophobicContact CG2-CD1 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.41Å; I176-L180 PolarHBondContact O-N 3.36Å; I177-L180 PolarHBondContact O-N 2.97Å; L180-L182 PolarHBondContact O-N 3.26Å; L180-N183 VanDerWaalsContact O-CB 3.3Å; L180-N183 WeakPolarHBondContact O-CB 3.24Å; L180-N183 PolarHBondContact O-N 3.44Å; L180-N183 VanDerWaalsContact O-N 3.13Å; L180-N183 PolarHBondContact O-ND2 3.43Å
181A94.9Very high93.2Very high0 Ų038.6 Ų38.60%022%0.222CC..Hα-helixtrans-63.7-24176.800000113V92 A93 L96 I177 G178 A179 N183 L184V92-A181 HydrophobicContact CG1-CB 3.91Å; A93-A181 HydrophobicContact CB-CB 4.1Å; L96-A181 HydrophobicContact CD1-CB 4.03Å; I177-A181 PolarHBondContact O-N 3.34Å; G178-A181 WeakPolarHBondContact O-CB 3.49Å; G178-A181 PolarHBondContact O-N 2.92Å; A179-A181 VanDerWaalsContact C-N 3.29Å; A179-A181 PolarHBondContact O-N 3.46Å; A181-N183 PolarHBondContact O-N 3.44Å; A181-N183 VanDerWaalsContact O-N 3.08Å; A181-L184 HydrophobicContact CB-CD1 4.24Å; A181-L184 WeakPolarHBondContact O-CB 3.17Å; A181-L184 VanDerWaalsContact O-CD1 3.27Å; A181-L184 WeakPolarHBondContact O-CD1 3.4Å; A181-L184 WeakPolarHBondContact O-CG 3.24Å; A181-L184 PolarHBondContact O-N 2.87Å
182L94.6Very high92.5Very high68 Ų6841.1 Ų41.136%0.35623%0.227SC..THydrogen-bonded Turntrans-59.1-23.5173.7-66.5170.7000112.8A93 G178 A179 L180 L184 M185A93-L182 HydrophobicContact CB-CD2 3.36Å; A93-L182 HydrophobicContact CB-CG 3.7Å; G178-L182 PolarHBondContact O-N 2.85Å; A179-L182 WeakPolarHBondContact O-CB 3.22Å; A179-L182 PolarHBondContact O-N 3.08Å; L180-L182 PolarHBondContact O-N 3.26Å; L182-L184 PolarHBondContact O-N 3.37Å; L182-L184 VanDerWaalsContact O-N 3.09Å; L182-M185 HydrophobicContact CB-CE 3.71Å; L182-M185 HydrophobicContact CD2-CE 3.5Å; L182-M185 HydrophobicContact CG-CE 4.18Å; L182-M185 WeakPolarHBondContact O-CB 3.42Å; L182-M185 VanDerWaalsContact O-CE 3.28Å; L182-M185 WeakPolarHBondContact O-CE 3.4Å; L182-M185 PolarHBondContact O-N 2.8Å
183N95.6Very high91.4Very high82 Ų8242.3 Ų42.344%0.43923%0.231SC..Hα-helixtrans-63.5-11.8173.7-66.7-63.8000113.7L28 L180 A181 M185 A186 C187L28-N183 HydrophobicContact CD1-CB 3.66Å; L180-N183 VanDerWaalsContact O-CB 3.3Å; L180-N183 WeakPolarHBondContact O-CB 3.24Å; L180-N183 PolarHBondContact O-N 3.44Å; L180-N183 VanDerWaalsContact O-N 3.13Å; L180-N183 PolarHBondContact O-ND2 3.43Å; A181-N183 PolarHBondContact O-N 3.44Å; A181-N183 VanDerWaalsContact O-N 3.08Å; N183-M185 PolarHBondContact O-N 3.14Å; N183-A186 WeakPolarHBondContact O-CB 3.35Å; N183-A186 PolarHBondContact O-N 2.75Å; N183-A186 VanDerWaalsContact O-N 3.13Å; N183-C187 PolarHBondContact O-N 3.14Å; N183-C187 VanDerWaalsContact O-N 3.07Å; N183-C187 PolarHBondContact O-SG 3.3Å
184L92.5Very high89.8Confident0 Ų044.2 Ų44.20%024%0.241CC..Hα-helixtrans-54.4-36.4166.6-84.7150.3000112.1A25 L28 A29 V92 V123 A181 L182 A186 C187 A188A25-L184 HydrophobicContact CB-CD2 3.89Å; A25-L184 WeakPolarHBondContact O-CD2 3.38Å; L28-L184 HydrophobicContact CB-CD1 4.27Å; L28-L184 HydrophobicContact CB-CG 4.05Å; L28-L184 HydrophobicContact CD1-CG 4.49Å; A29-L184 HydrophobicContact CB-CD1 4.05Å; A29-L184 HydrophobicContact CB-CD2 4.13Å; V92-L184 HydrophobicContact CB-CD1 4.23Å; V92-L184 HydrophobicContact CG1-CD1 4.17Å; V123-L184 HydrophobicContact CG1-CD2 4.22Å; V123-L184 HydrophobicContact CG2-CD2 3.89Å; A181-L184 HydrophobicContact CB-CD1 4.24Å; A181-L184 WeakPolarHBondContact O-CB 3.17Å; A181-L184 VanDerWaalsContact O-CD1 3.27Å; A181-L184 WeakPolarHBondContact O-CD1 3.4Å; A181-L184 WeakPolarHBondContact O-CG 3.24Å; A181-L184 PolarHBondContact O-N 2.87Å; L182-L184 PolarHBondContact O-N 3.37Å; L182-L184 VanDerWaalsContact O-N 3.09Å; L184-A186 VanDerWaalsContact C-N 3.35Å; L184-A186 PolarHBondContact O-N 3.31Å; L184-C187 WeakPolarHBondContact O-CB 3.41Å; L184-C187 PolarHBondContact O-N 2.86Å; L184-A188 PolarHBondContact O-N 3.5Å
185M93.4Very high88.2Confident69 Ų6948.5 Ų48.534%0.3426%0.264SS..Hα-helixtrans-66.3-37.8178-64-178.4-77.100111.9I86 V90 L182 N183 A188 G189I86-M185 HydrophobicContact CG2-CG 4.28Å; V90-M185 HydrophobicContact CG2-SD 4.01Å; L182-M185 HydrophobicContact CB-CE 3.71Å; L182-M185 HydrophobicContact CD2-CE 3.5Å; L182-M185 HydrophobicContact CG-CE 4.18Å; L182-M185 WeakPolarHBondContact O-CB 3.42Å; L182-M185 VanDerWaalsContact O-CE 3.28Å; L182-M185 WeakPolarHBondContact O-CE 3.4Å; L182-M185 PolarHBondContact O-N 2.8Å; N183-M185 PolarHBondContact O-N 3.14Å; M185-A188 WeakPolarHBondContact O-CB 3.41Å; M185-A188 PolarHBondContact O-N 3.07Å; M185-G189 PolarHBondContact O-N 3.36Å
186A92.9Very high86.3Confident57 Ų5750.6 Ų50.647%0.47127%0.274SS..Hα-helixtrans-66-42.7174.700000111N183 L184 A188 G189 F190N183-A186 WeakPolarHBondContact O-CB 3.35Å; N183-A186 PolarHBondContact O-N 2.75Å; N183-A186 VanDerWaalsContact O-N 3.13Å; L184-A186 VanDerWaalsContact C-N 3.35Å; L184-A186 PolarHBondContact O-N 3.31Å; A186-A188 VanDerWaalsContact C-N 3.29Å; A186-A188 PolarHBondContact O-N 2.92Å; A186-G189 PolarHBondContact O-N 3.48Å; A186-F190 WeakPolarHBondContact O-CD2 3.45Å
187C90.8Very high84.5Confident13 Ų1348.6 Ų48.69%0.08827%0.265CS..Hα-helixtrans-59.8-39.1175.6-620000112A25 N183 L184 G189 F190A25-C187 HydrophobicContact CB-CB 4.2Å; N183-C187 PolarHBondContact O-N 3.14Å; N183-C187 VanDerWaalsContact O-N 3.07Å; N183-C187 PolarHBondContact O-SG 3.3Å; L184-C187 WeakPolarHBondContact O-CB 3.41Å; L184-C187 PolarHBondContact O-N 2.86Å; C187-G189 PolarHBondContact O-N 3.24Å; C187-F190 PolarHBondContact O-N 3.21Å
188A89.4Confident82.6Confident0 Ų050.4 Ų50.40%028%0.284CS..Hα-helixtrans-61.7-27.417600000113R82 T85 I86 L184 M185 A186 F190 M191R82-A188 WeakPolarHBondContact CD-O 3.27Å; R82-A188 WeakPolarHBondContact CG-O 3.44Å; T85-A188 HydrophobicContact CG2-CB 3.77Å; I86-A188 HydrophobicContact CD1-CB 4.44Å; I86-A188 HydrophobicContact CG1-CB 3.59Å; L184-A188 PolarHBondContact O-N 3.5Å; M185-A188 WeakPolarHBondContact O-CB 3.41Å; M185-A188 PolarHBondContact O-N 3.07Å; A186-A188 VanDerWaalsContact C-N 3.29Å; A186-A188 PolarHBondContact O-N 2.92Å; A188-F190 PolarHBondContact O-N 3.31Å; A188-M191 PolarHBondContact O-N 3.03Å
189G87.9Confident80.8Confident35 Ų3557 Ų5736%0.36131%0.309SS..Hα-helixtrans-57.4-35176.100000113.5M185 A186 C187M185-G189 PolarHBondContact O-N 3.36Å; A186-G189 PolarHBondContact O-N 3.48Å; C187-G189 PolarHBondContact O-N 3.24Å
190F87.6Confident78.8Confident105 Ų10561 Ų6146%0.46132%0.315SS..Hα-helixtrans-81-18-178.8-64.9-81.7000113.7W14 V17 A21 A186 C187 A188 R192W14-F190 HydrophobicContact CZ2-CD1 4.47Å; V17-F190 HydrophobicContact CG1-CD1 4.1Å; A21-F190 HydrophobicContact CB-CB 3.76Å; A21-F190 HydrophobicContact CB-CG 4.41Å; A186-F190 WeakPolarHBondContact O-CD2 3.45Å; C187-F190 PolarHBondContact O-N 3.21Å; A188-F190 PolarHBondContact O-N 3.31Å; F190-R192 VanDerWaalsContact C-N 3.28Å; F190-R192 PolarHBondContact O-N 3.5Å
191M83.8Confident77.1Confident0 Ų061.8 Ų61.80%032%0.319CS..  trans-78.170.7-178.5-61.2-173.7-169.200111.7C22 A25 T85 T127 I130 A188 P193C22-M191 HydrophobicContact CB-CE 4.47Å; A25-M191 HydrophobicContact CB-CE 3.94Å; T85-M191 HydrophobicContact CG2-CE 4.14Å; T85-M191 HydrophobicContact CG2-SD 4.25Å; T127-M191 HydrophobicContact CG2-CE 3.92Å; I130-M191 HydrophobicContact CG1-CB 4.49Å; I130-M191 HydrophobicContact CG2-SD 4.34Å; A188-M191 PolarHBondContact O-N 3.03Å; M191-P193 WeakPolarHBondContact O-CD 3.44Å
192R79.1Confident75.4Confident177 Ų17769.6 Ų69.667%0.66835%0.353SS*.  trans-73.1123.6179.9-166.1175.8-173.2176.43.6110.5Y134 F190 L194Y134-R192 VanDerWaalsContact CE2-O 3.31Å; Y134-R192 WeakPolarHBondContact CE2-O 3.38Å; Y134-R192 PolarHBondContact OH-O 3.13Å; F190-R192 VanDerWaalsContact C-N 3.28Å; F190-R192 PolarHBondContact O-N 3.5Å; R192-L194 PolarHBondContact O-N 3.29Å
193P70.1Confident73.8Confident42 Ų4270.3 Ų70.327%0.27336%0.355SS..  trans-68.3128.8178.626.6-32.5000110.7M191M191-P193 WeakPolarHBondContact O-CD 3.44Å
194L62.7Low72Confident39 Ų3972 Ų7220%0.20436%0.358CS..SBendtrans-77.3-38.6174.8-72.1170.6000111.5L10 Q133 Y134 R192L10-L194 HydrophobicContact CD1-CD2 4.15Å; Q133-L194 WeakPolarHBondContact O-CD1 3.31Å; Y134-L194 HydrophobicContact CD1-CD1 3.77Å; Y134-L194 HydrophobicContact CD1-CG 4.39Å; Y134-L194 HydrophobicContact CD2-CD1 3.58Å; Y134-L194 HydrophobicContact CD2-CG 4.06Å; Y134-L194 HydrophobicContact CE1-CD1 3.86Å; Y134-L194 HydrophobicContact CE1-CD2 3.92Å; Y134-L194 HydrophobicContact CE1-CG 3.97Å; Y134-L194 HydrophobicContact CE2-CD1 3.67Å; Y134-L194 HydrophobicContact CE2-CD2 4.38Å; Y134-L194 HydrophobicContact CE2-CG 3.6Å; Y134-L194 HydrophobicContact CG-CD1 3.64Å; Y134-L194 HydrophobicContact CG-CG 4.44Å; R192-L194 PolarHBondContact O-N 3.29Å
195N61Low70.5Confident92 Ų9274 Ų7449%0.49238%0.375SS..SBendtrans-107.1124.1170.5-68-29.9000108.3
196M56.1Low68.9Low97 Ų9772.9 Ų72.948%0.47838%0.377SS..  trans-61.3130.7179-69.1-74.9-89.700109.5Y200 L201M196-Y200 HydrophobicContact CE-CD1 3.46Å; M196-Y200 VanDerWaalsContact CE-CD1 3.46Å; M196-Y200 HydrophobicContact CE-CE1 4.01Å; M196-Y200 HydrophobicContact CE-CG 4.1Å; M196-L201 HydrophobicContact CB-CD2 4.15Å; M196-L201 HydrophobicContact CB-CG 4.12Å
197P58.9Low67.5Low17 Ų1774.6 Ų74.611%0.1138%0.378CS..  trans-55145.8178.8-2432.3000111.4Y199 Y200 L201P197-Y199 PolarHBondContact O-N 3.02Å; P197-Y199 VanDerWaalsContact O-N 3.08Å; P197-Y200 WeakPolarHBondContact O-CB 3.48Å; P197-Y200 PolarHBondContact O-N 3.08Å; P197-L201 PolarHBondContact O-N 3.19Å
198G56.4Low66Low40 Ų4078.6 Ų78.641%0.41240%0.395SS..Hα-helixtrans-56.6-29.9-176.300000114K202G198-K202 WeakPolarHBondContact O-CG 3.47Å; G198-K202 PolarHBondContact O-N 3.4Å; G198-K202 VanDerWaalsContact O-N 3.08Å
199Y57.7Low64.3Low138 Ų13886.8 Ų86.854%0.54143%0.426SS..Hα-helixtrans-63.6-43.8171.9176.2-97.4000112.6P197 L201 K202 Q203P197-Y199 PolarHBondContact O-N 3.02Å; P197-Y199 VanDerWaalsContact O-N 3.08Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 2.99Å; Y199-K202 PolarHBondContact O-N 3.09Å; Y199-Q203 WeakPolarHBondContact O-CB 3.43Å; Y199-Q203 PolarHBondContact O-N 2.94Å
200Y54.7Low62.8Low131 Ų13189.7 Ų89.751%0.51444%0.437SS..Hα-helixtrans-65.9-36.7179.6-124.2-84.9000112M196 P197 K204M196-Y200 HydrophobicContact CE-CD1 3.46Å; M196-Y200 VanDerWaalsContact CE-CD1 3.46Å; M196-Y200 HydrophobicContact CE-CE1 4.01Å; M196-Y200 HydrophobicContact CE-CG 4.1Å; P197-Y200 WeakPolarHBondContact O-CB 3.48Å; P197-Y200 PolarHBondContact O-N 3.08Å; Y200-K204 WeakPolarHBondContact O-CB 3.27Å; Y200-K204 PolarHBondContact O-N 3.27Å
201L58.2Low60.9Low95 Ų9592 Ų9250%0.49745%0.446SS..Hα-helixtrans-67.9-40.6173.9-69172.2000111.7M196 P197 Y199 A205M196-L201 HydrophobicContact CB-CD2 4.15Å; M196-L201 HydrophobicContact CB-CG 4.12Å; P197-L201 PolarHBondContact O-N 3.19Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 2.99Å; L201-A205 VanDerWaalsContact O-CB 3.22Å; L201-A205 WeakPolarHBondContact O-CB 3.42Å; L201-A205 PolarHBondContact O-N 3.32Å
202K60.6Low59.2Low164 Ų16499.8 Ų99.871%0.71348%0.483SS*.Hα-helixtrans-65.1-42.7174.3-76.2177.6-178.8177.50112.1G198 Y199 A205 A206G198-K202 WeakPolarHBondContact O-CG 3.47Å; G198-K202 PolarHBondContact O-N 3.4Å; G198-K202 VanDerWaalsContact O-N 3.08Å; Y199-K202 PolarHBondContact O-N 3.09Å; K202-A205 PolarHBondContact O-N 3.49Å; K202-A206 WeakPolarHBondContact O-CB 3.43Å; K202-A206 PolarHBondContact O-N 3.49Å
203Q59.9Low57.6Low83 Ų8397 Ų9739%0.38848%0.478SS..Hα-helixtrans-66.9-42.4177.1-170.9179.212.100111.3Y199 A206 L207Y199-Q203 WeakPolarHBondContact O-CB 3.43Å; Y199-Q203 PolarHBondContact O-N 2.94Å; Q203-A206 WeakPolarHBondContact O-CB 3.28Å; Q203-A206 PolarHBondContact O-N 2.92Å; Q203-L207 WeakPolarHBondContact O-CB 3.46Å; Q203-L207 PolarHBondContact O-N 3.34Å
204K58.9Low56.1Low117 Ų11799 Ų9951%0.50949%0.491SS..Hα-helixtrans-62.7-43.3173.8-170.1-177.3-178.6-158.60111.5Y200 A206 L207 E208Y200-K204 WeakPolarHBondContact O-CB 3.27Å; Y200-K204 PolarHBondContact O-N 3.27Å; K204-A206 VanDerWaalsContact C-N 3.31Å; K204-A206 PolarHBondContact O-N 3.46Å; K204-L207 PolarHBondContact O-N 3.29Å; K204-E208 WeakPolarHBondContact CE-OE1 3.45Å; K204-E208 HydrophobicContact CG-CG 4.5Å; K204-E208 IonicContact NZ-OE1 3.67Å; K204-E208 WeakPolarHBondContact O-CB 3.34Å; K204-E208 WeakPolarHBondContact O-CG 3.4Å; K204-E208 PolarHBondContact O-N 3.25Å
205A60.4Low55Low42 Ų42106.5 Ų106.535%0.34752%0.522SS..Hα-helixtrans-63.8-35.5174.500000112.3L201 K202 R209L201-A205 VanDerWaalsContact O-CB 3.22Å; L201-A205 WeakPolarHBondContact O-CB 3.42Å; L201-A205 PolarHBondContact O-N 3.32Å; K202-A205 PolarHBondContact O-N 3.49Å; A205-R209 WeakPolarHBondContact O-CB 3.47Å; A205-R209 WeakPolarHBondContact O-CG 3.48Å; A205-R209 PolarHBondContact O-N 3.35Å
206A60.2Low53.7Low46 Ų46111.8 Ų111.838%0.3854%0.54SS..Hα-helixtrans-66.8-44172.600000111.1K202 Q203 K204 R209 T210K202-A206 WeakPolarHBondContact O-CB 3.43Å; K202-A206 PolarHBondContact O-N 3.49Å; Q203-A206 WeakPolarHBondContact O-CB 3.28Å; Q203-A206 PolarHBondContact O-N 2.92Å; K204-A206 VanDerWaalsContact C-N 3.31Å; K204-A206 PolarHBondContact O-N 3.46Å; A206-R209 WeakPolarHBondContact O-CB 3.36Å; A206-R209 PolarHBondContact O-N 3.42Å; A206-T210 PolarHBondContact O-N 3.27Å; A206-T210 PolarHBondContact O-OG1 3.06Å
207L62.3Low52.4Low94 Ų94115.9 Ų115.949%0.49256%0.556SS.*Hα-helixtrans-65.8-39.2177.7-129.894.6000112.7Q203 K204 T210 K211Q203-L207 WeakPolarHBondContact O-CB 3.46Å; Q203-L207 PolarHBondContact O-N 3.34Å; K204-L207 PolarHBondContact O-N 3.29Å; L207-T210 PolarHBondContact O-N 3.09Å; L207-K211 WeakPolarHBondContact O-CB 3.28Å; L207-K211 WeakPolarHBondContact O-CG 3.37Å; L207-K211 PolarHBondContact O-N 3.25Å
208E60.2Low51.1Low96 Ų96120.4 Ų120.445%0.44959%0.585SS.*Hα-helixtrans-64.7-42.8173.9-76.8173.3177.400110.4K204 T210 K211 E212K204-E208 WeakPolarHBondContact CE-OE1 3.45Å; K204-E208 HydrophobicContact CG-CG 4.5Å; K204-E208 IonicContact NZ-OE1 3.67Å; K204-E208 WeakPolarHBondContact O-CB 3.34Å; K204-E208 WeakPolarHBondContact O-CG 3.4Å; K204-E208 PolarHBondContact O-N 3.25Å; E208-T210 VanDerWaalsContact C-N 3.27Å; E208-T210 PolarHBondContact O-N 3.49Å; E208-K211 CarbonylContact O-C 3.53Å; E208-K211 PolarHBondContact O-N 2.81Å; E208-K211 VanDerWaalsContact O-N 3.13Å; E208-E212 WeakPolarHBondContact O-CG 3.45Å; E208-E212 PolarHBondContact O-N 3.29Å
209R54.5Low50Low172 Ų172124.5 Ų124.565%0.64960%0.604SS**Hα-helixtrans-61.2-32.5172.1-76.7173.2178.1-166.6-0.8113.5A205 A206A205-R209 WeakPolarHBondContact O-CB 3.47Å; A205-R209 WeakPolarHBondContact O-CG 3.48Å; A205-R209 PolarHBondContact O-N 3.35Å; A206-R209 WeakPolarHBondContact O-CB 3.36Å; A206-R209 PolarHBondContact O-N 3.42Å
210T54.9Low49Very low97 Ų97122.4 Ų122.460%0.59562%0.616SS**Hα-helixtrans-76.4-35.3174.3-520000111.6A206 L207 E208 Q213 P214A206-T210 PolarHBondContact O-N 3.27Å; A206-T210 PolarHBondContact O-OG1 3.06Å; L207-T210 PolarHBondContact O-N 3.09Å; E208-T210 VanDerWaalsContact C-N 3.27Å; E208-T210 PolarHBondContact O-N 3.49Å; T210-Q213 PolarHBondContact O-N 3.45Å; T210-P214 WeakPolarHBondContact O-CD 3.42Å
211K48.4Very low48Very low152 Ų152123.2 Ų123.266%0.66163%0.629SS**Hα-helixtrans-76-17.6175.5-79.6-176176.9-175.60114.7L207 E208 Q213 P214L207-K211 WeakPolarHBondContact O-CB 3.28Å; L207-K211 WeakPolarHBondContact O-CG 3.37Å; L207-K211 PolarHBondContact O-N 3.25Å; E208-K211 CarbonylContact O-C 3.53Å; E208-K211 PolarHBondContact O-N 2.81Å; E208-K211 VanDerWaalsContact O-N 3.13Å; K211-Q213 VanDerWaalsContact C-N 3.32Å; K211-P214 WeakPolarHBondContact O-CD 3.35Å; K211-P214 VanDerWaalsContact O-CG 3.29Å; K211-P214 WeakPolarHBondContact O-CG 3.27Å
212E47.7Very low46.7Very low165 Ų165126.2 Ų126.277%0.77165%0.645SS**THydrogen-bonded Turntrans-81.4-12.4168.8-75.3177.5170.300112.6E208E208-E212 WeakPolarHBondContact O-CG 3.45Å; E208-E212 PolarHBondContact O-N 3.29Å
213Q45.5Very low45.4Very low119 Ų119126.5 Ų126.556%0.55665%0.654SS**SBendtrans-93.1-4.5177.2-72.8-160.3-56.900119.2T210 K211 F215T210-Q213 PolarHBondContact O-N 3.45Å; K211-Q213 VanDerWaalsContact C-N 3.32Å; Q213-F215 VanDerWaalsContact C-N 3.32Å; Q213-F215 PolarHBondContact O-N 3.34Å
214P39.8Very low44Very low84 Ų84132.1 Ų132.155%0.54568%0.677SS.*SBendtrans-92.357.4178.938.4-29.8000110.4T210 K211T210-P214 WeakPolarHBondContact O-CD 3.42Å; K211-P214 WeakPolarHBondContact O-CD 3.35Å; K211-P214 VanDerWaalsContact O-CG 3.29Å; K211-P214 WeakPolarHBondContact O-CG 3.27Å
215F37.9Very low42.4Very low196 Ų196132.3 Ų132.386%0.8669%0.688SS**  trans-168.260.5161.4-100.8-71.6000111.2Q213Q213-F215 VanDerWaalsContact C-N 3.32Å; Q213-F215 PolarHBondContact O-N 3.34Å
216K33.5Very low40.7Very low203 Ų203137 Ų13788%0.88371%0.713SS**  trans-121.785.6148.8-92.3-173.7174.6-177.20107.5
217K30.1Very low39.2Very low183 Ų183140.7 Ų140.780%0.79673%0.733SS**PPolyproline II helixtrans-56127.8156.8-92.8-179.7172.5178.90106.4
218P32.1Very low37.4Very low112 Ų112139.5 Ų139.573%0.72774%0.743SS**PPolyproline II helixtrans-60.9142167.425.8-30.3000108.2A220P218-A220 PolarHBondContact O-N 3.22Å
219P32.4Very low35.6Very low125 Ų125142.2 Ų142.281%0.81277%0.766SS**PPolyproline II helixtrans-59.7127.2174.324.9-31.2000108.6D221P219-D221 PolarHBondContact O-N 2.89Å; P219-D221 VanDerWaalsContact O-N 3.14Å
220A37.2Very low34.1Very low95 Ų95137.9 Ų137.979%0.78578%0.775SS**  trans-74.695.816800000107P218P218-A220 PolarHBondContact O-N 3.22Å
221D32.7Very low32.7Very low148 Ų148142.5 Ų142.579%0.79179%0.79SS**  trans-166.795.4154.7-94.6-24.7000107.7P219P219-D221 PolarHBondContact O-N 2.89Å; P219-D221 VanDerWaalsContact O-N 3.14Å
222D31.6Very low31.5Very low158 Ų158145.4 Ų145.485%0.84580%0.802SS**  179.386.2127.7-92-23.6000108.5K224D222-K224 PolarHBondContact O-N 3.45Å; D222-K224 VanDerWaalsContact O-N 3.17Å
223L34Very low30.2Very low169 Ų169147.3 Ų147.389%0.88581%0.808SS**  trans-69.199.5163.9-125.3129.1000107.7
224K28.7Very low29.4Very low201 Ų201149.1 Ų149.187%0.87482%0.821SS**  trans-128.8110.6151.7-76.8-170.6-179.7175.10110.3D222D222-K224 PolarHBondContact O-N 3.45Å; D222-K224 VanDerWaalsContact O-N 3.17Å
225T26.1Very low28.8Very low121 Ų121150.7 Ų150.774%0.74283%0.831SS**  trans-52.2135.7170.135.90000114.4
226T26Very low28.3Very low141 Ų141147.1 Ų147.187%0.86583%0.825SS**  trans-151.7133.7133.7-29.60000109.9
227P28Very low27.9Very low124 Ų124146.4 Ų146.481%0.80582%0.822SS**  trans-93.1147.5-17535.6-31.9000112.6
228G24.1Very low27.6Very low68 Ų68144 Ų14470%0.70182%0.818SS**  trans176.483.3173.700000116.3
229T22Very low27.3Very low154 Ų154148.3 Ų148.395%0.94583%0.827SS**  trans56.7122.4141.949.70000121.7
230G23.9Very low26.9Very low80 Ų80148.7 Ų148.783%0.82582%0.822SS**  trans135.582.9138.800000116.2
231E25.3Very low26.6Very low194 Ų194151.6 Ų151.691%0.90782%0.823SS**  trans-60.2138.1162.4-68-176.7139.400111.3
232K22.7Very low26.2Very low214 Ų214150.7 Ų150.793%0.9382%0.823SS**  trans-159.4136.9138.9-110167.4-171.5179.60112.3
233K20.9Very low26.4Very low205 Ų205150.2 Ų150.289%0.89182%0.819SS**  trans-66.5152.9-171.1-73.6165.8168.9173.10114.6
234L28.1Very low26.2Very low157 Ų157149.1 Ų149.182%0.82281%0.814SS**  trans-41.3155160.2-100.691.2000113.7
235P27.2Very low26.3Very low116 Ų116143.5 Ų143.575%0.75381%0.805SS**  -154.215370.636.9-14.5000119.5
236V27.9Very low26.7Very low122 Ų122143.1 Ų143.174%0.73979%0.793SS**  trans42.2109.6136.7-168.60000119.8
237K25.2Very low26.9Very low188 Ų188143 Ų14382%0.81779%0.787SS**  177154.1122.3-100.7178-177.3178.30112.9
238D22.9Very low27Very low133 Ų133144 Ų14471%0.71178%0.784SS**  trans87.281.4162.7-56.1-16.3000119.5L240D238-L240 VanDerWaalsContact C-N 3.28Å; D238-L240 PolarHBondContact O-N 3.37Å; D238-L240 VanDerWaalsContact O-N 3.16Å
239H25.6Very low27.5Very low201 Ų201142.8 Ų142.893%0.93176%0.764SS**  trans-79.279.8152.5-80.2-43.3000110.2
240L24.9Very low28Very low134 Ų134140.9 Ų140.970%0.70275%0.752SS**  trans-81.6131.6157.5-121.893.5000109.1D238 T242D238-L240 VanDerWaalsContact C-N 3.28Å; D238-L240 PolarHBondContact O-N 3.37Å; D238-L240 VanDerWaalsContact O-N 3.16Å; L240-T242 PolarHBondContact O-N 2.91Å
241I31.5Very low28.7Very low155 Ų155143.5 Ų143.580%0.79575%0.754SS**  trans-3.991.7156.7-51.9170.9000113.1I243I241-I243 PolarHBondContact O-N 3Å
242T24.6Very low29.3Very low130 Ų130140.4 Ų140.480%0.79874%0.744SS**  trans-87.5100.9167.8180000108.4L240L240-T242 PolarHBondContact O-N 2.91Å
243I35.6Very low30.1Very low147 Ų147138.6 Ų138.675%0.75475%0.745SS**  trans-48.9138.8156.5-64.2167.9000108.4I241 A245I241-I243 PolarHBondContact O-N 3Å; I243-A245 PolarHBondContact O-N 3.22Å
244D29.9Very low31.2Very low147 Ų147137.4 Ų137.479%0.78674%0.74SS**  trans-29.3103.7175.2-97-50.2000113.8K246D244-K246 PolarHBondContact O-N 2.89Å
245A30.5Very low31.8Very low83 Ų83136.3 Ų136.369%0.68673%0.725SS**THydrogen-bonded Turntrans-83.355.2168.400000110.5I243I243-A245 PolarHBondContact O-N 3.22Å
246K33.2Very low32.7Very low112 Ų112133.8 Ų133.849%0.48772%0.72SS.*THydrogen-bonded Turntrans-124.213.9170.8-135.2178.5-178.7173.40115.3D244D244-K246 PolarHBondContact O-N 2.89Å
247D31.9Very low33.6Very low138 Ų138135.5 Ų135.574%0.73872%0.718SS**  trans-139.155.6167.3-78.5-48.3000110.5P249D247-P249 VanDerWaalsContact C-CD 3.47Å; D247-P249 WeakPolarHBondContact O-CD 3.35Å
248I29.4Very low34.5Very low146 Ų146132.3 Ų132.375%0.74971%0.707SS**  trans-89.497.6160.6-56.3177.1000107.4
249P34Very low35.8Very low43 Ų43128.7 Ų128.728%0.27970%0.696SS.*  trans-66.4143.8156.430.8-32.5000109D247 R255D247-P249 VanDerWaalsContact C-CD 3.47Å; D247-P249 WeakPolarHBondContact O-CD 3.35Å; P249-R255 VanDerWaalsContact CB-CD 3.47Å; P249-R255 VanDerWaalsContact CG-NH1 3.34Å
250T33Very low37.2Very low114 Ų114120.7 Ų120.770%0.69967%0.667SS**  trans-46.7147.6151.242.60000110.6D252T250-D252 PolarHBondContact O-N 2.76Å
251P37.5Very low38.9Very low134 Ų134117.4 Ų117.487%0.8765%0.65SS**SBendtrans-71.190.8-165.429.9-33.8000110.8
252D37.9Very low40.2Very low130 Ų130112.3 Ų112.370%0.69563%0.631SS**  trans-115.2123.1166.3-97.7-28.7000109.4T250 K254T250-D252 PolarHBondContact O-N 2.76Å; D252-K254 PolarHBondContact O-N 2.93Å
253N40.6Very low42Very low176 Ų176110.9 Ų110.994%0.94162%0.618SS**THydrogen-bonded Turntrans-61.614.6-166.7-147.65.3000115.8
254K43Very low43.5Very low180 Ų180108 Ų10878%0.78361%0.607SS**THydrogen-bonded Turntrans-108.9-9.3-173.8-70.4-177.6178.5176.20115.1D252D252-K254 PolarHBondContact O-N 2.93Å
255R41.5Very low45.2Very low133 Ų133107.6 Ų107.650%0.50260%0.598SS.*Hα-helixtrans-87.8-20.8-174.4-90.5177.1179.1-15513116.5P249 F257 M258 A259P249-R255 VanDerWaalsContact CB-CD 3.47Å; P249-R255 VanDerWaalsContact CG-NH1 3.34Å; R255-F257 VanDerWaalsContact C-N 3.27Å; R255-F257 PolarHBondContact O-N 3.31Å; R255-M258 PolarHBondContact O-N 2.93Å; R255-M258 VanDerWaalsContact O-N 3.15Å; R255-A259 PolarHBondContact O-N 2.84Å
256G46.1Very low47Very low63 Ų63108.6 Ų108.665%0.64959%0.591SS**Hα-helixtrans-60.4-37.5173.900000112.9G260G256-G260 PolarHBondContact O-N 2.95Å; G256-G260 VanDerWaalsContact O-N 3.08Å
257F46.5Very low48.8Very low159 Ų159108.1 Ų108.170%0.69759%0.592SS**Hα-helixtrans-65.9-39.1174.8-172.9-102.9000112.4R255 L261R255-F257 VanDerWaalsContact C-N 3.27Å; R255-F257 PolarHBondContact O-N 3.31Å; F257-L261 HydrophobicContact CE1-CD1 4.02Å; F257-L261 HydrophobicContact CZ-CD1 4.16Å; F257-L261 WeakPolarHBondContact O-CB 3.31Å; F257-L261 PolarHBondContact O-N 2.89Å
258M43.5Very low50.6Low121 Ų121108 Ų10860%0.59659%0.585SS**Hα-helixtrans-75.4-35.5-179-75-70.1-80.400113.4R255 L261 A262R255-M258 PolarHBondContact O-N 2.93Å; R255-M258 VanDerWaalsContact O-N 3.15Å; M258-L261 PolarHBondContact O-N 3.1Å; M258-L261 HydrophobicContact SD-CD2 4.43Å; M258-A262 PolarHBondContact O-N 3.05Å
259A50.6Low52.5Low57 Ų57108.6 Ų108.647%0.47158%0.582SS.*Hα-helixtrans-66.6-42.6171.500000111.4R255 L261 A262 I263R255-A259 PolarHBondContact O-N 2.84Å; A259-L261 VanDerWaalsContact C-N 3.34Å; A259-L261 PolarHBondContact O-N 3.07Å; A259-A262 PolarHBondContact O-N 3.37Å; A259-I263 WeakPolarHBondContact O-CG1 3.47Å; A259-I263 PolarHBondContact O-N 3.46Å
260G56.3Low54.2Low32 Ų32114.1 Ų114.133%0.3360%0.602SS.*Hα-helixtrans-58.9-43.117000000112.3G256 A262 I263 V264G256-G260 PolarHBondContact O-N 2.95Å; G256-G260 VanDerWaalsContact O-N 3.08Å; G260-A262 VanDerWaalsContact C-N 3.32Å; G260-A262 PolarHBondContact O-N 3.06Å; G260-I263 PolarHBondContact O-N 2.96Å; G260-V264 WeakPolarHBondContact O-CB 3.42Å; G260-V264 WeakPolarHBondContact O-CG2 3.39Å; G260-V264 PolarHBondContact O-N 3.22Å
261L58.9Low55.8Low65 Ų65118 Ų11834%0.3460%0.604SS.*Hα-helixtrans-63.3-36177-146.291.3000112.6F257 M258 A259 K265F257-L261 HydrophobicContact CE1-CD1 4.02Å; F257-L261 HydrophobicContact CZ-CD1 4.16Å; F257-L261 WeakPolarHBondContact O-CB 3.31Å; F257-L261 PolarHBondContact O-N 2.89Å; M258-L261 PolarHBondContact O-N 3.1Å; M258-L261 HydrophobicContact SD-CD2 4.43Å; A259-L261 VanDerWaalsContact C-N 3.34Å; A259-L261 PolarHBondContact O-N 3.07Å; L261-K265 WeakPolarHBondContact O-CB 3.45Å; L261-K265 VanDerWaalsContact O-CG 3.27Å; L261-K265 WeakPolarHBondContact O-CG 3.35Å; L261-K265 PolarHBondContact O-N 2.75Å
262A59.5Low57.3Low49 Ų49117.8 Ų117.841%0.40559%0.591SS.*Hα-helixtrans-69.7-44.4177.100000111.8M258 A259 G260 K265 I266M258-A262 PolarHBondContact O-N 3.05Å; A259-A262 PolarHBondContact O-N 3.37Å; G260-A262 VanDerWaalsContact C-N 3.32Å; G260-A262 PolarHBondContact O-N 3.06Å; A262-K265 PolarHBondContact O-N 3.28Å; A262-I266 VanDerWaalsContact O-CG1 3.31Å; A262-I266 WeakPolarHBondContact O-CG1 3.27Å; A262-I266 PolarHBondContact O-N 3.19Å
263I63.2Low58.7Low100 Ų100114.6 Ų114.651%0.51358%0.583SS.*Hα-helixtrans-63-44.5174.4-65.7168.3000110.2A259 G260 K265 I266 I267A259-I263 WeakPolarHBondContact O-CG1 3.47Å; A259-I263 PolarHBondContact O-N 3.46Å; G260-I263 PolarHBondContact O-N 2.96Å; I263-K265 VanDerWaalsContact C-N 3.34Å; I263-K265 PolarHBondContact O-N 3.39Å; I263-I266 PolarHBondContact O-N 3.37Å; I263-I267 HydrophobicContact CG2-CD1 3.67Å; I263-I267 HydrophobicContact CG2-CG1 4.32Å; I263-I267 WeakPolarHBondContact O-CB 3.37Å; I263-I267 VanDerWaalsContact O-CG1 3.26Å; I263-I267 WeakPolarHBondContact O-CG1 3.21Å; I263-I267 PolarHBondContact O-N 2.99Å
264V66.9Low60Low86 Ų86113.5 Ų113.552%0.52157%0.567SS.*Hα-helixtrans-62.1-40175.2170.60000111.4G260 I267 K268G260-V264 WeakPolarHBondContact O-CB 3.42Å; G260-V264 WeakPolarHBondContact O-CG2 3.39Å; G260-V264 PolarHBondContact O-N 3.22Å; V264-I267 PolarHBondContact O-N 3.24Å; V264-K268 WeakPolarHBondContact O-CB 3.17Å; V264-K268 PolarHBondContact O-N 2.84Å
265K64.1Low61.2Low139 Ų139107.5 Ų107.560%0.60455%0.547SS*.Hα-helixtrans-64.1-40.5174-82.1177.7-178.8-179.80112.2L261 A262 I263 K268 K269L261-K265 WeakPolarHBondContact O-CB 3.45Å; L261-K265 VanDerWaalsContact O-CG 3.27Å; L261-K265 WeakPolarHBondContact O-CG 3.35Å; L261-K265 PolarHBondContact O-N 2.75Å; A262-K265 PolarHBondContact O-N 3.28Å; I263-K265 VanDerWaalsContact C-N 3.34Å; I263-K265 PolarHBondContact O-N 3.39Å; K265-K268 PolarHBondContact O-N 3.08Å; K265-K269 VanDerWaalsContact O-CB 3.24Å; K265-K269 WeakPolarHBondContact O-CB 3.42Å; K265-K269 PolarHBondContact O-N 3.4Å
266I69.4Low62.6Low104 Ų104109 Ų10953%0.53356%0.557SS.*Hα-helixtrans-66.6-45.3176.4-68.1165.3000110.7A262 I263 K269 K270A262-I266 VanDerWaalsContact O-CG1 3.31Å; A262-I266 WeakPolarHBondContact O-CG1 3.27Å; A262-I266 PolarHBondContact O-N 3.19Å; I263-I266 PolarHBondContact O-N 3.37Å; I266-K269 PolarHBondContact O-N 3.02Å; I266-K270 WeakPolarHBondContact O-CB 3.26Å; I266-K270 PolarHBondContact O-N 3.35Å
267I70.8Confident63.8Low102 Ų102110.3 Ų110.352%0.52354%0.543SS..Hα-helixtrans-62.5-44.6176.1-67.4168.3000110.1I263 V264 K269 K270 R271I263-I267 HydrophobicContact CG2-CD1 3.67Å; I263-I267 HydrophobicContact CG2-CG1 4.32Å; I263-I267 WeakPolarHBondContact O-CB 3.37Å; I263-I267 VanDerWaalsContact O-CG1 3.26Å; I263-I267 WeakPolarHBondContact O-CG1 3.21Å; I263-I267 PolarHBondContact O-N 2.99Å; V264-I267 PolarHBondContact O-N 3.24Å; I267-K269 PolarHBondContact O-N 3.28Å; I267-K270 PolarHBondContact O-N 2.98Å; I267-R271 WeakPolarHBondContact O-CB 3.27Å; I267-R271 PolarHBondContact O-N 2.87Å
268K69.2Low64.9Low135 Ų135106.6 Ų106.659%0.58753%0.529SS*.Hα-helixtrans-64.9-39178.1-163.2174.7-175.1178.30111.7V264 K265 R271 Q272V264-K268 WeakPolarHBondContact O-CB 3.17Å; V264-K268 PolarHBondContact O-N 2.84Å; K265-K268 PolarHBondContact O-N 3.08Å; K268-R271 PolarHBondContact O-N 3.43Å; K268-Q272 WeakPolarHBondContact O-CB 3.16Å; K268-Q272 WeakPolarHBondContact O-CG 3.43Å; K268-Q272 PolarHBondContact O-N 3.25Å
269K69.6Low66.4Low159 Ų159106.7 Ų106.769%0.69153%0.528SS*.Hα-helixtrans-66.9-43.8174.8-172176.1-179.6177.60112K265 I266 I267 Q272 A273K265-K269 VanDerWaalsContact O-CB 3.24Å; K265-K269 WeakPolarHBondContact O-CB 3.42Å; K265-K269 PolarHBondContact O-N 3.4Å; I266-K269 PolarHBondContact O-N 3.02Å; I267-K269 PolarHBondContact O-N 3.28Å; K269-Q272 PolarHBondContact O-N 3.05Å; K269-A273 PolarHBondContact O-N 3.07Å
270K69.4Low67.4Low159 Ų159105.3 Ų105.369%0.69152%0.515SS*.Hα-helixtrans-64.2-41.6173-82.7-167.5172.9-1710111.8I266 I267 A273 Y274I266-K270 WeakPolarHBondContact O-CB 3.26Å; I266-K270 PolarHBondContact O-N 3.35Å; I267-K270 PolarHBondContact O-N 2.98Å; K270-A273 PolarHBondContact O-N 3.34Å; K270-Y274 WeakPolarHBondContact O-CB 3.43Å; K270-Y274 PolarHBondContact O-N 3.33Å
271R68.1Low68.2Low196 Ų196104.7 Ų104.774%0.7451%0.505SS*.Hα-helixtrans-63-40.5175.7-174179.6-179.5-165.1-0.3111.8I267 K268 Y274 S275I267-R271 WeakPolarHBondContact O-CB 3.27Å; I267-R271 PolarHBondContact O-N 2.87Å; K268-R271 PolarHBondContact O-N 3.43Å; R271-Y274 PolarHBondContact O-N 3.01Å; R271-S275 WeakPolarHBondContact O-CB 3.22Å; R271-S275 PolarHBondContact O-N 3.1Å
272Q67.2Low68.9Low128 Ų128104.1 Ų104.160%0.59851%0.509SS*.Hα-helixtrans-67-41.7174.3-82.9179.5-31.700112.3K268 K269 Y274 S275 K276K268-Q272 WeakPolarHBondContact O-CB 3.16Å; K268-Q272 WeakPolarHBondContact O-CG 3.43Å; K268-Q272 PolarHBondContact O-N 3.25Å; K269-Q272 PolarHBondContact O-N 3.05Å; Q272-Y274 VanDerWaalsContact C-N 3.34Å; Q272-S275 PolarHBondContact O-N 3.09Å; Q272-K276 WeakPolarHBondContact O-CB 3.41Å; Q272-K276 PolarHBondContact O-N 2.77Å
273A67.6Low69.9Low63 Ų63107.2 Ų107.252%0.52152%0.519SS..Hα-helixtrans-62.4-42.6174.100000111.7K269 K270 K276 Y277K269-A273 PolarHBondContact O-N 3.07Å; K270-A273 PolarHBondContact O-N 3.34Å; A273-K276 PolarHBondContact O-N 2.9Å; A273-Y277 WeakPolarHBondContact O-CB 3.12Å; A273-Y277 PolarHBondContact O-N 3.4Å
274Y68.2Low70.5Confident154 Ų154103.3 Ų103.360%0.60450%0.498SS*.Hα-helixtrans-67-42176.4-168.1-106.2000112.5K270 R271 Q272 Y277 M278K270-Y274 WeakPolarHBondContact O-CB 3.43Å; K270-Y274 PolarHBondContact O-N 3.33Å; R271-Y274 PolarHBondContact O-N 3.01Å; Q272-Y274 VanDerWaalsContact C-N 3.34Å; Y274-Y277 WeakPolarHBondContact O-CB 3.39Å; Y274-Y277 PolarHBondContact O-N 3.26Å; Y274-M278 HydrophobicContact CD1-CE 3.64Å; Y274-M278 HydrophobicContact CD2-CE 4.4Å; Y274-M278 HydrophobicContact CE1-CE 2.98Å; Y274-M278 HydrophobicContact CE2-CE 3.85Å; Y274-M278 HydrophobicContact CG-CE 4.32Å; Y274-M278 WeakPolarHBondContact O-CB 3.49Å; Y274-M278 PolarHBondContact O-N 3.25Å; Y274-M278 WeakPolarHBondContact OH-CE 3.46Å
275S67.7Low71.1Confident53 Ų53102.1 Ų102.137%0.37149%0.489SS..Hα-helixtrans-62.2-42.6174.1169.10000111.3R271 Q272 M278 H279R271-S275 WeakPolarHBondContact O-CB 3.22Å; R271-S275 PolarHBondContact O-N 3.1Å; Q272-S275 PolarHBondContact O-N 3.09Å; S275-M278 PolarHBondContact O-N 3.39Å; S275-H279 PolarHBondContact O-CD2 2.86Å; S275-H279 PolarHBondContact O-N 3.45Å
276K72.8Confident71.8Confident164 Ų164103.3 Ų103.371%0.71350%0.496SS*.Hα-helixtrans-63.9-40.3174.9-167.4177-177.3-179.20112.2Q272 A273 S280Q272-K276 WeakPolarHBondContact O-CB 3.41Å; Q272-K276 PolarHBondContact O-N 2.77Å; A273-K276 PolarHBondContact O-N 2.9Å; K276-S280 WeakPolarHBondContact O-CB 3.34Å; K276-S280 PolarHBondContact O-N 3.43Å
277Y69.4Low72.4Confident91 Ų91100.9 Ų100.936%0.35748%0.484SS..Hα-helixtrans-61.7-44.9172.7177.6-93.8000111.7A273 Y274 S280 T281 Q414A273-Y277 WeakPolarHBondContact O-CB 3.12Å; A273-Y277 PolarHBondContact O-N 3.4Å; Y274-Y277 WeakPolarHBondContact O-CB 3.39Å; Y274-Y277 PolarHBondContact O-N 3.26Å; Y277-S280 PolarHBondContact O-N 3.25Å; Y277-T281 WeakPolarHBondContact O-CB 3.47Å; Y277-T281 PolarHBondContact O-N 2.87Å; Y277-T281 PolarHBondContact O-OG1 3.02Å; Y277-Q414 HydrophobicContact CE2-CG 3.89Å
278M69.9Low72.9Confident81 Ų81104.2 Ų104.240%0.39949%0.49SS..Hα-helixtrans-64.8-42.5179.3-146.868.767.600112.4Y274 S275 T281 A282Y274-M278 HydrophobicContact CD1-CE 3.64Å; Y274-M278 HydrophobicContact CD2-CE 4.4Å; Y274-M278 HydrophobicContact CE1-CE 2.98Å; Y274-M278 HydrophobicContact CE2-CE 3.85Å; Y274-M278 HydrophobicContact CG-CE 4.32Å; Y274-M278 WeakPolarHBondContact O-CB 3.49Å; Y274-M278 PolarHBondContact O-N 3.25Å; Y274-M278 WeakPolarHBondContact OH-CE 3.46Å; S275-M278 PolarHBondContact O-N 3.39Å; M278-T281 WeakPolarHBondContact O-CB 3.35Å; M278-T281 PolarHBondContact O-N 3.21Å; M278-A282 WeakPolarHBondContact O-CB 3.42Å; M278-A282 PolarHBondContact O-N 3.23Å
279H74.9Confident73.4Confident123 Ų123100 Ų10057%0.56947%0.474SS*.Hα-helixtrans-62.7-48174.9-78.3-62.6000111.5S275 T281 A282 D283S275-H279 PolarHBondContact O-CD2 2.86Å; S275-H279 PolarHBondContact O-N 3.45Å; H279-T281 PolarHBondContact O-N 3.43Å; H279-A282 WeakPolarHBondContact O-CB 3.37Å; H279-A282 PolarHBondContact O-N 3.22Å; H279-A282 VanDerWaalsContact O-N 3.14Å; H279-D283 VanDerWaalsContact O-CG 3.26Å; H279-D283 PolarHBondContact O-N 3.5Å
280S72.8Confident74.1Confident28 Ų2892.5 Ų92.520%0.19644%0.441CS..Hα-helixtrans-61.3-32.6175.7-177.40000112.6K276 Y277 F284 Q414K276-S280 WeakPolarHBondContact O-CB 3.34Å; K276-S280 PolarHBondContact O-N 3.43Å; Y277-S280 PolarHBondContact O-N 3.25Å; S280-F284 WeakPolarHBondContact O-CD2 3.35Å; S280-F284 WeakPolarHBondContact O-CE2 3.38Å; S280-F284 PolarHBondContact O-N 2.84Å; S280-F284 WeakPolarHBondContact OG-CE2 3.41Å; S280-Q414 PolarHBondContact OG-NE2 2.89Å
281T72.9Confident75Confident20 Ų2087.7 Ų87.712%0.12342%0.422CS..Hα-helixtrans-70.5-42176.4-58.30000111Y277 M278 H279 D283 F284 L285 Q414 I418Y277-T281 WeakPolarHBondContact O-CB 3.47Å; Y277-T281 PolarHBondContact O-N 2.87Å; Y277-T281 PolarHBondContact O-OG1 3.02Å; M278-T281 WeakPolarHBondContact O-CB 3.35Å; M278-T281 PolarHBondContact O-N 3.21Å; H279-T281 PolarHBondContact O-N 3.43Å; T281-D283 VanDerWaalsContact C-N 3.31Å; T281-D283 PolarHBondContact O-N 2.87Å; T281-F284 PolarHBondContact O-N 2.95Å; T281-L285 HydrophobicContact CG2-CD1 4.32Å; T281-L285 WeakPolarHBondContact O-CG 3.28Å; T281-L285 PolarHBondContact O-N 2.98Å; T281-L285 VanDerWaalsContact O-N 3.08Å; T281-Q414 PolarHBondContact OG1-NE2 2.82Å; T281-I418 HydrophobicContact CG2-CD1 3.76Å; T281-I418 HydrophobicContact CG2-CG1 4.17Å
282A73.6Confident75.8Confident52 Ų5278.7 Ų78.743%0.4339%0.389SS..Hα-helixtrans-62.2-39173.500000111.8M278 H279 F284 L285 H286M278-A282 WeakPolarHBondContact O-CB 3.42Å; M278-A282 PolarHBondContact O-N 3.23Å; H279-A282 WeakPolarHBondContact O-CB 3.37Å; H279-A282 PolarHBondContact O-N 3.22Å; H279-A282 VanDerWaalsContact O-N 3.14Å; A282-F284 PolarHBondContact O-N 3.06Å; A282-L285 CarbonylContact O-C 3.57Å; A282-L285 PolarHBondContact O-N 3.37Å; A282-H286 PolarHBondContact O-N 3.35Å
283D79.3Confident76.8Confident114 Ų11472.7 Ų72.761%0.6136%0.361SS*.Hα-helixtrans-61.9-41.3176.2-65.1-22.3000111.8H279 T281 H286 D287H279-D283 VanDerWaalsContact O-CG 3.26Å; H279-D283 PolarHBondContact O-N 3.5Å; T281-D283 VanDerWaalsContact C-N 3.31Å; T281-D283 PolarHBondContact O-N 2.87Å; D283-H286 PolarHBondContact O-N 2.91Å; D283-D287 PolarHBondContact O-N 3.4Å
284F77.6Confident77.8Confident18 Ų1869.7 Ų69.78%0.07934%0.337CS..Hα-helixtrans-64.6-43.5174.6-67.5-55.3000112.2S280 T281 A282 H286 D287 F290 V407 K411 Q414 I418S280-F284 WeakPolarHBondContact O-CD2 3.35Å; S280-F284 WeakPolarHBondContact O-CE2 3.38Å; S280-F284 PolarHBondContact O-N 2.84Å; S280-F284 WeakPolarHBondContact OG-CE2 3.41Å; T281-F284 PolarHBondContact O-N 2.95Å; A282-F284 PolarHBondContact O-N 3.06Å; F284-H286 PolarHBondContact O-N 2.92Å; F284-D287 PolarHBondContact O-N 3.49Å; F284-D287 VanDerWaalsContact O-N 3.11Å; F284-F290 HydrophobicContact CB-CD1 3.85Å; F284-F290 HydrophobicContact CB-CE1 3.86Å; F284-F290 VanDerWaalsContact O-CD1 3.25Å; F284-F290 WeakPolarHBondContact O-CD1 3.35Å; F284-V407 HydrophobicContact CD1-CG1 3.78Å; F284-V407 HydrophobicContact CE1-CG1 3.21Å; F284-V407 HydrophobicContact CZ-CG1 3.94Å; F284-K411 HydrophobicContact CE1-CB 4.31Å; F284-K411 HydrophobicContact CE1-CD 3.88Å; F284-K411 HydrophobicContact CE1-CG 4.48Å; F284-K411 HydrophobicContact CZ-CB 3.83Å; F284-K411 HydrophobicContact CZ-CD 3.63Å; F284-K411 HydrophobicContact CZ-CG 3.85Å; F284-Q414 HydrophobicContact CE2-CG 4.1Å; F284-I418 HydrophobicContact CB-CD1 4.49Å; F284-I418 HydrophobicContact CD2-CD1 4.15Å
285L78.9Confident78.9Confident62 Ų6266.1 Ų66.133%0.32533%0.327SS..Hα-helixtrans-69.4-10.9177-64.4173.3000112.9T281 A282 F290 M291 I418 F422T281-L285 HydrophobicContact CG2-CD1 4.32Å; T281-L285 WeakPolarHBondContact O-CG 3.28Å; T281-L285 PolarHBondContact O-N 2.98Å; T281-L285 VanDerWaalsContact O-N 3.08Å; A282-L285 CarbonylContact O-C 3.57Å; A282-L285 PolarHBondContact O-N 3.37Å; L285-F290 HydrophobicContact CD2-CE1 4.44Å; L285-M291 HydrophobicContact CB-SD 3.81Å; L285-M291 HydrophobicContact CD2-SD 3.41Å; L285-M291 WeakPolarHBondContact CD2-SD 3.44Å; L285-M291 HydrophobicContact CG-SD 4.21Å; L285-M291 WeakPolarHBondContact O-CG 3.46Å; L285-I418 HydrophobicContact CD2-CG2 4.11Å; L285-F422 HydrophobicContact CD2-CE2 3.98Å; L285-F422 HydrophobicContact CD2-CZ 4.38Å
286H79.6Confident80.1Confident164 Ų16463.6 Ų63.676%0.75931%0.31SS*.Hα-helixtrans-89.8-17173.2-152.1-85.6000112.3A282 D283 F284 R288A282-H286 PolarHBondContact O-N 3.35Å; D283-H286 PolarHBondContact O-N 2.91Å; F284-H286 PolarHBondContact O-N 2.92Å; H286-R288 PolarHBondContact O-N 2.99Å
287D81Confident81Confident52 Ų5256 Ų5628%0.27828%0.277SS..  trans-74.7119.7173.1-161.6-21.9000110.2D283 F284 N289 F290 M291 K474D283-D287 PolarHBondContact O-N 3.4Å; F284-D287 PolarHBondContact O-N 3.49Å; F284-D287 VanDerWaalsContact O-N 3.11Å; D287-N289 VanDerWaalsContact C-N 3.26Å; D287-N289 PolarHBondContact O-N 2.9Å; D287-N289 PolarHBondContact OD1-N 3.21Å; D287-F290 HydrophobicContact CB-CB 4.13Å; D287-F290 PolarHBondContact O-N 3.4Å; D287-M291 PolarHBondContact O-N 3.44Å; D287-K474 IonicContact OD2-NZ 2.72Å
288R80.6Confident82.1Confident172 Ų17254.5 Ų54.565%0.64927%0.272SS*.Hα-helixtrans-60.3-36.7-175.5-63.1-179.3-179.4-171.6-1.8112H286 A292H286-R288 PolarHBondContact O-N 2.99Å; R288-A292 WeakPolarHBondContact O-CB 3.28Å; R288-A292 PolarHBondContact O-N 3.4Å
289N80.9Confident83.3Confident46 Ų4651.7 Ų51.725%0.24626%0.259CS..Hα-helixtrans-72.5-38.4-178.5-67.3-2.7000111.2D287 L293D287-N289 VanDerWaalsContact C-N 3.26Å; D287-N289 PolarHBondContact O-N 2.9Å; D287-N289 PolarHBondContact OD1-N 3.21Å; N289-L293 PolarHBondContact O-N 2.93Å
290F84.3Confident84.2Confident2 Ų246.1 Ų46.11%0.00923%0.233CC..Hα-helixtrans-70.1-40.9176.1-173.5-102.9000111.5F284 L285 D287 L293 C294 V407 A415 I418 L419F284-F290 HydrophobicContact CB-CD1 3.85Å; F284-F290 HydrophobicContact CB-CE1 3.86Å; F284-F290 VanDerWaalsContact O-CD1 3.25Å; F284-F290 WeakPolarHBondContact O-CD1 3.35Å; L285-F290 HydrophobicContact CD2-CE1 4.44Å; D287-F290 HydrophobicContact CB-CB 4.13Å; D287-F290 PolarHBondContact O-N 3.4Å; F290-L293 WeakPolarHBondContact O-CB 3.12Å; F290-L293 PolarHBondContact O-N 2.83Å; F290-C294 VanDerWaalsContact CE1-SG 3.58Å; F290-C294 PolarHBondContact O-N 3.08Å; F290-C294 PolarHBondContact O-SG 3.39Å; F290-C294 VanDerWaalsContact O-SG 3.39Å; F290-V407 HydrophobicContact CD2-CG2 3.83Å; F290-V407 HydrophobicContact CE2-CG2 4.1Å; F290-A415 HydrophobicContact CE2-CB 3.75Å; F290-A415 HydrophobicContact CZ-CB 4.04Å; F290-I418 HydrophobicContact CE1-CB 4.4Å; F290-I418 HydrophobicContact CE1-CD1 4.42Å; F290-I418 HydrophobicContact CE1-CG2 3.98Å; F290-I418 HydrophobicContact CZ-CB 4.17Å; F290-I418 HydrophobicContact CZ-CD1 4.47Å; F290-I418 HydrophobicContact CZ-CG2 4.19Å; F290-L419 HydrophobicContact CE2-CD1 4.03Å; F290-L419 HydrophobicContact CE2-CD2 4.01Å; F290-L419 HydrophobicContact CE2-CG 3.94Å; F290-L419 HydrophobicContact CZ-CD2 4.1Å; F290-L419 HydrophobicContact CZ-CG 3.99Å
291M87.1Confident85.1Confident59 Ų5944.9 Ų44.929%0.29122%0.224SC..Hα-helixtrans-62.8-42.1174.5-78.6-58.6-65.800113.3L285 D287 L293 C294 I295L285-M291 HydrophobicContact CB-SD 3.81Å; L285-M291 HydrophobicContact CD2-SD 3.41Å; L285-M291 WeakPolarHBondContact CD2-SD 3.44Å; L285-M291 HydrophobicContact CG-SD 4.21Å; L285-M291 WeakPolarHBondContact O-CG 3.46Å; D287-M291 PolarHBondContact O-N 3.44Å; M291-L293 PolarHBondContact O-N 3.15Å; M291-C294 WeakPolarHBondContact O-CB 3.24Å; M291-C294 PolarHBondContact O-N 2.94Å; M291-I295 WeakPolarHBondContact O-CG1 3.49Å; M291-I295 PolarHBondContact O-N 3.27Å
292A85.9Confident86.1Confident6 Ų644.9 Ų44.95%0.0522%0.223CC..Hα-helixtrans-58.7-39.8174.300000111.4R288 I295 A296 C465R288-A292 WeakPolarHBondContact O-CB 3.28Å; R288-A292 PolarHBondContact O-N 3.4Å; A292-I295 PolarHBondContact O-N 3.41Å; A292-A296 WeakPolarHBondContact O-CB 3.48Å; A292-A296 PolarHBondContact O-N 3.2Å; A292-C465 HydrophobicContact CB-CB 4.15Å; A292-C465 WeakPolarHBondContact CB-SG 3.38Å
293L87.3Confident87Confident2 Ų242.4 Ų42.41%0.0120%0.203CC..Hα-helixtrans-65.5-42.8174.2-171.769.8000112.3N289 F290 M291 I295 A296 I297 I402 I406 L419 L462N289-L293 PolarHBondContact O-N 2.93Å; F290-L293 WeakPolarHBondContact O-CB 3.12Å; F290-L293 PolarHBondContact O-N 2.83Å; M291-L293 PolarHBondContact O-N 3.15Å; L293-I295 PolarHBondContact O-N 2.69Å; L293-A296 PolarHBondContact O-N 2.85Å; L293-I297 HydrophobicContact CD1-CD1 4.37Å; L293-I297 HydrophobicContact CG-CD1 4.07Å; L293-I297 WeakPolarHBondContact O-CB 3.31Å; L293-I297 WeakPolarHBondContact O-CG1 3.5Å; L293-I297 PolarHBondContact O-N 2.89Å; L293-I402 HydrophobicContact CD1-CG2 4.44Å; L293-I402 HydrophobicContact CD2-CG2 4.48Å; L293-I406 HydrophobicContact CD2-CD1 3.9Å; L293-L419 HydrophobicContact CB-CD2 4.34Å; L293-L419 HydrophobicContact CD2-CD1 3.74Å; L293-L419 HydrophobicContact CD2-CD2 3.9Å; L293-L419 HydrophobicContact CG-CD2 3.91Å; L293-L462 HydrophobicContact CB-CD2 4.42Å; L293-L462 HydrophobicContact CD1-CD1 4.11Å; L293-L462 HydrophobicContact CD1-CD2 3.87Å
294C89.9Confident87.5Confident1 Ų137.3 Ų37.31%0.00718%0.176CC..Hα-helixtrans-58.4-47.2174.3-69.60000112F290 M291 I297 F298 L419 F422F290-C294 VanDerWaalsContact CE1-SG 3.58Å; F290-C294 PolarHBondContact O-N 3.08Å; F290-C294 PolarHBondContact O-SG 3.39Å; F290-C294 VanDerWaalsContact O-SG 3.39Å; M291-C294 WeakPolarHBondContact O-CB 3.24Å; M291-C294 PolarHBondContact O-N 2.94Å; C294-I297 PolarHBondContact O-N 3.29Å; C294-F298 WeakPolarHBondContact O-CB 3.3Å; C294-F298 PolarHBondContact O-N 3.41Å; C294-L419 HydrophobicContact CB-CD2 4.36Å; C294-L419 WeakPolarHBondContact SG-CD2 3.25Å; C294-F422 HydrophobicContact CB-CD2 3.97Å; C294-F422 HydrophobicContact CB-CE2 4.28Å; C294-F422 HydrophobicContact CB-CG 4.33Å
295I91.5Very high88Confident79 Ų7937.6 Ų37.641%0.40518%0.178SC..Hα-helixtrans-62.6-45.6179.4-68.5166.5000110.3M291 A292 L293 F298 L299M291-I295 WeakPolarHBondContact O-CG1 3.49Å; M291-I295 PolarHBondContact O-N 3.27Å; A292-I295 PolarHBondContact O-N 3.41Å; L293-I295 PolarHBondContact O-N 2.69Å; I295-F298 PolarHBondContact O-N 3.21Å; I295-L299 HydrophobicContact CG2-CD1 3.91Å; I295-L299 HydrophobicContact CG2-CG 4.37Å; I295-L299 WeakPolarHBondContact O-CB 3.05Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.39Å
296A91.3Very high88.5Confident0 Ų034.6 Ų34.60%016%0.162CC..Hα-helixtrans-67.4-38.3-179.400000113.1A292 L293 L299 F300 G458 L462A292-A296 WeakPolarHBondContact O-CB 3.48Å; A292-A296 PolarHBondContact O-N 3.2Å; L293-A296 PolarHBondContact O-N 2.85Å; A296-L299 PolarHBondContact O-N 3.13Å; A296-F300 VanDerWaalsContact O-CB 3.22Å; A296-F300 WeakPolarHBondContact O-CB 3.37Å; A296-F300 PolarHBondContact O-N 2.95Å; A296-G458 WeakPolarHBondContact CB-O 3.28Å; A296-L462 HydrophobicContact CB-CB 4.45Å; A296-L462 HydrophobicContact CB-CD1 3.28Å; A296-L462 HydrophobicContact CB-CD2 4.38Å; A296-L462 HydrophobicContact CB-CG 3.41Å; A296-L462 VanDerWaalsContact CB-CG 3.41Å
297I91.6Very high88.7Confident4 Ų426.9 Ų26.92%0.02113%0.126CC..Hα-helixtrans-66-41.3173.6-71.2176000110.9L293 C294 F300 S301 T399 L419L293-I297 HydrophobicContact CD1-CD1 4.37Å; L293-I297 HydrophobicContact CG-CD1 4.07Å; L293-I297 WeakPolarHBondContact O-CB 3.31Å; L293-I297 WeakPolarHBondContact O-CG1 3.5Å; L293-I297 PolarHBondContact O-N 2.89Å; C294-I297 PolarHBondContact O-N 3.29Å; I297-F300 PolarHBondContact O-N 2.83Å; I297-S301 WeakPolarHBondContact O-CB 3.4Å; I297-S301 PolarHBondContact O-N 2.85Å; I297-S301 PolarHBondContact O-OG 2.65Å; I297-T399 HydrophobicContact CD1-CG2 3.59Å; I297-L419 HydrophobicContact CD1-CB 3.87Å; I297-L419 HydrophobicContact CD1-CD1 4.19Å; I297-L419 HydrophobicContact CD1-CD2 3.68Å; I297-L419 HydrophobicContact CD1-CG 4.11Å
298F94.3Very high88.8Confident59 Ų5925.4 Ų25.426%0.25912%0.119SC..Hα-helixtrans-59.3-51.2175172.3-100.2000111.2C294 I295 S301 L302 F422 F425C294-F298 WeakPolarHBondContact O-CB 3.3Å; C294-F298 PolarHBondContact O-N 3.41Å; I295-F298 PolarHBondContact O-N 3.21Å; F298-S301 PolarHBondContact O-N 3.34Å; F298-L302 HydrophobicContact CE1-CD2 4.41Å; F298-L302 WeakPolarHBondContact O-CB 3.23Å; F298-L302 PolarHBondContact O-N 3.4Å; F298-F422 HydrophobicContact CB-CB 4.4Å; F298-F422 WeakPolarHBondContact CD2-O 3.4Å; F298-F425 HydrophobicContact CE2-CB 4.34Å
299L94.4Very high89.2Confident23 Ų2317.2 Ų17.212%0.129%0.089CC..Hα-helixtrans-64.3-40.2179.4-72.7176.6000112.8I295 A296 L302 G303 S454 L457I295-L299 HydrophobicContact CG2-CD1 3.91Å; I295-L299 HydrophobicContact CG2-CG 4.37Å; I295-L299 WeakPolarHBondContact O-CB 3.05Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.39Å; A296-L299 PolarHBondContact O-N 3.13Å; L299-L302 PolarHBondContact O-N 3.26Å; L299-G303 PolarHBondContact O-N 3.47Å; L299-S454 WeakPolarHBondContact CB-O 3.26Å; L299-L457 HydrophobicContact CD1-CB 4.26Å; L299-L457 HydrophobicContact CD1-CD2 3.97Å; L299-L457 HydrophobicContact CD1-CG 3.97Å
300F93.3Very high89.6Confident6 Ų615 Ų153%0.0268%0.077CC..Hα-helixtrans-59.6-49.3172.3174-109.9000111.3A296 I297 L302 G303 A304 L363 T366 N395 W396 V455A296-F300 VanDerWaalsContact O-CB 3.22Å; A296-F300 WeakPolarHBondContact O-CB 3.37Å; A296-F300 PolarHBondContact O-N 2.95Å; I297-F300 PolarHBondContact O-N 2.83Å; F300-L302 VanDerWaalsContact C-N 3.28Å; F300-L302 PolarHBondContact O-N 3.01Å; F300-G303 PolarHBondContact O-N 3.22Å; F300-A304 HydrophobicContact CD2-CB 3.84Å; F300-A304 HydrophobicContact CE1-CB 4.19Å; F300-A304 HydrophobicContact CE2-CB 3.52Å; F300-A304 HydrophobicContact CG-CB 4.36Å; F300-A304 HydrophobicContact CZ-CB 3.7Å; F300-A304 WeakPolarHBondContact O-CB 3.34Å; F300-A304 PolarHBondContact O-N 2.92Å; F300-L363 HydrophobicContact CB-CD2 3.54Å; F300-L363 HydrophobicContact CD2-CD2 3.17Å; F300-L363 HydrophobicContact CE2-CD2 3.97Å; F300-L363 HydrophobicContact CG-CD2 3.49Å; F300-L363 VanDerWaalsContact CG-CD2 3.49Å; F300-T366 HydrophobicContact CE2-CG2 4.19Å; F300-N395 WeakPolarHBondContact CE1-OD1 3.33Å; F300-N395 WeakPolarHBondContact CZ-ND2 3.37Å; F300-N395 VanDerWaalsContact CZ-OD1 3.29Å; F300-N395 WeakPolarHBondContact CZ-OD1 3.46Å; F300-W396 HydrophobicContact CD1-CE3 4.38Å; F300-W396 HydrophobicContact CD1-CZ3 4.01Å; F300-W396 AromaticContact CE1-CE3 3.85Å; F300-W396 HydrophobicContact CE1-CE3 3.85Å; F300-W396 AromaticContact CE1-CZ3 3.83Å; F300-W396 HydrophobicContact CE1-CZ3 3.83Å; F300-V455 HydrophobicContact CD2-CG1 3.93Å; F300-V455 HydrophobicContact CD2-CG2 4.42Å
301S92.6Very high89.5Confident2 Ų215.1 Ų15.11%0.0148%0.077CC..Hα-helixtrans-64.5-34.9-178.5-62.10000112.2I297 F298 G423 G426I297-S301 WeakPolarHBondContact O-CB 3.4Å; I297-S301 PolarHBondContact O-N 2.85Å; I297-S301 PolarHBondContact O-OG 2.65Å; F298-S301 PolarHBondContact O-N 3.34Å; S301-G423 WeakPolarHBondContact CB-O 3.24Å; S301-G423 WeakPolarHBondContact OG-CA 3.41Å; S301-G423 PolarHBondContact OG-O 3.11Å; S301-G426 CarbonylContact O-C 3.2Å
302L94.2Very high89.3Confident19 Ų1913 Ų1310%0.0997%0.067CC..Hα-helixtrans-64-39.7176.2-169.972.4000112.2F298 L299 F300 P306 G426 L429 G430 F450F298-L302 HydrophobicContact CE1-CD2 4.41Å; F298-L302 WeakPolarHBondContact O-CB 3.23Å; F298-L302 PolarHBondContact O-N 3.4Å; L299-L302 PolarHBondContact O-N 3.26Å; F300-L302 VanDerWaalsContact C-N 3.28Å; F300-L302 PolarHBondContact O-N 3.01Å; L302-P306 WeakPolarHBondContact O-CD 3.04Å; L302-P306 VanDerWaalsContact O-CG 3.27Å; L302-P306 WeakPolarHBondContact O-CG 3.42Å; L302-G426 WeakPolarHBondContact CA-O 3.49Å; L302-L429 HydrophobicContact CD1-CB 4.01Å; L302-G430 VanDerWaalsContact O-CA 3.27Å; L302-G430 WeakPolarHBondContact O-CA 3.39Å; L302-F450 HydrophobicContact CD2-CE1 4.28Å; L302-F450 HydrophobicContact CD2-CZ 4.03Å; L302-F450 HydrophobicContact CG-CE1 4.44Å
303G91.9Very high89.2Confident0 Ų013.4 Ų13.40%07%0.068CC..Hα-helixtrans-101.7-24-174.900000116.3L299 F300 P307 L370 S451 S454L299-G303 PolarHBondContact O-N 3.47Å; F300-G303 PolarHBondContact O-N 3.22Å; G303-P307 WeakPolarHBondContact O-CD 3.49Å; G303-L370 WeakPolarHBondContact O-CD1 3.33Å; G303-S451 WeakPolarHBondContact O-CB 3.4Å; G303-S454 WeakPolarHBondContact CA-OG 3.48Å
304A89.2Confident89Confident7 Ų713.7 Ų13.76%0.0587%0.07CC..Hα-helixtrans-83.9-25.9-17500000113.8F300 V455F300-A304 HydrophobicContact CD2-CB 3.84Å; F300-A304 HydrophobicContact CE1-CB 4.19Å; F300-A304 HydrophobicContact CE2-CB 3.52Å; F300-A304 HydrophobicContact CG-CB 4.36Å; F300-A304 HydrophobicContact CZ-CB 3.7Å; F300-A304 WeakPolarHBondContact O-CB 3.34Å; F300-A304 PolarHBondContact O-N 2.92Å; A304-V455 HydrophobicContact CB-CG2 4.49Å
305F88.8Confident88.6Confident24 Ų2413.6 Ų13.611%0.1057%0.069CC..Hα-helixtrans-82.2-38.5-178.4-162.6-102.5000115.1S62 V308 L309 I427 P431S62-F305 WeakPolarHBondContact OG-CZ 3.09Å; F305-V308 WeakPolarHBondContact O-CB 3.4Å; F305-V308 PolarHBondContact O-N 2.85Å; F305-L309 PolarHBondContact O-N 2.97Å; F305-I427 HydrophobicContact CB-CG1 4.07Å; F305-I427 HydrophobicContact CD1-CG2 3.84Å; F305-I427 HydrophobicContact CD2-CG1 4.34Å; F305-I427 HydrophobicContact CD2-CG2 4.2Å; F305-I427 HydrophobicContact CE1-CG2 4.09Å; F305-I427 HydrophobicContact CE2-CG2 4.4Å; F305-I427 HydrophobicContact CG-CG1 4.18Å; F305-I427 HydrophobicContact CG-CG2 3.93Å; F305-I427 HydrophobicContact CZ-CG2 4.37Å; F305-P431 HydrophobicContact CD1-CG 3.48Å; F305-P431 VanDerWaalsContact CD1-CG 3.48Å; F305-P431 HydrophobicContact CE1-CG 4.07Å
306P89.8Confident88Confident0 Ų014.4 Ų14.40%07%0.071CC..Hα-helixtrans-53.5-44.4177.3-18.525.6000114.6L302 V308 L309 F310 P431 V434L302-P306 WeakPolarHBondContact O-CD 3.04Å; L302-P306 VanDerWaalsContact O-CG 3.27Å; L302-P306 WeakPolarHBondContact O-CG 3.42Å; P306-V308 PolarHBondContact O-N 3.12Å; P306-L309 PolarHBondContact O-N 3.45Å; P306-F310 HydrophobicContact CB-CD2 4.01Å; P306-F310 HydrophobicContact CB-CE2 4.12Å; P306-F310 WeakPolarHBondContact O-CD2 3.28Å; P306-F310 PolarHBondContact O-N 3Å; P306-P431 HydrophobicContact CG-CG 4.36Å; P306-V434 HydrophobicContact CB-CB 3.9Å; P306-V434 HydrophobicContact CB-CG1 3.88Å; P306-V434 HydrophobicContact CB-CG2 3.7Å; P306-V434 HydrophobicContact CG-CB 4.34Å; P306-V434 HydrophobicContact CG-CG2 3.72Å
307P83.7Confident87.4Confident1 Ų117.9 Ų17.91%0.00610%0.096CC..Hα-helixtrans-55.6-39175.4-26.434.8000113.3G303 L309 M311 L370 F448G303-P307 WeakPolarHBondContact O-CD 3.49Å; P307-L309 VanDerWaalsContact C-N 3.25Å; P307-L309 PolarHBondContact O-N 2.85Å; P307-M311 WeakPolarHBondContact O-CB 3.49Å; P307-M311 PolarHBondContact O-N 2.83Å; P307-L370 HydrophobicContact CB-CD2 3.75Å; P307-L370 HydrophobicContact CG-CD1 4.02Å; P307-L370 HydrophobicContact CG-CD2 3.3Å; P307-L370 HydrophobicContact CG-CG 4.27Å; P307-F448 HydrophobicContact CB-CE1 3.85Å; P307-F448 HydrophobicContact CG-CD1 4.21Å; P307-F448 HydrophobicContact CG-CE1 3.92Å
308V83Confident86.7Confident21 Ų2122.1 Ų22.113%0.12712%0.115CC..Hα-helixtrans-65.7-31.1179-176.10000111.6F305 P306 V333F305-V308 WeakPolarHBondContact O-CB 3.4Å; F305-V308 PolarHBondContact O-N 2.85Å; P306-V308 PolarHBondContact O-N 3.12Å; V308-V333 HydrophobicContact CG2-CG1 4.22Å
309L89.3Confident85.6Confident1 Ų122 Ų221%0.00513%0.131CC..Hα-helixtrans-82.5-45.3178.3-172.769.1000112.5V36 Y40 A55 F305 P306 P307 P431V36-L309 HydrophobicContact CB-CD1 4.4Å; V36-L309 HydrophobicContact CG1-CD1 3.6Å; V36-L309 HydrophobicContact CG2-CD1 4.13Å; Y40-L309 HydrophobicContact CD2-CD1 4Å; Y40-L309 HydrophobicContact CD2-CD2 4.09Å; Y40-L309 HydrophobicContact CD2-CG 4.03Å; Y40-L309 HydrophobicContact CE2-CD2 4.26Å; Y40-L309 HydrophobicContact CG-CD1 4.07Å; Y40-L309 HydrophobicContact CG-CG 4.13Å; A55-L309 HydrophobicContact CB-CD2 3.83Å; F305-L309 PolarHBondContact O-N 2.97Å; P306-L309 PolarHBondContact O-N 3.45Å; P307-L309 VanDerWaalsContact C-N 3.25Å; P307-L309 PolarHBondContact O-N 2.85Å; L309-P431 HydrophobicContact CD2-CB 3.52Å; L309-P431 HydrophobicContact CD2-CG 4.22Å
310F87.6Confident84.4Confident0 Ų023.4 Ų23.40%014%0.138CC..Hα-helixtrans-92.4-10.6-170-64.6-69.4000114.4Y40 A55 P306 E312 D313 V314 P431 V434 Y444Y40-F310 AromaticContact CE1-CD1 3.82Å; Y40-F310 HydrophobicContact CE1-CD1 3.82Å; Y40-F310 AromaticContact CE1-CE1 3.89Å; Y40-F310 HydrophobicContact CE1-CE1 3.89Å; Y40-F310 HydrophobicContact CE2-CE1 4.28Å; Y40-F310 AromaticContact CZ-CE1 3.58Å; Y40-F310 WeakPolarHBondContact OH-CE1 3.31Å; A55-F310 HydrophobicContact CB-CE1 4.27Å; A55-F310 HydrophobicContact CB-CZ 3.7Å; P306-F310 HydrophobicContact CB-CD2 4.01Å; P306-F310 HydrophobicContact CB-CE2 4.12Å; P306-F310 WeakPolarHBondContact O-CD2 3.28Å; P306-F310 PolarHBondContact O-N 3Å; F310-E312 VanDerWaalsContact C-N 3.3Å; F310-E312 PolarHBondContact O-N 3.23Å; F310-D313 PolarHBondContact O-N 2.87Å; F310-D313 VanDerWaalsContact O-N 3.15Å; F310-V314 HydrophobicContact CB-CG2 4.48Å; F310-V314 WeakPolarHBondContact O-CG2 3.44Å; F310-V314 PolarHBondContact O-N 3.42Å; F310-P431 HydrophobicContact CE2-CB 3.92Å; F310-P431 WeakPolarHBondContact CE2-O 3.28Å; F310-P431 HydrophobicContact CZ-CB 4.31Å; F310-P431 VanDerWaalsContact CZ-O 3.28Å; F310-P431 WeakPolarHBondContact CZ-O 3.42Å; F310-V434 HydrophobicContact CD2-CG1 3.74Å; F310-V434 HydrophobicContact CE2-CB 3.93Å; F310-V434 HydrophobicContact CE2-CG1 3.6Å; F310-V434 HydrophobicContact CZ-CG1 4.5Å; F310-Y444 HydrophobicContact CB-CE1 4.12Å; F310-Y444 AromaticContact CD1-CE1 3.93Å; F310-Y444 HydrophobicContact CD1-CE1 3.93Å; F310-Y444 HydrophobicContact CG-CE1 4.06Å
311M83.4Confident83.1Confident4 Ų426 Ų262%0.0215%0.152CC..Hα-helixtrans-58.8-39.4-173.6-128.3158176.800114P307 A315 L329 I373 L382 S386P307-M311 WeakPolarHBondContact O-CB 3.49Å; P307-M311 PolarHBondContact O-N 2.83Å; M311-A315 WeakPolarHBondContact O-CB 3.49Å; M311-A315 PolarHBondContact O-N 3.33Å; M311-L329 HydrophobicContact CB-CB 4.48Å; M311-L329 HydrophobicContact CB-CD1 4.46Å; M311-L329 HydrophobicContact CG-CD1 4.38Å; M311-I373 HydrophobicContact CE-CD1 3.76Å; M311-I373 HydrophobicContact CE-CG1 4.18Å; M311-L382 HydrophobicContact CE-CD2 4.44Å; M311-S386 WeakPolarHBondContact CE-OG 3.41Å; M311-S386 PolarHBondContact SD-OG 3.47Å
312E83.3Confident81.3Confident15 Ų1532.8 Ų32.87%0.0719%0.188CC..Hα-helixtrans-67.2-45177.8-60.2-66.7175.200110.5P41 F310 V314 A315 Q316 P328 L329 V330P41-E312 HydrophobicContact CG-CB 4.35Å; F310-E312 VanDerWaalsContact C-N 3.3Å; F310-E312 PolarHBondContact O-N 3.23Å; E312-V314 VanDerWaalsContact C-N 3.32Å; E312-V314 PolarHBondContact O-N 2.97Å; E312-A315 PolarHBondContact O-N 3.31Å; E312-Q316 WeakPolarHBondContact O-CG 3.26Å; E312-Q316 PolarHBondContact O-N 2.81Å; E312-P328 VanDerWaalsContact OE1-C 3.31Å; E312-P328 WeakPolarHBondContact OE1-CA 3.27Å; E312-P328 VanDerWaalsContact OE1-CB 3.22Å; E312-P328 WeakPolarHBondContact OE1-CB 3.1Å; E312-L329 WeakPolarHBondContact OE1-CA 3.4Å; E312-L329 PolarHBondContact OE1-N 3.45Å; E312-V330 HydrophobicContact CG-CG2 3.78Å; E312-V330 PolarHBondContact OE1-N 3.42Å
313D82.4Confident79.3Confident13 Ų1341.3 Ų41.37%0.0723%0.227CC..Hα-helixtrans-62.7-38.4177.4-173.982.2000112Y40 P41 K51 F310 Q316 S317 Y444Y40-D313 HydrophobicContact CD1-CB 4.32Å; Y40-D313 HydrophobicContact CE1-CB 4.29Å; P41-D313 HydrophobicContact CG-CB 4.33Å; K51-D313 IonicContact NZ-OD2 2.69Å; K51-D313 PolarHBondContact NZ-OD2 3.41Å; F310-D313 PolarHBondContact O-N 2.87Å; F310-D313 VanDerWaalsContact O-N 3.15Å; D313-Q316 PolarHBondContact O-N 3.13Å; D313-S317 VanDerWaalsContact O-CB 3.26Å; D313-S317 WeakPolarHBondContact O-CB 3.17Å; D313-S317 PolarHBondContact O-N 3.23Å; D313-S317 PolarHBondContact O-OG 3.15Å; D313-Y444 VanDerWaalsContact OD2-CE2 3.28Å; D313-Y444 WeakPolarHBondContact OD2-CE2 3.46Å; D313-Y444 VanDerWaalsContact OD2-CZ 3.25Å; D313-Y444 PolarHBondContact OD2-OH 2.87Å
314V84.5Confident77.2Confident8 Ų847.4 Ų47.45%0.04826%0.264CS..Hα-helixtrans-61.4-51.2173.9171.70000110.3F310 E312 Q316 S317 E318 Y444 F448F310-V314 HydrophobicContact CB-CG2 4.48Å; F310-V314 WeakPolarHBondContact O-CG2 3.44Å; F310-V314 PolarHBondContact O-N 3.42Å; E312-V314 VanDerWaalsContact C-N 3.32Å; E312-V314 PolarHBondContact O-N 2.97Å; V314-Q316 VanDerWaalsContact C-N 3.29Å; V314-Q316 PolarHBondContact O-N 3.11Å; V314-S317 WeakPolarHBondContact CA-OG 3.44Å; V314-S317 PolarHBondContact O-N 3.32Å; V314-S317 PolarHBondContact O-OG 3.28Å; V314-E318 PolarHBondContact O-N 3.1Å; V314-Y444 HydrophobicContact CB-CD2 4.44Å; V314-Y444 HydrophobicContact CG2-CD1 4.09Å; V314-Y444 HydrophobicContact CG2-CD2 3.49Å; V314-Y444 VanDerWaalsContact CG2-CD2 3.49Å; V314-Y444 HydrophobicContact CG2-CE1 4.38Å; V314-Y444 HydrophobicContact CG2-CE2 3.78Å; V314-Y444 HydrophobicContact CG2-CG 3.64Å; V314-F448 HydrophobicContact CG2-CE2 3.61Å; V314-F448 HydrophobicContact CG2-CZ 3.89Å
315A81.4Confident75.4Confident0 Ų055.5 Ų55.50%030%0.298CS..Hα-helixtrans-63-35.2-179.400000112.6M311 E312 L320 I321 L329 Y379 L382M311-A315 WeakPolarHBondContact O-CB 3.49Å; M311-A315 PolarHBondContact O-N 3.33Å; E312-A315 PolarHBondContact O-N 3.31Å; A315-L320 PolarHBondContact O-N 3.48Å; A315-L320 VanDerWaalsContact O-N 3.14Å; A315-I321 HydrophobicContact CB-CD1 3.61Å; A315-I321 HydrophobicContact CB-CG1 4.03Å; A315-L329 HydrophobicContact CB-CD1 3.68Å; A315-Y379 HydrophobicContact CB-CD2 4.45Å; A315-Y379 HydrophobicContact CB-CE2 4.22Å; A315-L382 HydrophobicContact CB-CD1 4.46Å
316Q78.6Confident73.9Confident96 Ų9661.5 Ų61.545%0.44933%0.329SS..Hα-helixtrans-68.3-45.9172.4-72-179.1-5.800111.7E312 D313 V314 E318 G319 I321E312-Q316 WeakPolarHBondContact O-CG 3.26Å; E312-Q316 PolarHBondContact O-N 2.81Å; D313-Q316 PolarHBondContact O-N 3.13Å; V314-Q316 VanDerWaalsContact C-N 3.29Å; V314-Q316 PolarHBondContact O-N 3.11Å; Q316-E318 VanDerWaalsContact C-N 3.3Å; Q316-E318 PolarHBondContact O-N 3.47Å; Q316-G319 PolarHBondContact O-N 3.39Å; Q316-I321 HydrophobicContact CG-CD1 3.69Å
317S77.5Confident73.1Confident73 Ų7365.4 Ų65.451%0.5135%0.35SS..Hα-helixtrans-65.2-30.7-176.971.20000113.7D313 V314 G319D313-S317 VanDerWaalsContact O-CB 3.26Å; D313-S317 WeakPolarHBondContact O-CB 3.17Å; D313-S317 PolarHBondContact O-N 3.23Å; D313-S317 PolarHBondContact O-OG 3.15Å; V314-S317 WeakPolarHBondContact CA-OG 3.44Å; V314-S317 PolarHBondContact O-N 3.32Å; V314-S317 PolarHBondContact O-OG 3.28Å; S317-G319 PolarHBondContact O-N 3.16Å
318E77.8Confident73Confident93 Ų9366.1 Ų66.144%0.43535%0.354SS..THydrogen-bonded Turntrans-81.8-0.7174.7-66.4-160.4159.500113.2V314 Q316 L320V314-E318 PolarHBondContact O-N 3.1Å; Q316-E318 VanDerWaalsContact C-N 3.3Å; Q316-E318 PolarHBondContact O-N 3.47Å; E318-L320 HydrophobicContact CB-CD1 3.92Å; E318-L320 HydrophobicContact CB-CG 3.83Å; E318-L320 PolarHBondContact O-N 3.19Å; E318-L320 VanDerWaalsContact OE2-CD1 3.28Å; E318-L320 WeakPolarHBondContact OE2-CD1 3.31Å
319G70.4Confident73.1Confident57 Ų5765.1 Ų65.159%0.58835%0.348SS*.THydrogen-bonded Turntrans65.124.4-177.600000113.2Q316 S317 I321Q316-G319 PolarHBondContact O-N 3.39Å; S317-G319 PolarHBondContact O-N 3.16Å; G319-I321 PolarHBondContact O-N 3.13Å
320L69.4Low72.9Confident51 Ų5165.2 Ų65.227%0.26735%0.349SS..  trans-81.4-4.6-178-69.3174.3000113.1A315 E318 Y379 L382A315-L320 PolarHBondContact O-N 3.48Å; A315-L320 VanDerWaalsContact O-N 3.14Å; E318-L320 HydrophobicContact CB-CD1 3.92Å; E318-L320 HydrophobicContact CB-CG 3.83Å; E318-L320 PolarHBondContact O-N 3.19Å; E318-L320 VanDerWaalsContact OE2-CD1 3.28Å; E318-L320 WeakPolarHBondContact OE2-CD1 3.31Å; L320-Y379 HydrophobicContact CB-CD2 4.28Å; L320-L382 HydrophobicContact CD1-CD1 3.7Å
321I65.7Low73Confident61 Ų6165.2 Ų65.231%0.31335%0.349SS..  trans-114.6102.4-178.1-53.8171.1000108.4A315 Q316 G319 Y379A315-I321 HydrophobicContact CB-CD1 3.61Å; A315-I321 HydrophobicContact CB-CG1 4.03Å; Q316-I321 HydrophobicContact CG-CD1 3.69Å; G319-I321 PolarHBondContact O-N 3.13Å; I321-Y379 HydrophobicContact CG1-CE2 4.12Å
322D55Low73.3Confident145 Ų14566.5 Ų66.578%0.77536%0.355SS*.  trans-72.8139.4157.8-69.6-44.4000108V324D322-V324 PolarHBondContact O-N 3.07Å
323E52.3Low73.7Confident197 Ų19766.2 Ų66.292%0.92135%0.354SS*.SBendtrans-48.8-0.3-166.8-65.9-178.5156.900118.1
324V48.4Very low74.1Confident128 Ų12865.9 Ų65.978%0.77635%0.354SS*.  trans-142.182.9-178.2-168.90000112.2D322D322-V324 PolarHBondContact O-N 3.07Å
325K52Low74.5Confident177 Ų17769.3 Ų69.377%0.7737%0.371SS*.  trans-141.6144.9154.8-79.2-168.1-177.6163.60113.7I327K325-I327 PolarHBondContact O-N 2.97Å
326I57.2Low75Confident150 Ų15070.7 Ų70.777%0.76938%0.379SS*.SBendtrans-84.5-10.8-144.9-60.4155.6000114.9
327I71.8Confident75.6Confident83 Ų8366.8 Ų66.843%0.42636%0.362SS..  trans-136.5110-172.2-50.8176.8000110.8K325 I332K325-I327 PolarHBondContact O-N 2.97Å; I327-I332 HydrophobicContact CG2-CG1 4.1Å
328P81.1Confident76.2Confident15 Ų1563.6 Ų63.610%0.09734%0.341CS..  trans-58.5145.1173.4-23.132.4000112.1V38 N162 E312 V330 S331 I332V38-P328 HydrophobicContact CG2-CB 4.23Å; N162-P328 WeakPolarHBondContact ND2-CG 3.42Å; E312-P328 VanDerWaalsContact OE1-C 3.31Å; E312-P328 WeakPolarHBondContact OE1-CA 3.27Å; E312-P328 VanDerWaalsContact OE1-CB 3.22Å; E312-P328 WeakPolarHBondContact OE1-CB 3.1Å; P328-V330 PolarHBondContact O-N 2.85Å; P328-S331 WeakPolarHBondContact CD-OG 3.5Å; P328-S331 WeakPolarHBondContact O-CA 3.39Å; P328-S331 WeakPolarHBondContact O-CB 3.32Å; P328-S331 PolarHBondContact O-N 2.88Å; P328-I332 PolarHBondContact O-N 2.66Å
329L85.4Confident76.8Confident0 Ų062.5 Ų62.50%034%0.341CS..Hα-helixtrans-56.4-38.3175.7-74.4155.5000111.5M311 E312 A315 S331 I332 V333 Y379 L382 Q383 S386M311-L329 HydrophobicContact CB-CB 4.48Å; M311-L329 HydrophobicContact CB-CD1 4.46Å; M311-L329 HydrophobicContact CG-CD1 4.38Å; E312-L329 WeakPolarHBondContact OE1-CA 3.4Å; E312-L329 PolarHBondContact OE1-N 3.45Å; A315-L329 HydrophobicContact CB-CD1 3.68Å; L329-S331 PolarHBondContact O-N 2.97Å; L329-I332 WeakPolarHBondContact O-CB 3.03Å; L329-I332 PolarHBondContact O-N 3.33Å; L329-V333 PolarHBondContact O-N 3.48Å; L329-V333 VanDerWaalsContact O-N 3.07Å; L329-Y379 HydrophobicContact CD1-CE2 3.89Å; L329-Y379 HydrophobicContact CD2-CE2 4.43Å; L329-Y379 HydrophobicContact CG-CE2 4.14Å; L329-L382 HydrophobicContact CD2-CB 4.24Å; L329-Q383 HydrophobicContact CD2-CB 4.47Å; L329-Q383 HydrophobicContact CD2-CG 3.88Å; L329-S386 WeakPolarHBondContact CD2-OG 3.48Å
330V86.5Confident77.7Confident3 Ų359.8 Ų59.82%0.01831%0.313CS..Hα-helixtrans-59.9-33.1176.3179.30000111.8Q34 E312 P328 V333 A334Q34-V330 WeakPolarHBondContact O-CG1 3.5Å; E312-V330 HydrophobicContact CG-CG2 3.78Å; E312-V330 PolarHBondContact OE1-N 3.42Å; P328-V330 PolarHBondContact O-N 2.85Å; V330-V333 PolarHBondContact O-N 3.37Å; V330-A334 WeakPolarHBondContact O-CB 3.27Å; V330-A334 PolarHBondContact O-N 3.38Å
331S89.1Confident78.6Confident0 Ų058.7 Ų58.70%031%0.306CS..Hα-helixtrans-65.9-39.9176.1-60.10000111.7A158 P328 L329 A334 I335A158-S331 WeakPolarHBondContact CB-OG 3.39Å; P328-S331 WeakPolarHBondContact CD-OG 3.5Å; P328-S331 WeakPolarHBondContact O-CA 3.39Å; P328-S331 WeakPolarHBondContact O-CB 3.32Å; P328-S331 PolarHBondContact O-N 2.88Å; L329-S331 PolarHBondContact O-N 2.97Å; S331-A334 PolarHBondContact O-N 3.45Å; S331-I335 PolarHBondContact O-N 2.89Å; S331-I335 VanDerWaalsContact O-N 3.12Å
332I90.6Very high79.5Confident31 Ų3159.9 Ų59.916%0.15931%0.312CS..Hα-helixtrans-64.2-48.6176.1-60.1174.6000109.6I327 P328 L329 A334 I335 T336 Q383 A387I327-I332 HydrophobicContact CG2-CG1 4.1Å; P328-I332 PolarHBondContact O-N 2.66Å; L329-I332 WeakPolarHBondContact O-CB 3.03Å; L329-I332 PolarHBondContact O-N 3.33Å; I332-A334 VanDerWaalsContact C-N 3.29Å; I332-A334 PolarHBondContact O-N 3.24Å; I332-I335 PolarHBondContact O-N 3.3Å; I332-T336 HydrophobicContact CG2-CG2 4.41Å; I332-T336 WeakPolarHBondContact O-CG2 3.26Å; I332-T336 PolarHBondContact O-N 3.19Å; I332-T336 PolarHBondContact O-OG1 3.03Å; I332-T336 VanDerWaalsContact O-OG1 3.07Å; I332-Q383 HydrophobicContact CD1-CB 3.93Å; I332-Q383 HydrophobicContact CD1-CG 3.69Å; I332-A387 HydrophobicContact CG2-CB 3.89Å
333V91.2Very high81Confident9 Ų955.1 Ų55.16%0.05529%0.288CS..Hα-helixtrans-56.3-44.8176.3177.30000110.8V308 L329 V330 T336 T337V308-V333 HydrophobicContact CG2-CG1 4.22Å; L329-V333 PolarHBondContact O-N 3.48Å; L329-V333 VanDerWaalsContact O-N 3.07Å; V330-V333 PolarHBondContact O-N 3.37Å; V333-T336 PolarHBondContact O-OG1 3.01Å; V333-T337 WeakPolarHBondContact O-CB 3.47Å; V333-T337 PolarHBondContact O-N 3.18Å; V333-T337 PolarHBondContact O-OG1 3.49Å
334A90.9Very high82.6Confident7 Ų746 Ų466%0.05825%0.246CC..Hα-helixtrans-63.7-46.1-177.300000112.6S151 F155 V330 S331 I332 T337 G338S151-A334 WeakPolarHBondContact CB-O 3.28Å; F155-A334 HydrophobicContact CB-CB 4.36Å; V330-A334 WeakPolarHBondContact O-CB 3.27Å; V330-A334 PolarHBondContact O-N 3.38Å; S331-A334 PolarHBondContact O-N 3.45Å; I332-A334 VanDerWaalsContact C-N 3.29Å; I332-A334 PolarHBondContact O-N 3.24Å; A334-T337 PolarHBondContact O-N 3.16Å; A334-G338 PolarHBondContact O-N 2.82Å
335I91.3Very high84.1Confident79 Ų7941.1 Ų41.141%0.40522%0.222SC..Hα-helixtrans-64.1-50.2177.1-68.9172.1000110.5F155 S331 I332 T337 G338 V339F155-I335 HydrophobicContact CB-CD1 4.46Å; F155-I335 HydrophobicContact CB-CG1 3.96Å; F155-I335 HydrophobicContact CD1-CD1 4.26Å; F155-I335 HydrophobicContact CD2-CD1 3.18Å; F155-I335 HydrophobicContact CD2-CG1 3.58Å; F155-I335 HydrophobicContact CE1-CD1 4.37Å; F155-I335 HydrophobicContact CE2-CD1 3.35Å; F155-I335 HydrophobicContact CE2-CG1 4.26Å; F155-I335 HydrophobicContact CG-CD1 3.71Å; F155-I335 HydrophobicContact CG-CG1 3.75Å; F155-I335 HydrophobicContact CZ-CD1 3.96Å; S331-I335 PolarHBondContact O-N 2.89Å; S331-I335 VanDerWaalsContact O-N 3.12Å; I332-I335 PolarHBondContact O-N 3.3Å; I335-T337 VanDerWaalsContact C-N 3.26Å; I335-T337 PolarHBondContact O-N 3.35Å; I335-G338 WeakPolarHBondContact O-CA 3.21Å; I335-G338 PolarHBondContact O-N 2.83Å; I335-V339 HydrophobicContact CG2-CG2 4.45Å; I335-V339 WeakPolarHBondContact O-CG2 3.25Å; I335-V339 PolarHBondContact O-N 3.25Å
336T93Very high85.5Confident29 Ų2939.5 Ų39.518%0.17822%0.218CC..Hα-helixtrans-67.3-30.6-177.160.30000111.7I332 V333 V339 G340 A387 G390 F391I332-T336 HydrophobicContact CG2-CG2 4.41Å; I332-T336 WeakPolarHBondContact O-CG2 3.26Å; I332-T336 PolarHBondContact O-N 3.19Å; I332-T336 PolarHBondContact O-OG1 3.03Å; I332-T336 VanDerWaalsContact O-OG1 3.07Å; V333-T336 PolarHBondContact O-OG1 3.01Å; T336-V339 PolarHBondContact O-N 3.4Å; T336-G340 PolarHBondContact O-N 2.8Å; T336-A387 WeakPolarHBondContact CB-O 3.35Å; T336-A387 HydrophobicContact CG2-CB 3.85Å; T336-A387 PolarHBondContact OG1-O 3.03Å; T336-A387 VanDerWaalsContact OG1-O 3.05Å; T336-G390 WeakPolarHBondContact OG1-CA 3.19Å; T336-F391 WeakPolarHBondContact O-CA 3.23Å; T336-F391 PolarHBondContact OG1-N 3.44Å
337T91.6Very high86.9Confident14 Ų1435.4 Ų35.49%0.08620%0.198CC..Hα-helixtrans-62.7-43.7168.4-57.50000111.4V333 A334 I335 V339 G340 K341 G390V333-T337 WeakPolarHBondContact O-CB 3.47Å; V333-T337 PolarHBondContact O-N 3.18Å; V333-T337 PolarHBondContact O-OG1 3.49Å; A334-T337 PolarHBondContact O-N 3.16Å; I335-T337 VanDerWaalsContact C-N 3.26Å; I335-T337 PolarHBondContact O-N 3.35Å; T337-V339 PolarHBondContact O-N 3.16Å; T337-G340 PolarHBondContact O-N 3.27Å; T337-K341 HydrophobicContact CG2-CD 4.35Å; T337-K341 HydrophobicContact CG2-CG 4.37Å; T337-K341 WeakPolarHBondContact O-CB 3.5Å; T337-K341 VanDerWaalsContact O-CG 3.24Å; T337-K341 WeakPolarHBondContact O-CG 3.47Å; T337-K341 PolarHBondContact O-N 3.04Å; T337-G390 WeakPolarHBondContact CA-O 3.4Å; T337-G390 PolarHBondContact N-O 3.48Å; T337-G390 WeakPolarHBondContact OG1-CA 3.49Å; T337-G390 PolarHBondContact OG1-O 3.04Å; T337-G390 VanDerWaalsContact OG1-O 3.12Å
338G88.8Confident87.2Confident7 Ų731.6 Ų31.67%0.07218%0.179CC..Hα-helixtrans-58.4-47.3174.300000112.2S151 A334 I335 K341 L342S151-G338 PolarHBondContact OG-N 3.44Å; A334-G338 PolarHBondContact O-N 2.82Å; I335-G338 WeakPolarHBondContact O-CA 3.21Å; I335-G338 PolarHBondContact O-N 2.83Å; G338-K341 PolarHBondContact O-N 3.4Å; G338-L342 WeakPolarHBondContact O-CG 3.25Å; G338-L342 PolarHBondContact O-N 2.79Å
339V90.9Very high87.1Confident70 Ų7036.5 Ų36.542%0.42420%0.204SC..Hα-helixtrans-61.5-47175.2176.60000110.7I335 T336 T337 K341 L342 T343 F391I335-V339 HydrophobicContact CG2-CG2 4.45Å; I335-V339 WeakPolarHBondContact O-CG2 3.25Å; I335-V339 PolarHBondContact O-N 3.25Å; T336-V339 PolarHBondContact O-N 3.4Å; T337-V339 PolarHBondContact O-N 3.16Å; V339-K341 PolarHBondContact O-N 3.46Å; V339-L342 PolarHBondContact O-N 3.36Å; V339-T343 HydrophobicContact CG1-CG2 3.98Å; V339-T343 WeakPolarHBondContact O-CG2 3.17Å; V339-T343 PolarHBondContact O-N 3.35Å; V339-T343 PolarHBondContact O-OG1 3.34Å; V339-T343 VanDerWaalsContact O-OG1 3.05Å; V339-F391 HydrophobicContact CG1-CD2 4.42Å; V339-F391 HydrophobicContact CG1-CE2 4.35Å
340G90.3Very high87Confident0 Ų040.3 Ų40.30%022%0.224CC..Hα-helixtrans-59.6-42.9178.800000113T336 T337 L342 T343 L344 F391T336-G340 PolarHBondContact O-N 2.8Å; T337-G340 PolarHBondContact O-N 3.27Å; G340-L342 VanDerWaalsContact C-N 3.3Å; G340-L342 PolarHBondContact O-N 3.08Å; G340-T343 WeakPolarHBondContact CA-OG1 3.3Å; G340-T343 PolarHBondContact O-OG1 3.07Å; G340-L344 WeakPolarHBondContact O-CB 3.04Å; G340-L344 VanDerWaalsContact O-CG 3.22Å; G340-L344 WeakPolarHBondContact O-CG 3.27Å; G340-L344 PolarHBondContact O-N 3.06Å; G340-F391 WeakPolarHBondContact CA-O 3.19Å
341K86.8Confident86.5Confident28 Ų2852 Ų5212%0.12227%0.267CS..Hα-helixtrans-57.4-44.4175.6-75.2175.2178163.90111.3T150 S151 T337 G338 V339 G345 S397T150-K341 PolarHBondContact OG1-NZ 3.22Å; T150-K341 VanDerWaalsContact OG1-NZ 3.11Å; S151-K341 PolarHBondContact OG-NZ 2.96Å; T337-K341 HydrophobicContact CG2-CD 4.35Å; T337-K341 HydrophobicContact CG2-CG 4.37Å; T337-K341 WeakPolarHBondContact O-CB 3.5Å; T337-K341 VanDerWaalsContact O-CG 3.24Å; T337-K341 WeakPolarHBondContact O-CG 3.47Å; T337-K341 PolarHBondContact O-N 3.04Å; G338-K341 PolarHBondContact O-N 3.4Å; V339-K341 PolarHBondContact O-N 3.46Å; K341-G345 PolarHBondContact O-N 3.36Å; K341-G345 VanDerWaalsContact O-N 3.15Å; K341-S397 VanDerWaalsContact CB-OG 3.32Å; K341-S397 WeakPolarHBondContact CB-OG 3.42Å; K341-S397 VanDerWaalsContact CG-OG 3.29Å; K341-S397 WeakPolarHBondContact CG-OG 3.45Å
342L84.5Confident86.3Confident86 Ų8663.7 Ų63.745%0.4531%0.312SS..Hα-helixtrans-72-50.6-179.9-66.4171.8000111.8G338 V339 G340 G345 M346G338-L342 WeakPolarHBondContact O-CG 3.25Å; G338-L342 PolarHBondContact O-N 2.79Å; V339-L342 PolarHBondContact O-N 3.36Å; G340-L342 VanDerWaalsContact C-N 3.3Å; G340-L342 PolarHBondContact O-N 3.08Å; L342-G345 PolarHBondContact O-N 3.4Å; L342-M346 WeakPolarHBondContact O-CG 3.17Å; L342-M346 PolarHBondContact O-N 2.98Å
343T87.1Confident85.9Confident44 Ų4464.8 Ų64.827%0.2732%0.318SS..Hα-helixtrans-65-51.1-177.456.20000111.2V339 G340 G345 M346 L347 F391V339-T343 HydrophobicContact CG1-CG2 3.98Å; V339-T343 WeakPolarHBondContact O-CG2 3.17Å; V339-T343 PolarHBondContact O-N 3.35Å; V339-T343 PolarHBondContact O-OG1 3.34Å; V339-T343 VanDerWaalsContact O-OG1 3.05Å; G340-T343 WeakPolarHBondContact CA-OG1 3.3Å; G340-T343 PolarHBondContact O-OG1 3.07Å; T343-G345 VanDerWaalsContact C-N 3.26Å; T343-G345 PolarHBondContact O-N 3.05Å; T343-M346 PolarHBondContact O-N 3.01Å; T343-M346 VanDerWaalsContact O-N 3.11Å; T343-L347 WeakPolarHBondContact O-CD1 3.46Å; T343-L347 PolarHBondContact O-N 3.25Å; T343-F391 HydrophobicContact CG2-CE2 4.34Å; T343-F391 VanDerWaalsContact OG1-CE2 3.24Å; T343-F391 WeakPolarHBondContact OG1-CE2 3.18Å; T343-F391 WeakPolarHBondContact OG1-CZ 3.32Å
344L86.4Confident85.7Confident6 Ų668.4 Ų68.43%0.03134%0.336CS..Hα-helixtrans-62.8-36.1178.7-64.7172000111.3G340 L347 A348 L358 T362 L398G340-L344 WeakPolarHBondContact O-CB 3.04Å; G340-L344 VanDerWaalsContact O-CG 3.22Å; G340-L344 WeakPolarHBondContact O-CG 3.27Å; G340-L344 PolarHBondContact O-N 3.06Å; L344-L347 PolarHBondContact O-N 3.27Å; L344-A348 PolarHBondContact O-N 2.97Å; L344-L358 HydrophobicContact CD2-CD1 4.27Å; L344-T362 HydrophobicContact CD1-CG2 3.71Å; L344-T362 HydrophobicContact CD2-CG2 3.8Å; L344-T362 HydrophobicContact CG-CG2 4.42Å; L344-L398 HydrophobicContact CB-CD1 4.1Å; L344-L398 HydrophobicContact CB-CD2 4.43Å; L344-L398 HydrophobicContact CB-CG 4.22Å; L344-L398 WeakPolarHBondContact O-CD2 3.45Å
345G80.1Confident85.3Confident26 Ų2668 Ų6827%0.26833%0.334SS..Hα-helixtrans-58.4-47.5171.600000112.6K341 L342 T343 A348K341-G345 PolarHBondContact O-N 3.36Å; K341-G345 VanDerWaalsContact O-N 3.15Å; L342-G345 PolarHBondContact O-N 3.4Å; T343-G345 VanDerWaalsContact C-N 3.26Å; T343-G345 PolarHBondContact O-N 3.05Å; G345-A348 WeakPolarHBondContact O-CB 3.36Å; G345-A348 PolarHBondContact O-N 3.39Å
346M82.1Confident84.9Confident142 Ų14266 Ų6670%0.733%0.325SS*.Hα-helixtrans-66.1-39.3175.9-66.4174.8104.300112.4L342 T343 A348 D349L342-M346 WeakPolarHBondContact O-CG 3.17Å; L342-M346 PolarHBondContact O-N 2.98Å; T343-M346 PolarHBondContact O-N 3.01Å; T343-M346 VanDerWaalsContact O-N 3.11Å; M346-A348 VanDerWaalsContact C-N 3.26Å; M346-A348 PolarHBondContact O-N 2.82Å; M346-D349 PolarHBondContact O-N 3.47Å
347L84.9Confident84.7Confident65 Ų6567.7 Ų67.734%0.3433%0.33SS..Hα-helixtrans-63.2-33.2176.1-90.581.6000111.9T343 L344 D349 I350 I353 L358T343-L347 WeakPolarHBondContact O-CD1 3.46Å; T343-L347 PolarHBondContact O-N 3.25Å; L344-L347 PolarHBondContact O-N 3.27Å; L347-D349 PolarHBondContact O-N 2.69Å; L347-I350 PolarHBondContact O-N 3.17Å; L347-I353 HydrophobicContact CB-CD1 4.21Å; L347-I353 HydrophobicContact CD2-CD1 4.19Å; L347-I353 HydrophobicContact CG-CD1 4.18Å; L347-L358 HydrophobicContact CB-CD2 3.95Å; L347-L358 HydrophobicContact CD2-CD1 4.18Å
348A78.1Confident84.6Confident3 Ų367.9 Ų67.93%0.02533%0.33CS..Hα-helixtrans-64.1-27.8179.200000113.7L344 G345 M346 L398 Y401L344-A348 PolarHBondContact O-N 2.97Å; G345-A348 WeakPolarHBondContact O-CB 3.36Å; G345-A348 PolarHBondContact O-N 3.39Å; M346-A348 VanDerWaalsContact C-N 3.26Å; M346-A348 PolarHBondContact O-N 2.82Å; A348-L398 HydrophobicContact CB-CD2 3.45Å; A348-L398 VanDerWaalsContact CB-CD2 3.45Å; A348-Y401 HydrophobicContact CB-CD1 4.4Å; A348-Y401 HydrophobicContact CB-CE1 4.44Å; A348-Y401 PolarHBondContact O-OH 3.43Å
349D79.3Confident84.6Confident117 Ų11767.6 Ų67.663%0.62633%0.327SS*.THydrogen-bonded Turntrans-84.3-10.1-178.9-72.9-25.6000113M346 L347 R351M346-D349 PolarHBondContact O-N 3.47Å; L347-D349 PolarHBondContact O-N 2.69Å; D349-R351 PolarHBondContact O-N 3.38Å
350I83.6Confident84.6Confident81 Ų8164.2 Ų64.242%0.41531%0.307SS..  trans-72.4122.4177.6-60.8177.3000109.5L347 W352 I353L347-I350 PolarHBondContact O-N 3.17Å; I350-W352 HydrophobicContact CG2-CB 4.32Å; I350-W352 PolarHBondContact O-N 2.9Å; I350-I353 HydrophobicContact CB-CD1 4.1Å; I350-I353 HydrophobicContact CB-CG1 4.18Å; I350-I353 HydrophobicContact CD1-CD1 4.05Å; I350-I353 HydrophobicContact CG2-CD1 4.32Å; I350-I353 HydrophobicContact CG2-CG1 4.14Å; I350-I353 PolarHBondContact O-N 3.38Å
351R76.5Confident84.7Confident247 Ų24770.2 Ų70.293%0.93233%0.333SS*.THydrogen-bonded Turntrans-56.7-24.2-175.6-66-179.7-180173.5-0.3115.2D349D349-R351 PolarHBondContact O-N 3.38Å
352W83.9Confident84.9Confident247 Ų24768.9 Ų68.994%0.93633%0.327SS*.THydrogen-bonded Turntrans-89.2-14.4-175.7-64.757.3000112.4I350I350-W352 HydrophobicContact CG2-CB 4.32Å; I350-W352 PolarHBondContact O-N 2.9Å
353I83.9Confident85.4Confident54 Ų5464.8 Ų64.828%0.27731%0.305SS..SBendtrans-97.7120.8-176.7-61.5-178.1000108.9L347 I350 S355 L358L347-I353 HydrophobicContact CB-CD1 4.21Å; L347-I353 HydrophobicContact CD2-CD1 4.19Å; L347-I353 HydrophobicContact CG-CD1 4.18Å; I350-I353 HydrophobicContact CB-CD1 4.1Å; I350-I353 HydrophobicContact CB-CG1 4.18Å; I350-I353 HydrophobicContact CD1-CD1 4.05Å; I350-I353 HydrophobicContact CG2-CD1 4.32Å; I350-I353 HydrophobicContact CG2-CG1 4.14Å; I350-I353 PolarHBondContact O-N 3.38Å; I353-S355 PolarHBondContact O-N 3.44Å; I353-L358 HydrophobicContact CG2-CB 3.96Å; I353-L358 HydrophobicContact CG2-CD1 4.41Å; I353-L358 HydrophobicContact CG2-CD2 4.15Å; I353-L358 HydrophobicContact CG2-CG 4.4Å
354N86Confident85.7Confident84 Ų8465.1 Ų65.145%0.44931%0.306SS..  trans-76.1114168.8-176.7-27.7000109.3V356 F357 L358N354-V356 PolarHBondContact O-N 2.83Å; N354-V356 PolarHBondContact OD1-N 3.41Å; N354-F357 HydrophobicContact CB-CB 4.39Å; N354-F357 HydrophobicContact CB-CD2 3.74Å; N354-F357 WeakPolarHBondContact ND2-CD2 3.46Å; N354-F357 PolarHBondContact O-N 2.96Å; N354-F357 VanDerWaalsContact O-N 3.14Å; N354-L358 PolarHBondContact O-N 2.94Å
355S82.3Confident86.1Confident0 Ų065.3 Ų65.30%031%0.309CS..Hα-helixtrans-62.9-26.7-173.9-35.70000113.5I353 Y359 Y401 I402 K405I353-S355 PolarHBondContact O-N 3.44Å; S355-Y359 PolarHBondContact O-N 3.47Å; S355-Y359 VanDerWaalsContact O-N 3.08Å; S355-Y401 WeakPolarHBondContact OG-CE1 3.42Å; S355-I402 WeakPolarHBondContact O-CD1 3.1Å; S355-K405 PolarHBondContact OG-NZ 3.44Å
356V83.6Confident86.7Confident37 Ų3764 Ų6422%0.22430%0.296CS..Hα-helixtrans-72.2-44.2175.6-176.50000110.5N354 L358 Y359 A360 I402 A466N354-V356 PolarHBondContact O-N 2.83Å; N354-V356 PolarHBondContact OD1-N 3.41Å; V356-L358 VanDerWaalsContact C-N 3.34Å; V356-Y359 PolarHBondContact O-N 3.38Å; V356-A360 PolarHBondContact O-N 2.91Å; V356-I402 HydrophobicContact CG2-CG2 4.33Å; V356-A466 HydrophobicContact CB-CB 4.5Å; V356-A466 HydrophobicContact CG1-CB 3.71Å
357F87.9Confident87.3Confident64 Ų6457.3 Ų57.328%0.28126%0.262SS..Hα-helixtrans-66.2-36.8174.5-75.2-69.2000111.9N354 Y359 A360 F361 F463 A466N354-F357 HydrophobicContact CB-CB 4.39Å; N354-F357 HydrophobicContact CB-CD2 3.74Å; N354-F357 WeakPolarHBondContact ND2-CD2 3.46Å; N354-F357 PolarHBondContact O-N 2.96Å; N354-F357 VanDerWaalsContact O-N 3.14Å; F357-Y359 VanDerWaalsContact C-N 3.32Å; F357-Y359 PolarHBondContact O-N 2.79Å; F357-A360 PolarHBondContact O-N 3.14Å; F357-F361 WeakPolarHBondContact O-CB 3.44Å; F357-F361 PolarHBondContact O-N 3.49Å; F357-F463 AromaticContact CD1-CD2 3.76Å; F357-F463 HydrophobicContact CD1-CD2 3.76Å; F357-F463 AromaticContact CD1-CE2 3.61Å; F357-F463 HydrophobicContact CD1-CE2 3.61Å; F357-F463 AromaticContact CE1-CD2 3.88Å; F357-F463 HydrophobicContact CE1-CD2 3.88Å; F357-F463 AromaticContact CE1-CE2 3.62Å; F357-F463 HydrophobicContact CE1-CE2 3.62Å; F357-F463 HydrophobicContact CE1-CZ 4.2Å; F357-A466 HydrophobicContact CD1-CB 4.34Å; F357-A466 HydrophobicContact CE1-CB 3.87Å; F357-A466 HydrophobicContact CE2-CB 4.22Å; F357-A466 HydrophobicContact CZ-CB 3.79Å; F357-A466 WeakPolarHBondContact CZ-O 3.16Å
358L89.6Confident87.8Confident17 Ų1757.6 Ų57.69%0.08927%0.267CS..Hα-helixtrans-58.5-44.5172.5-177.666.5000111.2L344 L347 I353 N354 V356 F361 T362 L398L344-L358 HydrophobicContact CD2-CD1 4.27Å; L347-L358 HydrophobicContact CB-CD2 3.95Å; L347-L358 HydrophobicContact CD2-CD1 4.18Å; I353-L358 HydrophobicContact CG2-CB 3.96Å; I353-L358 HydrophobicContact CG2-CD1 4.41Å; I353-L358 HydrophobicContact CG2-CD2 4.15Å; I353-L358 HydrophobicContact CG2-CG 4.4Å; N354-L358 PolarHBondContact O-N 2.94Å; V356-L358 VanDerWaalsContact C-N 3.34Å; L358-F361 WeakPolarHBondContact O-CB 3.19Å; L358-F361 PolarHBondContact O-N 3.39Å; L358-T362 WeakPolarHBondContact O-CG2 3.03Å; L358-T362 PolarHBondContact O-N 2.89Å; L358-L398 HydrophobicContact CD2-CD1 4.1Å; L358-L398 HydrophobicContact CD2-CD2 4.07Å; L358-L398 HydrophobicContact CG-CD1 4.16Å
359Y88.8Confident88.5Confident1 Ų157.6 Ų57.60%0.00427%0.267CS..Hα-helixtrans-66.7-45.2177.4-166.9-91.5000112.5S355 V356 F357 F361 T362 L363 N395 L398 T399 I402 L462S355-Y359 PolarHBondContact O-N 3.47Å; S355-Y359 VanDerWaalsContact O-N 3.08Å; V356-Y359 PolarHBondContact O-N 3.38Å; F357-Y359 VanDerWaalsContact C-N 3.32Å; F357-Y359 PolarHBondContact O-N 2.79Å; Y359-F361 VanDerWaalsContact C-N 3.26Å; Y359-F361 PolarHBondContact O-N 3.44Å; Y359-T362 PolarHBondContact O-N 3.33Å; Y359-T362 VanDerWaalsContact O-N 3.13Å; Y359-T362 PolarHBondContact O-OG1 3.06Å; Y359-L363 HydrophobicContact CD1-CD1 3.69Å; Y359-L363 HydrophobicContact CD1-CG 4.24Å; Y359-L363 HydrophobicContact CE1-CD1 3.61Å; Y359-L363 HydrophobicContact CE1-CD2 4.48Å; Y359-L363 HydrophobicContact CE1-CG 4.14Å; Y359-L363 PolarHBondContact O-N 3.45Å; Y359-N395 HydrophobicContact CD2-CB 4.06Å; Y359-N395 HydrophobicContact CE2-CB 3.86Å; Y359-N395 WeakPolarHBondContact CE2-O 3.09Å; Y359-L398 HydrophobicContact CD2-CB 3.73Å; Y359-L398 HydrophobicContact CD2-CD1 4.12Å; Y359-L398 HydrophobicContact CE2-CB 4.27Å; Y359-T399 WeakPolarHBondContact CE2-OG1 3.34Å; Y359-T399 PolarHBondContact OH-OG1 3.2Å; Y359-I402 HydrophobicContact CD2-CD1 3.62Å; Y359-I402 HydrophobicContact CG-CD1 3.6Å; Y359-L462 HydrophobicContact CD1-CD1 3.56Å; Y359-L462 HydrophobicContact CE1-CD1 3.63Å
360A90.7Very high89.2Confident0 Ų052 Ų520%024%0.238CC..Hα-helixtrans-57.5-41.1173.900000111.7V356 F357 T362 L363 L364 L462 F463V356-A360 PolarHBondContact O-N 2.91Å; F357-A360 PolarHBondContact O-N 3.14Å; A360-T362 PolarHBondContact O-N 3.07Å; A360-L363 WeakPolarHBondContact O-CB 3.37Å; A360-L363 PolarHBondContact O-N 2.61Å; A360-L364 WeakPolarHBondContact O-CG 3.39Å; A360-L364 PolarHBondContact O-N 3.19Å; A360-L462 HydrophobicContact CB-CB 4.49Å; A360-F463 HydrophobicContact CB-CB 4.16Å; A360-F463 HydrophobicContact CB-CD2 4.32Å
361F92.1Very high89.6Confident125 Ų12550.7 Ų50.755%0.54823%0.231SC..Hα-helixtrans-61.1-43.6174.9177-102.6000112.4F357 L358 Y359 L363 L364 G365 F392F357-F361 WeakPolarHBondContact O-CB 3.44Å; F357-F361 PolarHBondContact O-N 3.49Å; L358-F361 WeakPolarHBondContact O-CB 3.19Å; L358-F361 PolarHBondContact O-N 3.39Å; Y359-F361 VanDerWaalsContact C-N 3.26Å; Y359-F361 PolarHBondContact O-N 3.44Å; F361-L363 VanDerWaalsContact C-N 3.3Å; F361-L363 PolarHBondContact O-N 2.88Å; F361-L364 PolarHBondContact O-N 2.7Å; F361-G365 PolarHBondContact O-N 3.38Å; F361-F392 HydrophobicContact CD1-CE1 4.21Å; F361-F392 AromaticContact CE1-CE1 3.73Å; F361-F392 HydrophobicContact CE1-CE1 3.73Å; F361-F392 HydrophobicContact CE1-CZ 4.14Å; F361-F392 HydrophobicContact CZ-CE1 4.49Å; F361-F392 HydrophobicContact CZ-CZ 4.48Å
362T92.5Very high90.4Very high0 Ų043.3 Ų43.30%021%0.209CC..Hα-helixtrans-62.7-36.9176.564.60000112.4L344 L358 Y359 A360 G365 T366 F392 N395 L398L344-T362 HydrophobicContact CD1-CG2 3.71Å; L344-T362 HydrophobicContact CD2-CG2 3.8Å; L344-T362 HydrophobicContact CG-CG2 4.42Å; L358-T362 WeakPolarHBondContact O-CG2 3.03Å; L358-T362 PolarHBondContact O-N 2.89Å; Y359-T362 PolarHBondContact O-N 3.33Å; Y359-T362 VanDerWaalsContact O-N 3.13Å; Y359-T362 PolarHBondContact O-OG1 3.06Å; A360-T362 PolarHBondContact O-N 3.07Å; T362-G365 PolarHBondContact O-N 2.64Å; T362-T366 WeakPolarHBondContact O-CB 3.47Å; T362-T366 PolarHBondContact O-N 3.37Å; T362-T366 PolarHBondContact O-OG1 3.47Å; T362-F392 HydrophobicContact CG2-CD1 4.08Å; T362-N395 HydrophobicContact CG2-CB 4.31Å; T362-N395 VanDerWaalsContact OG1-CB 3.29Å; T362-N395 WeakPolarHBondContact OG1-CB 3.33Å; T362-N395 PolarHBondContact OG1-ND2 3.08Å; T362-L398 HydrophobicContact CG2-CD1 4.42Å
363L93.3Very high90.7Very high0 Ų031.8 Ų31.80%017%0.166CC..Hα-helixtrans-66.2-46.9175.5-70.3168.3000111.4F300 Y359 A360 F361 G365 T366 G367 V455 L462F300-L363 HydrophobicContact CB-CD2 3.54Å; F300-L363 HydrophobicContact CD2-CD2 3.17Å; F300-L363 HydrophobicContact CE2-CD2 3.97Å; F300-L363 HydrophobicContact CG-CD2 3.49Å; F300-L363 VanDerWaalsContact CG-CD2 3.49Å; Y359-L363 HydrophobicContact CD1-CD1 3.69Å; Y359-L363 HydrophobicContact CD1-CG 4.24Å; Y359-L363 HydrophobicContact CE1-CD1 3.61Å; Y359-L363 HydrophobicContact CE1-CD2 4.48Å; Y359-L363 HydrophobicContact CE1-CG 4.14Å; Y359-L363 PolarHBondContact O-N 3.45Å; A360-L363 WeakPolarHBondContact O-CB 3.37Å; A360-L363 PolarHBondContact O-N 2.61Å; F361-L363 VanDerWaalsContact C-N 3.3Å; F361-L363 PolarHBondContact O-N 2.88Å; L363-G365 VanDerWaalsContact C-N 3.33Å; L363-G365 PolarHBondContact O-N 3.41Å; L363-T366 PolarHBondContact O-N 3Å; L363-G367 PolarHBondContact O-N 3.28Å; L363-V455 HydrophobicContact CD2-CG1 4.24Å; L363-V455 VanDerWaalsContact O-CG1 3.32Å; L363-V455 WeakPolarHBondContact O-CG1 3.18Å; L363-L462 HydrophobicContact CD1-CD1 3.62Å
364L94.3Very high90.8Very high52 Ų5230.2 Ų30.227%0.27216%0.159SC..Hα-helixtrans-62-42.1177-66.4174.8000111.5A360 F361 G367 T368 L456 V460A360-L364 WeakPolarHBondContact O-CG 3.39Å; A360-L364 PolarHBondContact O-N 3.19Å; F361-L364 PolarHBondContact O-N 2.7Å; L364-G367 PolarHBondContact O-N 3.07Å; L364-T368 WeakPolarHBondContact O-CB 3.35Å; L364-T368 WeakPolarHBondContact O-CG2 3.33Å; L364-T368 PolarHBondContact O-N 3.45Å; L364-T368 PolarHBondContact O-OG1 3.5Å; L364-L456 HydrophobicContact CD2-CD2 3.81Å; L364-V460 HydrophobicContact CD2-CG2 4.03Å
365G94.1Very high90.9Very high9 Ų931.5 Ų31.59%0.09317%0.165CC..Hα-helixtrans-61.4-44174.700000112.9F361 T362 L363 T368 A369F361-G365 PolarHBondContact O-N 3.38Å; T362-G365 PolarHBondContact O-N 2.64Å; L363-G365 VanDerWaalsContact C-N 3.33Å; L363-G365 PolarHBondContact O-N 3.41Å; G365-T368 PolarHBondContact O-OG1 2.9Å; G365-A369 WeakPolarHBondContact O-CB 3.37Å; G365-A369 PolarHBondContact O-N 3.32Å; G365-A369 VanDerWaalsContact O-N 3.09Å
366T94.2Very high91Very high0 Ų032.6 Ų32.60%017%0.173CC..Hα-helixtrans-64.1-51.5175.9-51.10000110.6F300 T362 L363 T368 A369 L370 V389 F392 V455F300-T366 HydrophobicContact CE2-CG2 4.19Å; T362-T366 WeakPolarHBondContact O-CB 3.47Å; T362-T366 PolarHBondContact O-N 3.37Å; T362-T366 PolarHBondContact O-OG1 3.47Å; L363-T366 PolarHBondContact O-N 3Å; T366-T368 PolarHBondContact O-N 2.92Å; T366-A369 PolarHBondContact O-N 2.94Å; T366-L370 HydrophobicContact CG2-CD1 4.33Å; T366-L370 HydrophobicContact CG2-CG 4.45Å; T366-L370 WeakPolarHBondContact O-CG 3.4Å; T366-L370 PolarHBondContact O-N 3.08Å; T366-V389 HydrophobicContact CG2-CG1 4.29Å; T366-F392 WeakPolarHBondContact OG1-CB 3.5Å; T366-V455 HydrophobicContact CG2-CG1 4.38Å
367G94.2Very high90.8Very high0 Ų039.4 Ų39.40%020%0.199CC..Hα-helixtrans-62-40.7-177.200000113.2L363 L364 L370 L371L363-G367 PolarHBondContact O-N 3.28Å; L364-G367 PolarHBondContact O-N 3.07Å; G367-L370 PolarHBondContact O-N 3.39Å; G367-L371 WeakPolarHBondContact O-CG 3.44Å; G367-L371 PolarHBondContact O-N 3.37Å; G367-L371 VanDerWaalsContact O-N 3.13Å
368T94.4Very high90.6Very high71 Ų7139.3 Ų39.344%0.43621%0.206SC..Hα-helixtrans-64.7-43.6174490000112.3L364 G365 T366 L370 L371 L372 L456L364-T368 WeakPolarHBondContact O-CB 3.35Å; L364-T368 WeakPolarHBondContact O-CG2 3.33Å; L364-T368 PolarHBondContact O-N 3.45Å; L364-T368 PolarHBondContact O-OG1 3.5Å; G365-T368 PolarHBondContact O-OG1 2.9Å; T366-T368 PolarHBondContact O-N 2.92Å; T368-L370 VanDerWaalsContact C-N 3.28Å; T368-L370 PolarHBondContact O-N 2.96Å; T368-L371 PolarHBondContact O-N 3.19Å; T368-L372 WeakPolarHBondContact O-CG 3.35Å; T368-L372 PolarHBondContact O-N 3.19Å; T368-L456 HydrophobicContact CG2-CD2 4.07Å
369A94Very high90.3Very high4 Ų440.2 Ų40.23%0.03321%0.209CC..Hα-helixtrans-60-39.6175.700000111.9G365 T366 L372 I373 L385 V388 V389G365-A369 WeakPolarHBondContact O-CB 3.37Å; G365-A369 PolarHBondContact O-N 3.32Å; G365-A369 VanDerWaalsContact O-N 3.09Å; T366-A369 PolarHBondContact O-N 2.94Å; A369-L372 PolarHBondContact O-N 3.11Å; A369-I373 PolarHBondContact O-N 3.46Å; A369-L385 HydrophobicContact CB-CD2 4.4Å; A369-V388 HydrophobicContact CB-CB 4.41Å; A369-V388 HydrophobicContact CB-CG1 3.77Å; A369-V389 HydrophobicContact CB-CG2 3.76Å
370L92.8Very high90.2Very high0 Ų044.5 Ų44.50%024%0.235CC..Hα-helixtrans-64.7-38.8176.8-66.5-177.1000113.4G303 P307 T366 G367 T368 L372 I373 P374 V389 V455G303-L370 WeakPolarHBondContact O-CD1 3.33Å; P307-L370 HydrophobicContact CB-CD2 3.75Å; P307-L370 HydrophobicContact CG-CD1 4.02Å; P307-L370 HydrophobicContact CG-CD2 3.3Å; P307-L370 HydrophobicContact CG-CG 4.27Å; T366-L370 HydrophobicContact CG2-CD1 4.33Å; T366-L370 HydrophobicContact CG2-CG 4.45Å; T366-L370 WeakPolarHBondContact O-CG 3.4Å; T366-L370 PolarHBondContact O-N 3.08Å; G367-L370 PolarHBondContact O-N 3.39Å; T368-L370 VanDerWaalsContact C-N 3.28Å; T368-L370 PolarHBondContact O-N 2.96Å; L370-L372 PolarHBondContact O-N 3.5Å; L370-I373 HydrophobicContact CD2-CD1 3.61Å; L370-I373 PolarHBondContact O-N 3.41Å; L370-P374 WeakPolarHBondContact O-CD 3.46Å; L370-V389 HydrophobicContact CD2-CG1 4.28Å; L370-V389 HydrophobicContact CD2-CG2 3.69Å; L370-V389 HydrophobicContact CG-CG2 4.34Å; L370-V455 HydrophobicContact CD1-CG2 4.1Å
371L93.3Very high90.1Very high53 Ų5345.4 Ų45.428%0.27724%0.244SC..Hα-helixtrans-67.2-22.9175-66.2-177000113.1G367 T368 Y449 L456G367-L371 WeakPolarHBondContact O-CG 3.44Å; G367-L371 PolarHBondContact O-N 3.37Å; G367-L371 VanDerWaalsContact O-N 3.13Å; T368-L371 PolarHBondContact O-N 3.19Å; L371-Y449 HydrophobicContact CD2-CD1 3.83Å; L371-L456 HydrophobicContact CD1-CD1 3.45Å; L371-L456 VanDerWaalsContact CD1-CD1 3.45Å; L371-L456 HydrophobicContact CG-CD1 4.29Å
372L92.4Very high89.8Confident91 Ų9139.5 Ų39.548%0.47622%0.219SC..Hα-helixtrans-85.6-15.6178.7-67.4173.6000113.3T368 A369 L370 I375 S376 L385T368-L372 WeakPolarHBondContact O-CG 3.35Å; T368-L372 PolarHBondContact O-N 3.19Å; A369-L372 PolarHBondContact O-N 3.11Å; L370-L372 PolarHBondContact O-N 3.5Å; L372-I375 HydrophobicContact CD2-CD1 4.26Å; L372-I375 PolarHBondContact O-N 3.47Å; L372-S376 PolarHBondContact O-N 3.41Å; L372-L385 HydrophobicContact CB-CD1 4.18Å; L372-L385 HydrophobicContact CB-CD2 3.94Å; L372-L385 HydrophobicContact CD1-CD2 4.42Å
373I89.5Confident89.6Confident5 Ų542.3 Ų42.33%0.02623%0.231CC..G310 helixtrans-57.9-52.2-180-71.5169.7000111.7M311 A369 L370 I375 S376 L382 L385 F448M311-I373 HydrophobicContact CE-CD1 3.76Å; M311-I373 HydrophobicContact CE-CG1 4.18Å; A369-I373 PolarHBondContact O-N 3.46Å; L370-I373 HydrophobicContact CD2-CD1 3.61Å; L370-I373 PolarHBondContact O-N 3.41Å; I373-I375 PolarHBondContact O-N 3.08Å; I373-I375 VanDerWaalsContact O-N 3.07Å; I373-S376 WeakPolarHBondContact O-CB 3.44Å; I373-S376 PolarHBondContact O-N 2.98Å; I373-L382 HydrophobicContact CG2-CD2 3.91Å; I373-L385 HydrophobicContact CB-CD1 4.48Å; I373-L385 HydrophobicContact CG1-CB 4.11Å; I373-L385 HydrophobicContact CG1-CD1 3.98Å; I373-F448 HydrophobicContact CD1-CD1 4.26Å; I373-F448 HydrophobicContact CD1-CE1 4.19Å; I373-F448 HydrophobicContact CG2-CD1 4.26Å; I373-F448 HydrophobicContact CG2-CD2 4.15Å; I373-F448 HydrophobicContact CG2-CE1 4.2Å; I373-F448 HydrophobicContact CG2-CE2 4.09Å; I373-F448 HydrophobicContact CG2-CG 4.25Å; I373-F448 HydrophobicContact CG2-CZ 4.13Å
374P87.8Confident89.6Confident21 Ų2146.3 Ų46.314%0.13626%0.256CS..G310 helixtrans-59.2-23179.5-29.238.9000115.1L370 S376 D445 F448 Y449L370-P374 WeakPolarHBondContact O-CD 3.46Å; P374-S376 VanDerWaalsContact C-N 3.33Å; P374-D445 HydrophobicContact CB-CB 4.24Å; P374-F448 HydrophobicContact CG-CB 3.58Å; P374-F448 HydrophobicContact CG-CD2 4.36Å; P374-F448 HydrophobicContact CG-CG 4.31Å; P374-Y449 HydrophobicContact CB-CE1 4.36Å; P374-Y449 HydrophobicContact CG-CD1 4.47Å; P374-Y449 HydrophobicContact CG-CE1 4.12Å
375I87.9Confident89.5Confident111 Ų11144.9 Ų44.957%0.56925%0.248SC*.G310 helixtrans-83.3-19-177.9-56.2172.6000110.3L372 I373 K377L372-I375 HydrophobicContact CD2-CD1 4.26Å; L372-I375 PolarHBondContact O-N 3.47Å; I373-I375 PolarHBondContact O-N 3.08Å; I373-I375 VanDerWaalsContact O-N 3.07Å; I375-K377 PolarHBondContact O-N 3.37Å
376S83.6Confident89.4Confident23 Ų2344.4 Ų44.416%0.16124%0.244CC..  trans-87.697.1-172.1-156.70000112.3L372 I373 P374 S378 G381L372-S376 PolarHBondContact O-N 3.41Å; I373-S376 WeakPolarHBondContact O-CB 3.44Å; I373-S376 PolarHBondContact O-N 2.98Å; P374-S376 VanDerWaalsContact C-N 3.33Å; S376-S378 PolarHBondContact O-N 3.04Å; S376-G381 WeakPolarHBondContact OG-CA 3.39Å
377K79.8Confident89.3Confident181 Ų18145.7 Ų45.779%0.78725%0.254SS*.  trans-85.317.6177.6-58.7-170.3176.1-170.30114.6I375I375-K377 PolarHBondContact O-N 3.37Å
378S84.3Confident89.3Confident61 Ų6148 Ų4843%0.42727%0.269SS..SBendtrans-128.2132.7-176.4-178.80000109.8S376 V380 G381 L382S376-S378 PolarHBondContact O-N 3.04Å; S378-V380 PolarHBondContact O-N 3.33Å; S378-G381 WeakPolarHBondContact O-CA 3.48Å; S378-G381 PolarHBondContact O-N 3.4Å; S378-L382 PolarHBondContact O-N 3.32Å
379Y83.1Confident89.2Confident37 Ų3744.8 Ų44.815%0.14525%0.249CC..Hα-helixtrans-56.4-38.7176.6-170.2-108.5000112.4A315 L320 I321 L329 G381 L382 Q383A315-Y379 HydrophobicContact CB-CD2 4.45Å; A315-Y379 HydrophobicContact CB-CE2 4.22Å; L320-Y379 HydrophobicContact CB-CD2 4.28Å; I321-Y379 HydrophobicContact CG1-CE2 4.12Å; L329-Y379 HydrophobicContact CD1-CE2 3.89Å; L329-Y379 HydrophobicContact CD2-CE2 4.43Å; L329-Y379 HydrophobicContact CG-CE2 4.14Å; Y379-G381 VanDerWaalsContact C-N 3.29Å; Y379-G381 PolarHBondContact O-N 3.12Å; Y379-L382 WeakPolarHBondContact O-CB 3.25Å; Y379-L382 PolarHBondContact O-N 3.37Å; Y379-Q383 HydrophobicContact CD1-CG 4.19Å; Y379-Q383 HydrophobicContact CE1-CG 3.99Å; Y379-Q383 WeakPolarHBondContact O-CG 3.46Å; Y379-Q383 PolarHBondContact O-N 3.41Å
380V85.5Confident89.1Confident90 Ų9044.6 Ų44.655%0.54525%0.247SC..Hα-helixtrans-63.9-37.7175.6-179.80000111S378 Q383 V384S378-V380 PolarHBondContact O-N 3.33Å; V380-Q383 PolarHBondContact O-N 3.13Å; V380-V384 WeakPolarHBondContact O-CG2 3.36Å; V380-V384 PolarHBondContact O-N 2.86Å
381G88Confident89.2Confident19 Ų1947.9 Ų47.920%0.19626%0.261CS..Hα-helixtrans-63.3-43174.400000112.3S376 S378 Y379 Q383 V384 L385S376-G381 WeakPolarHBondContact OG-CA 3.39Å; S378-G381 WeakPolarHBondContact O-CA 3.48Å; S378-G381 PolarHBondContact O-N 3.4Å; Y379-G381 VanDerWaalsContact C-N 3.29Å; Y379-G381 PolarHBondContact O-N 3.12Å; G381-Q383 PolarHBondContact O-N 3.49Å; G381-V384 PolarHBondContact O-N 3.06Å; G381-L385 WeakPolarHBondContact O-CG 3.48Å; G381-L385 PolarHBondContact O-N 2.99Å
382L86.9Confident89.1Confident2 Ų246.8 Ų46.81%0.0125%0.254CS..Hα-helixtrans-62.4-40.4173.4-70.1172.5000112.2M311 A315 L320 L329 I373 S378 Y379 L385 S386M311-L382 HydrophobicContact CE-CD2 4.44Å; A315-L382 HydrophobicContact CB-CD1 4.46Å; L320-L382 HydrophobicContact CD1-CD1 3.7Å; L329-L382 HydrophobicContact CD2-CB 4.24Å; I373-L382 HydrophobicContact CG2-CD2 3.91Å; S378-L382 PolarHBondContact O-N 3.32Å; Y379-L382 WeakPolarHBondContact O-CB 3.25Å; Y379-L382 PolarHBondContact O-N 3.37Å; L382-L385 PolarHBondContact O-N 3.45Å; L382-S386 VanDerWaalsContact O-CB 3.3Å; L382-S386 WeakPolarHBondContact O-CB 3.31Å; L382-S386 PolarHBondContact O-N 3.05Å; L382-S386 PolarHBondContact O-OG 3.05Å
383Q89.3Confident88.9Confident58 Ų5843.3 Ų43.327%0.27124%0.238SC..Hα-helixtrans-61.9-44.5175.5-71.1-179.5-36.900112.1L329 I332 Y379 V380 G381 S386 A387L329-Q383 HydrophobicContact CD2-CB 4.47Å; L329-Q383 HydrophobicContact CD2-CG 3.88Å; I332-Q383 HydrophobicContact CD1-CB 3.93Å; I332-Q383 HydrophobicContact CD1-CG 3.69Å; Y379-Q383 HydrophobicContact CD1-CG 4.19Å; Y379-Q383 HydrophobicContact CE1-CG 3.99Å; Y379-Q383 WeakPolarHBondContact O-CG 3.46Å; Y379-Q383 PolarHBondContact O-N 3.41Å; V380-Q383 PolarHBondContact O-N 3.13Å; G381-Q383 PolarHBondContact O-N 3.49Å; Q383-S386 WeakPolarHBondContact O-CB 3.48Å; Q383-S386 PolarHBondContact O-N 2.89Å; Q383-A387 WeakPolarHBondContact O-CB 3.25Å; Q383-A387 PolarHBondContact O-N 3.31Å
384V92.3Very high88.6Confident85 Ų8543 Ų4352%0.51524%0.236SC..Hα-helixtrans-64.5-45.5177.4172.60000110.8V380 G381 S386 A387 V388V380-V384 WeakPolarHBondContact O-CG2 3.36Å; V380-V384 PolarHBondContact O-N 2.86Å; G381-V384 PolarHBondContact O-N 3.06Å; V384-S386 PolarHBondContact O-N 2.82Å; V384-A387 WeakPolarHBondContact O-CB 3.4Å; V384-A387 PolarHBondContact O-N 3.11Å; V384-V388 WeakPolarHBondContact O-CG2 3.45Å; V384-V388 PolarHBondContact O-N 3.32Å
385L92.4Very high88.5Confident21 Ų2142 Ų4211%0.1123%0.23CC..Hα-helixtrans-64.8-38.9177.7-69.5172.8000111.9A369 L372 I373 G381 L382 A387 V388 V389A369-L385 HydrophobicContact CB-CD2 4.4Å; L372-L385 HydrophobicContact CB-CD1 4.18Å; L372-L385 HydrophobicContact CB-CD2 3.94Å; L372-L385 HydrophobicContact CD1-CD2 4.42Å; I373-L385 HydrophobicContact CB-CD1 4.48Å; I373-L385 HydrophobicContact CG1-CB 4.11Å; I373-L385 HydrophobicContact CG1-CD1 3.98Å; G381-L385 WeakPolarHBondContact O-CG 3.48Å; G381-L385 PolarHBondContact O-N 2.99Å; L382-L385 PolarHBondContact O-N 3.45Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 2.95Å; L385-V388 PolarHBondContact O-N 3.4Å; L385-V389 WeakPolarHBondContact O-CB 3.47Å; L385-V389 VanDerWaalsContact O-CG2 3.29Å; L385-V389 WeakPolarHBondContact O-CG2 3.22Å; L385-V389 PolarHBondContact O-N 3.31Å
386S90.7Very high88.1Confident0 Ų039.8 Ų39.80%021%0.214CC..Hα-helixtrans-58.8-45.4172.4-57.70000111.8M311 L329 L382 Q383 V384 V388 V389 G390M311-S386 WeakPolarHBondContact CE-OG 3.41Å; M311-S386 PolarHBondContact SD-OG 3.47Å; L329-S386 WeakPolarHBondContact CD2-OG 3.48Å; L382-S386 VanDerWaalsContact O-CB 3.3Å; L382-S386 WeakPolarHBondContact O-CB 3.31Å; L382-S386 PolarHBondContact O-N 3.05Å; L382-S386 PolarHBondContact O-OG 3.05Å; Q383-S386 WeakPolarHBondContact O-CB 3.48Å; Q383-S386 PolarHBondContact O-N 2.89Å; V384-S386 PolarHBondContact O-N 2.82Å; S386-V388 VanDerWaalsContact C-N 3.32Å; S386-V388 PolarHBondContact O-N 3.3Å; S386-V389 PolarHBondContact O-N 2.96Å; S386-G390 PolarHBondContact O-N 3.42Å
387A93.2Very high87.8Confident26 Ų2640.7 Ų40.722%0.21522%0.221CC..Hα-helixtrans-60.5-43.917800000111.3I332 T336 Q383 V384 L385 G390 F391I332-A387 HydrophobicContact CG2-CB 3.89Å; T336-A387 WeakPolarHBondContact CB-O 3.35Å; T336-A387 HydrophobicContact CG2-CB 3.85Å; T336-A387 PolarHBondContact OG1-O 3.03Å; T336-A387 VanDerWaalsContact OG1-O 3.05Å; Q383-A387 WeakPolarHBondContact O-CB 3.25Å; Q383-A387 PolarHBondContact O-N 3.31Å; V384-A387 WeakPolarHBondContact O-CB 3.4Å; V384-A387 PolarHBondContact O-N 3.11Å; L385-A387 VanDerWaalsContact C-N 3.34Å; L385-A387 PolarHBondContact O-N 2.95Å; A387-G390 PolarHBondContact O-N 3.03Å; A387-F391 WeakPolarHBondContact O-CB 3.43Å; A387-F391 PolarHBondContact O-N 2.9Å
388V94.2Very high87.9Confident50 Ų5032.1 Ų32.130%0.30318%0.184SC..Hα-helixtrans-64.7-48.2177.6173.50000111.5A369 V384 L385 S386 G390 F391 F392A369-V388 HydrophobicContact CB-CB 4.41Å; A369-V388 HydrophobicContact CB-CG1 3.77Å; V384-V388 WeakPolarHBondContact O-CG2 3.45Å; V384-V388 PolarHBondContact O-N 3.32Å; L385-V388 PolarHBondContact O-N 3.4Å; S386-V388 VanDerWaalsContact C-N 3.32Å; S386-V388 PolarHBondContact O-N 3.3Å; V388-G390 VanDerWaalsContact C-N 3.34Å; V388-G390 PolarHBondContact O-N 3.42Å; V388-F391 PolarHBondContact O-N 2.92Å; V388-F392 HydrophobicContact CG1-CD2 3.64Å; V388-F392 HydrophobicContact CG1-CE2 3.56Å; V388-F392 VanDerWaalsContact O-CD2 3.27Å; V388-F392 WeakPolarHBondContact O-CD2 3.17Å; V388-F392 PolarHBondContact O-N 3.37Å
389V92.8Very high87.8Confident3 Ų329.4 Ų29.42%0.01816%0.164CC..Hα-helixtrans-58.9-45.8176.7169.30000110.8T366 A369 L370 L385 S386 S393T366-V389 HydrophobicContact CG2-CG1 4.29Å; A369-V389 HydrophobicContact CB-CG2 3.76Å; L370-V389 HydrophobicContact CD2-CG1 4.28Å; L370-V389 HydrophobicContact CD2-CG2 3.69Å; L370-V389 HydrophobicContact CG-CG2 4.34Å; L385-V389 WeakPolarHBondContact O-CB 3.47Å; L385-V389 VanDerWaalsContact O-CG2 3.29Å; L385-V389 WeakPolarHBondContact O-CG2 3.22Å; L385-V389 PolarHBondContact O-N 3.31Å; S386-V389 PolarHBondContact O-N 2.96Å; V389-S393 VanDerWaalsContact O-CB 3.26Å; V389-S393 WeakPolarHBondContact O-CB 3.23Å; V389-S393 PolarHBondContact O-N 3.1Å; V389-S393 PolarHBondContact O-OG 3.3Å
390G91.9Very high87.4Confident0 Ų029.7 Ų29.70%017%0.172CC..Hα-helixtrans-63.5-46.917800000112.3T336 T337 S386 A387 V388 F392 S393 G394T336-G390 WeakPolarHBondContact OG1-CA 3.19Å; T337-G390 WeakPolarHBondContact CA-O 3.4Å; T337-G390 PolarHBondContact N-O 3.48Å; T337-G390 WeakPolarHBondContact OG1-CA 3.49Å; T337-G390 PolarHBondContact OG1-O 3.04Å; T337-G390 VanDerWaalsContact OG1-O 3.12Å; S386-G390 PolarHBondContact O-N 3.42Å; A387-G390 PolarHBondContact O-N 3.03Å; V388-G390 VanDerWaalsContact C-N 3.34Å; V388-G390 PolarHBondContact O-N 3.42Å; G390-F392 PolarHBondContact O-N 3.38Å; G390-S393 PolarHBondContact O-N 2.87Å; G390-G394 PolarHBondContact O-N 3.36Å
391F93.7Very high87Confident68 Ų6828.6 Ų28.630%0.29816%0.158SC..Hα-helixtrans-56.3-48.5177.9-179.1-93000112.1T336 V339 G340 T343 A387 V388 G394T336-F391 WeakPolarHBondContact O-CA 3.23Å; T336-F391 PolarHBondContact OG1-N 3.44Å; V339-F391 HydrophobicContact CG1-CD2 4.42Å; V339-F391 HydrophobicContact CG1-CE2 4.35Å; G340-F391 WeakPolarHBondContact CA-O 3.19Å; T343-F391 HydrophobicContact CG2-CE2 4.34Å; T343-F391 VanDerWaalsContact OG1-CE2 3.24Å; T343-F391 WeakPolarHBondContact OG1-CE2 3.18Å; T343-F391 WeakPolarHBondContact OG1-CZ 3.32Å; A387-F391 WeakPolarHBondContact O-CB 3.43Å; A387-F391 PolarHBondContact O-N 2.9Å; V388-F391 PolarHBondContact O-N 2.92Å; F391-G394 PolarHBondContact O-N 3.08Å
392F92.4Very high86.6Confident30 Ų3027.9 Ų27.913%0.13215%0.15CC..Hα-helixtrans-72.8-28.4179-70.3-55.7000113.7F361 T362 T366 V388 G390 G394 N395F361-F392 HydrophobicContact CD1-CE1 4.21Å; F361-F392 AromaticContact CE1-CE1 3.73Å; F361-F392 HydrophobicContact CE1-CE1 3.73Å; F361-F392 HydrophobicContact CE1-CZ 4.14Å; F361-F392 HydrophobicContact CZ-CE1 4.49Å; F361-F392 HydrophobicContact CZ-CZ 4.48Å; T362-F392 HydrophobicContact CG2-CD1 4.08Å; T366-F392 WeakPolarHBondContact OG1-CB 3.5Å; V388-F392 HydrophobicContact CG1-CD2 3.64Å; V388-F392 HydrophobicContact CG1-CE2 3.56Å; V388-F392 VanDerWaalsContact O-CD2 3.27Å; V388-F392 WeakPolarHBondContact O-CD2 3.17Å; V388-F392 PolarHBondContact O-N 3.37Å; G390-F392 PolarHBondContact O-N 3.38Å; F392-G394 PolarHBondContact O-N 2.93Å; F392-G394 VanDerWaalsContact O-N 3.17Å; F392-N395 VanDerWaalsContact O-CB 3.31Å; F392-N395 WeakPolarHBondContact O-CB 3.38Å; F392-N395 PolarHBondContact O-N 3.33Å; F392-N395 VanDerWaalsContact O-N 3.11Å
393S87.2Confident86.2Confident18 Ų1827.8 Ų27.813%0.12615%0.149CC..Hα-helixtrans-66.3-10.7171.1-61.40000113.3V389 G390 N395 W396V389-S393 VanDerWaalsContact O-CB 3.26Å; V389-S393 WeakPolarHBondContact O-CB 3.23Å; V389-S393 PolarHBondContact O-N 3.1Å; V389-S393 PolarHBondContact O-OG 3.3Å; G390-S393 PolarHBondContact O-N 2.87Å; S393-N395 PolarHBondContact O-N 3.19Å; S393-N395 PolarHBondContact O-OD1 3.38Å; S393-W396 PolarHBondContact O-N 3.38Å
394G83Confident85.3Confident0 Ų026.5 Ų26.50%015%0.146CC..THydrogen-bonded Turntrans-60.2-10.8166.900000114.2G390 F391 F392 W396 S397G390-G394 PolarHBondContact O-N 3.36Å; F391-G394 PolarHBondContact O-N 3.08Å; F392-G394 PolarHBondContact O-N 2.93Å; F392-G394 VanDerWaalsContact O-N 3.17Å; G394-W396 PolarHBondContact O-N 3.32Å; G394-S397 PolarHBondContact O-N 3.27Å
395N85.7Confident84.4Confident0 Ų028.1 Ų28.10%015%0.146CC..THydrogen-bonded Turntrans-55.3-18.7174.670.90.2000114.4F300 Y359 T362 F392 S393 S397 L398 T399F300-N395 WeakPolarHBondContact CE1-OD1 3.33Å; F300-N395 WeakPolarHBondContact CZ-ND2 3.37Å; F300-N395 VanDerWaalsContact CZ-OD1 3.29Å; F300-N395 WeakPolarHBondContact CZ-OD1 3.46Å; Y359-N395 HydrophobicContact CD2-CB 4.06Å; Y359-N395 HydrophobicContact CE2-CB 3.86Å; Y359-N395 WeakPolarHBondContact CE2-O 3.09Å; T362-N395 HydrophobicContact CG2-CB 4.31Å; T362-N395 VanDerWaalsContact OG1-CB 3.29Å; T362-N395 WeakPolarHBondContact OG1-CB 3.33Å; T362-N395 PolarHBondContact OG1-ND2 3.08Å; F392-N395 VanDerWaalsContact O-CB 3.31Å; F392-N395 WeakPolarHBondContact O-CB 3.38Å; F392-N395 PolarHBondContact O-N 3.33Å; F392-N395 VanDerWaalsContact O-N 3.11Å; S393-N395 PolarHBondContact O-N 3.19Å; S393-N395 PolarHBondContact O-OD1 3.38Å; N395-S397 PolarHBondContact O-N 3.31Å; N395-L398 HydrophobicContact CB-CD1 4.35Å; N395-L398 WeakPolarHBondContact O-CA 3.18Å; N395-L398 VanDerWaalsContact O-CB 3.26Å; N395-L398 WeakPolarHBondContact O-CB 3.49Å; N395-L398 PolarHBondContact O-N 2.78Å; N395-T399 PolarHBondContact O-N 3.15Å; N395-T399 PolarHBondContact O-OG1 3.29Å
396W79.8Confident83.5Confident63 Ų6330 Ų3024%0.23916%0.155CC..Hα-helixtrans-54.7-29.4175.1-147.1-95.2000112.8L66 F300 S393 G394 T399 M420 I427L66-W396 HydrophobicContact CD1-CH2 4.33Å; L66-W396 HydrophobicContact CD1-CZ2 3.83Å; F300-W396 HydrophobicContact CD1-CE3 4.38Å; F300-W396 HydrophobicContact CD1-CZ3 4.01Å; F300-W396 AromaticContact CE1-CE3 3.85Å; F300-W396 HydrophobicContact CE1-CE3 3.85Å; F300-W396 AromaticContact CE1-CZ3 3.83Å; F300-W396 HydrophobicContact CE1-CZ3 3.83Å; S393-W396 PolarHBondContact O-N 3.38Å; G394-W396 PolarHBondContact O-N 3.32Å; W396-T399 WeakPolarHBondContact O-CB 3.46Å; W396-M420 HydrophobicContact CZ2-CE 4.26Å; W396-M420 HydrophobicContact CZ2-SD 3.78Å; W396-I427 HydrophobicContact CH2-CD1 3.78Å; W396-I427 HydrophobicContact CZ2-CD1 4.36Å; W396-I427 HydrophobicContact CZ3-CD1 4.49Å
397S78Confident82.7Confident43 Ų4331.2 Ų31.230%0.30116%0.163SC..Hα-helixtrans-72.6-31174.9-53.70000113.1K341 G394 N395 T399K341-S397 VanDerWaalsContact CB-OG 3.32Å; K341-S397 WeakPolarHBondContact CB-OG 3.42Å; K341-S397 VanDerWaalsContact CG-OG 3.29Å; K341-S397 WeakPolarHBondContact CG-OG 3.45Å; G394-S397 PolarHBondContact O-N 3.27Å; N395-S397 PolarHBondContact O-N 3.31Å; S397-T399 VanDerWaalsContact C-N 3.32Å
398L80.6Confident81.5Confident1 Ų131.5 Ų31.51%0.00517%0.168CC..Hα-helixtrans-72.5-27.2176.6-65.4174.9000111.9L344 A348 L358 Y359 T362 N395 S400 Y401 I402L344-L398 HydrophobicContact CB-CD1 4.1Å; L344-L398 HydrophobicContact CB-CD2 4.43Å; L344-L398 HydrophobicContact CB-CG 4.22Å; L344-L398 WeakPolarHBondContact O-CD2 3.45Å; A348-L398 HydrophobicContact CB-CD2 3.45Å; A348-L398 VanDerWaalsContact CB-CD2 3.45Å; L358-L398 HydrophobicContact CD2-CD1 4.1Å; L358-L398 HydrophobicContact CD2-CD2 4.07Å; L358-L398 HydrophobicContact CG-CD1 4.16Å; Y359-L398 HydrophobicContact CD2-CB 3.73Å; Y359-L398 HydrophobicContact CD2-CD1 4.12Å; Y359-L398 HydrophobicContact CE2-CB 4.27Å; T362-L398 HydrophobicContact CG2-CD1 4.42Å; N395-L398 HydrophobicContact CB-CD1 4.35Å; N395-L398 WeakPolarHBondContact O-CA 3.18Å; N395-L398 VanDerWaalsContact O-CB 3.26Å; N395-L398 WeakPolarHBondContact O-CB 3.49Å; N395-L398 PolarHBondContact O-N 2.78Å; L398-S400 PolarHBondContact O-N 3.43Å; L398-Y401 WeakPolarHBondContact O-CB 3.4Å; L398-Y401 PolarHBondContact O-N 3.5Å; L398-Y401 VanDerWaalsContact O-N 3.1Å; L398-I402 HydrophobicContact CB-CD1 4.19Å; L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 3.49Å
399T82.7Confident80.2Confident3 Ų335.5 Ų35.52%0.01819%0.187CC..Hα-helixtrans-55.9-49.2-176.9-570000111.9I297 Y359 N395 W396 S397 Y401 I402 T403I297-T399 HydrophobicContact CD1-CG2 3.59Å; Y359-T399 WeakPolarHBondContact CE2-OG1 3.34Å; Y359-T399 PolarHBondContact OH-OG1 3.2Å; N395-T399 PolarHBondContact O-N 3.15Å; N395-T399 PolarHBondContact O-OG1 3.29Å; W396-T399 WeakPolarHBondContact O-CB 3.46Å; S397-T399 VanDerWaalsContact C-N 3.32Å; T399-Y401 VanDerWaalsContact C-N 3.34Å; T399-Y401 PolarHBondContact O-N 3.46Å; T399-I402 PolarHBondContact O-N 2.98Å; T399-T403 WeakPolarHBondContact O-CB 3.42Å; T399-T403 PolarHBondContact O-N 3.46Å; T399-T403 PolarHBondContact O-OG1 3.1Å
400S75.6Confident78.8Confident44 Ų4443.4 Ų43.431%0.30823%0.229SC..Hα-helixtrans-61.5-43.1176.9-54.80000111.5L398 T403 T404 H416L398-S400 PolarHBondContact O-N 3.43Å; S400-T403 PolarHBondContact O-N 3.45Å; S400-T404 WeakPolarHBondContact O-CG2 3.47Å; S400-T404 PolarHBondContact O-N 3.5Å; S400-T404 VanDerWaalsContact O-N 3.07Å; S400-H416 PolarHBondContact OG-CE1 2.92Å; S400-H416 PolarHBondContact OG-NE2 3.32Å
401Y76.3Confident77.7Confident67 Ų6748.6 Ų48.626%0.26325%0.252SS..Hα-helixtrans-62.3-47.9179.5-179.3-82.8000111.9A348 S355 L398 T399 T403 T404 K405A348-Y401 HydrophobicContact CB-CD1 4.4Å; A348-Y401 HydrophobicContact CB-CE1 4.44Å; A348-Y401 PolarHBondContact O-OH 3.43Å; S355-Y401 WeakPolarHBondContact OG-CE1 3.42Å; L398-Y401 WeakPolarHBondContact O-CB 3.4Å; L398-Y401 PolarHBondContact O-N 3.5Å; L398-Y401 VanDerWaalsContact O-N 3.1Å; T399-Y401 VanDerWaalsContact C-N 3.34Å; T399-Y401 PolarHBondContact O-N 3.46Å; Y401-T403 VanDerWaalsContact C-N 3.3Å; Y401-T403 PolarHBondContact O-N 3.36Å; Y401-T404 PolarHBondContact O-N 3.43Å; Y401-T404 PolarHBondContact O-OG1 3Å; Y401-K405 HydrophobicContact CD1-CD 4.48Å; Y401-K405 HydrophobicContact CE1-CD 3.74Å; Y401-K405 HydrophobicContact CE1-CG 4.3Å; Y401-K405 VanDerWaalsContact CZ-CE 3.48Å; Y401-K405 PolarHBondContact O-N 3.19Å; Y401-K405 WeakPolarHBondContact OH-CE 3.4Å; Y401-K405 PolarHBondContact OH-NZ 3.39Å
402I79.2Confident76.5Confident3 Ų347.2 Ų47.22%0.01525%0.247CC..Hα-helixtrans-66-37.4179.5-67.7165.1000111L293 S355 V356 Y359 L398 T399 T404 K405 I406L293-I402 HydrophobicContact CD1-CG2 4.44Å; L293-I402 HydrophobicContact CD2-CG2 4.48Å; S355-I402 WeakPolarHBondContact O-CD1 3.1Å; V356-I402 HydrophobicContact CG2-CG2 4.33Å; Y359-I402 HydrophobicContact CD2-CD1 3.62Å; Y359-I402 HydrophobicContact CG-CD1 3.6Å; L398-I402 HydrophobicContact CB-CD1 4.19Å; L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 3.49Å; T399-I402 PolarHBondContact O-N 2.98Å; I402-T404 VanDerWaalsContact C-N 3.28Å; I402-T404 PolarHBondContact O-N 2.91Å; I402-K405 PolarHBondContact O-N 3.37Å; I402-K405 VanDerWaalsContact O-N 3.11Å; I402-I406 HydrophobicContact CG2-CD1 3.71Å; I402-I406 HydrophobicContact CG2-CG1 4.41Å; I402-I406 WeakPolarHBondContact O-CG1 3.45Å; I402-I406 PolarHBondContact O-N 2.91Å; I402-I406 VanDerWaalsContact O-N 3.08Å
403T78.4Confident75.3Confident0 Ų051 Ų510%027%0.273CS..Hα-helixtrans-61.2-39.5176.2-52.90000111T399 S400 Y401 K405 I406 V407 L412 A415 H416 L419T399-T403 WeakPolarHBondContact O-CB 3.42Å; T399-T403 PolarHBondContact O-N 3.46Å; T399-T403 PolarHBondContact O-OG1 3.1Å; S400-T403 PolarHBondContact O-N 3.45Å; Y401-T403 VanDerWaalsContact C-N 3.3Å; Y401-T403 PolarHBondContact O-N 3.36Å; T403-K405 VanDerWaalsContact C-N 3.33Å; T403-K405 PolarHBondContact O-N 3.03Å; T403-I406 PolarHBondContact O-N 3.14Å; T403-V407 HydrophobicContact CG2-CG2 4.37Å; T403-V407 PolarHBondContact O-N 3.32Å; T403-L412 HydrophobicContact CG2-CD1 3.72Å; T403-A415 HydrophobicContact CG2-CB 3.68Å; T403-H416 HydrophobicContact CG2-CB 4.48Å; T403-L419 HydrophobicContact CG2-CD1 3.75Å; T403-L419 WeakPolarHBondContact OG1-CD1 3.43Å
404T70.5Confident74.6Confident32 Ų3252.3 Ų52.320%0.19628%0.277CS..Hα-helixtrans-62.7-38.517563.70000112.8S400 Y401 I402 G408 L409 L412S400-T404 WeakPolarHBondContact O-CG2 3.47Å; S400-T404 PolarHBondContact O-N 3.5Å; S400-T404 VanDerWaalsContact O-N 3.07Å; Y401-T404 PolarHBondContact O-N 3.43Å; Y401-T404 PolarHBondContact O-OG1 3Å; I402-T404 VanDerWaalsContact C-N 3.28Å; I402-T404 PolarHBondContact O-N 2.91Å; T404-G408 WeakPolarHBondContact O-CA 3.49Å; T404-G408 PolarHBondContact O-N 3.22Å; T404-L409 HydrophobicContact CG2-CD2 3.8Å; T404-L412 HydrophobicContact CG2-CB 4.32Å; T404-L412 HydrophobicContact CG2-CD1 3.38Å; T404-L412 HydrophobicContact CG2-CD2 3.35Å; T404-L412 HydrophobicContact CG2-CG 3.8Å
405K73.3Confident74.5Confident119 Ų11952.3 Ų52.352%0.51728%0.277SS..Hα-helixtrans-68.4-35.9179.1-77.3-170.2171.3173.90112.7S355 Y401 I402 T403S355-K405 PolarHBondContact OG-NZ 3.44Å; Y401-K405 HydrophobicContact CD1-CD 4.48Å; Y401-K405 HydrophobicContact CE1-CD 3.74Å; Y401-K405 HydrophobicContact CE1-CG 4.3Å; Y401-K405 VanDerWaalsContact CZ-CE 3.48Å; Y401-K405 PolarHBondContact O-N 3.19Å; Y401-K405 WeakPolarHBondContact OH-CE 3.4Å; Y401-K405 PolarHBondContact OH-NZ 3.39Å; I402-K405 PolarHBondContact O-N 3.37Å; I402-K405 VanDerWaalsContact O-N 3.11Å; T403-K405 VanDerWaalsContact C-N 3.33Å; T403-K405 PolarHBondContact O-N 3.03Å
406I74.4Confident74.2Confident60 Ų6053.5 Ų53.531%0.30828%0.283SS..Hα-helixtrans-79.4-44.8-177.7-64.2167000111.3L293 I402 T403L293-I406 HydrophobicContact CD2-CD1 3.9Å; I402-I406 HydrophobicContact CG2-CD1 3.71Å; I402-I406 HydrophobicContact CG2-CG1 4.41Å; I402-I406 WeakPolarHBondContact O-CG1 3.45Å; I402-I406 PolarHBondContact O-N 2.91Å; I402-I406 VanDerWaalsContact O-N 3.08Å; T403-I406 PolarHBondContact O-N 3.14Å
407V73.3Confident74.2Confident26 Ų2651.1 Ų51.116%0.15828%0.278CS..Hα-helixtrans-106.2-15.7-167.4-163.20000113.1F284 F290 T403 K411 A415F284-V407 HydrophobicContact CD1-CG1 3.78Å; F284-V407 HydrophobicContact CE1-CG1 3.21Å; F284-V407 HydrophobicContact CZ-CG1 3.94Å; F290-V407 HydrophobicContact CD2-CG2 3.83Å; F290-V407 HydrophobicContact CE2-CG2 4.1Å; T403-V407 HydrophobicContact CG2-CG2 4.37Å; T403-V407 PolarHBondContact O-N 3.32Å; V407-K411 HydrophobicContact CG1-CB 3.65Å; V407-K411 HydrophobicContact CG1-CD 4.31Å; V407-A415 HydrophobicContact CB-CB 4.12Å; V407-A415 HydrophobicContact CG1-CB 4Å; V407-A415 HydrophobicContact CG2-CB 3.82Å
408G68.6Low74.5Confident31 Ų3149.7 Ų49.732%0.3227%0.266SS..  trans83.7160.3-172.700000113T404 D410 K411 L412T404-G408 WeakPolarHBondContact O-CA 3.49Å; T404-G408 PolarHBondContact O-N 3.22Å; G408-D410 PolarHBondContact O-N 2.91Å; G408-K411 PolarHBondContact O-N 3.17Å; G408-L412 PolarHBondContact O-N 3.3Å
409L66.3Low74.8Confident134 Ų13449.7 Ų49.770%0.70227%0.266SS*.G310 helixtrans-64.5-37.2-174.2-72.2170.8000113.2T404 K411 L412T404-L409 HydrophobicContact CG2-CD2 3.8Å; L409-K411 PolarHBondContact O-N 2.91Å; L409-L412 WeakPolarHBondContact O-CB 3.41Å; L409-L412 PolarHBondContact O-N 3.28Å
410D63.1Low75Confident170 Ų17049.9 Ų49.991%0.90927%0.267SS*.G310 helixtrans-66.2-23.7-174-60.3-34.7000113.5G408G408-D410 PolarHBondContact O-N 2.91Å
411K69.2Low75.6Confident108 Ų10851.7 Ų51.747%0.4727%0.27SS..G310 helixtrans-112.52.1-176.3-72.5165.9165.4-168.70112.7F284 V407 G408 L409 T413 Q414 A415F284-K411 HydrophobicContact CE1-CB 4.31Å; F284-K411 HydrophobicContact CE1-CD 3.88Å; F284-K411 HydrophobicContact CE1-CG 4.48Å; F284-K411 HydrophobicContact CZ-CB 3.83Å; F284-K411 HydrophobicContact CZ-CD 3.63Å; F284-K411 HydrophobicContact CZ-CG 3.85Å; V407-K411 HydrophobicContact CG1-CB 3.65Å; V407-K411 HydrophobicContact CG1-CD 4.31Å; G408-K411 PolarHBondContact O-N 3.17Å; L409-K411 PolarHBondContact O-N 2.91Å; K411-T413 PolarHBondContact O-N 3.03Å; K411-Q414 PolarHBondContact O-N 2.8Å; K411-A415 WeakPolarHBondContact O-CB 3.42Å; K411-A415 PolarHBondContact O-N 2.89Å
412L68.9Low76.3Confident39 Ų3951.4 Ų51.420%0.20427%0.27CS..Hα-helixtrans-54.8-50.8-175.117662.4000112.3T403 T404 G408 L409 Q414 A415 H416T403-L412 HydrophobicContact CG2-CD1 3.72Å; T404-L412 HydrophobicContact CG2-CB 4.32Å; T404-L412 HydrophobicContact CG2-CD1 3.38Å; T404-L412 HydrophobicContact CG2-CD2 3.35Å; T404-L412 HydrophobicContact CG2-CG 3.8Å; G408-L412 PolarHBondContact O-N 3.3Å; L409-L412 WeakPolarHBondContact O-CB 3.41Å; L409-L412 PolarHBondContact O-N 3.28Å; L412-Q414 VanDerWaalsContact C-N 3.28Å; L412-Q414 PolarHBondContact O-N 2.99Å; L412-A415 PolarHBondContact O-N 3.12Å; L412-H416 HydrophobicContact CD1-CB 4.42Å; L412-H416 WeakPolarHBondContact O-CB 3.37Å; L412-H416 PolarHBondContact O-N 3.4Å
413T67.9Low76.8Confident111 Ų11151.2 Ų51.268%0.68127%0.269SS*.Hα-helixtrans-61.3-38.8-174.5-47.80000111.8K411 G417K411-T413 PolarHBondContact O-N 3.03Å; T413-G417 PolarHBondContact O-N 3.3Å; T413-G417 VanDerWaalsContact O-N 3.08Å
414Q72.5Confident77.5Confident44 Ų4451.2 Ų51.221%0.20627%0.269CS..Hα-helixtrans-70.4-49.5177.8-176.3177.21.900111.3Y277 S280 T281 F284 K411 L412 H416 G417 I418Y277-Q414 HydrophobicContact CE2-CG 3.89Å; S280-Q414 PolarHBondContact OG-NE2 2.89Å; T281-Q414 PolarHBondContact OG1-NE2 2.82Å; F284-Q414 HydrophobicContact CE2-CG 4.1Å; K411-Q414 PolarHBondContact O-N 2.8Å; L412-Q414 VanDerWaalsContact C-N 3.28Å; L412-Q414 PolarHBondContact O-N 2.99Å; Q414-H416 PolarHBondContact O-N 2.98Å; Q414-G417 PolarHBondContact O-N 3.11Å; Q414-I418 HydrophobicContact CG-CD1 4.4Å; Q414-I418 WeakPolarHBondContact O-CG1 3.41Å; Q414-I418 PolarHBondContact O-N 3.32Å; Q414-I418 VanDerWaalsContact O-N 3.15Å
415A79.6Confident78.6Confident0 Ų053.2 Ų53.20%028%0.275CS..Hα-helixtrans-61.7-44.8179.100000112.1F290 T403 V407 K411 L412 G417 I418 L419F290-A415 HydrophobicContact CE2-CB 3.75Å; F290-A415 HydrophobicContact CZ-CB 4.04Å; T403-A415 HydrophobicContact CG2-CB 3.68Å; V407-A415 HydrophobicContact CB-CB 4.12Å; V407-A415 HydrophobicContact CG1-CB 4Å; V407-A415 HydrophobicContact CG2-CB 3.82Å; K411-A415 WeakPolarHBondContact O-CB 3.42Å; K411-A415 PolarHBondContact O-N 2.89Å; L412-A415 PolarHBondContact O-N 3.12Å; A415-G417 VanDerWaalsContact C-N 3.32Å; A415-G417 PolarHBondContact O-N 3.34Å; A415-I418 PolarHBondContact O-N 3.28Å; A415-L419 WeakPolarHBondContact O-CG 3.38Å; A415-L419 PolarHBondContact O-N 3.24Å
416H79.6Confident79.5Confident25 Ų2547.6 Ų47.612%0.11625%0.251CS..Hα-helixtrans-63.6-37.7177.6-168.469.5000112.1S400 T403 L412 Q414 I418 L419 M420S400-H416 PolarHBondContact OG-CE1 2.92Å; S400-H416 PolarHBondContact OG-NE2 3.32Å; T403-H416 HydrophobicContact CG2-CB 4.48Å; L412-H416 HydrophobicContact CD1-CB 4.42Å; L412-H416 WeakPolarHBondContact O-CB 3.37Å; L412-H416 PolarHBondContact O-N 3.4Å; Q414-H416 PolarHBondContact O-N 2.98Å; H416-I418 PolarHBondContact O-N 2.95Å; H416-L419 PolarHBondContact O-N 3.37Å; H416-M420 WeakPolarHBondContact CE1-CE 3.07Å; H416-M420 VanDerWaalsContact NE2-CE 3.25Å; H416-M420 WeakPolarHBondContact NE2-CE 3.15Å; H416-M420 VanDerWaalsContact O-CG 3.3Å; H416-M420 WeakPolarHBondContact O-CG 2.86Å; H416-M420 PolarHBondContact O-N 3.12Å
417G79.2Confident80.4Confident13 Ų1345.3 Ų45.313%0.13424%0.239CC..Hα-helixtrans-61.7-40.2173.300000113.2T413 Q414 A415 M420 F421T413-G417 PolarHBondContact O-N 3.3Å; T413-G417 VanDerWaalsContact O-N 3.08Å; Q414-G417 PolarHBondContact O-N 3.11Å; A415-G417 VanDerWaalsContact C-N 3.32Å; A415-G417 PolarHBondContact O-N 3.34Å; G417-M420 PolarHBondContact O-N 3.44Å; G417-F421 PolarHBondContact O-N 2.94Å
418I85.2Confident81.4Confident13 Ų1345.4 Ų45.47%0.06724%0.238CC..Hα-helixtrans-65.1-43.9175.3-63158.7000110.5T281 F284 L285 F290 Q414 A415 H416 M420 F421 F422T281-I418 HydrophobicContact CG2-CD1 3.76Å; T281-I418 HydrophobicContact CG2-CG1 4.17Å; F284-I418 HydrophobicContact CB-CD1 4.49Å; F284-I418 HydrophobicContact CD2-CD1 4.15Å; L285-I418 HydrophobicContact CD2-CG2 4.11Å; F290-I418 HydrophobicContact CE1-CB 4.4Å; F290-I418 HydrophobicContact CE1-CD1 4.42Å; F290-I418 HydrophobicContact CE1-CG2 3.98Å; F290-I418 HydrophobicContact CZ-CB 4.17Å; F290-I418 HydrophobicContact CZ-CD1 4.47Å; F290-I418 HydrophobicContact CZ-CG2 4.19Å; Q414-I418 HydrophobicContact CG-CD1 4.4Å; Q414-I418 WeakPolarHBondContact O-CG1 3.41Å; Q414-I418 PolarHBondContact O-N 3.32Å; Q414-I418 VanDerWaalsContact O-N 3.15Å; A415-I418 PolarHBondContact O-N 3.28Å; H416-I418 PolarHBondContact O-N 2.95Å; I418-M420 VanDerWaalsContact C-N 3.35Å; I418-M420 PolarHBondContact O-N 2.88Å; I418-F421 WeakPolarHBondContact O-CB 3.19Å; I418-F421 PolarHBondContact O-N 3.04Å; I418-F422 HydrophobicContact CG2-CD2 4Å; I418-F422 HydrophobicContact CG2-CE2 3.84Å; I418-F422 WeakPolarHBondContact O-CD2 2.93Å; I418-F422 PolarHBondContact O-N 3.34Å; I418-F422 VanDerWaalsContact O-N 3.14Å
419L86.6Confident82.7Confident1 Ų146.8 Ų46.81%0.00524%0.238CC..Hα-helixtrans-62-42.4177.2-66.1168.3000111.8F290 L293 C294 I297 T403 A415 H416 F421 F422 G423F290-L419 HydrophobicContact CE2-CD1 4.03Å; F290-L419 HydrophobicContact CE2-CD2 4.01Å; F290-L419 HydrophobicContact CE2-CG 3.94Å; F290-L419 HydrophobicContact CZ-CD2 4.1Å; F290-L419 HydrophobicContact CZ-CG 3.99Å; L293-L419 HydrophobicContact CB-CD2 4.34Å; L293-L419 HydrophobicContact CD2-CD1 3.74Å; L293-L419 HydrophobicContact CD2-CD2 3.9Å; L293-L419 HydrophobicContact CG-CD2 3.91Å; C294-L419 HydrophobicContact CB-CD2 4.36Å; C294-L419 WeakPolarHBondContact SG-CD2 3.25Å; I297-L419 HydrophobicContact CD1-CB 3.87Å; I297-L419 HydrophobicContact CD1-CD1 4.19Å; I297-L419 HydrophobicContact CD1-CD2 3.68Å; I297-L419 HydrophobicContact CD1-CG 4.11Å; T403-L419 HydrophobicContact CG2-CD1 3.75Å; T403-L419 WeakPolarHBondContact OG1-CD1 3.43Å; A415-L419 WeakPolarHBondContact O-CG 3.38Å; A415-L419 PolarHBondContact O-N 3.24Å; H416-L419 PolarHBondContact O-N 3.37Å; L419-F421 VanDerWaalsContact C-N 3.31Å; L419-F421 PolarHBondContact O-N 3.29Å; L419-F422 PolarHBondContact O-N 3.08Å; L419-G423 PolarHBondContact O-N 3.26Å
420M86.8Confident84Confident7 Ų740.4 Ų40.43%0.03420%0.204CC..Hα-helixtrans-65.7-32.7175.6-70.5-63.3163.800112.4L66 W396 H416 G417 I418 G423 G424L66-M420 HydrophobicContact CD2-SD 3.71Å; W396-M420 HydrophobicContact CZ2-CE 4.26Å; W396-M420 HydrophobicContact CZ2-SD 3.78Å; H416-M420 WeakPolarHBondContact CE1-CE 3.07Å; H416-M420 VanDerWaalsContact NE2-CE 3.25Å; H416-M420 WeakPolarHBondContact NE2-CE 3.15Å; H416-M420 VanDerWaalsContact O-CG 3.3Å; H416-M420 WeakPolarHBondContact O-CG 2.86Å; H416-M420 PolarHBondContact O-N 3.12Å; G417-M420 PolarHBondContact O-N 3.44Å; I418-M420 VanDerWaalsContact C-N 3.35Å; I418-M420 PolarHBondContact O-N 2.88Å; M420-G423 PolarHBondContact O-N 3.23Å; M420-G424 PolarHBondContact O-N 3.03Å
421F88.4Confident85.4Confident83 Ų8332.3 Ų32.336%0.36416%0.161SC..Hα-helixtrans-62.5-49.8173.4178.6-92000111.4I67 G417 I418 L419 G424 F425I67-F421 HydrophobicContact CG2-CD2 3.97Å; I67-F421 HydrophobicContact CG2-CE2 3.92Å; G417-F421 PolarHBondContact O-N 2.94Å; I418-F421 WeakPolarHBondContact O-CB 3.19Å; I418-F421 PolarHBondContact O-N 3.04Å; L419-F421 VanDerWaalsContact C-N 3.31Å; L419-F421 PolarHBondContact O-N 3.29Å; F421-G424 PolarHBondContact O-N 2.93Å; F421-F425 HydrophobicContact CD1-CD2 4.2Å; F421-F425 HydrophobicContact CD1-CE2 4.4Å; F421-F425 HydrophobicContact CD2-CE2 4.36Å; F421-F425 AromaticContact CE1-CD2 3.86Å; F421-F425 HydrophobicContact CE1-CD2 3.86Å; F421-F425 AromaticContact CE1-CE2 3.71Å; F421-F425 HydrophobicContact CE1-CE2 3.71Å; F421-F425 HydrophobicContact CE2-CD2 4.29Å; F421-F425 AromaticContact CE2-CE2 3.68Å; F421-F425 HydrophobicContact CE2-CE2 3.68Å; F421-F425 AromaticContact CZ-CD2 3.93Å; F421-F425 HydrophobicContact CZ-CD2 3.93Å; F421-F425 AromaticContact CZ-CE2 3.32Å; F421-F425 HydrophobicContact CZ-CE2 3.32Å; F421-F425 HydrophobicContact CZ-CZ 4.27Å; F421-F425 WeakPolarHBondContact O-CD2 3.45Å; F421-F425 PolarHBondContact O-N 2.82Å; F421-F425 VanDerWaalsContact O-N 3.1Å
422F90.6Very high86.6Confident60 Ų6027.1 Ų27.126%0.26314%0.139SC..Hα-helixtrans-63.9-42.9175.5-78.5-75.6000112.2L285 C294 F298 I418 L419 G424 F425 G426L285-F422 HydrophobicContact CD2-CE2 3.98Å; L285-F422 HydrophobicContact CD2-CZ 4.38Å; C294-F422 HydrophobicContact CB-CD2 3.97Å; C294-F422 HydrophobicContact CB-CE2 4.28Å; C294-F422 HydrophobicContact CB-CG 4.33Å; F298-F422 HydrophobicContact CB-CB 4.4Å; F298-F422 WeakPolarHBondContact CD2-O 3.4Å; I418-F422 HydrophobicContact CG2-CD2 4Å; I418-F422 HydrophobicContact CG2-CE2 3.84Å; I418-F422 WeakPolarHBondContact O-CD2 2.93Å; I418-F422 PolarHBondContact O-N 3.34Å; I418-F422 VanDerWaalsContact O-N 3.14Å; L419-F422 PolarHBondContact O-N 3.08Å; F422-G424 PolarHBondContact O-N 3.05Å; F422-F425 PolarHBondContact O-N 3.23Å; F422-G426 PolarHBondContact O-N 3.31Å
423G91.4Very high87.7Confident0 Ų027.2 Ų27.20%014%0.14CC..Hα-helixtrans-61.5-41.8175.700000112.8S301 L419 M420 F425 G426 I427S301-G423 WeakPolarHBondContact CB-O 3.24Å; S301-G423 WeakPolarHBondContact OG-CA 3.41Å; S301-G423 PolarHBondContact OG-O 3.11Å; L419-G423 PolarHBondContact O-N 3.26Å; M420-G423 PolarHBondContact O-N 3.23Å; G423-F425 PolarHBondContact O-N 3.38Å; G423-G426 PolarHBondContact O-N 2.95Å; G423-G426 VanDerWaalsContact O-N 3.14Å; G423-I427 PolarHBondContact O-N 2.9Å
424G91.9Very high88.8Confident0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-61.9-40176.400000113G63 M420 F421 F422 M428G63-G424 WeakPolarHBondContact CA-O 3.36Å; M420-G424 PolarHBondContact O-N 3.03Å; F421-G424 PolarHBondContact O-N 2.93Å; F422-G424 PolarHBondContact O-N 3.05Å; G424-M428 VanDerWaalsContact O-CB 3.25Å; G424-M428 WeakPolarHBondContact O-CB 3.36Å; G424-M428 PolarHBondContact O-N 2.85Å
425F92.9Very high89.6Confident74 Ų7419.9 Ų19.933%0.32510%0.099SC..Hα-helixtrans-62.9-41.4171.7-96-82.8000112.5I67 F298 F421 F422 G423 M428 L429I67-F425 HydrophobicContact CD1-CD2 3.87Å; I67-F425 HydrophobicContact CD1-CE2 3.95Å; I67-F425 HydrophobicContact CD1-CG 4.24Å; I67-F425 HydrophobicContact CD1-CZ 4.44Å; I67-F425 HydrophobicContact CG1-CD2 4Å; I67-F425 HydrophobicContact CG1-CE2 4.2Å; I67-F425 HydrophobicContact CG2-CE2 4.36Å; F298-F425 HydrophobicContact CE2-CB 4.34Å; F421-F425 HydrophobicContact CD1-CD2 4.2Å; F421-F425 HydrophobicContact CD1-CE2 4.4Å; F421-F425 HydrophobicContact CD2-CE2 4.36Å; F421-F425 AromaticContact CE1-CD2 3.86Å; F421-F425 HydrophobicContact CE1-CD2 3.86Å; F421-F425 AromaticContact CE1-CE2 3.71Å; F421-F425 HydrophobicContact CE1-CE2 3.71Å; F421-F425 HydrophobicContact CE2-CD2 4.29Å; F421-F425 AromaticContact CE2-CE2 3.68Å; F421-F425 HydrophobicContact CE2-CE2 3.68Å; F421-F425 AromaticContact CZ-CD2 3.93Å; F421-F425 HydrophobicContact CZ-CD2 3.93Å; F421-F425 AromaticContact CZ-CE2 3.32Å; F421-F425 HydrophobicContact CZ-CE2 3.32Å; F421-F425 HydrophobicContact CZ-CZ 4.27Å; F421-F425 WeakPolarHBondContact O-CD2 3.45Å; F421-F425 PolarHBondContact O-N 2.82Å; F421-F425 VanDerWaalsContact O-N 3.1Å; F422-F425 PolarHBondContact O-N 3.23Å; G423-F425 PolarHBondContact O-N 3.38Å; F425-M428 HydrophobicContact CD1-CE 3.81Å; F425-M428 HydrophobicContact CE1-CE 3.85Å; F425-M428 PolarHBondContact O-N 2.89Å; F425-L429 WeakPolarHBondContact O-CB 3.45Å; F425-L429 WeakPolarHBondContact O-CG 3.34Å; F425-L429 PolarHBondContact O-N 3.45Å
426G93.6Very high90.2Very high0 Ų024.1 Ų24.10%012%0.115CC..Hα-helixtrans-61.4-50.5175.600000112.2S301 L302 F422 G423 M428 L429 G430S301-G426 CarbonylContact O-C 3.2Å; L302-G426 WeakPolarHBondContact CA-O 3.49Å; F422-G426 PolarHBondContact O-N 3.31Å; G423-G426 PolarHBondContact O-N 2.95Å; G423-G426 VanDerWaalsContact O-N 3.14Å; G426-M428 VanDerWaalsContact C-N 3.31Å; G426-M428 PolarHBondContact O-N 2.83Å; G426-L429 PolarHBondContact O-N 3.22Å; G426-G430 PolarHBondContact O-N 3.08Å
427I93.3Very high90.7Very high12 Ų1225.8 Ų25.86%0.06212%0.122CC..Hα-helixtrans-59.6-41.4177.3-79155000111.5S59 L66 F305 W396 G423 P431S59-I427 WeakPolarHBondContact CB-O 3.13Å; L66-I427 HydrophobicContact CD1-CD1 3.51Å; F305-I427 HydrophobicContact CB-CG1 4.07Å; F305-I427 HydrophobicContact CD1-CG2 3.84Å; F305-I427 HydrophobicContact CD2-CG1 4.34Å; F305-I427 HydrophobicContact CD2-CG2 4.2Å; F305-I427 HydrophobicContact CE1-CG2 4.09Å; F305-I427 HydrophobicContact CE2-CG2 4.4Å; F305-I427 HydrophobicContact CG-CG1 4.18Å; F305-I427 HydrophobicContact CG-CG2 3.93Å; F305-I427 HydrophobicContact CZ-CG2 4.37Å; W396-I427 HydrophobicContact CH2-CD1 3.78Å; W396-I427 HydrophobicContact CZ2-CD1 4.36Å; W396-I427 HydrophobicContact CZ3-CD1 4.49Å; G423-I427 PolarHBondContact O-N 2.9Å; I427-P431 WeakPolarHBondContact O-CD 3.44Å
428M94.4Very high91Very high29 Ų2926.2 Ų26.214%0.14312%0.12CC..Hα-helixtrans-64.5-43.5-179.6-178-179.577.100112.2W56 S59 L60 I67 G424 F425 G426 P432W56-M428 HydrophobicContact CE3-CG 4.33Å; W56-M428 HydrophobicContact CZ3-CE 4.48Å; W56-M428 HydrophobicContact CZ3-CG 3.62Å; W56-M428 HydrophobicContact CZ3-SD 4.21Å; S59-M428 VanDerWaalsContact CB-O 3.31Å; S59-M428 WeakPolarHBondContact CB-O 3.25Å; S59-M428 PolarHBondContact OG-O 3.23Å; L60-M428 HydrophobicContact CD2-CG 3.67Å; L60-M428 HydrophobicContact CD2-SD 3.55Å; L60-M428 VanDerWaalsContact CD2-SD 3.55Å; L60-M428 HydrophobicContact CG-CG 4.34Å; I67-M428 HydrophobicContact CD1-SD 4.13Å; G424-M428 VanDerWaalsContact O-CB 3.25Å; G424-M428 WeakPolarHBondContact O-CB 3.36Å; G424-M428 PolarHBondContact O-N 2.85Å; F425-M428 HydrophobicContact CD1-CE 3.81Å; F425-M428 HydrophobicContact CE1-CE 3.85Å; F425-M428 PolarHBondContact O-N 2.89Å; G426-M428 VanDerWaalsContact C-N 3.31Å; G426-M428 PolarHBondContact O-N 2.83Å; M428-P432 VanDerWaalsContact O-CD 3.27Å; M428-P432 WeakPolarHBondContact O-CD 3.22Å; M428-P432 WeakPolarHBondContact O-CG 3.47Å
429L94.3Very high91.1Very high59 Ų5927.8 Ų27.831%0.30913%0.128SC..Hα-helixtrans-83.9-30-175.6-67.9174.6000113.6W56 L302 F425 G426 P432 V433W56-L429 HydrophobicContact CH2-CD2 3.95Å; L302-L429 HydrophobicContact CD1-CB 4.01Å; F425-L429 WeakPolarHBondContact O-CB 3.45Å; F425-L429 WeakPolarHBondContact O-CG 3.34Å; F425-L429 PolarHBondContact O-N 3.45Å; G426-L429 PolarHBondContact O-N 3.22Å; L429-P432 WeakPolarHBondContact O-CD 3.41Å; L429-V433 WeakPolarHBondContact O-CB 3.38Å; L429-V433 WeakPolarHBondContact O-CG2 3.32Å; L429-V433 PolarHBondContact O-N 2.78Å; L429-V433 VanDerWaalsContact O-N 3.09Å
430G93.6Very high91.1Very high0 Ų037 Ų370%016%0.163CC..Hα-helixtrans-53.9-62.6-17300000113L302 G426 V433 V434L302-G430 VanDerWaalsContact O-CA 3.27Å; L302-G430 WeakPolarHBondContact O-CA 3.39Å; G426-G430 PolarHBondContact O-N 3.08Å; G430-V433 PolarHBondContact O-N 3.2Å; G430-V434 WeakPolarHBondContact O-CG2 3.45Å; G430-V434 PolarHBondContact O-N 3.49Å
431P93.3Very high91.2Very high0 Ų039.4 Ų39.40%018%0.178CC..Hα-helixtrans-63.5-42.2-175.1-20.530.8000114.6A55 F305 P306 L309 F310 I427 V433 V434 G435A55-P431 HydrophobicContact CB-CB 3.99Å; F305-P431 HydrophobicContact CD1-CG 3.48Å; F305-P431 VanDerWaalsContact CD1-CG 3.48Å; F305-P431 HydrophobicContact CE1-CG 4.07Å; P306-P431 HydrophobicContact CG-CG 4.36Å; L309-P431 HydrophobicContact CD2-CB 3.52Å; L309-P431 HydrophobicContact CD2-CG 4.22Å; F310-P431 HydrophobicContact CE2-CB 3.92Å; F310-P431 WeakPolarHBondContact CE2-O 3.28Å; F310-P431 HydrophobicContact CZ-CB 4.31Å; F310-P431 VanDerWaalsContact CZ-O 3.28Å; F310-P431 WeakPolarHBondContact CZ-O 3.42Å; I427-P431 WeakPolarHBondContact O-CD 3.44Å; P431-V433 VanDerWaalsContact C-N 3.35Å; P431-V433 PolarHBondContact O-N 3.2Å; P431-V434 PolarHBondContact O-N 2.71Å; P431-G435 PolarHBondContact O-N 3.3Å
432P93.5Very high91Very high0 Ų041.9 Ų41.90%019%0.191CC..Hα-helixtrans-58.4-42.8172.8-28.236.2000113.8W56 M428 L429 G435 W436W56-P432 HydrophobicContact CB-CG 4.46Å; W56-P432 HydrophobicContact CD2-CB 4.01Å; W56-P432 HydrophobicContact CD2-CG 3.43Å; W56-P432 VanDerWaalsContact CD2-CG 3.43Å; W56-P432 VanDerWaalsContact CE2-CG 3.47Å; W56-P432 HydrophobicContact CE3-CG 3.89Å; W56-P432 HydrophobicContact CG-CB 4.23Å; W56-P432 HydrophobicContact CG-CG 3.7Å; W56-P432 HydrophobicContact CH2-CG 4.39Å; W56-P432 HydrophobicContact CZ2-CB 3.88Å; W56-P432 HydrophobicContact CZ2-CG 3.96Å; W56-P432 HydrophobicContact CZ3-CG 4.36Å; M428-P432 VanDerWaalsContact O-CD 3.27Å; M428-P432 WeakPolarHBondContact O-CD 3.22Å; M428-P432 WeakPolarHBondContact O-CG 3.47Å; L429-P432 WeakPolarHBondContact O-CD 3.41Å; P432-G435 PolarHBondContact O-N 3.14Å; P432-W436 PolarHBondContact O-N 2.88Å
433V93.2Very high90.7Very high40 Ų4040.9 Ų40.924%0.24219%0.191CC..Hα-helixtrans-62.9-46.6178169.40000110.8L429 G430 P431 G435 W436 F437 F450L429-V433 WeakPolarHBondContact O-CB 3.38Å; L429-V433 WeakPolarHBondContact O-CG2 3.32Å; L429-V433 PolarHBondContact O-N 2.78Å; L429-V433 VanDerWaalsContact O-N 3.09Å; G430-V433 PolarHBondContact O-N 3.2Å; P431-V433 VanDerWaalsContact C-N 3.35Å; P431-V433 PolarHBondContact O-N 3.2Å; V433-G435 VanDerWaalsContact C-N 3.35Å; V433-W436 PolarHBondContact O-N 3.31Å; V433-F437 HydrophobicContact CG1-CD2 4.05Å; V433-F437 HydrophobicContact CG1-CE2 3.77Å; V433-F437 WeakPolarHBondContact O-CD2 3.34Å; V433-F437 PolarHBondContact O-N 3.48Å; V433-F450 HydrophobicContact CG1-CE1 3.85Å; V433-F450 HydrophobicContact CG1-CZ 4.1Å
434V90.6Very high90.3Very high1 Ų141.5 Ų41.51%0.00619%0.194CC..Hα-helixtrans-64-39.7176.4169.40000111.4P306 F310 G430 P431 F437 F438 A447 F450 S451P306-V434 HydrophobicContact CB-CB 3.9Å; P306-V434 HydrophobicContact CB-CG1 3.88Å; P306-V434 HydrophobicContact CB-CG2 3.7Å; P306-V434 HydrophobicContact CG-CB 4.34Å; P306-V434 HydrophobicContact CG-CG2 3.72Å; F310-V434 HydrophobicContact CD2-CG1 3.74Å; F310-V434 HydrophobicContact CE2-CB 3.93Å; F310-V434 HydrophobicContact CE2-CG1 3.6Å; F310-V434 HydrophobicContact CZ-CG1 4.5Å; G430-V434 WeakPolarHBondContact O-CG2 3.45Å; G430-V434 PolarHBondContact O-N 3.49Å; P431-V434 PolarHBondContact O-N 2.71Å; V434-F437 WeakPolarHBondContact O-CB 3.35Å; V434-F437 PolarHBondContact O-N 3.41Å; V434-F438 PolarHBondContact O-N 2.89Å; V434-F438 VanDerWaalsContact O-N 3.1Å; V434-A447 HydrophobicContact CB-CB 4.34Å; V434-A447 HydrophobicContact CG1-CB 3.44Å; V434-A447 VanDerWaalsContact CG1-CB 3.44Å; V434-F450 HydrophobicContact CG2-CD1 4.18Å; V434-S451 WeakPolarHBondContact CG2-OG 3.49Å
435G89.8Confident90.1Very high0 Ų044.6 Ų44.60%021%0.21CC..Hα-helixtrans-63.5-40.4175.400000112.5P431 P432 V433 F438 D439P431-G435 PolarHBondContact O-N 3.3Å; P432-G435 PolarHBondContact O-N 3.14Å; V433-G435 VanDerWaalsContact C-N 3.35Å; G435-F438 WeakPolarHBondContact O-CB 3.46Å; G435-F438 PolarHBondContact O-N 3.08Å; G435-F438 VanDerWaalsContact O-N 3.16Å; G435-D439 VanDerWaalsContact O-CG 3.27Å; G435-D439 PolarHBondContact O-N 3.22Å
436W91.6Very high89.8Confident90 Ų9045.6 Ų45.634%0.34122%0.219SC..Hα-helixtrans-67.3-35.2174.1-69.6-34.1000113.2W56 P432 V433 F438 D439 W440W56-W436 HydrophobicContact CZ2-CH2 4.26Å; W56-W436 AromaticContact NE1-CZ2 3.84Å; P432-W436 PolarHBondContact O-N 2.88Å; V433-W436 PolarHBondContact O-N 3.31Å; W436-F438 VanDerWaalsContact C-N 3.26Å; W436-F438 PolarHBondContact O-N 3.25Å; W436-D439 PolarHBondContact O-N 2.98Å; W436-W440 PolarHBondContact O-N 3.06Å
437F89.8Confident89.5Confident60 Ų6045.6 Ų45.626%0.26322%0.219SC..Hα-helixtrans-57.9-42.9170-84.5-67.2000111V433 V434 T441 A447 F450V433-F437 HydrophobicContact CG1-CD2 4.05Å; V433-F437 HydrophobicContact CG1-CE2 3.77Å; V433-F437 WeakPolarHBondContact O-CD2 3.34Å; V433-F437 PolarHBondContact O-N 3.48Å; V434-F437 WeakPolarHBondContact O-CB 3.35Å; V434-F437 PolarHBondContact O-N 3.41Å; F437-T441 WeakPolarHBondContact O-CB 3.46Å; F437-T441 WeakPolarHBondContact O-CG2 3.43Å; F437-T441 PolarHBondContact O-N 2.79Å; F437-T441 PolarHBondContact O-OG1 3.22Å; F437-A447 HydrophobicContact CB-CB 4.18Å; F437-F450 HydrophobicContact CE2-CB 4.41Å; F437-F450 HydrophobicContact CE2-CD1 4.2Å; F437-F450 HydrophobicContact CE2-CD2 4.08Å; F437-F450 HydrophobicContact CE2-CE2 4.41Å; F437-F450 AromaticContact CE2-CG 3.96Å; F437-F450 HydrophobicContact CE2-CG 3.96Å; F437-F450 HydrophobicContact CZ-CD2 4.38Å
438F85.7Confident89.4Confident22 Ų2245.2 Ų45.210%0.09622%0.217CC..Hα-helixtrans-64.5-47.9174-174.1-82.9000111.7K51 V434 G435 W436 W440 T441 Q442 Y444K51-F438 HydrophobicContact CD-CD1 3.4Å; K51-F438 HydrophobicContact CD-CE1 3.73Å; K51-F438 HydrophobicContact CD-CG 3.96Å; K51-F438 HydrophobicContact CD-CZ 4.5Å; K51-F438 VanDerWaalsContact CE-CD1 3.46Å; K51-F438 HydrophobicContact CG-CD1 3.99Å; K51-F438 HydrophobicContact CG-CE1 4.46Å; V434-F438 PolarHBondContact O-N 2.89Å; V434-F438 VanDerWaalsContact O-N 3.1Å; G435-F438 WeakPolarHBondContact O-CB 3.46Å; G435-F438 PolarHBondContact O-N 3.08Å; G435-F438 VanDerWaalsContact O-N 3.16Å; W436-F438 VanDerWaalsContact C-N 3.26Å; W436-F438 PolarHBondContact O-N 3.25Å; F438-W440 PolarHBondContact O-N 3.25Å; F438-W440 VanDerWaalsContact O-N 3.17Å; F438-T441 PolarHBondContact O-N 3.24Å; F438-Q442 VanDerWaalsContact O-CA 3.28Å; F438-Q442 WeakPolarHBondContact O-CA 3.47Å; F438-Q442 PolarHBondContact O-N 2.84Å; F438-Y444 HydrophobicContact CB-CD1 4.28Å; F438-Y444 HydrophobicContact CB-CE1 3.99Å; F438-Y444 AromaticContact CD2-CD1 3.55Å; F438-Y444 HydrophobicContact CD2-CD1 3.55Å; F438-Y444 AromaticContact CD2-CD2 3.41Å; F438-Y444 HydrophobicContact CD2-CD2 3.41Å; F438-Y444 VanDerWaalsContact CD2-CD2 3.41Å; F438-Y444 AromaticContact CD2-CE1 3.55Å; F438-Y444 HydrophobicContact CD2-CE1 3.55Å; F438-Y444 AromaticContact CD2-CE2 3.45Å; F438-Y444 HydrophobicContact CD2-CE2 3.45Å; F438-Y444 VanDerWaalsContact CD2-CE2 3.45Å; F438-Y444 AromaticContact CD2-CG 3.47Å; F438-Y444 HydrophobicContact CD2-CG 3.47Å; F438-Y444 VanDerWaalsContact CD2-CG 3.47Å; F438-Y444 AromaticContact CD2-CZ 3.52Å; F438-Y444 HydrophobicContact CE2-CD1 4.33Å; F438-Y444 AromaticContact CE2-CD2 3.3Å; F438-Y444 HydrophobicContact CE2-CD2 3.3Å; F438-Y444 HydrophobicContact CE2-CE1 4.31Å; F438-Y444 AromaticContact CE2-CE2 3.32Å; F438-Y444 HydrophobicContact CE2-CE2 3.32Å; F438-Y444 AromaticContact CE2-CG 3.85Å; F438-Y444 HydrophobicContact CE2-CG 3.85Å; F438-Y444 AromaticContact CE2-CZ 3.85Å; F438-Y444 HydrophobicContact CG-CD1 4.24Å; F438-Y444 AromaticContact CG-CE1 3.9Å; F438-Y444 HydrophobicContact CG-CE1 3.9Å; F438-Y444 HydrophobicContact CG-CE2 4.27Å; F438-Y444 AromaticContact CG-CZ 3.93Å; F438-Y444 HydrophobicContact CZ-CD2 4.39Å; F438-Y444 HydrophobicContact CZ-CE2 4.07Å
439D87.9Confident89.3Confident45 Ų4548.7 Ų48.724%0.24123%0.229CC..Hα-helixtrans-56.2-37.2-178.6-67.1-29.5000111.6K51 G52 G435 W436 Q442K51-D439 WeakPolarHBondContact CB-OD1 2.94Å; K51-D439 PolarHBondContact N-OD1 3.46Å; K51-D439 PolarHBondContact N-OD2 3.41Å; G52-D439 PolarHBondContact N-OD2 2.93Å; G435-D439 VanDerWaalsContact O-CG 3.27Å; G435-D439 PolarHBondContact O-N 3.22Å; W436-D439 PolarHBondContact O-N 2.98Å; D439-Q442 PolarHBondContact O-NE2 3.45Å
440W87.5Confident89.2Confident196 Ų19649.3 Ų49.374%0.74223%0.229SC*.Hα-helixtrans-80-37.5177.7-63.4-21.5000114.6W436 F438W436-W440 PolarHBondContact O-N 3.06Å; F438-W440 PolarHBondContact O-N 3.25Å; F438-W440 VanDerWaalsContact O-N 3.17Å
441T87.5Confident89.2Confident57 Ų5749.3 Ų49.335%0.3523%0.229SC..Hα-helixtrans-105.5-12.1-168.866.70000113.9F437 F438 S443 L446F437-T441 WeakPolarHBondContact O-CB 3.46Å; F437-T441 WeakPolarHBondContact O-CG2 3.43Å; F437-T441 PolarHBondContact O-N 2.79Å; F437-T441 PolarHBondContact O-OG1 3.22Å; F438-T441 PolarHBondContact O-N 3.24Å; T441-S443 PolarHBondContact O-N 3.24Å; T441-S443 VanDerWaalsContact O-N 3.1Å; T441-S443 PolarHBondContact OG1-O 2.86Å; T441-L446 HydrophobicContact CG2-CD1 3.72Å
442Q84.3Confident89.2Confident135 Ų13549.3 Ų49.363%0.63123%0.229SC*.SBendtrans55.219.3-175.7-59.4-67.7-5200113.8F438 D439F438-Q442 VanDerWaalsContact O-CA 3.28Å; F438-Q442 WeakPolarHBondContact O-CA 3.47Å; F438-Q442 PolarHBondContact O-N 2.84Å; D439-Q442 PolarHBondContact O-NE2 3.45Å
443S85.2Confident89.3Confident38 Ų3850.9 Ų50.927%0.26625%0.245SC..  trans-136.5145.2175.9170.20000110.4T441 D445T441-S443 PolarHBondContact O-N 3.24Å; T441-S443 VanDerWaalsContact O-N 3.1Å; T441-S443 PolarHBondContact OG1-O 2.86Å; S443-D445 VanDerWaalsContact OG-CG 3.24Å; S443-D445 PolarHBondContact OG-N 3.46Å; S443-D445 VanDerWaalsContact OG-N 3.16Å; S443-D445 PolarHBondContact OG-OD2 2.84Å
444Y83.2Confident89.4Confident13 Ų1349.4 Ų49.45%0.05124%0.237CC..SBendtrans-83.9-11.6176.1-82.1-66.1000113.6K51 F310 D313 V314 F438 L446 A447 F448K51-Y444 WeakPolarHBondContact CD-OH 2.84Å; K51-Y444 PolarHBondContact NZ-OH 3.08Å; F310-Y444 HydrophobicContact CB-CE1 4.12Å; F310-Y444 AromaticContact CD1-CE1 3.93Å; F310-Y444 HydrophobicContact CD1-CE1 3.93Å; F310-Y444 HydrophobicContact CG-CE1 4.06Å; D313-Y444 VanDerWaalsContact OD2-CE2 3.28Å; D313-Y444 WeakPolarHBondContact OD2-CE2 3.46Å; D313-Y444 VanDerWaalsContact OD2-CZ 3.25Å; D313-Y444 PolarHBondContact OD2-OH 2.87Å; V314-Y444 HydrophobicContact CB-CD2 4.44Å; V314-Y444 HydrophobicContact CG2-CD1 4.09Å; V314-Y444 HydrophobicContact CG2-CD2 3.49Å; V314-Y444 VanDerWaalsContact CG2-CD2 3.49Å; V314-Y444 HydrophobicContact CG2-CE1 4.38Å; V314-Y444 HydrophobicContact CG2-CE2 3.78Å; V314-Y444 HydrophobicContact CG2-CG 3.64Å; F438-Y444 HydrophobicContact CB-CD1 4.28Å; F438-Y444 HydrophobicContact CB-CE1 3.99Å; F438-Y444 AromaticContact CD2-CD1 3.55Å; F438-Y444 HydrophobicContact CD2-CD1 3.55Å; F438-Y444 AromaticContact CD2-CD2 3.41Å; F438-Y444 HydrophobicContact CD2-CD2 3.41Å; F438-Y444 VanDerWaalsContact CD2-CD2 3.41Å; F438-Y444 AromaticContact CD2-CE1 3.55Å; F438-Y444 HydrophobicContact CD2-CE1 3.55Å; F438-Y444 AromaticContact CD2-CE2 3.45Å; F438-Y444 HydrophobicContact CD2-CE2 3.45Å; F438-Y444 VanDerWaalsContact CD2-CE2 3.45Å; F438-Y444 AromaticContact CD2-CG 3.47Å; F438-Y444 HydrophobicContact CD2-CG 3.47Å; F438-Y444 VanDerWaalsContact CD2-CG 3.47Å; F438-Y444 AromaticContact CD2-CZ 3.52Å; F438-Y444 HydrophobicContact CE2-CD1 4.33Å; F438-Y444 AromaticContact CE2-CD2 3.3Å; F438-Y444 HydrophobicContact CE2-CD2 3.3Å; F438-Y444 HydrophobicContact CE2-CE1 4.31Å; F438-Y444 AromaticContact CE2-CE2 3.32Å; F438-Y444 HydrophobicContact CE2-CE2 3.32Å; F438-Y444 AromaticContact CE2-CG 3.85Å; F438-Y444 HydrophobicContact CE2-CG 3.85Å; F438-Y444 AromaticContact CE2-CZ 3.85Å; F438-Y444 HydrophobicContact CG-CD1 4.24Å; F438-Y444 AromaticContact CG-CE1 3.9Å; F438-Y444 HydrophobicContact CG-CE1 3.9Å; F438-Y444 HydrophobicContact CG-CE2 4.27Å; F438-Y444 AromaticContact CG-CZ 3.93Å; F438-Y444 HydrophobicContact CZ-CD2 4.39Å; F438-Y444 HydrophobicContact CZ-CE2 4.07Å; Y444-L446 PolarHBondContact O-N 3.29Å; Y444-A447 HydrophobicContact CD1-CB 4.4Å; Y444-A447 WeakPolarHBondContact O-CA 3.49Å; Y444-A447 VanDerWaalsContact O-CB 3.3Å; Y444-A447 WeakPolarHBondContact O-CB 3.29Å; Y444-A447 PolarHBondContact O-N 3.41Å; Y444-A447 VanDerWaalsContact O-N 3.07Å; Y444-F448 HydrophobicContact CD1-CE2 4.41Å; Y444-F448 HydrophobicContact CG-CE2 4.32Å; Y444-F448 VanDerWaalsContact O-CD2 3.24Å; Y444-F448 WeakPolarHBondContact O-CD2 3.44Å; Y444-F448 PolarHBondContact O-N 2.86Å
445D87.3Confident89.6Confident65 Ų6549.4 Ų49.435%0.34824%0.237SC..Hα-helixtrans-59.3-50.7-173.2-60.4-20.8000111.6P374 S443 A447 F448 Y449P374-D445 HydrophobicContact CB-CB 4.24Å; S443-D445 VanDerWaalsContact OG-CG 3.24Å; S443-D445 PolarHBondContact OG-N 3.46Å; S443-D445 VanDerWaalsContact OG-N 3.16Å; S443-D445 PolarHBondContact OG-OD2 2.84Å; D445-A447 PolarHBondContact O-N 2.93Å; D445-F448 PolarHBondContact O-N 3.07Å; D445-Y449 HydrophobicContact CB-CD2 4.41Å; D445-Y449 HydrophobicContact CB-CE2 4.01Å; D445-Y449 WeakPolarHBondContact O-CB 3.48Å; D445-Y449 WeakPolarHBondContact O-CD2 3.44Å; D445-Y449 VanDerWaalsContact O-CG 3.25Å; D445-Y449 PolarHBondContact O-N 3.26Å
446L86.7Confident89.8Confident96 Ų9651.1 Ų51.150%0.50325%0.246SC..Hα-helixtrans-63-33.8178-72171.4000112.1T441 Y444 Y449 F450T441-L446 HydrophobicContact CG2-CD1 3.72Å; Y444-L446 PolarHBondContact O-N 3.29Å; L446-Y449 PolarHBondContact O-N 2.89Å; L446-F450 WeakPolarHBondContact O-CB 3.42Å; L446-F450 PolarHBondContact O-N 3.42Å
447A87.8Confident90Very high0 Ų051.6 Ų51.60%026%0.255CS..Hα-helixtrans-68.9-40.5-179.400000111.3V434 F437 Y444 D445 S451V434-A447 HydrophobicContact CB-CB 4.34Å; V434-A447 HydrophobicContact CG1-CB 3.44Å; V434-A447 VanDerWaalsContact CG1-CB 3.44Å; F437-A447 HydrophobicContact CB-CB 4.18Å; Y444-A447 HydrophobicContact CD1-CB 4.4Å; Y444-A447 WeakPolarHBondContact O-CA 3.49Å; Y444-A447 VanDerWaalsContact O-CB 3.3Å; Y444-A447 WeakPolarHBondContact O-CB 3.29Å; Y444-A447 PolarHBondContact O-N 3.41Å; Y444-A447 VanDerWaalsContact O-N 3.07Å; D445-A447 PolarHBondContact O-N 2.93Å; A447-S451 WeakPolarHBondContact O-CB 3.21Å; A447-S451 PolarHBondContact O-N 3.01Å; A447-S451 PolarHBondContact O-OG 3.13Å
448F89.6Confident90.1Very high4 Ų448.8 Ų48.82%0.01824%0.242CC..Hα-helixtrans-75.6-35173.5-76.1-66.7000113.2P307 V314 I373 P374 Y444 D445 F450 S451 G452P307-F448 HydrophobicContact CB-CE1 3.85Å; P307-F448 HydrophobicContact CG-CD1 4.21Å; P307-F448 HydrophobicContact CG-CE1 3.92Å; V314-F448 HydrophobicContact CG2-CE2 3.61Å; V314-F448 HydrophobicContact CG2-CZ 3.89Å; I373-F448 HydrophobicContact CD1-CD1 4.26Å; I373-F448 HydrophobicContact CD1-CE1 4.19Å; I373-F448 HydrophobicContact CG2-CD1 4.26Å; I373-F448 HydrophobicContact CG2-CD2 4.15Å; I373-F448 HydrophobicContact CG2-CE1 4.2Å; I373-F448 HydrophobicContact CG2-CE2 4.09Å; I373-F448 HydrophobicContact CG2-CG 4.25Å; I373-F448 HydrophobicContact CG2-CZ 4.13Å; P374-F448 HydrophobicContact CG-CB 3.58Å; P374-F448 HydrophobicContact CG-CD2 4.36Å; P374-F448 HydrophobicContact CG-CG 4.31Å; Y444-F448 HydrophobicContact CD1-CE2 4.41Å; Y444-F448 HydrophobicContact CG-CE2 4.32Å; Y444-F448 VanDerWaalsContact O-CD2 3.24Å; Y444-F448 WeakPolarHBondContact O-CD2 3.44Å; Y444-F448 PolarHBondContact O-N 2.86Å; D445-F448 PolarHBondContact O-N 3.07Å; F448-F450 VanDerWaalsContact C-N 3.34Å; F448-S451 PolarHBondContact O-N 2.91Å; F448-G452 PolarHBondContact O-N 3.29Å
449Y92.5Very high90.4Very high101 Ų10147.7 Ų47.740%0.39624%0.237SC..Hα-helixtrans-63.2-41.4172.1-67.8-41000112L371 P374 D445 L446 G453L371-Y449 HydrophobicContact CD2-CD1 3.83Å; P374-Y449 HydrophobicContact CB-CE1 4.36Å; P374-Y449 HydrophobicContact CG-CD1 4.47Å; P374-Y449 HydrophobicContact CG-CE1 4.12Å; D445-Y449 HydrophobicContact CB-CD2 4.41Å; D445-Y449 HydrophobicContact CB-CE2 4.01Å; D445-Y449 WeakPolarHBondContact O-CB 3.48Å; D445-Y449 WeakPolarHBondContact O-CD2 3.44Å; D445-Y449 VanDerWaalsContact O-CG 3.25Å; D445-Y449 PolarHBondContact O-N 3.26Å; L446-Y449 PolarHBondContact O-N 2.89Å; Y449-G453 PolarHBondContact O-N 3.29Å
450F92.8Very high90.6Very high72 Ų7248.7 Ų48.732%0.31625%0.245SC..Hα-helixtrans-60.7-48.1171.8175.1-99.2000111.4L302 V433 V434 F437 L446 F448 G453 S454L302-F450 HydrophobicContact CD2-CE1 4.28Å; L302-F450 HydrophobicContact CD2-CZ 4.03Å; L302-F450 HydrophobicContact CG-CE1 4.44Å; V433-F450 HydrophobicContact CG1-CE1 3.85Å; V433-F450 HydrophobicContact CG1-CZ 4.1Å; V434-F450 HydrophobicContact CG2-CD1 4.18Å; F437-F450 HydrophobicContact CE2-CB 4.41Å; F437-F450 HydrophobicContact CE2-CD1 4.2Å; F437-F450 HydrophobicContact CE2-CD2 4.08Å; F437-F450 HydrophobicContact CE2-CE2 4.41Å; F437-F450 AromaticContact CE2-CG 3.96Å; F437-F450 HydrophobicContact CE2-CG 3.96Å; F437-F450 HydrophobicContact CZ-CD2 4.38Å; L446-F450 WeakPolarHBondContact O-CB 3.42Å; L446-F450 PolarHBondContact O-N 3.42Å; F448-F450 VanDerWaalsContact C-N 3.34Å; F450-G453 PolarHBondContact O-N 2.98Å; F450-S454 WeakPolarHBondContact O-CB 3.24Å; F450-S454 PolarHBondContact O-N 3.02Å; F450-S454 PolarHBondContact O-OG 3.37Å
451S92.9Very high90.6Very high0 Ų041.1 Ų41.10%022%0.22CC..Hα-helixtrans-59.3-54.3178.8-66.20000111.7G303 V434 A447 F448 G453 S454 V455G303-S451 WeakPolarHBondContact O-CB 3.4Å; V434-S451 WeakPolarHBondContact CG2-OG 3.49Å; A447-S451 WeakPolarHBondContact O-CB 3.21Å; A447-S451 PolarHBondContact O-N 3.01Å; A447-S451 PolarHBondContact O-OG 3.13Å; F448-S451 PolarHBondContact O-N 2.91Å; S451-G453 PolarHBondContact O-N 3.29Å; S451-S454 PolarHBondContact O-N 3.16Å; S451-S454 PolarHBondContact O-OG 2.86Å; S451-V455 WeakPolarHBondContact O-CG2 3.47Å; S451-V455 PolarHBondContact O-N 2.87Å; S451-V455 VanDerWaalsContact O-N 3.14Å
452G94.1Very high90.5Very high0 Ų038.8 Ų38.80%021%0.206CC..Hα-helixtrans-61.5-41.917800000113.1F448 S454 V455 L456F448-G452 PolarHBondContact O-N 3.29Å; G452-S454 PolarHBondContact O-N 3Å; G452-V455 PolarHBondContact O-N 3.33Å; G452-L456 WeakPolarHBondContact O-CB 3.22Å; G452-L456 VanDerWaalsContact O-CG 3.32Å; G452-L456 WeakPolarHBondContact O-CG 3.31Å; G452-L456 PolarHBondContact O-N 2.99Å
453G94.9Very high90.7Very high33 Ų3336.5 Ų36.534%0.3419%0.194SC..Hα-helixtrans-61.5-43.1176.500000112.9Y449 F450 S451 L456 L457Y449-G453 PolarHBondContact O-N 3.29Å; F450-G453 PolarHBondContact O-N 2.98Å; S451-G453 PolarHBondContact O-N 3.29Å; G453-L456 PolarHBondContact O-N 3.32Å; G453-L457 WeakPolarHBondContact O-CB 3.41Å; G453-L457 PolarHBondContact O-N 3.43Å
454S94.8Very high90.7Very high10 Ų1039 Ų397%0.0720%0.204CC..Hα-helixtrans-63.3-44.6176.971.30000112L299 G303 F450 S451 G452 L457 G458L299-S454 WeakPolarHBondContact CB-O 3.26Å; G303-S454 WeakPolarHBondContact CA-OG 3.48Å; F450-S454 WeakPolarHBondContact O-CB 3.24Å; F450-S454 PolarHBondContact O-N 3.02Å; F450-S454 PolarHBondContact O-OG 3.37Å; S451-S454 PolarHBondContact O-N 3.16Å; S451-S454 PolarHBondContact O-OG 2.86Å; G452-S454 PolarHBondContact O-N 3Å; S454-L457 PolarHBondContact O-N 3.02Å; S454-G458 PolarHBondContact O-N 3.44Å
455V95.1Very high90.4Very high0 Ų040 Ų400%021%0.212CC..Hα-helixtrans-65.2-43177.8177.60000111.6F300 A304 L363 T366 L370 S451 G452 L457 G458 G459F300-V455 HydrophobicContact CD2-CG1 3.93Å; F300-V455 HydrophobicContact CD2-CG2 4.42Å; A304-V455 HydrophobicContact CB-CG2 4.49Å; L363-V455 HydrophobicContact CD2-CG1 4.24Å; L363-V455 VanDerWaalsContact O-CG1 3.32Å; L363-V455 WeakPolarHBondContact O-CG1 3.18Å; T366-V455 HydrophobicContact CG2-CG1 4.38Å; L370-V455 HydrophobicContact CD1-CG2 4.1Å; S451-V455 WeakPolarHBondContact O-CG2 3.47Å; S451-V455 PolarHBondContact O-N 2.87Å; S451-V455 VanDerWaalsContact O-N 3.14Å; G452-V455 PolarHBondContact O-N 3.33Å; V455-L457 PolarHBondContact O-N 3.36Å; V455-G458 PolarHBondContact O-N 2.89Å; V455-G459 PolarHBondContact O-N 2.87Å
456L95.3Very high89.7Confident37 Ų3738.1 Ų38.119%0.19421%0.206CC..Hα-helixtrans-61.5-43.2176.2-75.7178.3000111.9L364 T368 L371 G452 G453 G458 G459 V460L364-L456 HydrophobicContact CD2-CD2 3.81Å; T368-L456 HydrophobicContact CG2-CD2 4.07Å; L371-L456 HydrophobicContact CD1-CD1 3.45Å; L371-L456 VanDerWaalsContact CD1-CD1 3.45Å; L371-L456 HydrophobicContact CG-CD1 4.29Å; G452-L456 WeakPolarHBondContact O-CB 3.22Å; G452-L456 VanDerWaalsContact O-CG 3.32Å; G452-L456 WeakPolarHBondContact O-CG 3.31Å; G452-L456 PolarHBondContact O-N 2.99Å; G453-L456 PolarHBondContact O-N 3.32Å; L456-G458 VanDerWaalsContact C-N 3.29Å; L456-G458 PolarHBondContact O-N 3.44Å; L456-G459 PolarHBondContact O-N 2.8Å; L456-G459 VanDerWaalsContact O-N 3.15Å; L456-V460 WeakPolarHBondContact O-CG2 3.42Å; L456-V460 PolarHBondContact O-N 3.18Å
457L94.9Very high89.3Confident100 Ų10036.7 Ų36.752%0.52420%0.198SC..Hα-helixtrans-59.5-41.8176.1-177.166000111.2L299 G453 S454 V455 T461L299-L457 HydrophobicContact CD1-CB 4.26Å; L299-L457 HydrophobicContact CD1-CD2 3.97Å; L299-L457 HydrophobicContact CD1-CG 3.97Å; G453-L457 WeakPolarHBondContact O-CB 3.41Å; G453-L457 PolarHBondContact O-N 3.43Å; S454-L457 PolarHBondContact O-N 3.02Å; V455-L457 PolarHBondContact O-N 3.36Å; L457-T461 WeakPolarHBondContact O-CB 2.95Å; L457-T461 PolarHBondContact O-N 3.02Å; L457-T461 PolarHBondContact O-OG1 2.85Å
458G92.1Very high88Confident0 Ų041.3 Ų41.30%023%0.228CC..Hα-helixtrans-61.6-44.2173.200000112.8A296 S454 V455 L456 T461 L462A296-G458 WeakPolarHBondContact CB-O 3.28Å; S454-G458 PolarHBondContact O-N 3.44Å; V455-G458 PolarHBondContact O-N 2.89Å; L456-G458 VanDerWaalsContact C-N 3.29Å; L456-G458 PolarHBondContact O-N 3.44Å; G458-T461 PolarHBondContact O-N 3.06Å; G458-L462 PolarHBondContact O-N 2.79Å; G458-L462 VanDerWaalsContact O-N 3.08Å
459G91.5Very high86.1Confident0 Ų046.3 Ų46.30%026%0.263CS..Hα-helixtrans-62.2-46.5176.400000113.4V455 L456 L462 F463V455-G459 PolarHBondContact O-N 2.87Å; L456-G459 PolarHBondContact O-N 2.8Å; L456-G459 VanDerWaalsContact O-N 3.15Å; G459-L462 PolarHBondContact O-N 2.77Å; G459-F463 WeakPolarHBondContact O-CB 3.41Å; G459-F463 PolarHBondContact O-N 3.35Å
460V91.8Very high84Confident65 Ų6548.4 Ų48.439%0.39427%0.27SS..Hα-helixtrans-63.9-42.3176.5172.40000110.8L364 L456 L462 F463 L464L364-V460 HydrophobicContact CD2-CG2 4.03Å; L456-V460 WeakPolarHBondContact O-CG2 3.42Å; L456-V460 PolarHBondContact O-N 3.18Å; V460-L462 PolarHBondContact O-N 3.48Å; V460-F463 PolarHBondContact O-N 3.44Å; V460-L464 HydrophobicContact CG1-CD1 3.84Å; V460-L464 HydrophobicContact CG1-CG 4.14Å; V460-L464 WeakPolarHBondContact O-CB 3.18Å; V460-L464 VanDerWaalsContact O-CG 3.28Å; V460-L464 WeakPolarHBondContact O-CG 3.27Å; V460-L464 PolarHBondContact O-N 3.27Å
461T88.4Confident81.9Confident37 Ų3749.4 Ų49.423%0.22728%0.278CS..Hα-helixtrans-58.6-47.3177.6-57.60000111.1L457 G458 L464 C465L457-T461 WeakPolarHBondContact O-CB 2.95Å; L457-T461 PolarHBondContact O-N 3.02Å; L457-T461 PolarHBondContact O-OG1 2.85Å; G458-T461 PolarHBondContact O-N 3.06Å; T461-L464 PolarHBondContact O-N 3.19Å; T461-C465 PolarHBondContact O-N 2.87Å; T461-C465 VanDerWaalsContact O-N 3.08Å; T461-C465 PolarHBondContact O-SG 3.49Å; T461-C465 VanDerWaalsContact O-SG 3.41Å
462L86.4Confident79.6Confident9 Ų956.7 Ų56.75%0.04731%0.31CS..Hα-helixtrans-66.5-39176.1-88.3172.1000113L293 A296 Y359 A360 L363 G458 G459 V460 C465 A466L293-L462 HydrophobicContact CB-CD2 4.42Å; L293-L462 HydrophobicContact CD1-CD1 4.11Å; L293-L462 HydrophobicContact CD1-CD2 3.87Å; A296-L462 HydrophobicContact CB-CB 4.45Å; A296-L462 HydrophobicContact CB-CD1 3.28Å; A296-L462 HydrophobicContact CB-CD2 4.38Å; A296-L462 HydrophobicContact CB-CG 3.41Å; A296-L462 VanDerWaalsContact CB-CG 3.41Å; Y359-L462 HydrophobicContact CD1-CD1 3.56Å; Y359-L462 HydrophobicContact CE1-CD1 3.63Å; A360-L462 HydrophobicContact CB-CB 4.49Å; L363-L462 HydrophobicContact CD1-CD1 3.62Å; G458-L462 PolarHBondContact O-N 2.79Å; G458-L462 VanDerWaalsContact O-N 3.08Å; G459-L462 PolarHBondContact O-N 2.77Å; V460-L462 PolarHBondContact O-N 3.48Å; L462-C465 PolarHBondContact O-N 2.84Å; L462-A466 WeakPolarHBondContact O-CB 3.33Å; L462-A466 PolarHBondContact O-N 3.46Å
463F87.9Confident77Confident86 Ų8664.9 Ų64.938%0.37735%0.346SS..Hα-helixtrans-62-44.6177.1-172.6-94.6000111.6F357 A360 G459 V460 A466 L467F357-F463 AromaticContact CD1-CD2 3.76Å; F357-F463 HydrophobicContact CD1-CD2 3.76Å; F357-F463 AromaticContact CD1-CE2 3.61Å; F357-F463 HydrophobicContact CD1-CE2 3.61Å; F357-F463 AromaticContact CE1-CD2 3.88Å; F357-F463 HydrophobicContact CE1-CD2 3.88Å; F357-F463 AromaticContact CE1-CE2 3.62Å; F357-F463 HydrophobicContact CE1-CE2 3.62Å; F357-F463 HydrophobicContact CE1-CZ 4.2Å; A360-F463 HydrophobicContact CB-CB 4.16Å; A360-F463 HydrophobicContact CB-CD2 4.32Å; G459-F463 WeakPolarHBondContact O-CB 3.41Å; G459-F463 PolarHBondContact O-N 3.35Å; V460-F463 PolarHBondContact O-N 3.44Å; F463-A466 PolarHBondContact O-N 2.93Å; F463-L467 HydrophobicContact CE1-CD2 4.33Å; F463-L467 PolarHBondContact O-N 3.39Å
464L85.3Confident74.4Confident91 Ų9168.8 Ų68.848%0.47635%0.354SS..Hα-helixtrans-64.4-41.3177.5-70.4174.6000112.1V460 T461 A466 L467V460-L464 HydrophobicContact CG1-CD1 3.84Å; V460-L464 HydrophobicContact CG1-CG 4.14Å; V460-L464 WeakPolarHBondContact O-CB 3.18Å; V460-L464 VanDerWaalsContact O-CG 3.28Å; V460-L464 WeakPolarHBondContact O-CG 3.27Å; V460-L464 PolarHBondContact O-N 3.27Å; T461-L464 PolarHBondContact O-N 3.19Å; L464-A466 VanDerWaalsContact C-N 3.26Å; L464-A466 PolarHBondContact O-N 2.97Å; L464-L467 HydrophobicContact CD2-CD1 4.05Å; L464-L467 WeakPolarHBondContact O-CB 3.34Å; L464-L467 PolarHBondContact O-N 3.25Å
465C76.9Confident71.7Confident34 Ų3471.3 Ų71.323%0.2338%0.375CS..Hα-helixtrans-68.2-25175.3-71.20000113.2A292 T461 L462 L467A292-C465 HydrophobicContact CB-CB 4.15Å; A292-C465 WeakPolarHBondContact CB-SG 3.38Å; T461-C465 PolarHBondContact O-N 2.87Å; T461-C465 VanDerWaalsContact O-N 3.08Å; T461-C465 PolarHBondContact O-SG 3.49Å; T461-C465 VanDerWaalsContact O-SG 3.41Å; L462-C465 PolarHBondContact O-N 2.84Å; C465-L467 VanDerWaalsContact C-N 3.3Å
466A72.8Confident69Low25 Ų2578.6 Ų78.621%0.20741%0.414CS..THydrogen-bonded Turntrans-79.4-10176.400000113.6V356 F357 L462 F463 L464V356-A466 HydrophobicContact CB-CB 4.5Å; V356-A466 HydrophobicContact CG1-CB 3.71Å; F357-A466 HydrophobicContact CD1-CB 4.34Å; F357-A466 HydrophobicContact CE1-CB 3.87Å; F357-A466 HydrophobicContact CE2-CB 4.22Å; F357-A466 HydrophobicContact CZ-CB 3.79Å; F357-A466 WeakPolarHBondContact CZ-O 3.16Å; L462-A466 WeakPolarHBondContact O-CB 3.33Å; L462-A466 PolarHBondContact O-N 3.46Å; F463-A466 PolarHBondContact O-N 2.93Å; L464-A466 VanDerWaalsContact C-N 3.26Å; L464-A466 PolarHBondContact O-N 2.97Å
467L77.4Confident66.4Low66 Ų6683.3 Ų83.335%0.34644%0.438SS..SBendtrans-70.8132.3179.6-70.6171.8000111.1F463 L464 C465 C469 W470F463-L467 HydrophobicContact CE1-CD2 4.33Å; F463-L467 PolarHBondContact O-N 3.39Å; L464-L467 HydrophobicContact CD2-CD1 4.05Å; L464-L467 WeakPolarHBondContact O-CB 3.34Å; L464-L467 PolarHBondContact O-N 3.25Å; C465-L467 VanDerWaalsContact C-N 3.3Å; L467-C469 PolarHBondContact O-N 3.05Å; L467-W470 PolarHBondContact O-N 2.85Å
468P59.8Low63.6Low98 Ų9884.8 Ų84.864%0.63645%0.446SS*.THydrogen-bonded Turntrans-63-14-174.922.6-32.3000114.5W470P468-W470 PolarHBondContact O-N 3.36Å
469C50.2Low60.6Low109 Ų10995.3 Ų95.374%0.73649%0.486SS*.THydrogen-bonded Turntrans-68.1-19.8174.2-65.80000113.3L467L467-C469 PolarHBondContact O-N 3.05Å
470W48.6Very low57.9Low144 Ų14499.9 Ų99.955%0.54552%0.516SS..THydrogen-bonded Turntrans-85.5-25.7-177.7-152.9-87.4000113.2L467 P468L467-W470 PolarHBondContact O-N 2.85Å; P468-W470 PolarHBondContact O-N 3.36Å
471D49.3Very low55.1Low93 Ų93104.3 Ų104.350%0.49754%0.537SS..THydrogen-bonded Turntrans-85.2-13.5-179.4-114.6-12.7000113.8K473 K474 A475D471-K473 PolarHBondContact O-N 3.01Å; D471-K473 VanDerWaalsContact O-N 3.12Å; D471-K474 PolarHBondContact O-N 3.47Å; D471-A475 PolarHBondContact O-N 2.86Å
472K43.1Very low52.6Low154 Ų154109 Ų10967%0.6756%0.559SS**Hα-helixtrans-58.4-26.4176.7-86.8-173.6172.7-177.90113.3K474K472-K474 VanDerWaalsContact C-N 3.3Å; K472-K474 PolarHBondContact O-N 3.25Å
473K40.9Very low49.7Very low171 Ų171116.5 Ų116.574%0.74359%0.594SS**Hα-helixtrans-72-17.5177.3-107.6-178.7179.3177.70114.5D471D471-K473 PolarHBondContact O-N 3.01Å; D471-K473 VanDerWaalsContact O-N 3.12Å
474K39.6Very low47.1Very low116 Ų116122.4 Ų122.450%0.50462%0.616SS.*Hα-helixtrans-95.4-32.5174.2-114174.7177.7176.10111.8D287 D471 K472 D476 I477D287-K474 IonicContact OD2-NZ 2.72Å; D471-K474 PolarHBondContact O-N 3.47Å; K472-K474 VanDerWaalsContact C-N 3.3Å; K472-K474 PolarHBondContact O-N 3.25Å; K474-D476 VanDerWaalsContact C-N 3.27Å; K474-D476 PolarHBondContact O-N 3.36Å; K474-I477 PolarHBondContact O-N 3.08Å
475A38Very low44.6Very low63 Ų63124 Ų12452%0.52163%0.629SS.*Hα-helixtrans-66.4-23179.300000114.5D471D471-A475 PolarHBondContact O-N 2.86Å
476D37.8Very low42.6Very low152 Ų152128 Ų12881%0.81365%0.653SS**THydrogen-bonded Turntrans-86.8-4.5176.6-88.1-19000114.3K474K474-D476 VanDerWaalsContact C-N 3.27Å; K474-D476 PolarHBondContact O-N 3.36Å
477I41.3Very low40.8Very low136 Ų136134.3 Ų134.370%0.69768%0.683SS**THydrogen-bonded Turntrans-107.6-23.5-177-57.9176.9000112.5K474K474-I477 PolarHBondContact O-N 3.08Å
478D37.1Very low38.9Very low132 Ų132136.4 Ų136.471%0.70670%0.702SS**  trans-109.535.4-174.8-84.1-27000114.8P480D478-P480 VanDerWaalsContact C-CD 3.42Å; D478-P480 WeakPolarHBondContact O-CD 3.36Å
479R28.4Very low37.7Very low220 Ų220139.4 Ų139.483%0.8371%0.713SS**  trans-97.291.5161.1-77.3-169.6-178-174.82110.6
480P34Very low37Very low97 Ų97143.4 Ų143.463%0.6372%0.717SS**  trans-70.5130.2143.830.6-26.5000107.1D478 I482D478-P480 VanDerWaalsContact C-CD 3.42Å; D478-P480 WeakPolarHBondContact O-CD 3.36Å; P480-I482 PolarHBondContact O-N 3.15Å
481D33.6Very low36.7Very low158 Ų158143.8 Ų143.885%0.84574%0.736SS**  trans-55.697172.5-71.9-46.9000110Q483D481-Q483 VanDerWaalsContact C-N 3.3Å; D481-Q483 PolarHBondContact O-N 3.35Å
482I35.1Very low36.2Very low134 Ų134144 Ų14469%0.68775%0.75SS**  trans-78.690.5166.8-59.9175.4000105.9P480 Y484P480-I482 PolarHBondContact O-N 3.15Å; I482-Y484 PolarHBondContact O-N 2.87Å
483Q27.5Very low36.1Very low168 Ų168142 Ų14279%0.78576%0.756SS**  trans-53.5109.3155.2-90176-25.700107.5D481 T485D481-Q483 VanDerWaalsContact C-N 3.3Å; D481-Q483 PolarHBondContact O-N 3.35Å; Q483-T485 VanDerWaalsContact C-N 3.31Å; Q483-T485 PolarHBondContact O-N 3.14Å
484Y32.8Very low36.3Very low210 Ų210141.4 Ų141.482%0.82477%0.766SS**  trans-62.996.9162.6-81.4-95.8000107.3I482 T486I482-Y484 PolarHBondContact O-N 2.87Å; Y484-T486 VanDerWaalsContact C-N 3.27Å; Y484-T486 PolarHBondContact O-N 2.78Å
485T33.3Very low36Very low123 Ų123144.1 Ų144.176%0.75581%0.81SS**  trans-7294.3159.147.20000106.8Q483 N487Q483-T485 VanDerWaalsContact C-N 3.31Å; Q483-T485 PolarHBondContact O-N 3.14Å; T485-N487 VanDerWaalsContact C-N 3.32Å; T485-N487 PolarHBondContact O-N 2.73Å
486T33.3Very low35.9Very low120 Ų120148.2 Ų148.274%0.73683%0.825SS**  trans-61.996169.3-12.90000107.6Y484 C488Y484-T486 VanDerWaalsContact C-N 3.27Å; Y484-T486 PolarHBondContact O-N 2.78Å; T486-C488 PolarHBondContact O-N 3.17Å
487N35Very low35.8Very low157 Ų157148 Ų14884%0.8483%0.825SS**  trans-79.961.8173.4-127-6000109.2T485T485-N487 VanDerWaalsContact C-N 3.32Å; T485-N487 PolarHBondContact O-N 2.73Å
488C38.9Very low35.5Very low110 Ų110148.7 Ų148.774%0.74383%0.832SS**  trans-131.127.1179.9-103.90000113.6T486T486-C488 PolarHBondContact O-N 3.17Å
489D34.2Very low35.4Very low160 Ų160149.6 Ų149.686%0.85684%0.84SS**SBendtrans-132.934.1176.9-86.4-29.7000114.2
490K36.1Very low35.9Very low193 Ų193145.3 Ų145.384%0.83984%0.841SS**SBendtrans-127.226.6173.5-91.7-171.5178.5-179.90116.1
491V42.4Very low36Very low153 Ų153148.5 Ų148.593%0.92786%0.855SS**SBendtrans-132.756.1167.1-161.90000110.4
492A38.8Very low36.2Very low98 Ų98147.8 Ų147.881%0.8186%0.855SS**SBendtrans-162.855.7167.600000111.5
493S39.5Very low36.3Very low112 Ų112148.8 Ų148.878%0.78387%0.868SS**  trans-160.645.1164.759.20000113.3
494V45.1Very low37Very low157 Ų157147.3 Ų147.395%0.95288%0.875SS**  trans-127.378.2153.7-171.30000107.3
495A34.6Very low37.4Very low174 Ų174141.5 Ų141.5100%1.43888%0.88SS**  trans-140.70152.800000106.1

Retrieved 495 of 495 residues in 1082.8 ms (Link to these results)

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