A0A5K4F1A0_SCHMA Loading...

MFS domain-containing protein

AlphaFold DB (A0A5K4F490), UniProt , Accession A0A5K4F1A0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 507 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
1M35.1Very low64.5Low243 Ų243114.9 Ų114.9100%1.19763%0.628SS**  01020-73.5175.197.700106.5A3M1-A3 PolarHBondContact O-N 3Å
2D35.1Very low66.9Low156 Ų156105.6 Ų105.683%0.83458%0.577SS**  trans-59.8112.3172.8-78.3-34000107.7T4D2-T4 PolarHBondContact O-N 2.94Å
3A40.6Very low69.1Low92 Ų92105.3 Ų105.376%0.7657%0.573SS**  trans-63.294.2168.900000106.4M1 V5M1-A3 PolarHBondContact O-N 3Å; A3-V5 VanDerWaalsContact C-N 3.33Å; A3-V5 PolarHBondContact O-N 2.86Å
4T46.1Very low71Confident124 Ų12499.9 Ų99.976%0.76154%0.543SS*.  trans-59.1101.4171.944.80000106.4D2 K6D2-T4 PolarHBondContact O-N 2.94Å; T4-K6 PolarHBondContact O-N 3.41Å
5V54.3Low72.7Confident127 Ų12793.3 Ų93.377%0.7751%0.507SS*.  trans-53.8106.1174.7176.20000105.9A3 R7A3-V5 VanDerWaalsContact C-N 3.33Å; A3-V5 PolarHBondContact O-N 2.86Å; V5-R7 PolarHBondContact O-N 3.08Å
6K64.2Low74.1Confident199 Ų19990.9 Ų90.987%0.86549%0.491SS*.  trans-56.5108.8-178.1-102.8-176.8176.3178.10107.3T4T4-K6 PolarHBondContact O-N 3.41Å
7R73.5Confident75.4Confident154 Ų15492.7 Ų92.758%0.58149%0.489SS*.  trans-55.8130.1178.4-67.8179.2175.2153.72.5108.2V5 L9 E133V5-R7 PolarHBondContact O-N 3.08Å; R7-L9 PolarHBondContact O-N 2.81Å; R7-E133 IonicContact CZ-OE1 2.7Å; R7-E133 VanDerWaalsContact CZ-OE1 3.24Å; R7-E133 IonicContact NE-OE1 3.43Å; R7-E133 PolarHBondContact NE-OE1 3.03Å; R7-E133 IonicContact NE-OE2 3.24Å; R7-E133 PolarHBondContact NE-OE2 3.06Å; R7-E133 IonicContact NH2-OE1 3.91Å; R7-E133 PolarHBondContact NH2-OE1 3.29Å
8P85.6Confident76.7Confident32 Ų3287.6 Ų87.621%0.20846%0.462CS..  trans-77.459.7178.833.4-36.1000110.2G10 L11 L12 S128P8-G10 PolarHBondContact O-N 3.25Å; P8-L11 HydrophobicContact CB-CB 4.18Å; P8-L11 WeakPolarHBondContact O-CB 3.5Å; P8-L11 PolarHBondContact O-N 3.04Å; P8-L12 HydrophobicContact CG-CD1 4.42Å; P8-L12 WeakPolarHBondContact O-CG 3.45Å; P8-L12 PolarHBondContact O-N 3.02Å; P8-L12 VanDerWaalsContact O-N 3.11Å; P8-S128 WeakPolarHBondContact CG-O 3.03Å
9L88.7Confident77.7Confident93 Ų9383.7 Ų83.749%0.48744%0.44SS..Hα-helixtrans-55.4-40.5-171.5-165.179.1000111.8R7 L11 L12 I13 W137R7-L9 PolarHBondContact O-N 2.81Å; L9-L11 PolarHBondContact O-N 3.06Å; L9-L12 PolarHBondContact O-N 3.32Å; L9-L12 VanDerWaalsContact O-N 3.16Å; L9-I13 HydrophobicContact CD2-CD1 4.26Å; L9-I13 HydrophobicContact CG-CD1 4.03Å; L9-I13 WeakPolarHBondContact O-CG1 3.46Å; L9-I13 PolarHBondContact O-N 3.35Å; L9-W137 HydrophobicContact CD1-CH2 3.96Å; L9-W137 HydrophobicContact CD1-CZ2 4.44Å
10G91.9Very high78.7Confident43 Ų4380.3 Ų80.344%0.44342%0.422SS..Hα-helixtrans-58.7-42.6175.900000113.2P8 L14P8-G10 PolarHBondContact O-N 3.25Å; G10-L14 WeakPolarHBondContact O-CB 3.19Å; G10-L14 VanDerWaalsContact O-CG 3.29Å; G10-L14 WeakPolarHBondContact O-CG 3.42Å; G10-L14 PolarHBondContact O-N 3Å
11L94Very high79.6Confident1 Ų176.9 Ų76.91%0.00540%0.403CS..Hα-helixtrans-64.1-43.1174.9177.758.8000111.1P8 L9 I13 L14 L15 L77 T124 Y193P8-L11 HydrophobicContact CB-CB 4.18Å; P8-L11 WeakPolarHBondContact O-CB 3.5Å; P8-L11 PolarHBondContact O-N 3.04Å; L9-L11 PolarHBondContact O-N 3.06Å; L11-I13 PolarHBondContact O-N 3.15Å; L11-L14 PolarHBondContact O-N 3.38Å; L11-L15 HydrophobicContact CD1-CD1 4.2Å; L11-L15 HydrophobicContact CD1-CD2 4.37Å; L11-L15 HydrophobicContact CD1-CG 4Å; L11-L15 HydrophobicContact CG-CD1 4.02Å; L11-L15 HydrophobicContact CG-CG 4.25Å; L11-L15 VanDerWaalsContact O-CG 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.47Å; L11-L15 PolarHBondContact O-N 3.08Å; L11-L77 HydrophobicContact CD1-CD1 3.85Å; L11-T124 HydrophobicContact CD2-CG2 4.11Å; L11-Y193 HydrophobicContact CB-CE1 4.01Å; L11-Y193 HydrophobicContact CB-CE2 4.06Å; L11-Y193 HydrophobicContact CD1-CD1 4.01Å; L11-Y193 HydrophobicContact CD1-CE1 3.71Å; L11-Y193 HydrophobicContact CD2-CE1 4.14Å; L11-Y193 HydrophobicContact CG-CE1 4.16Å
12L94Very high82.6Confident3 Ų365.3 Ų65.32%0.01635%0.347CS..Hα-helixtrans-66-40.7-176.3-63.2166.1000111.7P8 L9 L15 F16 L125 V129 W137P8-L12 HydrophobicContact CG-CD1 4.42Å; P8-L12 WeakPolarHBondContact O-CG 3.45Å; P8-L12 PolarHBondContact O-N 3.02Å; P8-L12 VanDerWaalsContact O-N 3.11Å; L9-L12 PolarHBondContact O-N 3.32Å; L9-L12 VanDerWaalsContact O-N 3.16Å; L12-L15 PolarHBondContact O-N 3.38Å; L12-F16 PolarHBondContact O-N 3.17Å; L12-L125 HydrophobicContact CD2-CD1 3.51Å; L12-V129 HydrophobicContact CD1-CG2 4.26Å; L12-V129 HydrophobicContact CD2-CG2 3.7Å; L12-W137 HydrophobicContact CB-CE3 3.89Å; L12-W137 HydrophobicContact CB-CH2 4.13Å; L12-W137 HydrophobicContact CB-CZ3 3.64Å; L12-W137 HydrophobicContact CD1-CD2 3.73Å; L12-W137 HydrophobicContact CD1-CE3 3.88Å; L12-W137 HydrophobicContact CD1-CG 4.47Å; L12-W137 HydrophobicContact CD1-CH2 3.72Å; L12-W137 HydrophobicContact CD1-CZ2 3.55Å; L12-W137 HydrophobicContact CD1-CZ3 3.87Å; L12-W137 HydrophobicContact CD2-CD2 4.06Å; L12-W137 HydrophobicContact CD2-CE3 4.01Å; L12-W137 HydrophobicContact CD2-CG 4.32Å; L12-W137 HydrophobicContact CG-CD2 4.33Å; L12-W137 HydrophobicContact CG-CE3 4.13Å; L12-W137 HydrophobicContact CG-CZ3 4.22Å
13I94.9Very high85.5Confident102 Ų10258 Ų5852%0.52331%0.307SS..Hα-helixtrans-62.5-45.7172.6-66.5166.4000110.3L9 L11 L15 F16 W17L9-I13 HydrophobicContact CD2-CD1 4.26Å; L9-I13 HydrophobicContact CG-CD1 4.03Å; L9-I13 WeakPolarHBondContact O-CG1 3.46Å; L9-I13 PolarHBondContact O-N 3.35Å; L11-I13 PolarHBondContact O-N 3.15Å; I13-L15 VanDerWaalsContact C-N 3.34Å; I13-L15 PolarHBondContact O-N 3.1Å; I13-F16 PolarHBondContact O-N 3.05Å; I13-W17 WeakPolarHBondContact O-CB 3.38Å; I13-W17 PolarHBondContact O-N 3.12Å
14L95.9Very high88.2Confident30 Ų3053.7 Ų53.716%0.15727%0.272CS..Hα-helixtrans-61.8-40.1177.4-76.6167.7000112.4G10 L11 S18 L189 L190 Y193G10-L14 WeakPolarHBondContact O-CB 3.19Å; G10-L14 VanDerWaalsContact O-CG 3.29Å; G10-L14 WeakPolarHBondContact O-CG 3.42Å; G10-L14 PolarHBondContact O-N 3Å; L11-L14 PolarHBondContact O-N 3.38Å; L14-S18 WeakPolarHBondContact O-CB 3.49Å; L14-S18 PolarHBondContact O-N 3.1Å; L14-S18 PolarHBondContact O-OG 3.18Å; L14-L189 HydrophobicContact CD2-CB 3.62Å; L14-L189 HydrophobicContact CD2-CD1 4.07Å; L14-L189 HydrophobicContact CD2-CG 4.43Å; L14-L190 HydrophobicContact CB-CD2 3.96Å; L14-L190 HydrophobicContact CD1-CD2 4.49Å; L14-Y193 HydrophobicContact CD1-CD2 4.24Å; L14-Y193 HydrophobicContact CD1-CG 4.15Å
15L96.3Very high90.6Very high0 Ų047.8 Ų47.80%024%0.236CC..Hα-helixtrans-66.5-42.7177-70.1176.3000111.6L11 L12 I13 Y19 L77 F80 I121 T124 I141L11-L15 HydrophobicContact CD1-CD1 4.2Å; L11-L15 HydrophobicContact CD1-CD2 4.37Å; L11-L15 HydrophobicContact CD1-CG 4Å; L11-L15 HydrophobicContact CG-CD1 4.02Å; L11-L15 HydrophobicContact CG-CG 4.25Å; L11-L15 VanDerWaalsContact O-CG 3.28Å; L11-L15 WeakPolarHBondContact O-CG 3.47Å; L11-L15 PolarHBondContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 3.38Å; I13-L15 VanDerWaalsContact C-N 3.34Å; I13-L15 PolarHBondContact O-N 3.1Å; L15-Y19 WeakPolarHBondContact O-CB 3.34Å; L15-Y19 PolarHBondContact O-N 3.02Å; L15-L77 HydrophobicContact CD2-CD1 4.18Å; L15-F80 HydrophobicContact CD2-CD1 4.28Å; L15-F80 HydrophobicContact CD2-CE1 4.22Å; L15-I121 HydrophobicContact CD2-CG1 4.28Å; L15-T124 HydrophobicContact CD1-CG2 4.15Å; L15-I141 HydrophobicContact CB-CD1 3.93Å; L15-I141 HydrophobicContact CD1-CD1 4.27Å
16F96Very high92.6Very high56 Ų5643.1 Ų43.125%0.24620%0.204CC..Hα-helixtrans-59.8-51.2174.8-178.5-82.7000111.1L12 I13 Y19 F20 L140 L147L12-F16 PolarHBondContact O-N 3.17Å; I13-F16 PolarHBondContact O-N 3.05Å; F16-Y19 PolarHBondContact O-N 3.14Å; F16-F20 PolarHBondContact O-N 3.33Å; F16-L140 HydrophobicContact CD2-CG 4.26Å; F16-L140 VanDerWaalsContact CD2-O 3.28Å; F16-L140 WeakPolarHBondContact CD2-O 3.25Å; F16-L140 HydrophobicContact CE2-CD1 4.44Å; F16-L140 HydrophobicContact CE2-CG 4.41Å; F16-L140 WeakPolarHBondContact CE2-O 3.3Å; F16-L147 HydrophobicContact CE1-CD2 4.35Å; F16-L147 HydrophobicContact CZ-CD2 4.06Å
17W96.4Very high94.1Very high121 Ų12135.1 Ų35.146%0.45817%0.169SC..Hα-helixtrans-60-49.4179178.1-92.4000112.2I13 Y19 F20 F21 S186I13-W17 WeakPolarHBondContact O-CB 3.38Å; I13-W17 PolarHBondContact O-N 3.12Å; W17-Y19 VanDerWaalsContact C-N 3.3Å; W17-Y19 PolarHBondContact O-N 2.97Å; W17-F20 WeakPolarHBondContact O-CB 3.27Å; W17-F20 PolarHBondContact O-N 2.97Å; W17-F21 HydrophobicContact CD2-CD2 4.21Å; W17-F21 AromaticContact CD2-CE2 3.72Å; W17-F21 HydrophobicContact CD2-CE2 3.72Å; W17-F21 AromaticContact CE2-CD2 3.84Å; W17-F21 AromaticContact CE2-CE2 3.24Å; W17-F21 HydrophobicContact CE3-CE2 4.14Å; W17-F21 HydrophobicContact CG-CD2 4.38Å; W17-F21 HydrophobicContact CG-CE2 4.35Å; W17-F21 AromaticContact CH2-CE2 3.73Å; W17-F21 HydrophobicContact CH2-CE2 3.73Å; W17-F21 HydrophobicContact CH2-CZ 4.05Å; W17-F21 HydrophobicContact CZ2-CD2 4.26Å; W17-F21 AromaticContact CZ2-CE2 3.27Å; W17-F21 HydrophobicContact CZ2-CE2 3.27Å; W17-F21 AromaticContact CZ2-CZ 3.8Å; W17-F21 HydrophobicContact CZ2-CZ 3.8Å; W17-F21 HydrophobicContact CZ3-CE2 4.13Å; W17-F21 AromaticContact NE1-CD2 3.69Å; W17-F21 AromaticContact NE1-CE2 3.57Å; W17-F21 WeakPolarHBondContact O-CD2 3.43Å; W17-F21 PolarHBondContact O-N 3.04Å; W17-S186 PolarHBondContact NE1-OG 3.07Å
18S97.6Very high95.1Very high0 Ų027.9 Ų27.90%014%0.141CC..Hα-helixtrans-65.7-34.6-178.4-55.70000111.9L14 T22L14-S18 WeakPolarHBondContact O-CB 3.49Å; L14-S18 PolarHBondContact O-N 3.1Å; L14-S18 PolarHBondContact O-OG 3.18Å; S18-T22 WeakPolarHBondContact O-CB 3.44Å; S18-T22 PolarHBondContact O-N 3.24Å; S18-T22 PolarHBondContact O-OG1 3.47Å
19Y96.9Very high95.5Very high14 Ų1426.3 Ų26.36%0.05513%0.131CC..Hα-helixtrans-76.3-30.1177.9-168.4-124000113L15 F16 W17 T22 S23 W118 I121 I141 S144L15-Y19 WeakPolarHBondContact O-CB 3.34Å; L15-Y19 PolarHBondContact O-N 3.02Å; F16-Y19 PolarHBondContact O-N 3.14Å; W17-Y19 VanDerWaalsContact C-N 3.3Å; W17-Y19 PolarHBondContact O-N 2.97Å; Y19-T22 HydrophobicContact CD2-CG2 4.19Å; Y19-T22 HydrophobicContact CE2-CG2 4.38Å; Y19-T22 PolarHBondContact O-N 3.13Å; Y19-S23 WeakPolarHBondContact O-CB 3.17Å; Y19-S23 PolarHBondContact O-N 3.02Å; Y19-S23 PolarHBondContact O-OG 3.4Å; Y19-W118 HydrophobicContact CD1-CE3 4.26Å; Y19-W118 AromaticContact CD1-CZ3 3.91Å; Y19-W118 HydrophobicContact CD1-CZ3 3.91Å; Y19-W118 HydrophobicContact CD2-CE3 4.27Å; Y19-W118 AromaticContact CE1-CE3 3.67Å; Y19-W118 HydrophobicContact CE1-CE3 3.67Å; Y19-W118 AromaticContact CE1-CZ3 3.46Å; Y19-W118 HydrophobicContact CE1-CZ3 3.46Å; Y19-W118 VanDerWaalsContact CE1-CZ3 3.46Å; Y19-W118 AromaticContact CE2-CE3 3.66Å; Y19-W118 HydrophobicContact CE2-CE3 3.66Å; Y19-W118 HydrophobicContact CE2-CZ3 4.27Å; Y19-W118 AromaticContact CZ-CE3 3.33Å; Y19-W118 AromaticContact CZ-CZ3 3.68Å; Y19-I121 HydrophobicContact CD2-CD1 3.37Å; Y19-I121 HydrophobicContact CE2-CD1 4.17Å; Y19-I121 HydrophobicContact CG-CD1 3.74Å; Y19-I141 HydrophobicContact CD1-CG2 4Å; Y19-I141 WeakPolarHBondContact CD1-O 3.04Å; Y19-I141 HydrophobicContact CG-CG2 4.37Å; Y19-S144 WeakPolarHBondContact CD1-OG 3.29Å
20F97.4Very high95.7Very high15 Ų1522.9 Ų22.97%0.06611%0.113CC..Hα-helixtrans-56.7-52.4166.9174.8-96.8000110.7F16 W17 S23 L24 S144 L147 A148 M151 I155F16-F20 PolarHBondContact O-N 3.33Å; W17-F20 WeakPolarHBondContact O-CB 3.27Å; W17-F20 PolarHBondContact O-N 2.97Å; F20-S23 CarbonylContact O-C 3.51Å; F20-S23 WeakPolarHBondContact O-CA 3.45Å; F20-S23 WeakPolarHBondContact O-CB 3.46Å; F20-S23 PolarHBondContact O-N 3.41Å; F20-S23 VanDerWaalsContact O-N 3.08Å; F20-L24 HydrophobicContact CD1-CD1 3.99Å; F20-L24 HydrophobicContact CD1-CG 4.48Å; F20-L24 HydrophobicContact CE1-CD1 3.37Å; F20-L24 HydrophobicContact CE1-CG 4.12Å; F20-L24 HydrophobicContact CZ-CD1 3.79Å; F20-L24 HydrophobicContact CZ-CG 4.27Å; F20-L24 PolarHBondContact O-N 3.31Å; F20-S144 WeakPolarHBondContact CD2-O 3.46Å; F20-L147 HydrophobicContact CD2-CB 4.32Å; F20-L147 HydrophobicContact CD2-CD2 4.28Å; F20-L147 HydrophobicContact CD2-CG 4.21Å; F20-L147 HydrophobicContact CE2-CB 4.36Å; F20-L147 HydrophobicContact CE2-CD2 4.29Å; F20-L147 HydrophobicContact CE2-CG 3.94Å; F20-A148 HydrophobicContact CD2-CB 3.73Å; F20-A148 HydrophobicContact CE2-CB 3.86Å; F20-A148 HydrophobicContact CG-CB 4.4Å; F20-M151 HydrophobicContact CE2-SD 4.24Å; F20-M151 HydrophobicContact CZ-CB 4.46Å; F20-M151 HydrophobicContact CZ-SD 4.25Å; F20-I155 HydrophobicContact CE1-CD1 4.45Å; F20-I155 HydrophobicContact CZ-CD1 3.99Å
21F97.3Very high95.8Very high9 Ų921.1 Ų21.14%0.0399%0.093CC..Hα-helixtrans-69.3-34.1178.8-75.8-73.2000113.7W17 S23 L24 A25 F178 C182W17-F21 HydrophobicContact CD2-CD2 4.21Å; W17-F21 AromaticContact CD2-CE2 3.72Å; W17-F21 HydrophobicContact CD2-CE2 3.72Å; W17-F21 AromaticContact CE2-CD2 3.84Å; W17-F21 AromaticContact CE2-CE2 3.24Å; W17-F21 HydrophobicContact CE3-CE2 4.14Å; W17-F21 HydrophobicContact CG-CD2 4.38Å; W17-F21 HydrophobicContact CG-CE2 4.35Å; W17-F21 AromaticContact CH2-CE2 3.73Å; W17-F21 HydrophobicContact CH2-CE2 3.73Å; W17-F21 HydrophobicContact CH2-CZ 4.05Å; W17-F21 HydrophobicContact CZ2-CD2 4.26Å; W17-F21 AromaticContact CZ2-CE2 3.27Å; W17-F21 HydrophobicContact CZ2-CE2 3.27Å; W17-F21 AromaticContact CZ2-CZ 3.8Å; W17-F21 HydrophobicContact CZ2-CZ 3.8Å; W17-F21 HydrophobicContact CZ3-CE2 4.13Å; W17-F21 AromaticContact NE1-CD2 3.69Å; W17-F21 AromaticContact NE1-CE2 3.57Å; W17-F21 WeakPolarHBondContact O-CD2 3.43Å; W17-F21 PolarHBondContact O-N 3.04Å; F21-S23 PolarHBondContact O-N 2.89Å; F21-L24 HydrophobicContact CD1-CD1 3.85Å; F21-L24 HydrophobicContact CE1-CD1 3.93Å; F21-L24 PolarHBondContact O-N 3.34Å; F21-A25 WeakPolarHBondContact O-CB 3.32Å; F21-A25 PolarHBondContact O-N 3.42Å; F21-F178 HydrophobicContact CE1-CE1 4.3Å; F21-C182 HydrophobicContact CD1-CB 3.28Å; F21-C182 HydrophobicContact CD2-CB 4.19Å; F21-C182 HydrophobicContact CE1-CB 3.3Å; F21-C182 VanDerWaalsContact CE1-SG 3.56Å; F21-C182 HydrophobicContact CE2-CB 4.26Å; F21-C182 HydrophobicContact CG-CB 3.75Å; F21-C182 HydrophobicContact CZ-CB 3.82Å
22T97.4Very high95.7Very high1 Ų121.1 Ų21.11%0.0069%0.093CC..Hα-helixtrans-58.2-38.8168.8-65.70000111.5S18 Y19 A25 R26 L84 L114S18-T22 WeakPolarHBondContact O-CB 3.44Å; S18-T22 PolarHBondContact O-N 3.24Å; S18-T22 PolarHBondContact O-OG1 3.47Å; Y19-T22 HydrophobicContact CD2-CG2 4.19Å; Y19-T22 HydrophobicContact CE2-CG2 4.38Å; Y19-T22 PolarHBondContact O-N 3.13Å; T22-A25 PolarHBondContact O-N 3.06Å; T22-R26 PolarHBondContact O-N 3.23Å; T22-L84 VanDerWaalsContact OG1-CD2 3.3Å; T22-L84 WeakPolarHBondContact OG1-CD2 3.37Å; T22-L114 HydrophobicContact CG2-CD1 4.38Å; T22-L114 HydrophobicContact CG2-CD2 3.85Å; T22-L114 HydrophobicContact CG2-CG 4.47Å
23S96.4Very high95.4Very high1 Ų121.4 Ų21.41%0.0079%0.094CC..Hα-helixtrans-74.2-36.3178.9-61.30000112.1Y19 F20 F21 R26 R27 S145Y19-S23 WeakPolarHBondContact O-CB 3.17Å; Y19-S23 PolarHBondContact O-N 3.02Å; Y19-S23 PolarHBondContact O-OG 3.4Å; F20-S23 CarbonylContact O-C 3.51Å; F20-S23 WeakPolarHBondContact O-CA 3.45Å; F20-S23 WeakPolarHBondContact O-CB 3.46Å; F20-S23 PolarHBondContact O-N 3.41Å; F20-S23 VanDerWaalsContact O-N 3.08Å; F21-S23 PolarHBondContact O-N 2.89Å; S23-R26 PolarHBondContact O-N 3.04Å; S23-R26 PolarHBondContact OG-NH2 3.31Å; S23-R27 PolarHBondContact O-N 2.91Å; S23-S145 WeakPolarHBondContact OG-CA 3.38Å; S23-S145 VanDerWaalsContact OG-CB 3.25Å; S23-S145 WeakPolarHBondContact OG-CB 3.2Å
24L96.9Very high95Very high3 Ų318.4 Ų18.42%0.0168%0.078CC..Hα-helixtrans-61.9-42.4167.8-71.6-179.5000111.7F20 F21 R26 R27 A28 A148 G152 I155 V179F20-L24 HydrophobicContact CD1-CD1 3.99Å; F20-L24 HydrophobicContact CD1-CG 4.48Å; F20-L24 HydrophobicContact CE1-CD1 3.37Å; F20-L24 HydrophobicContact CE1-CG 4.12Å; F20-L24 HydrophobicContact CZ-CD1 3.79Å; F20-L24 HydrophobicContact CZ-CG 4.27Å; F20-L24 PolarHBondContact O-N 3.31Å; F21-L24 HydrophobicContact CD1-CD1 3.85Å; F21-L24 HydrophobicContact CE1-CD1 3.93Å; F21-L24 PolarHBondContact O-N 3.34Å; L24-R26 PolarHBondContact O-N 2.98Å; L24-R27 CarbonylContact O-C 3.6Å; L24-R27 PolarHBondContact O-N 3.06Å; L24-A28 WeakPolarHBondContact O-CA 3.19Å; L24-A28 PolarHBondContact O-N 3.18Å; L24-A148 HydrophobicContact CD2-CB 3.88Å; L24-A148 WeakPolarHBondContact CD2-O 3.32Å; L24-A148 HydrophobicContact CG-CB 3.92Å; L24-G152 VanDerWaalsContact CD2-CA 3.48Å; L24-I155 HydrophobicContact CD1-CD1 4.28Å; L24-V179 HydrophobicContact CB-CG1 4Å; L24-V179 HydrophobicContact CB-CG2 4.27Å
25A97.5Very high94.6Very high0 Ų019.1 Ų19.10%08%0.081CC..Hα-helixtrans-62.5-40.4178.800000112.5F21 T22 R27 A28 L91 L114 V179F21-A25 WeakPolarHBondContact O-CB 3.32Å; F21-A25 PolarHBondContact O-N 3.42Å; T22-A25 PolarHBondContact O-N 3.06Å; A25-R27 PolarHBondContact O-N 3.21Å; A25-A28 PolarHBondContact O-N 2.9Å; A25-L91 HydrophobicContact CB-CD1 3.78Å; A25-L114 HydrophobicContact CB-CD1 3.82Å; A25-V179 HydrophobicContact CB-CG1 3.96Å
26R95.9Very high94.3Very high29 Ų2919.2 Ų19.211%0.1098%0.082CC..Hα-helixtrans-64-23.1173-86.1-170-62.6154.32.2114.2T22 S23 L24 Q30 Y107 L114T22-R26 PolarHBondContact O-N 3.23Å; S23-R26 PolarHBondContact O-N 3.04Å; S23-R26 PolarHBondContact OG-NH2 3.31Å; L24-R26 PolarHBondContact O-N 2.98Å; R26-Q30 PolarHBondContact O-OE1 3.49Å; R26-Y107 PolarHBondContact O-OH 3.14Å; R26-L114 HydrophobicContact CB-CD1 4.46Å; R26-L114 HydrophobicContact CG-CB 4.31Å; R26-L114 HydrophobicContact CG-CD1 3.63Å
27R94.7Very high93.9Very high31 Ų3118.5 Ų18.512%0.1178%0.083CC..THydrogen-bonded Turntrans-114.69.5-175.6-61.9-176.176.11783.4112.8S23 L24 A25 I29 Q30 N31 Y107 G337 D338 E364S23-R27 PolarHBondContact O-N 2.91Å; L24-R27 CarbonylContact O-C 3.6Å; L24-R27 PolarHBondContact O-N 3.06Å; A25-R27 PolarHBondContact O-N 3.21Å; R27-I29 PolarHBondContact O-N 2.93Å; R27-Q30 VanDerWaalsContact C-OE1 3.27Å; R27-Q30 PolarHBondContact O-N 3.47Å; R27-Q30 PolarHBondContact O-OE1 3.04Å; R27-N31 WeakPolarHBondContact O-CB 3.4Å; R27-N31 PolarHBondContact O-N 3.19Å; R27-N31 PolarHBondContact O-ND2 3.44Å; R27-Y107 VanDerWaalsContact C-OH 3.3Å; R27-Y107 WeakPolarHBondContact CA-OH 3.21Å; R27-Y107 PolarHBondContact N-OH 2.63Å; R27-G337 PolarHBondContact NH2-O 3.12Å; R27-D338 IonicContact NE-OD1 3.34Å; R27-D338 IonicContact NH2-OD1 3.35Å; R27-E364 IonicContact CZ-OE1 3.75Å; R27-E364 VanDerWaalsContact NH1-CD 3.31Å; R27-E364 IonicContact NH1-OE1 3.36Å; R27-E364 PolarHBondContact NH1-OE1 3.45Å; R27-E364 IonicContact NH1-OE2 3.19Å; R27-E364 IonicContact NH2-OE1 3.84Å; R27-E364 PolarHBondContact NH2-OE1 3.29Å
28A95.6Very high93.4Very high1 Ų118 Ų181%0.0089%0.093CC..Hα-helixtrans-58.8-47.8-170.300000111.1L24 A25 N31 I32 L91 Y107 F176L24-A28 WeakPolarHBondContact O-CA 3.19Å; L24-A28 PolarHBondContact O-N 3.18Å; A25-A28 PolarHBondContact O-N 2.9Å; A28-N31 PolarHBondContact O-N 3.22Å; A28-I32 WeakPolarHBondContact O-CD1 3.47Å; A28-I32 VanDerWaalsContact O-CG1 3.25Å; A28-I32 WeakPolarHBondContact O-CG1 3.12Å; A28-I32 PolarHBondContact O-N 3.33Å; A28-L91 HydrophobicContact CB-CD2 3.79Å; A28-Y107 HydrophobicContact CB-CE2 4.45Å; A28-Y107 PolarHBondContact N-OH 3.49Å; A28-F176 HydrophobicContact CB-CD1 3.86Å; A28-F176 HydrophobicContact CB-CE1 3.88Å
29I93.6Very high92.7Very high0 Ų024.7 Ų24.70%012%0.124CC..Hα-helixtrans-68.1-39.9179.9-157.1171.6000111.5R27 N31 I32 Y33 L49 I52 W103 Y107 F176R27-I29 PolarHBondContact O-N 2.93Å; I29-N31 VanDerWaalsContact C-N 3.34Å; I29-N31 PolarHBondContact O-N 2.97Å; I29-I32 PolarHBondContact O-N 2.84Å; I29-Y33 HydrophobicContact CG1-CD2 4.42Å; I29-Y33 WeakPolarHBondContact O-CA 3.48Å; I29-Y33 VanDerWaalsContact O-CB 3.29Å; I29-Y33 WeakPolarHBondContact O-CB 3.33Å; I29-Y33 PolarHBondContact O-N 2.81Å; I29-L49 HydrophobicContact CD1-CD1 4.42Å; I29-L49 HydrophobicContact CG1-CD1 4.28Å; I29-L49 HydrophobicContact CG2-CD1 3.92Å; I29-I52 HydrophobicContact CD1-CB 4.47Å; I29-I52 HydrophobicContact CD1-CD1 3.97Å; I29-I52 HydrophobicContact CD1-CG2 3.73Å; I29-I52 HydrophobicContact CG2-CG2 4.42Å; I29-W103 HydrophobicContact CD1-CE3 4.19Å; I29-Y107 HydrophobicContact CB-CE1 4.15Å; I29-Y107 HydrophobicContact CB-CE2 4.35Å; I29-Y107 HydrophobicContact CG2-CD1 3.8Å; I29-Y107 HydrophobicContact CG2-CE1 3.25Å; I29-Y107 HydrophobicContact CG2-CE2 4.3Å; I29-Y107 HydrophobicContact CG2-CG 4.5Å; I29-Y107 PolarHBondContact N-OH 3.02Å; I29-F176 HydrophobicContact CB-CE1 4.25Å; I29-F176 HydrophobicContact CB-CZ 4.32Å; I29-F176 HydrophobicContact CG1-CZ 4.17Å
30Q93.1Very high92.1Very high20 Ų2026.2 Ų26.29%0.09313%0.13CC..Hα-helixtrans-60.5-44177.8-63.896.4-44.100111.5R26 R27 I32 I53 Y107 D338R26-Q30 PolarHBondContact O-OE1 3.49Å; R27-Q30 VanDerWaalsContact C-OE1 3.27Å; R27-Q30 PolarHBondContact O-N 3.47Å; R27-Q30 PolarHBondContact O-OE1 3.04Å; Q30-I32 VanDerWaalsContact C-N 3.32Å; Q30-I32 PolarHBondContact O-N 3.05Å; Q30-I53 HydrophobicContact CG-CD1 3.61Å; Q30-I53 HydrophobicContact CG-CG1 3.93Å; Q30-Y107 PolarHBondContact OE1-OH 2.95Å; Q30-D338 HydrophobicContact CG-CB 4.39Å
31N93.4Very high91.3Very high6 Ų626.5 Ų26.53%0.03213%0.131CC..Hα-helixtrans-67-32-178.3-67.8-22.9000112.9R27 A28 I29 H34 G152R27-N31 WeakPolarHBondContact O-CB 3.4Å; R27-N31 PolarHBondContact O-N 3.19Å; R27-N31 PolarHBondContact O-ND2 3.44Å; A28-N31 PolarHBondContact O-N 3.22Å; I29-N31 VanDerWaalsContact C-N 3.34Å; I29-N31 PolarHBondContact O-N 2.97Å; N31-H34 PolarHBondContact O-CE1 3.27Å; N31-H34 PolarHBondContact O-ND1 3.09Å; N31-G152 WeakPolarHBondContact ND2-CA 3.44Å
32I92.1Very high90.2Very high1 Ų127.7 Ų27.71%0.00515%0.146CC..Hα-helixtrans-96.7-19.1-175.7-57.2157.8000111.5A28 I29 Q30 H34 I35 I36 W172 P175 F176A28-I32 WeakPolarHBondContact O-CD1 3.47Å; A28-I32 VanDerWaalsContact O-CG1 3.25Å; A28-I32 WeakPolarHBondContact O-CG1 3.12Å; A28-I32 PolarHBondContact O-N 3.33Å; I29-I32 PolarHBondContact O-N 2.84Å; Q30-I32 VanDerWaalsContact C-N 3.32Å; Q30-I32 PolarHBondContact O-N 3.05Å; I32-H34 PolarHBondContact O-N 3.23Å; I32-I35 HydrophobicContact CG2-CB 4.45Å; I32-I35 WeakPolarHBondContact O-CA 3.46Å; I32-I35 WeakPolarHBondContact O-CB 3.03Å; I32-I35 PolarHBondContact O-N 3.32Å; I32-I36 HydrophobicContact CG2-CG1 4.02Å; I32-I36 PolarHBondContact O-N 3.08Å; I32-W172 WeakPolarHBondContact CG2-O 3.43Å; I32-P175 HydrophobicContact CD1-CB 3.58Å; I32-P175 HydrophobicContact CD1-CG 4.25Å; I32-P175 HydrophobicContact CG1-CB 3.8Å; I32-P175 HydrophobicContact CG1-CG 4.17Å; I32-F176 HydrophobicContact CB-CZ 4.46Å; I32-F176 HydrophobicContact CD1-CD1 3.69Å; I32-F176 HydrophobicContact CD1-CD2 3.9Å; I32-F176 HydrophobicContact CD1-CE1 3.59Å; I32-F176 HydrophobicContact CD1-CE2 3.78Å; I32-F176 HydrophobicContact CD1-CG 3.85Å; I32-F176 HydrophobicContact CD1-CZ 3.62Å; I32-F176 HydrophobicContact CG2-CE2 4.44Å
33Y88.6Confident88.7Confident10 Ų1034.6 Ų34.64%0.03919%0.188CC..G310 helixtrans-52-42.7-163.7-162.8-112.6000113I29 I35 I36 K41 S45 L49I29-Y33 HydrophobicContact CG1-CD2 4.42Å; I29-Y33 WeakPolarHBondContact O-CA 3.48Å; I29-Y33 VanDerWaalsContact O-CB 3.29Å; I29-Y33 WeakPolarHBondContact O-CB 3.33Å; I29-Y33 PolarHBondContact O-N 2.81Å; Y33-I35 VanDerWaalsContact C-N 3.28Å; Y33-I35 PolarHBondContact O-N 3.48Å; Y33-I36 HydrophobicContact CD2-CD1 4.11Å; Y33-I36 WeakPolarHBondContact O-CB 2.73Å; Y33-I36 PolarHBondContact O-N 3.5Å; Y33-K41 HydrophobicContact CE1-CD 4.15Å; Y33-K41 HydrophobicContact CE1-CG 4.4Å; Y33-K41 HydrophobicContact CE2-CG 4.21Å; Y33-K41 WeakPolarHBondContact O-CE 3.44Å; Y33-K41 PolarHBondContact O-NZ 3.48Å; Y33-S45 VanDerWaalsContact OH-C 3.25Å; Y33-S45 WeakPolarHBondContact OH-CA 3.39Å; Y33-S45 WeakPolarHBondContact OH-CB 3.16Å; Y33-S45 PolarHBondContact OH-O 2.87Å; Y33-L49 HydrophobicContact CD1-CB 4.33Å; Y33-L49 HydrophobicContact CD1-CD2 3.55Å; Y33-L49 HydrophobicContact CD1-CG 4.35Å; Y33-L49 HydrophobicContact CD2-CB 4.37Å; Y33-L49 HydrophobicContact CD2-CD1 3.74Å; Y33-L49 HydrophobicContact CD2-CD2 4.19Å; Y33-L49 HydrophobicContact CD2-CG 4.3Å; Y33-L49 HydrophobicContact CE1-CB 3.87Å; Y33-L49 HydrophobicContact CE1-CD2 3.94Å; Y33-L49 HydrophobicContact CE1-CG 4.39Å; Y33-L49 HydrophobicContact CE2-CB 3.97Å; Y33-L49 HydrophobicContact CE2-CD1 4.04Å; Y33-L49 HydrophobicContact CE2-CG 4.39Å; Y33-L49 HydrophobicContact CG-CD1 4.04Å; Y33-L49 HydrophobicContact CG-CD2 3.68Å; Y33-L49 HydrophobicContact CG-CG 4.29Å
34H85.4Confident87.4Confident38 Ų3839.6 Ų39.618%0.17621%0.21CC..G310 helixtrans-60.9-33.4179.467.2-91.8000113.8N31 I32 K41 L345 Y357N31-H34 PolarHBondContact O-CE1 3.27Å; N31-H34 PolarHBondContact O-ND1 3.09Å; I32-H34 PolarHBondContact O-N 3.23Å; H34-K41 PolarHBondContact O-NZ 3.14Å; H34-K41 VanDerWaalsContact O-NZ 3.12Å; H34-L345 HydrophobicContact CB-CD1 3.94Å; H34-Y357 AromaticContact CD2-CZ 3.58Å; H34-Y357 PolarHBondContact CD2-OH 3.31Å; H34-Y357 AromaticContact CE1-CE1 3.7Å; H34-Y357 AromaticContact CE1-CE2 3.98Å; H34-Y357 AromaticContact CE1-CZ 3.35Å; H34-Y357 PolarHBondContact CE1-OH 3.34Å; H34-Y357 VanDerWaalsContact CE1-OH 3.29Å; H34-Y357 AromaticContact CG-CZ 3.77Å; H34-Y357 AromaticContact ND1-CE1 3.77Å; H34-Y357 AromaticContact ND1-CZ 3.67Å; H34-Y357 PolarHBondContact ND1-OH 2.96Å; H34-Y357 AromaticContact NE2-CE2 3.66Å; H34-Y357 AromaticContact NE2-CZ 3.26Å; H34-Y357 VanDerWaalsContact NE2-CZ 3.26Å; H34-Y357 PolarHBondContact NE2-OH 2.91Å
35I88.5Confident86.7Confident45 Ų4541 Ų4123%0.23122%0.22CC..G310 helixtrans-75.4-27.8-179.4-44.6176.1000111.2I32 Y33 P37 I157 W172I32-I35 HydrophobicContact CG2-CB 4.45Å; I32-I35 WeakPolarHBondContact O-CA 3.46Å; I32-I35 WeakPolarHBondContact O-CB 3.03Å; I32-I35 PolarHBondContact O-N 3.32Å; Y33-I35 VanDerWaalsContact C-N 3.28Å; Y33-I35 PolarHBondContact O-N 3.48Å; I35-P37 WeakPolarHBondContact O-CD 3.48Å; I35-I157 HydrophobicContact CD1-CB 4.47Å; I35-I157 HydrophobicContact CD1-CG1 3.78Å; I35-I157 HydrophobicContact CG1-CG1 4.47Å; I35-W172 HydrophobicContact CG2-CB 4.3Å
36I90.2Very high86.3Confident2 Ų242.6 Ų42.61%0.0123%0.229CC..SBendtrans-59.1125.4-179.1-60.3-178.6000109.3I32 Y33 Y40 K41 W103 W172I32-I36 HydrophobicContact CG2-CG1 4.02Å; I32-I36 PolarHBondContact O-N 3.08Å; Y33-I36 HydrophobicContact CD2-CD1 4.11Å; Y33-I36 WeakPolarHBondContact O-CB 2.73Å; Y33-I36 PolarHBondContact O-N 3.5Å; I36-Y40 HydrophobicContact CG2-CD2 4.31Å; I36-K41 HydrophobicContact CB-CG 4.47Å; I36-K41 HydrophobicContact CG2-CG 4.09Å; I36-K41 WeakPolarHBondContact O-CE 3.27Å; I36-K41 PolarHBondContact O-NZ 2.76Å; I36-W103 HydrophobicContact CD1-CH2 3.96Å; I36-W103 HydrophobicContact CD1-CZ3 4.09Å; I36-W103 HydrophobicContact CG2-CH2 3.86Å; I36-W103 HydrophobicContact CG2-CZ3 4.48Å; I36-W172 HydrophobicContact CD1-CE3 4.11Å; I36-W172 HydrophobicContact CD1-CZ3 4.32Å; I36-W172 HydrophobicContact CG1-CD2 4.25Å; I36-W172 HydrophobicContact CG1-CE3 3.79Å; I36-W172 HydrophobicContact CG1-CZ3 4.45Å
37P88Confident86.1Confident41 Ų4141.7 Ų41.727%0.26623%0.226SC..  trans-56.4144.4178.1-2935.4000113.3I35 Q39 Y40I35-P37 WeakPolarHBondContact O-CD 3.48Å; P37-Q39 HydrophobicContact CB-CG 4.02Å; P37-Q39 PolarHBondContact O-N 3.45Å; P37-Q39 VanDerWaalsContact O-N 3.14Å; P37-Y40 HydrophobicContact CB-CD2 3.78Å; P37-Y40 HydrophobicContact CB-CE2 3.99Å; P37-Y40 HydrophobicContact CG-CD2 3.98Å; P37-Y40 HydrophobicContact CG-CE2 3.92Å; P37-Y40 PolarHBondContact O-N 3.01Å
38V84.8Confident86Confident112 Ų11243.5 Ų43.568%0.67924%0.236SC*.Hα-helixtrans-56.6-34.4-175.6177.90000112.3Y40 K41 G42V38-Y40 PolarHBondContact O-N 2.97Å; V38-Y40 VanDerWaalsContact O-N 3.12Å; V38-K41 PolarHBondContact O-N 2.99Å; V38-G42 PolarHBondContact O-N 3.32Å
39Q84.1Confident85.9Confident139 Ų13943.5 Ų43.565%0.6524%0.236SC*.Hα-helixtrans-54.8-29.8176.867.8-170.54.700113.8P37P37-Q39 HydrophobicContact CB-CG 4.02Å; P37-Q39 PolarHBondContact O-N 3.45Å; P37-Q39 VanDerWaalsContact O-N 3.14Å
40Y82.8Confident86Confident46 Ų4643.5 Ų43.518%0.1824%0.236CC..Hα-helixtrans-90.2-25.9178.5-56.1-63.2000112.8I36 P37 V38 S98 Q100 W172I36-Y40 HydrophobicContact CG2-CD2 4.31Å; P37-Y40 HydrophobicContact CB-CD2 3.78Å; P37-Y40 HydrophobicContact CB-CE2 3.99Å; P37-Y40 HydrophobicContact CG-CD2 3.98Å; P37-Y40 HydrophobicContact CG-CE2 3.92Å; P37-Y40 PolarHBondContact O-N 3.01Å; V38-Y40 PolarHBondContact O-N 2.97Å; V38-Y40 VanDerWaalsContact O-N 3.12Å; Y40-S98 WeakPolarHBondContact CE1-OG 3.34Å; Y40-Q100 PolarHBondContact O-NE2 3.41Å; Y40-W172 HydrophobicContact CD2-CZ2 4.07Å; Y40-W172 AromaticContact CD2-NE1 3.87Å; Y40-W172 AromaticContact CE2-CE2 3.96Å; Y40-W172 HydrophobicContact CE2-CZ2 4.09Å; Y40-W172 AromaticContact CE2-NE1 3.43Å; Y40-W172 HydrophobicContact CG-CZ2 4.39Å
41K80.7Confident86.1Confident22 Ų2244 Ų4410%0.09624%0.241CC..Hα-helixtrans-78.1-29.2-178.2-69.8175.5171.71530113.8Y33 H34 I36 V38 Q100Y33-K41 HydrophobicContact CE1-CD 4.15Å; Y33-K41 HydrophobicContact CE1-CG 4.4Å; Y33-K41 HydrophobicContact CE2-CG 4.21Å; Y33-K41 WeakPolarHBondContact O-CE 3.44Å; Y33-K41 PolarHBondContact O-NZ 3.48Å; H34-K41 PolarHBondContact O-NZ 3.14Å; H34-K41 VanDerWaalsContact O-NZ 3.12Å; I36-K41 HydrophobicContact CB-CG 4.47Å; I36-K41 HydrophobicContact CG2-CG 4.09Å; I36-K41 WeakPolarHBondContact O-CE 3.27Å; I36-K41 PolarHBondContact O-NZ 2.76Å; V38-K41 PolarHBondContact O-N 2.99Å; K41-Q100 VanDerWaalsContact C-NE2 3.29Å; K41-Q100 PolarHBondContact O-NE2 3.12Å
42G74.3Confident86.2Confident34 Ų3443.9 Ų43.935%0.35124%0.241SC..  trans69.2-176.6-170.300000113.3V38V38-G42 PolarHBondContact O-N 3.32Å
43T65.3Low86.4Confident145 Ų14544 Ų4489%0.8924%0.241SC*.THydrogen-bonded Turntrans-73.9-35.2-172.649.90000113.6S45T43-S45 PolarHBondContact O-N 3.37Å
44K70.5Confident86.8Confident107 Ų10744.3 Ų44.347%0.46524%0.244SC..THydrogen-bonded Turntrans-9850.4177.5-68.9-160.5177.3-146.60112.7N46 T47 H48 E482K44-N46 VanDerWaalsContact C-N 3.31Å; K44-N46 PolarHBondContact O-N 3.27Å; K44-T47 PolarHBondContact O-N 2.87Å; K44-T47 PolarHBondContact O-OG1 3.12Å; K44-H48 PolarHBondContact O-CD2 3.42Å; K44-H48 PolarHBondContact O-N 3.38Å; K44-H48 VanDerWaalsContact O-N 3.14Å; K44-E482 WeakPolarHBondContact CD-OE1 3.43Å; K44-E482 WeakPolarHBondContact CE-OE1 3.44Å; K44-E482 IonicContact NZ-OE1 2.71Å; K44-E482 PolarHBondContact NZ-OE1 3.37Å
45S82.2Confident87.3Confident31 Ų3143.5 Ų43.522%0.21724%0.244CC..Hα-helixtrans-55.9-41.2-168.364.70000113.5Y33 T43 L49Y33-S45 VanDerWaalsContact OH-C 3.25Å; Y33-S45 WeakPolarHBondContact OH-CA 3.39Å; Y33-S45 WeakPolarHBondContact OH-CB 3.16Å; Y33-S45 PolarHBondContact OH-O 2.87Å; T43-S45 PolarHBondContact O-N 3.37Å; S45-L49 PolarHBondContact O-N 3.04Å
46N89.2Confident87.7Confident35 Ų3541.8 Ų41.819%0.18724%0.235CC..Hα-helixtrans-73.1-40.5-175.1-63.8-29.9000113.1K44 L49 G50 W339 N346 W486K44-N46 VanDerWaalsContact C-N 3.31Å; K44-N46 PolarHBondContact O-N 3.27Å; N46-L49 PolarHBondContact O-N 3.24Å; N46-G50 PolarHBondContact O-N 2.81Å; N46-W339 HydrophobicContact CB-CZ3 4.35Å; N46-W339 WeakPolarHBondContact O-CH2 3.19Å; N46-N346 PolarHBondContact ND2-ND2 3.18Å; N46-N346 VanDerWaalsContact ND2-ND2 3.16Å; N46-W486 HydrophobicContact CB-CZ2 4Å
47T91.9Very high88Confident9 Ų942.1 Ų42.16%0.05524%0.237CC..Hα-helixtrans-70.6-34.9177.733.60000112.1K44 G50 S51 Y475 A478 L479 E482K44-T47 PolarHBondContact O-N 2.87Å; K44-T47 PolarHBondContact O-OG1 3.12Å; T47-G50 PolarHBondContact O-N 2.97Å; T47-S51 PolarHBondContact O-N 3.47Å; T47-Y475 WeakPolarHBondContact O-CD2 3.42Å; T47-A478 HydrophobicContact CG2-CB 4.25Å; T47-L479 HydrophobicContact CG2-CB 4.18Å; T47-L479 HydrophobicContact CG2-CD1 4.13Å; T47-E482 WeakPolarHBondContact CB-OE2 3.38Å; T47-E482 HydrophobicContact CG2-CB 4.26Å; T47-E482 WeakPolarHBondContact CG2-OE2 3.37Å; T47-E482 PolarHBondContact OG1-OE2 3.24Å
48H91.3Very high88.4Confident69 Ų6944.1 Ų44.132%0.31925%0.245SC..Hα-helixtrans-63.9-41.7169.4-71.7-61.6000112.5K44 G50 S51 I52K44-H48 PolarHBondContact O-CD2 3.42Å; K44-H48 PolarHBondContact O-N 3.38Å; K44-H48 VanDerWaalsContact O-N 3.14Å; H48-G50 VanDerWaalsContact C-N 3.29Å; H48-G50 PolarHBondContact O-N 3.43Å; H48-S51 PolarHBondContact O-N 2.95Å; H48-S51 PolarHBondContact O-OG 3.36Å; H48-I52 WeakPolarHBondContact O-CG1 3.4Å; H48-I52 PolarHBondContact O-N 3.41Å
49L93.7Very high88.9Confident1 Ų139.1 Ų39.11%0.00522%0.216CC..Hα-helixtrans-60.3-43.5171.6176.662.2000110.8I29 Y33 S45 N46 S51 I52 I53 W339 I342I29-L49 HydrophobicContact CD1-CD1 4.42Å; I29-L49 HydrophobicContact CG1-CD1 4.28Å; I29-L49 HydrophobicContact CG2-CD1 3.92Å; Y33-L49 HydrophobicContact CD1-CB 4.33Å; Y33-L49 HydrophobicContact CD1-CD2 3.55Å; Y33-L49 HydrophobicContact CD1-CG 4.35Å; Y33-L49 HydrophobicContact CD2-CB 4.37Å; Y33-L49 HydrophobicContact CD2-CD1 3.74Å; Y33-L49 HydrophobicContact CD2-CD2 4.19Å; Y33-L49 HydrophobicContact CD2-CG 4.3Å; Y33-L49 HydrophobicContact CE1-CB 3.87Å; Y33-L49 HydrophobicContact CE1-CD2 3.94Å; Y33-L49 HydrophobicContact CE1-CG 4.39Å; Y33-L49 HydrophobicContact CE2-CB 3.97Å; Y33-L49 HydrophobicContact CE2-CD1 4.04Å; Y33-L49 HydrophobicContact CE2-CG 4.39Å; Y33-L49 HydrophobicContact CG-CD1 4.04Å; Y33-L49 HydrophobicContact CG-CD2 3.68Å; Y33-L49 HydrophobicContact CG-CG 4.29Å; S45-L49 PolarHBondContact O-N 3.04Å; N46-L49 PolarHBondContact O-N 3.24Å; L49-S51 VanDerWaalsContact C-N 3.3Å; L49-S51 PolarHBondContact O-N 2.9Å; L49-I52 PolarHBondContact O-N 2.95Å; L49-I52 VanDerWaalsContact O-N 3.16Å; L49-I53 HydrophobicContact CD1-CD1 3.95Å; L49-I53 HydrophobicContact CD1-CG1 4.01Å; L49-I53 HydrophobicContact CD2-CD1 4.15Å; L49-I53 HydrophobicContact CG-CD1 3.69Å; L49-I53 HydrophobicContact CG-CG1 4.19Å; L49-I53 WeakPolarHBondContact O-CG1 3.36Å; L49-I53 PolarHBondContact O-N 3.48Å; L49-W339 HydrophobicContact CB-CH2 4.13Å; L49-W339 HydrophobicContact CB-CZ3 4.44Å; L49-W339 HydrophobicContact CD2-CH2 3.93Å; L49-W339 HydrophobicContact CD2-CZ3 3.74Å; L49-W339 HydrophobicContact CG-CH2 3.93Å; L49-W339 HydrophobicContact CG-CZ3 4.24Å; L49-I342 HydrophobicContact CD2-CD1 3.66Å
50G95.4Very high89.4Confident0 Ų033.1 Ų33.10%019%0.188CC..Hα-helixtrans-58.5-41.1179.200000112.3N46 T47 H48 I53 T54 Y475N46-G50 PolarHBondContact O-N 2.81Å; T47-G50 PolarHBondContact O-N 2.97Å; H48-G50 VanDerWaalsContact C-N 3.29Å; H48-G50 PolarHBondContact O-N 3.43Å; G50-I53 PolarHBondContact O-N 3.4Å; G50-T54 WeakPolarHBondContact O-CB 3.42Å; G50-T54 PolarHBondContact O-N 3.32Å; G50-T54 PolarHBondContact O-OG1 2.99Å; G50-Y475 PolarHBondContact O-N 3.4Å; G50-Y475 VanDerWaalsContact O-N 3.14Å
51S95.4Very high89.8Confident30 Ų3031.5 Ų31.521%0.2118%0.183CC..Hα-helixtrans-66.6-40.1176.568.20000112.4T47 H48 L49 T54 A55T47-S51 PolarHBondContact O-N 3.47Å; H48-S51 PolarHBondContact O-N 2.95Å; H48-S51 PolarHBondContact O-OG 3.36Å; L49-S51 VanDerWaalsContact C-N 3.3Å; L49-S51 PolarHBondContact O-N 2.9Å; S51-T54 PolarHBondContact O-N 2.9Å; S51-A55 PolarHBondContact O-N 3.18Å
52I95.3Very high90.3Very high4 Ų434.2 Ų34.22%0.02120%0.201CC..Hα-helixtrans-64.3-45.7176-61.8164.6000111.3I29 H48 L49 T54 A55 Q56 W103 L104 Y107I29-I52 HydrophobicContact CD1-CB 4.47Å; I29-I52 HydrophobicContact CD1-CD1 3.97Å; I29-I52 HydrophobicContact CD1-CG2 3.73Å; I29-I52 HydrophobicContact CG2-CG2 4.42Å; H48-I52 WeakPolarHBondContact O-CG1 3.4Å; H48-I52 PolarHBondContact O-N 3.41Å; L49-I52 PolarHBondContact O-N 2.95Å; L49-I52 VanDerWaalsContact O-N 3.16Å; I52-T54 VanDerWaalsContact C-N 3.29Å; I52-T54 PolarHBondContact O-N 2.81Å; I52-A55 PolarHBondContact O-N 3.4Å; I52-Q56 PolarHBondContact O-N 3.18Å; I52-Q56 VanDerWaalsContact O-N 3.1Å; I52-W103 HydrophobicContact CD1-CB 3.93Å; I52-W103 HydrophobicContact CD1-CE3 4.14Å; I52-L104 HydrophobicContact CG1-CB 4.1Å; I52-Y107 HydrophobicContact CG2-CD1 3.63Å; I52-Y107 HydrophobicContact CG2-CG 3.99Å
53I95.9Very high91.1Very high3 Ų334 Ų342%0.01519%0.193CC..Hα-helixtrans-60.7-40.1175.6-66171000110.8Q30 L49 G50 Q56 T57 D338 W339Q30-I53 HydrophobicContact CG-CD1 3.61Å; Q30-I53 HydrophobicContact CG-CG1 3.93Å; L49-I53 HydrophobicContact CD1-CD1 3.95Å; L49-I53 HydrophobicContact CD1-CG1 4.01Å; L49-I53 HydrophobicContact CD2-CD1 4.15Å; L49-I53 HydrophobicContact CG-CD1 3.69Å; L49-I53 HydrophobicContact CG-CG1 4.19Å; L49-I53 WeakPolarHBondContact O-CG1 3.36Å; L49-I53 PolarHBondContact O-N 3.48Å; G50-I53 PolarHBondContact O-N 3.4Å; I53-Q56 PolarHBondContact O-N 3.16Å; I53-T57 WeakPolarHBondContact O-CB 3.49Å; I53-T57 PolarHBondContact O-N 2.85Å; I53-T57 PolarHBondContact O-OG1 3.26Å; I53-D338 HydrophobicContact CD1-CB 4.47Å; I53-W339 HydrophobicContact CD1-CH2 4.13Å; I53-W339 HydrophobicContact CD1-CZ2 3.86Å
54T97.3Very high92.2Very high17 Ų1729.6 Ų29.610%0.10416%0.161CC..Hα-helixtrans-66.2-44.5179.2-53.50000111.3G50 S51 I52 Q56 T57 L58 I471 Y475G50-T54 WeakPolarHBondContact O-CB 3.42Å; G50-T54 PolarHBondContact O-N 3.32Å; G50-T54 PolarHBondContact O-OG1 2.99Å; S51-T54 PolarHBondContact O-N 2.9Å; I52-T54 VanDerWaalsContact C-N 3.29Å; I52-T54 PolarHBondContact O-N 2.81Å; T54-Q56 VanDerWaalsContact C-N 3.31Å; T54-Q56 PolarHBondContact O-N 3.06Å; T54-T57 PolarHBondContact O-N 2.71Å; T54-L58 HydrophobicContact CG2-CD1 4.05Å; T54-L58 HydrophobicContact CG2-CG 4.4Å; T54-L58 WeakPolarHBondContact O-CB 3.32Å; T54-L58 WeakPolarHBondContact O-CG 3.47Å; T54-L58 PolarHBondContact O-N 2.87Å; T54-I471 HydrophobicContact CG2-CG2 3.87Å; T54-Y475 VanDerWaalsContact OG1-CB 3.31Å; T54-Y475 WeakPolarHBondContact OG1-CB 3.48Å; T54-Y475 PolarHBondContact OG1-N 3.48Å
55A97.1Very high92.7Very high21 Ų2128.7 Ų28.717%0.17416%0.161CC..Hα-helixtrans-58.6-44.2176.700000111.4S51 I52 L58 G59 L104S51-A55 PolarHBondContact O-N 3.18Å; I52-A55 PolarHBondContact O-N 3.4Å; A55-L58 PolarHBondContact O-N 2.96Å; A55-G59 PolarHBondContact O-N 3.14Å; A55-L104 HydrophobicContact CB-CD2 4.12Å; A55-L104 HydrophobicContact CB-CG 4.01Å
56Q97Very high92.8Very high10 Ų1031.2 Ų31.25%0.04717%0.172CC..Hα-helixtrans-62.6-46.2174.9-177.3-78.8-38.200112I52 I53 T54 L58 G59 Y60 Y107 G111I52-Q56 PolarHBondContact O-N 3.18Å; I52-Q56 VanDerWaalsContact O-N 3.1Å; I53-Q56 PolarHBondContact O-N 3.16Å; T54-Q56 VanDerWaalsContact C-N 3.31Å; T54-Q56 PolarHBondContact O-N 3.06Å; Q56-L58 PolarHBondContact O-N 3.35Å; Q56-G59 PolarHBondContact O-N 3.28Å; Q56-Y60 WeakPolarHBondContact O-CB 3.36Å; Q56-Y60 PolarHBondContact O-N 3.37Å; Q56-Y107 HydrophobicContact CB-CD1 3.36Å; Q56-Y107 HydrophobicContact CB-CE1 3.78Å; Q56-Y107 HydrophobicContact CB-CG 4.02Å; Q56-Y107 WeakPolarHBondContact CB-O 3.33Å; Q56-Y107 HydrophobicContact CG-CD1 3.67Å; Q56-Y107 HydrophobicContact CG-CE1 3.69Å; Q56-Y107 HydrophobicContact CG-CG 4.14Å; Q56-Y107 WeakPolarHBondContact CG-O 3.37Å; Q56-G111 VanDerWaalsContact O-CA 3.23Å; Q56-G111 WeakPolarHBondContact O-CA 3.46Å
57T96Very high92.3Very high8 Ų829.7 Ų29.75%0.04916%0.164CC..Hα-helixtrans-65.8-38-179.8-56.70000112.1I53 T54 Y60 T61 A470 I471I53-T57 WeakPolarHBondContact O-CB 3.49Å; I53-T57 PolarHBondContact O-N 2.85Å; I53-T57 PolarHBondContact O-OG1 3.26Å; T54-T57 PolarHBondContact O-N 2.71Å; T57-Y60 PolarHBondContact O-N 3.41Å; T57-T61 WeakPolarHBondContact O-CB 3.32Å; T57-T61 PolarHBondContact O-N 2.83Å; T57-T61 PolarHBondContact O-OG1 3.27Å; T57-A470 HydrophobicContact CG2-CB 3.66Å; T57-I471 HydrophobicContact CG2-CG1 3.76Å
58L95.8Very high91.3Very high84 Ų8431.1 Ų31.144%0.4418%0.18SC..Hα-helixtrans-61.9-50.5174-80.6168.4000111.1T54 A55 Q56 Y60 T61 V62 I471T54-L58 HydrophobicContact CG2-CD1 4.05Å; T54-L58 HydrophobicContact CG2-CG 4.4Å; T54-L58 WeakPolarHBondContact O-CB 3.32Å; T54-L58 WeakPolarHBondContact O-CG 3.47Å; T54-L58 PolarHBondContact O-N 2.87Å; A55-L58 PolarHBondContact O-N 2.96Å; Q56-L58 PolarHBondContact O-N 3.35Å; L58-Y60 VanDerWaalsContact C-N 3.3Å; L58-Y60 PolarHBondContact O-N 3.44Å; L58-T61 PolarHBondContact O-N 3.04Å; L58-T61 VanDerWaalsContact O-N 3.14Å; L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 2.95Å; L58-I471 HydrophobicContact CD2-CD1 3.57Å; L58-I471 HydrophobicContact CD2-CG1 4.17Å; L58-I471 HydrophobicContact CD2-CG2 4.37Å; L58-I471 HydrophobicContact CG-CD1 4.27Å; L58-I471 HydrophobicContact CG-CG1 4.35Å; L58-I471 HydrophobicContact CG-CG2 4.49Å
59G94.9Very high90.6Very high7 Ų731.1 Ų31.17%0.07218%0.182CC..Hα-helixtrans-55.9-46175.500000111.9A55 Q56 T61 V62 T63 G111A55-G59 PolarHBondContact O-N 3.14Å; Q56-G59 PolarHBondContact O-N 3.28Å; G59-T61 VanDerWaalsContact C-N 3.34Å; G59-T61 PolarHBondContact O-N 3.2Å; G59-V62 PolarHBondContact O-N 3.29Å; G59-T63 PolarHBondContact O-N 2.93Å; G59-T63 VanDerWaalsContact O-N 3.13Å; G59-T63 PolarHBondContact O-OG1 3.18Å; G59-G111 VanDerWaalsContact C-C 3.47Å
60Y94.7Very high89.8Confident12 Ų1234.8 Ų34.85%0.04720%0.201CC..Hα-helixtrans-60.4-42.9176.9-178.8-91.6000112.4Q56 T57 L58 K64 G111 L114 G115Q56-Y60 WeakPolarHBondContact O-CB 3.36Å; Q56-Y60 PolarHBondContact O-N 3.37Å; T57-Y60 PolarHBondContact O-N 3.41Å; L58-Y60 VanDerWaalsContact C-N 3.3Å; L58-Y60 PolarHBondContact O-N 3.44Å; Y60-K64 HydrophobicContact CD1-CD 4.33Å; Y60-K64 HydrophobicContact CE1-CB 4.42Å; Y60-K64 HydrophobicContact CE1-CD 3.51Å; Y60-K64 WeakPolarHBondContact O-CB 3.39Å; Y60-K64 PolarHBondContact O-N 2.88Å; Y60-G111 WeakPolarHBondContact CA-O 3.3Å; Y60-G111 VanDerWaalsContact N-C 3.31Å; Y60-G111 PolarHBondContact N-O 3.25Å; Y60-L114 HydrophobicContact CD2-CB 4.35Å; Y60-L114 WeakPolarHBondContact CE2-O 3.39Å; Y60-G115 WeakPolarHBondContact O-CA 2.94Å
61T92.3Very high89.1Confident12 Ų1235.1 Ų35.17%0.07420%0.203CC..Hα-helixtrans-64.1-45.5-179.1-60.10000111.7T57 L58 G59 K64 L65 L464 N467T57-T61 WeakPolarHBondContact O-CB 3.32Å; T57-T61 PolarHBondContact O-N 2.83Å; T57-T61 PolarHBondContact O-OG1 3.27Å; L58-T61 PolarHBondContact O-N 3.04Å; L58-T61 VanDerWaalsContact O-N 3.14Å; G59-T61 VanDerWaalsContact C-N 3.34Å; G59-T61 PolarHBondContact O-N 3.2Å; T61-K64 PolarHBondContact O-N 3.2Å; T61-L65 PolarHBondContact O-N 3.36Å; T61-L65 VanDerWaalsContact O-N 3.16Å; T61-L464 HydrophobicContact CG2-CD1 4.23Å; T61-N467 HydrophobicContact CG2-CB 3.72Å
62V90.5Very high88.1Confident79 Ų7938.5 Ų38.548%0.47922%0.219SC..Hα-helixtrans-60.5-52.9178.41720000110.4L58 G59 K64 L65 I66 L112L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 2.95Å; G59-V62 PolarHBondContact O-N 3.29Å; V62-K64 PolarHBondContact O-N 3.11Å; V62-L65 PolarHBondContact O-N 2.92Å; V62-I66 HydrophobicContact CG1-CD1 3.91Å; V62-I66 WeakPolarHBondContact O-CG1 3.23Å; V62-I66 PolarHBondContact O-N 3Å; V62-L112 HydrophobicContact CB-CD2 4.49Å
63T90.9Very high87.4Confident30 Ų3044.9 Ų44.918%0.18425%0.248CC..Hα-helixtrans-73-27.6-176.8-42.80000112.6G59 L65 G67 L112G59-T63 PolarHBondContact O-N 2.93Å; G59-T63 VanDerWaalsContact O-N 3.13Å; G59-T63 PolarHBondContact O-OG1 3.18Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-G67 WeakPolarHBondContact O-CA 3.46Å; T63-G67 PolarHBondContact O-N 3.21Å; T63-L112 WeakPolarHBondContact CB-O 3.38Å; T63-L112 VanDerWaalsContact CG2-O 3.23Å; T63-L112 WeakPolarHBondContact CG2-O 3.24Å; T63-L112 WeakPolarHBondContact OG1-CA 3.44Å; T63-L112 WeakPolarHBondContact OG1-CD2 3.38Å; T63-L112 PolarHBondContact OG1-O 3.4Å
64K88Confident87Confident52 Ų5248.2 Ų48.223%0.22627%0.265CS..Hα-helixtrans-64.7-39.8173.7-178172.9174.4-176.10111.8Y60 T61 V62 G68 G115 P119Y60-K64 HydrophobicContact CD1-CD 4.33Å; Y60-K64 HydrophobicContact CE1-CB 4.42Å; Y60-K64 HydrophobicContact CE1-CD 3.51Å; Y60-K64 WeakPolarHBondContact O-CB 3.39Å; Y60-K64 PolarHBondContact O-N 2.88Å; T61-K64 PolarHBondContact O-N 3.2Å; V62-K64 PolarHBondContact O-N 3.11Å; K64-G68 PolarHBondContact O-N 2.94Å; K64-G68 VanDerWaalsContact O-N 3.07Å; K64-G115 VanDerWaalsContact CA-O 3.23Å; K64-G115 WeakPolarHBondContact CA-O 3.29Å; K64-G115 WeakPolarHBondContact CB-O 3.31Å; K64-P119 HydrophobicContact CG-CG 4.25Å
65L81.4Confident86.6Confident88 Ų8850.5 Ų50.546%0.46128%0.277SS..Hα-helixtrans-65.5-48.9176.5-174.7138.2000111.2T61 V62 T63 I69 L464T61-L65 PolarHBondContact O-N 3.36Å; T61-L65 VanDerWaalsContact O-N 3.16Å; V62-L65 PolarHBondContact O-N 2.92Å; T63-L65 VanDerWaalsContact C-N 3.34Å; L65-I69 WeakPolarHBondContact O-CD1 3.26Å; L65-L464 HydrophobicContact CD1-CD1 3.81Å; L65-L464 HydrophobicContact CD1-CD2 3.97Å; L65-L464 HydrophobicContact CD1-CG 4.48Å
66I84.1Confident86.3Confident85 Ų8550.5 Ų50.544%0.43628%0.275SS..Hα-helixtrans-65-46.8178.3-61.7166.8000110.8V62 G68 I69 L70V62-I66 HydrophobicContact CG1-CD1 3.91Å; V62-I66 WeakPolarHBondContact O-CG1 3.23Å; V62-I66 PolarHBondContact O-N 3Å; I66-G68 VanDerWaalsContact C-N 3.31Å; I66-G68 PolarHBondContact O-N 3.31Å; I66-I69 PolarHBondContact O-N 2.57Å; I66-I69 VanDerWaalsContact O-N 3.15Å; I66-L70 PolarHBondContact O-N 3.42Å
67G78.5Confident86.1Confident3 Ų350.5 Ų50.53%0.03128%0.276CS..Hα-helixtrans-61-37.7-177.400000112.7T63 I69 L70 M71T63-G67 WeakPolarHBondContact O-CA 3.46Å; T63-G67 PolarHBondContact O-N 3.21Å; G67-I69 PolarHBondContact O-N 2.96Å; G67-L70 PolarHBondContact O-N 3.48Å; G67-M71 VanDerWaalsContact O-CE 3.32Å; G67-M71 WeakPolarHBondContact O-CE 3.49Å; G67-M71 VanDerWaalsContact O-CG 3.22Å; G67-M71 WeakPolarHBondContact O-CG 3.24Å; G67-M71 PolarHBondContact O-N 3.36Å
68G71.8Confident86Confident38 Ų3855.9 Ų55.939%0.39230%0.295SS..Hα-helixtrans-54.6-38.917500000113.7K64 I66K64-G68 PolarHBondContact O-N 2.94Å; K64-G68 VanDerWaalsContact O-N 3.07Å; I66-G68 VanDerWaalsContact C-N 3.31Å; I66-G68 PolarHBondContact O-N 3.31Å
69I75.8Confident85.9Confident70 Ų7053.6 Ų53.636%0.35928%0.283SS..Hα-helixtrans-81.5-40.8-180-59.9146.9000110.7L65 I66 G67 M71 D72 I300L65-I69 WeakPolarHBondContact O-CD1 3.26Å; I66-I69 PolarHBondContact O-N 2.57Å; I66-I69 VanDerWaalsContact O-N 3.15Å; G67-I69 PolarHBondContact O-N 2.96Å; I69-M71 VanDerWaalsContact C-N 3.25Å; I69-M71 PolarHBondContact O-N 3.44Å; I69-D72 PolarHBondContact O-N 3.42Å; I69-I300 HydrophobicContact CD1-CD1 3.3Å; I69-I300 HydrophobicContact CD1-CG1 3.88Å; I69-I300 HydrophobicContact CG1-CD1 4.38Å; I69-I300 HydrophobicContact CG1-CG1 4.49Å
70L77.1Confident86Confident78 Ų7853.2 Ų53.241%0.40828%0.279SS..Hα-helixtrans-69.8-22.8-175.3-138.470.7000113I66 G67 D72 H73 L74I66-L70 PolarHBondContact O-N 3.42Å; G67-L70 PolarHBondContact O-N 3.48Å; L70-D72 PolarHBondContact O-N 2.9Å; L70-H73 PolarHBondContact O-N 3.49Å; L70-H73 VanDerWaalsContact O-N 3.17Å; L70-L74 HydrophobicContact CB-CD1 4.34Å; L70-L74 HydrophobicContact CD2-CD1 3.42Å; L70-L74 VanDerWaalsContact CD2-CD1 3.42Å; L70-L74 HydrophobicContact CG-CD1 3.55Å; L70-L74 HydrophobicContact CG-CG 4.19Å; L70-L74 PolarHBondContact O-N 3.21Å
71M81.4Confident86.1Confident7 Ų753 Ų533%0.03428%0.279CS..THydrogen-bonded Turntrans-66-14179.6-76.2-35.7100.400114.3G67 I69 P76 I79 P119 A120 K123G67-M71 VanDerWaalsContact O-CE 3.32Å; G67-M71 WeakPolarHBondContact O-CE 3.49Å; G67-M71 VanDerWaalsContact O-CG 3.22Å; G67-M71 WeakPolarHBondContact O-CG 3.24Å; G67-M71 PolarHBondContact O-N 3.36Å; I69-M71 VanDerWaalsContact C-N 3.25Å; I69-M71 PolarHBondContact O-N 3.44Å; M71-P76 HydrophobicContact SD-CB 3.99Å; M71-I79 HydrophobicContact CE-CB 4.07Å; M71-I79 HydrophobicContact CE-CG1 4.08Å; M71-I79 HydrophobicContact CE-CG2 3.71Å; M71-I79 HydrophobicContact SD-CB 4.26Å; M71-I79 HydrophobicContact SD-CG1 4.41Å; M71-I79 HydrophobicContact SD-CG2 4.41Å; M71-P119 HydrophobicContact CG-CB 3.83Å; M71-A120 HydrophobicContact SD-CB 3.77Å; M71-K123 HydrophobicContact CB-CB 4.25Å; M71-K123 HydrophobicContact CB-CG 4.35Å
72D74Confident86.3Confident101 Ų10159.6 Ų59.654%0.5430%0.303SS..THydrogen-bonded Turntrans-82.5-18176.1-71.1-28.1000113I69 L70 K123I69-D72 PolarHBondContact O-N 3.42Å; L70-D72 PolarHBondContact O-N 2.9Å; D72-K123 IonicContact OD1-NZ 2.7Å; D72-K123 PolarHBondContact OD1-NZ 3.38Å
73H81.2Confident86.5Confident137 Ų13756 Ų5663%0.63428%0.282SS*.THydrogen-bonded Turntrans-112.8-16.3-176.2-58.9-56.4000113.5L70L70-H73 PolarHBondContact O-N 3.49Å; L70-H73 VanDerWaalsContact O-N 3.17Å
74L86.8Confident86.8Confident73 Ų7354.6 Ų54.638%0.38227%0.273SS..SBendtrans-113.4159.8-177.1-58.8-178.8000111L70 P76 I79L70-L74 HydrophobicContact CB-CD1 4.34Å; L70-L74 HydrophobicContact CD2-CD1 3.42Å; L70-L74 VanDerWaalsContact CD2-CD1 3.42Å; L70-L74 HydrophobicContact CG-CD1 3.55Å; L70-L74 HydrophobicContact CG-CG 4.19Å; L70-L74 PolarHBondContact O-N 3.21Å; L74-P76 WeakPolarHBondContact O-CD 3.2Å; L74-I79 HydrophobicContact CB-CD1 4.41Å; L74-I79 HydrophobicContact CB-CG1 4.13Å; L74-I79 HydrophobicContact CD1-CD1 3.76Å; L74-I79 HydrophobicContact CD1-CG1 4.21Å
75N90.2Very high87.3Confident66 Ų6655.6 Ų55.635%0.35328%0.28SS..  trans-69.9112.6170.1-176.1-48.2000109.1L77 R78 I79N75-L77 VanDerWaalsContact C-N 3.33Å; N75-L77 PolarHBondContact O-N 3.33Å; N75-L77 PolarHBondContact OD1-N 3.2Å; N75-L77 VanDerWaalsContact OD1-N 3.11Å; N75-R78 HydrophobicContact CB-CB 4.23Å; N75-R78 HydrophobicContact CB-CG 4.09Å; N75-R78 PolarHBondContact O-N 2.86Å; N75-R78 PolarHBondContact OD1-N 2.72Å; N75-I79 PolarHBondContact O-N 3.29Å
76P90.5Very high88.1Confident20 Ų2054.2 Ų54.213%0.1328%0.278CS..Hα-helixtrans-64.7-37.9-171.826-35000112.2M71 L74 R78 I79 F80 A120 K123M71-P76 HydrophobicContact SD-CB 3.99Å; L74-P76 WeakPolarHBondContact O-CD 3.2Å; P76-R78 VanDerWaalsContact C-N 3.34Å; P76-R78 PolarHBondContact O-N 3.12Å; P76-I79 PolarHBondContact O-N 3.22Å; P76-F80 PolarHBondContact O-N 3.05Å; P76-A120 HydrophobicContact CB-CB 4.4Å; P76-A120 WeakPolarHBondContact CB-O 3.16Å; P76-A120 VanDerWaalsContact O-CB 3.32Å; P76-A120 WeakPolarHBondContact O-CB 3.4Å; P76-K123 HydrophobicContact CB-CB 3.92Å; P76-K123 HydrophobicContact CB-CG 4.07Å; P76-K123 HydrophobicContact CG-CB 4.19Å; P76-K123 HydrophobicContact CG-CG 3.92Å
77L92.7Very high88.7Confident11 Ų1150.2 Ų50.26%0.05826%0.257CS..Hα-helixtrans-64.6-39-179.6-158.285.2000111.7L11 L15 N75 F80 I81 T124 L190 Y193 L194L11-L77 HydrophobicContact CD1-CD1 3.85Å; L15-L77 HydrophobicContact CD2-CD1 4.18Å; N75-L77 VanDerWaalsContact C-N 3.33Å; N75-L77 PolarHBondContact O-N 3.33Å; N75-L77 PolarHBondContact OD1-N 3.2Å; N75-L77 VanDerWaalsContact OD1-N 3.11Å; L77-F80 PolarHBondContact O-N 3.13Å; L77-I81 WeakPolarHBondContact O-CG1 3.43Å; L77-I81 PolarHBondContact O-N 3.14Å; L77-T124 HydrophobicContact CD1-CG2 3.66Å; L77-L190 HydrophobicContact CD1-CD2 4.26Å; L77-Y193 HydrophobicContact CD2-CD1 4.3Å; L77-L194 HydrophobicContact CD2-CB 4.17Å; L77-L194 HydrophobicContact CD2-CD1 4.01Å
78R94.2Very high89.6Confident120 Ų12050.8 Ų50.845%0.45326%0.261SS..Hα-helixtrans-63.9-40.4175.9-68.7-174.2-175.6170.71.8111.9N75 P76 F80 I81 Y82 L194N75-R78 HydrophobicContact CB-CB 4.23Å; N75-R78 HydrophobicContact CB-CG 4.09Å; N75-R78 PolarHBondContact O-N 2.86Å; N75-R78 PolarHBondContact OD1-N 2.72Å; P76-R78 VanDerWaalsContact C-N 3.34Å; P76-R78 PolarHBondContact O-N 3.12Å; R78-F80 VanDerWaalsContact C-N 3.31Å; R78-F80 PolarHBondContact O-N 3.29Å; R78-I81 WeakPolarHBondContact O-CB 3.45Å; R78-I81 PolarHBondContact O-N 3.18Å; R78-Y82 HydrophobicContact CB-CE2 4.41Å; R78-Y82 VanDerWaalsContact O-CD2 3.22Å; R78-Y82 WeakPolarHBondContact O-CD2 3.33Å; R78-Y82 PolarHBondContact O-N 3.47Å; R78-L194 HydrophobicContact CG-CD2 3.65Å
79I93.9Very high90.8Very high36 Ų3650.8 Ų50.819%0.18526%0.261CS..Hα-helixtrans-64.3-39.3176.7-59.7-63.3000111.2M71 L74 N75 P76 I81 Y82 S83M71-I79 HydrophobicContact CE-CB 4.07Å; M71-I79 HydrophobicContact CE-CG1 4.08Å; M71-I79 HydrophobicContact CE-CG2 3.71Å; M71-I79 HydrophobicContact SD-CB 4.26Å; M71-I79 HydrophobicContact SD-CG1 4.41Å; M71-I79 HydrophobicContact SD-CG2 4.41Å; L74-I79 HydrophobicContact CB-CD1 4.41Å; L74-I79 HydrophobicContact CB-CG1 4.13Å; L74-I79 HydrophobicContact CD1-CD1 3.76Å; L74-I79 HydrophobicContact CD1-CG1 4.21Å; N75-I79 PolarHBondContact O-N 3.29Å; P76-I79 PolarHBondContact O-N 3.22Å; I79-I81 VanDerWaalsContact C-N 3.33Å; I79-I81 PolarHBondContact O-N 3.29Å; I79-Y82 HydrophobicContact CD1-CD2 4.43Å; I79-Y82 PolarHBondContact O-N 3.25Å; I79-S83 PolarHBondContact O-N 3.23Å
80F95.8Very high91.8Very high0 Ų047.8 Ų47.80%025%0.246CC..Hα-helixtrans-65.2-36.2175.6-174.7-138.7000112.9L15 P76 L77 R78 S83 L84 A120 I121 L190L15-F80 HydrophobicContact CD2-CD1 4.28Å; L15-F80 HydrophobicContact CD2-CE1 4.22Å; P76-F80 PolarHBondContact O-N 3.05Å; L77-F80 PolarHBondContact O-N 3.13Å; R78-F80 VanDerWaalsContact C-N 3.31Å; R78-F80 PolarHBondContact O-N 3.29Å; F80-S83 WeakPolarHBondContact CA-OG 3.39Å; F80-S83 PolarHBondContact O-N 3.42Å; F80-S83 PolarHBondContact O-OG 3.39Å; F80-L84 HydrophobicContact CD2-CG 4.41Å; F80-L84 HydrophobicContact CE1-CD1 4.24Å; F80-L84 HydrophobicContact CE2-CD1 4.23Å; F80-L84 HydrophobicContact CE2-CD2 4.25Å; F80-L84 HydrophobicContact CE2-CG 4.05Å; F80-L84 HydrophobicContact CZ-CD1 4.06Å; F80-L84 HydrophobicContact CZ-CD2 4.41Å; F80-L84 HydrophobicContact CZ-CG 4.33Å; F80-L84 WeakPolarHBondContact O-CG 3.39Å; F80-L84 PolarHBondContact O-N 2.82Å; F80-L84 VanDerWaalsContact O-N 3.14Å; F80-A120 HydrophobicContact CB-CB 3.86Å; F80-I121 HydrophobicContact CD1-CG1 3.98Å; F80-I121 HydrophobicContact CD2-CD1 4.37Å; F80-I121 HydrophobicContact CD2-CG1 4.31Å; F80-I121 HydrophobicContact CE1-CD1 4Å; F80-I121 HydrophobicContact CE1-CG1 3.84Å; F80-I121 HydrophobicContact CE2-CD1 3.84Å; F80-I121 HydrophobicContact CE2-CG1 4.22Å; F80-I121 HydrophobicContact CG-CG1 4.22Å; F80-I121 HydrophobicContact CZ-CD1 3.64Å; F80-I121 HydrophobicContact CZ-CG1 3.98Å; F80-L190 HydrophobicContact CD1-CD1 3.78Å; F80-L190 HydrophobicContact CE1-CD1 3.86Å
81I97Very high92.7Very high7 Ų744.1 Ų44.14%0.03623%0.227CC..Hα-helixtrans-61.5-47.8172.6-70.1161.1000110.4L77 R78 I79 S83 L84 I85 A187 L190 I191L77-I81 WeakPolarHBondContact O-CG1 3.43Å; L77-I81 PolarHBondContact O-N 3.14Å; R78-I81 WeakPolarHBondContact O-CB 3.45Å; R78-I81 PolarHBondContact O-N 3.18Å; I79-I81 VanDerWaalsContact C-N 3.33Å; I79-I81 PolarHBondContact O-N 3.29Å; I81-S83 VanDerWaalsContact C-N 3.33Å; I81-S83 PolarHBondContact O-N 3.2Å; I81-L84 PolarHBondContact O-N 3.33Å; I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 WeakPolarHBondContact O-CG1 3.17Å; I81-I85 PolarHBondContact O-N 2.71Å; I81-I85 VanDerWaalsContact O-N 3.13Å; I81-A187 HydrophobicContact CG2-CB 4.23Å; I81-L190 HydrophobicContact CD1-CB 3.89Å; I81-L190 HydrophobicContact CG1-CB 3.67Å; I81-L190 HydrophobicContact CG1-CD1 4.21Å; I81-I191 HydrophobicContact CD1-CG1 3.88Å; I81-I191 HydrophobicContact CG1-CG1 4.4Å; I81-I191 HydrophobicContact CG2-CD1 3.81Å; I81-I191 HydrophobicContact CG2-CG1 3.74Å
82Y95.7Very high93.4Very high151 Ų15149.2 Ų49.259%0.59225%0.249SC*.Hα-helixtrans-64.4-35.6179-63-42000112.9R78 I79 I85 S86R78-Y82 HydrophobicContact CB-CE2 4.41Å; R78-Y82 VanDerWaalsContact O-CD2 3.22Å; R78-Y82 WeakPolarHBondContact O-CD2 3.33Å; R78-Y82 PolarHBondContact O-N 3.47Å; I79-Y82 HydrophobicContact CD1-CD2 4.43Å; I79-Y82 PolarHBondContact O-N 3.25Å; Y82-I85 PolarHBondContact O-N 3.31Å; Y82-S86 VanDerWaalsContact O-CB 3.26Å; Y82-S86 WeakPolarHBondContact O-CB 3.48Å; Y82-S86 PolarHBondContact O-N 2.88Å
83S96.1Very high94.5Very high4 Ų448.7 Ų48.73%0.02825%0.246CC..Hα-helixtrans-65.3-40.3175.964.80000112.3I79 F80 I81 A87 A113 S117I79-S83 PolarHBondContact O-N 3.23Å; F80-S83 WeakPolarHBondContact CA-OG 3.39Å; F80-S83 PolarHBondContact O-N 3.42Å; F80-S83 PolarHBondContact O-OG 3.39Å; I81-S83 VanDerWaalsContact C-N 3.33Å; I81-S83 PolarHBondContact O-N 3.2Å; S83-A87 WeakPolarHBondContact O-CB 3.22Å; S83-A87 PolarHBondContact O-N 2.93Å; S83-A113 WeakPolarHBondContact CB-O 3.4Å; S83-S117 WeakPolarHBondContact CB-OG 3.41Å; S83-S117 PolarHBondContact OG-OG 3.44Å
84L97.7Very high95Very high0 Ų042.2 Ų42.20%022%0.216CC..Hα-helixtrans-62.4-45.9175.8-73.1168.8000112.2T22 F80 I81 A87 S88 C183 A187 L190T22-L84 VanDerWaalsContact OG1-CD2 3.3Å; T22-L84 WeakPolarHBondContact OG1-CD2 3.37Å; F80-L84 HydrophobicContact CD2-CG 4.41Å; F80-L84 HydrophobicContact CE1-CD1 4.24Å; F80-L84 HydrophobicContact CE2-CD1 4.23Å; F80-L84 HydrophobicContact CE2-CD2 4.25Å; F80-L84 HydrophobicContact CE2-CG 4.05Å; F80-L84 HydrophobicContact CZ-CD1 4.06Å; F80-L84 HydrophobicContact CZ-CD2 4.41Å; F80-L84 HydrophobicContact CZ-CG 4.33Å; F80-L84 WeakPolarHBondContact O-CG 3.39Å; F80-L84 PolarHBondContact O-N 2.82Å; F80-L84 VanDerWaalsContact O-N 3.14Å; I81-L84 PolarHBondContact O-N 3.33Å; L84-A87 PolarHBondContact O-N 3.16Å; L84-S88 PolarHBondContact O-N 3.3Å; L84-C183 HydrophobicContact CD2-CB 4.16Å; L84-A187 HydrophobicContact CB-CB 4.02Å; L84-A187 HydrophobicContact CD1-CB 4.28Å; L84-L190 HydrophobicContact CD1-CD1 3.89Å
85I98Very high95.4Very high72 Ų7238.9 Ų38.937%0.36920%0.199SC..Hα-helixtrans-64.8-46.8179.3-64.2169.3000110.6I81 Y82 A87 S88 G89 I184 A187I81-I85 HydrophobicContact CG2-CD1 3.96Å; I81-I85 WeakPolarHBondContact O-CG1 3.17Å; I81-I85 PolarHBondContact O-N 2.71Å; I81-I85 VanDerWaalsContact O-N 3.13Å; Y82-I85 PolarHBondContact O-N 3.31Å; I85-A87 PolarHBondContact O-N 3.01Å; I85-S88 WeakPolarHBondContact O-CB 3.33Å; I85-S88 PolarHBondContact O-N 3.22Å; I85-G89 PolarHBondContact O-N 3.45Å; I85-I184 HydrophobicContact CB-CD1 4.26Å; I85-I184 HydrophobicContact CG1-CD1 4.05Å; I85-I184 HydrophobicContact CG2-CD1 4.15Å; I85-A187 HydrophobicContact CD1-CB 4.28Å; I85-A187 HydrophobicContact CG1-CB 3.78Å
86S96.6Very high95.6Very high60 Ų6039.6 Ų39.642%0.4221%0.206SC..Hα-helixtrans-62.6-41.8178.8-179.80000112.3Y82 S88 G89 S90 A113Y82-S86 VanDerWaalsContact O-CB 3.26Å; Y82-S86 WeakPolarHBondContact O-CB 3.48Å; Y82-S86 PolarHBondContact O-N 2.88Å; S86-S88 PolarHBondContact O-N 3.46Å; S86-G89 PolarHBondContact O-N 2.91Å; S86-S90 PolarHBondContact O-N 3.05Å; S86-S90 VanDerWaalsContact O-N 3.09Å; S86-S90 PolarHBondContact O-OG 3.37Å; S86-A113 WeakPolarHBondContact OG-CB 3.41Å
87A97.4Very high95.6Very high0 Ų039.6 Ų39.60%021%0.206CC..Hα-helixtrans-63.7-40.5174.800000112S83 L84 I85 G89 S90 L91 T110 A113 L114S83-A87 WeakPolarHBondContact O-CB 3.22Å; S83-A87 PolarHBondContact O-N 2.93Å; L84-A87 PolarHBondContact O-N 3.16Å; I85-A87 PolarHBondContact O-N 3.01Å; A87-G89 PolarHBondContact O-N 3.44Å; A87-S90 PolarHBondContact O-N 3.38Å; A87-L91 WeakPolarHBondContact O-CG 3.47Å; A87-L91 PolarHBondContact O-N 3Å; A87-T110 HydrophobicContact CB-CG2 4.44Å; A87-A113 HydrophobicContact CB-CB 4.21Å; A87-L114 HydrophobicContact CB-CD1 4.18Å; A87-L114 HydrophobicContact CB-CD2 3.42Å; A87-L114 VanDerWaalsContact CB-CD2 3.42Å; A87-L114 HydrophobicContact CB-CG 3.75Å
88S97.8Very high95.4Very high15 Ų1540.9 Ų40.911%0.10522%0.216CC..Hα-helixtrans-61-43.8175.2-178.10000112.3L84 I85 S86 S90 L91 F92 G180 I184L84-S88 PolarHBondContact O-N 3.3Å; I85-S88 WeakPolarHBondContact O-CB 3.33Å; I85-S88 PolarHBondContact O-N 3.22Å; S86-S88 PolarHBondContact O-N 3.46Å; S88-S90 VanDerWaalsContact C-N 3.3Å; S88-S90 PolarHBondContact O-N 2.93Å; S88-L91 PolarHBondContact O-N 2.92Å; S88-F92 PolarHBondContact O-N 3.28Å; S88-G180 VanDerWaalsContact OG-C 3.27Å; S88-G180 WeakPolarHBondContact OG-CA 3.26Å; S88-G180 PolarHBondContact OG-O 3.27Å; S88-I184 VanDerWaalsContact OG-CG1 3.27Å; S88-I184 WeakPolarHBondContact OG-CG1 3.22Å
89G96.6Very high95.2Very high38 Ų3841.8 Ų41.839%0.39223%0.225SC..Hα-helixtrans-59.7-42.8176.100000112I85 S86 A87 F92 L93I85-G89 PolarHBondContact O-N 3.45Å; S86-G89 PolarHBondContact O-N 2.91Å; A87-G89 PolarHBondContact O-N 3.44Å; G89-F92 PolarHBondContact O-N 2.75Å; G89-L93 WeakPolarHBondContact O-CG 3.41Å; G89-L93 PolarHBondContact O-N 2.91Å; G89-L93 VanDerWaalsContact O-N 3.08Å
90S96.5Very high94.9Very high8 Ų842.7 Ų42.76%0.05623%0.228CC..Hα-helixtrans-66.1-39177.9-55.90000112.7S86 A87 S88 L93 L94 T110S86-S90 PolarHBondContact O-N 3.05Å; S86-S90 VanDerWaalsContact O-N 3.09Å; S86-S90 PolarHBondContact O-OG 3.37Å; A87-S90 PolarHBondContact O-N 3.38Å; S88-S90 VanDerWaalsContact C-N 3.3Å; S88-S90 PolarHBondContact O-N 2.93Å; S90-L93 PolarHBondContact O-N 3.29Å; S90-L94 PolarHBondContact O-N 2.72Å; S90-L94 VanDerWaalsContact O-N 3.08Å; S90-T110 WeakPolarHBondContact CB-OG1 3.2Å
91L97Very high94.6Very high0 Ų047.9 Ų47.90%026%0.26CS..Hα-helixtrans-66.8-36.3174.2-72.1176.3000112.7A25 A28 A87 S88 L94 S95 Y107 F176 V179A25-L91 HydrophobicContact CB-CD1 3.78Å; A28-L91 HydrophobicContact CB-CD2 3.79Å; A87-L91 WeakPolarHBondContact O-CG 3.47Å; A87-L91 PolarHBondContact O-N 3Å; S88-L91 PolarHBondContact O-N 2.92Å; L91-L94 HydrophobicContact CD2-CD1 4.25Å; L91-L94 WeakPolarHBondContact O-CB 3.35Å; L91-L94 PolarHBondContact O-N 3.45Å; L91-S95 PolarHBondContact O-N 3.01Å; L91-Y107 HydrophobicContact CD2-CE2 4.46Å; L91-F176 HydrophobicContact CD2-CD1 4.19Å; L91-V179 HydrophobicContact CD1-CB 4.34Å; L91-V179 HydrophobicContact CD1-CG1 3.88Å
92F96.8Very high94.4Very high115 Ų11550.2 Ų50.250%0.50428%0.275SS..Hα-helixtrans-64-43.2173.8-177.9-102.3000111.4S88 G89 L94 S95 V96S88-F92 PolarHBondContact O-N 3.28Å; G89-F92 PolarHBondContact O-N 2.75Å; F92-L94 VanDerWaalsContact C-N 3.3Å; F92-L94 PolarHBondContact O-N 3.26Å; F92-S95 WeakPolarHBondContact O-CB 3.29Å; F92-S95 PolarHBondContact O-N 3Å; F92-S95 VanDerWaalsContact O-N 3.1Å; F92-V96 HydrophobicContact CD1-CG2 4.39Å; F92-V96 HydrophobicContact CE1-CG2 3.95Å; F92-V96 HydrophobicContact CE2-CG2 4.24Å; F92-V96 HydrophobicContact CZ-CG2 3.87Å; F92-V96 WeakPolarHBondContact O-CG2 3.47Å; F92-V96 PolarHBondContact O-N 3.38Å; F92-V96 VanDerWaalsContact O-N 3.1Å
93L95.5Very high94.3Very high90 Ų9043.2 Ų43.247%0.47125%0.247SC..Hα-helixtrans-60-39.1174.4-70173.1000112.6G89 S90 S95 S97G89-L93 WeakPolarHBondContact O-CG 3.41Å; G89-L93 PolarHBondContact O-N 2.91Å; G89-L93 VanDerWaalsContact O-N 3.08Å; S90-L93 PolarHBondContact O-N 3.29Å; L93-S95 VanDerWaalsContact C-N 3.35Å; L93-S97 WeakPolarHBondContact O-CB 3.33Å; L93-S97 PolarHBondContact O-N 3.45Å
94L93.3Very high94.3Very high0 Ų046.1 Ų46.10%026%0.262CS..Hα-helixtrans-60.6-42.8172.4-90.4152.8000112.5S90 L91 F92 W103 Y107S90-L94 PolarHBondContact O-N 2.72Å; S90-L94 VanDerWaalsContact O-N 3.08Å; L91-L94 HydrophobicContact CD2-CD1 4.25Å; L91-L94 WeakPolarHBondContact O-CB 3.35Å; L91-L94 PolarHBondContact O-N 3.45Å; F92-L94 VanDerWaalsContact C-N 3.3Å; F92-L94 PolarHBondContact O-N 3.26Å; L94-W103 HydrophobicContact CD2-CB 3.7Å; L94-W103 HydrophobicContact CD2-CG 3.74Å; L94-W103 PolarHBondContact O-NE1 2.94Å; L94-Y107 HydrophobicContact CD1-CD2 3.44Å; L94-Y107 VanDerWaalsContact CD1-CD2 3.44Å; L94-Y107 HydrophobicContact CD1-CE2 4.32Å; L94-Y107 HydrophobicContact CD1-CG 4.14Å
95S94.4Very high94.2Very high3 Ų349.9 Ų49.92%0.02129%0.285CS..Hα-helixtrans-64-40.5-179.5-172.40000112.6L91 F92 L93 R173 I177L91-S95 PolarHBondContact O-N 3.01Å; F92-S95 WeakPolarHBondContact O-CB 3.29Å; F92-S95 PolarHBondContact O-N 3Å; F92-S95 VanDerWaalsContact O-N 3.1Å; L93-S95 VanDerWaalsContact C-N 3.35Å; S95-R173 WeakPolarHBondContact O-CD 3.39Å; S95-R173 VanDerWaalsContact O-CG 3.29Å; S95-R173 WeakPolarHBondContact O-CG 3.24Å; S95-R173 PolarHBondContact O-NE 3.07Å; S95-R173 PolarHBondContact O-NH1 3.12Å; S95-R173 WeakPolarHBondContact OG-CB 3.38Å; S95-R173 PolarHBondContact OG-O 3.34Å; S95-I177 WeakPolarHBondContact OG-CD1 3.22Å; S95-I177 WeakPolarHBondContact OG-CG1 3.32Å
96V93.6Very high94.1Very high82 Ų8246.8 Ų46.850%0.49727%0.269SS..Hα-helixtrans-77.2-33.5-175.7176.50000112.3F92 R173F92-V96 HydrophobicContact CD1-CG2 4.39Å; F92-V96 HydrophobicContact CE1-CG2 3.95Å; F92-V96 HydrophobicContact CE2-CG2 4.24Å; F92-V96 HydrophobicContact CZ-CG2 3.87Å; F92-V96 WeakPolarHBondContact O-CG2 3.47Å; F92-V96 PolarHBondContact O-N 3.38Å; F92-V96 VanDerWaalsContact O-N 3.1Å; V96-R173 VanDerWaalsContact O-CZ 3.26Å; V96-R173 PolarHBondContact O-NH1 3.38Å; V96-R173 PolarHBondContact O-NH2 2.89Å
97S91.1Very high94.1Very high19 Ų1943.9 Ų43.913%0.13325%0.249CC..  trans-84.7146.4-175.1-173.90000113.2L93 H99 V102 W103L93-S97 WeakPolarHBondContact O-CB 3.33Å; L93-S97 PolarHBondContact O-N 3.45Å; S97-H99 PolarHBondContact OG-N 3.23Å; S97-H99 VanDerWaalsContact OG-N 3.15Å; S97-V102 VanDerWaalsContact OG-CB 3.27Å; S97-V102 WeakPolarHBondContact OG-CB 3.19Å; S97-V102 WeakPolarHBondContact OG-CG1 3.4Å; S97-W103 PolarHBondContact O-NE1 3.36Å
98S88.4Confident94.1Very high38 Ų3844.4 Ų44.427%0.26626%0.255SS..  trans-110.61.2167.9-64.70000113Y40 R173Y40-S98 WeakPolarHBondContact CE1-OG 3.34Å; S98-R173 PolarHBondContact OG-NH2 3.03Å
99H90.1Very high94Very high139 Ų13947.4 Ų47.464%0.64427%0.269SS*.  trans-89.4128.4-179.1-72.5-68.2000111.7S97 T101 V102 W103S97-H99 PolarHBondContact OG-N 3.23Å; S97-H99 VanDerWaalsContact OG-N 3.15Å; H99-T101 VanDerWaalsContact C-N 3.32Å; H99-T101 PolarHBondContact O-N 3.47Å; H99-V102 HydrophobicContact CB-CB 4.34Å; H99-V102 HydrophobicContact CB-CG2 3.96Å; H99-V102 WeakPolarHBondContact O-CB 3.25Å; H99-V102 PolarHBondContact O-N 2.92Å; H99-W103 PolarHBondContact O-N 3.46Å
100Q86.9Confident94.1Very high56 Ų5645.6 Ų45.626%0.26225%0.25SS..Hα-helixtrans-60.5-37.1-176.9-62.1-177.8-5.800113.5Y40 K41 V102 W103 L104Y40-Q100 PolarHBondContact O-NE2 3.41Å; K41-Q100 VanDerWaalsContact C-NE2 3.29Å; K41-Q100 PolarHBondContact O-NE2 3.12Å; Q100-V102 VanDerWaalsContact C-N 3.31Å; Q100-V102 PolarHBondContact O-N 3.39Å; Q100-W103 WeakPolarHBondContact O-CB 3.39Å; Q100-W103 PolarHBondContact O-N 2.94Å; Q100-L104 PolarHBondContact O-N 2.95Å
101T90.2Very high94.1Very high109 Ų10945.2 Ų45.267%0.66925%0.248SC*.Hα-helixtrans-63.3-39.8176-46.90000111.6H99 W103 L104 V105H99-T101 VanDerWaalsContact C-N 3.32Å; H99-T101 PolarHBondContact O-N 3.47Å; T101-W103 VanDerWaalsContact C-N 3.31Å; T101-L104 PolarHBondContact O-N 2.85Å; T101-V105 WeakPolarHBondContact O-CG2 3.46Å; T101-V105 PolarHBondContact O-N 3.36Å
102V93.3Very high94Very high56 Ų5648.6 Ų48.634%0.33927%0.266SS..Hα-helixtrans-66.8-37.5175.9178.60000110S97 H99 Q100 V105 S106S97-V102 VanDerWaalsContact OG-CB 3.27Å; S97-V102 WeakPolarHBondContact OG-CB 3.19Å; S97-V102 WeakPolarHBondContact OG-CG1 3.4Å; H99-V102 HydrophobicContact CB-CB 4.34Å; H99-V102 HydrophobicContact CB-CG2 3.96Å; H99-V102 WeakPolarHBondContact O-CB 3.25Å; H99-V102 PolarHBondContact O-N 2.92Å; Q100-V102 VanDerWaalsContact C-N 3.31Å; Q100-V102 PolarHBondContact O-N 3.39Å; V102-V105 PolarHBondContact O-N 3.49Å; V102-S106 WeakPolarHBondContact O-CB 3.34Å; V102-S106 PolarHBondContact O-N 3.42Å; V102-S106 PolarHBondContact O-OG 3.3Å
103W93.7Very high94Very high4 Ų443.7 Ų43.72%0.01525%0.246CC..Hα-helixtrans-63.3-43.5173.8-65.8-1.6000112.3I29 I36 I52 L94 S97 H99 Q100 T101 Y107 W172I29-W103 HydrophobicContact CD1-CE3 4.19Å; I36-W103 HydrophobicContact CD1-CH2 3.96Å; I36-W103 HydrophobicContact CD1-CZ3 4.09Å; I36-W103 HydrophobicContact CG2-CH2 3.86Å; I36-W103 HydrophobicContact CG2-CZ3 4.48Å; I52-W103 HydrophobicContact CD1-CB 3.93Å; I52-W103 HydrophobicContact CD1-CE3 4.14Å; L94-W103 HydrophobicContact CD2-CB 3.7Å; L94-W103 HydrophobicContact CD2-CG 3.74Å; L94-W103 PolarHBondContact O-NE1 2.94Å; S97-W103 PolarHBondContact O-NE1 3.36Å; H99-W103 PolarHBondContact O-N 3.46Å; Q100-W103 WeakPolarHBondContact O-CB 3.39Å; Q100-W103 PolarHBondContact O-N 2.94Å; T101-W103 VanDerWaalsContact C-N 3.31Å; W103-Y107 WeakPolarHBondContact O-CB 3.5Å; W103-Y107 PolarHBondContact O-N 3.36Å; W103-W172 HydrophobicContact CH2-CH2 4.23Å; W103-W172 HydrophobicContact CH2-CZ3 4.3Å; W103-W172 AromaticContact CZ2-CH2 3.51Å; W103-W172 HydrophobicContact CZ2-CH2 3.51Å; W103-W172 HydrophobicContact CZ2-CZ2 4.43Å; W103-W172 AromaticContact CZ2-CZ3 3.8Å; W103-W172 HydrophobicContact CZ2-CZ3 3.8Å
104L95.1Very high94Very high64 Ų6439.4 Ų39.434%0.33522%0.223SC..Hα-helixtrans-59.6-49.2177-175150.6000111.4I52 A55 Q100 T101 G108I52-L104 HydrophobicContact CG1-CB 4.1Å; A55-L104 HydrophobicContact CB-CD2 4.12Å; A55-L104 HydrophobicContact CB-CG 4.01Å; Q100-L104 PolarHBondContact O-N 2.95Å; T101-L104 PolarHBondContact O-N 2.85Å; L104-G108 PolarHBondContact O-N 3.03Å
105V96.2Very high93.9Very high80 Ų8039.4 Ų39.449%0.48522%0.223SC..Hα-helixtrans-67.5-51-179.6174.10000111.1T101 V102 Y107 G108 L109T101-V105 WeakPolarHBondContact O-CG2 3.46Å; T101-V105 PolarHBondContact O-N 3.36Å; V102-V105 PolarHBondContact O-N 3.49Å; V105-Y107 VanDerWaalsContact C-N 3.34Å; V105-Y107 PolarHBondContact O-N 3.34Å; V105-G108 CarbonylContact O-C 3.59Å; V105-G108 WeakPolarHBondContact O-CA 3.29Å; V105-G108 PolarHBondContact O-N 2.93Å; V105-L109 HydrophobicContact CG1-CD1 4.35Å; V105-L109 WeakPolarHBondContact O-CG 3.48Å; V105-L109 PolarHBondContact O-N 3.22Å
106S96.1Very high93.8Very high6 Ų639.9 Ų39.94%0.04223%0.227CC..Hα-helixtrans-63.7-38-178.1-64.70000112.2V102 L109 T110V102-S106 WeakPolarHBondContact O-CB 3.34Å; V102-S106 PolarHBondContact O-N 3.42Å; V102-S106 PolarHBondContact O-OG 3.3Å; S106-L109 WeakPolarHBondContact O-CB 3.45Å; S106-L109 PolarHBondContact O-N 3.37Å; S106-T110 PolarHBondContact O-N 3.26Å; S106-T110 PolarHBondContact O-OG1 2.83Å
107Y96.2Very high93.8Very high0 Ų036 Ų360%020%0.203CC..Hα-helixtrans-75.6-30.6175.9-150.3-129.4000112.5R26 R27 A28 I29 Q30 I52 Q56 L91 L94 W103 V105 L109 T110 G111R26-Y107 PolarHBondContact O-OH 3.14Å; R27-Y107 VanDerWaalsContact C-OH 3.3Å; R27-Y107 WeakPolarHBondContact CA-OH 3.21Å; R27-Y107 PolarHBondContact N-OH 2.63Å; A28-Y107 HydrophobicContact CB-CE2 4.45Å; A28-Y107 PolarHBondContact N-OH 3.49Å; I29-Y107 HydrophobicContact CB-CE1 4.15Å; I29-Y107 HydrophobicContact CB-CE2 4.35Å; I29-Y107 HydrophobicContact CG2-CD1 3.8Å; I29-Y107 HydrophobicContact CG2-CE1 3.25Å; I29-Y107 HydrophobicContact CG2-CE2 4.3Å; I29-Y107 HydrophobicContact CG2-CG 4.5Å; I29-Y107 PolarHBondContact N-OH 3.02Å; Q30-Y107 PolarHBondContact OE1-OH 2.95Å; I52-Y107 HydrophobicContact CG2-CD1 3.63Å; I52-Y107 HydrophobicContact CG2-CG 3.99Å; Q56-Y107 HydrophobicContact CB-CD1 3.36Å; Q56-Y107 HydrophobicContact CB-CE1 3.78Å; Q56-Y107 HydrophobicContact CB-CG 4.02Å; Q56-Y107 WeakPolarHBondContact CB-O 3.33Å; Q56-Y107 HydrophobicContact CG-CD1 3.67Å; Q56-Y107 HydrophobicContact CG-CE1 3.69Å; Q56-Y107 HydrophobicContact CG-CG 4.14Å; Q56-Y107 WeakPolarHBondContact CG-O 3.37Å; L91-Y107 HydrophobicContact CD2-CE2 4.46Å; L94-Y107 HydrophobicContact CD1-CD2 3.44Å; L94-Y107 VanDerWaalsContact CD1-CD2 3.44Å; L94-Y107 HydrophobicContact CD1-CE2 4.32Å; L94-Y107 HydrophobicContact CD1-CG 4.14Å; W103-Y107 WeakPolarHBondContact O-CB 3.5Å; W103-Y107 PolarHBondContact O-N 3.36Å; V105-Y107 VanDerWaalsContact C-N 3.34Å; V105-Y107 PolarHBondContact O-N 3.34Å; Y107-L109 VanDerWaalsContact C-N 3.32Å; Y107-T110 HydrophobicContact CD2-CG2 4.39Å; Y107-T110 HydrophobicContact CE2-CG2 4.4Å; Y107-T110 WeakPolarHBondContact O-CB 3.35Å; Y107-T110 PolarHBondContact O-N 3.28Å; Y107-G111 PolarHBondContact O-N 2.96Å
108G97.1Very high93.8Very high11 Ų1136.9 Ų36.911%0.11320%0.204CC..Hα-helixtrans-56.5-44.7164.600000112.4L104 V105 G111 L112L104-G108 PolarHBondContact O-N 3.03Å; V105-G108 CarbonylContact O-C 3.59Å; V105-G108 WeakPolarHBondContact O-CA 3.29Å; V105-G108 PolarHBondContact O-N 2.93Å; G108-G111 WeakPolarHBondContact O-CA 3.46Å; G108-G111 PolarHBondContact O-N 3.23Å; G108-G111 VanDerWaalsContact O-N 3.11Å; G108-L112 PolarHBondContact O-N 2.73Å
109L96.6Very high93.8Very high77 Ų7735.7 Ų35.740%0.40320%0.195SC..Hα-helixtrans-63.4-41174.2-69.2171.5000112V105 S106 Y107 G111 L112 A113V105-L109 HydrophobicContact CG1-CD1 4.35Å; V105-L109 WeakPolarHBondContact O-CG 3.48Å; V105-L109 PolarHBondContact O-N 3.22Å; S106-L109 WeakPolarHBondContact O-CB 3.45Å; S106-L109 PolarHBondContact O-N 3.37Å; Y107-L109 VanDerWaalsContact C-N 3.32Å; L109-G111 VanDerWaalsContact C-N 3.25Å; L109-G111 PolarHBondContact O-N 3.43Å; L109-L112 HydrophobicContact CD2-CD1 4.24Å; L109-L112 PolarHBondContact O-N 2.8Å; L109-A113 WeakPolarHBondContact O-CB 3.33Å; L109-A113 PolarHBondContact O-N 3.06Å
110T97.2Very high93.9Very high0 Ų029.1 Ų29.10%017%0.165CC..Hα-helixtrans-57.2-41.5170.6-57.60000111.2A87 S90 S106 Y107 A113 L114A87-T110 HydrophobicContact CB-CG2 4.44Å; S90-T110 WeakPolarHBondContact CB-OG1 3.2Å; S106-T110 PolarHBondContact O-N 3.26Å; S106-T110 PolarHBondContact O-OG1 2.83Å; Y107-T110 HydrophobicContact CD2-CG2 4.39Å; Y107-T110 HydrophobicContact CE2-CG2 4.4Å; Y107-T110 WeakPolarHBondContact O-CB 3.35Å; Y107-T110 PolarHBondContact O-N 3.28Å; T110-A113 PolarHBondContact O-N 2.9Å; T110-L114 HydrophobicContact CG2-CD1 3.71Å; T110-L114 HydrophobicContact CG2-CG 4.31Å; T110-L114 WeakPolarHBondContact O-CB 3.31Å; T110-L114 VanDerWaalsContact O-CG 3.27Å; T110-L114 WeakPolarHBondContact O-CG 3.42Å; T110-L114 PolarHBondContact O-N 3.1Å
111G96.6Very high94.2Very high0 Ų026.5 Ų26.50%015%0.152CC..Hα-helixtrans-57.1-54.5172.500000112.5Q56 G59 Y60 Y107 G108 L109 A113 L114 G115Q56-G111 VanDerWaalsContact O-CA 3.23Å; Q56-G111 WeakPolarHBondContact O-CA 3.46Å; G59-G111 VanDerWaalsContact C-C 3.47Å; Y60-G111 WeakPolarHBondContact CA-O 3.3Å; Y60-G111 VanDerWaalsContact N-C 3.31Å; Y60-G111 PolarHBondContact N-O 3.25Å; Y107-G111 PolarHBondContact O-N 2.96Å; G108-G111 WeakPolarHBondContact O-CA 3.46Å; G108-G111 PolarHBondContact O-N 3.23Å; G108-G111 VanDerWaalsContact O-N 3.11Å; L109-G111 VanDerWaalsContact C-N 3.25Å; L109-G111 PolarHBondContact O-N 3.43Å; G111-A113 VanDerWaalsContact C-N 3.3Å; G111-A113 PolarHBondContact O-N 3.41Å; G111-L114 PolarHBondContact O-N 3.41Å; G111-G115 PolarHBondContact O-N 2.91Å
112L96.1Very high94.1Very high72 Ų7221.7 Ų21.738%0.37712%0.123SC..Hα-helixtrans-57.3-43.1178.1-73.7168.3000111.9V62 T63 G108 L109V62-L112 HydrophobicContact CB-CD2 4.49Å; T63-L112 WeakPolarHBondContact CB-O 3.38Å; T63-L112 VanDerWaalsContact CG2-O 3.23Å; T63-L112 WeakPolarHBondContact CG2-O 3.24Å; T63-L112 WeakPolarHBondContact OG1-CA 3.44Å; T63-L112 WeakPolarHBondContact OG1-CD2 3.38Å; T63-L112 PolarHBondContact OG1-O 3.4Å; G108-L112 PolarHBondContact O-N 2.73Å; L109-L112 HydrophobicContact CD2-CD1 4.24Å; L109-L112 PolarHBondContact O-N 2.8Å
113A95.8Very high93.8Very high11 Ų1121.8 Ų21.89%0.09112%0.119CC..Hα-helixtrans-61.9-48.4178.300000111.4S83 S86 A87 L109 T110 G111 S116S83-A113 WeakPolarHBondContact CB-O 3.4Å; S86-A113 WeakPolarHBondContact OG-CB 3.41Å; A87-A113 HydrophobicContact CB-CB 4.21Å; L109-A113 WeakPolarHBondContact O-CB 3.33Å; L109-A113 PolarHBondContact O-N 3.06Å; T110-A113 PolarHBondContact O-N 2.9Å; G111-A113 VanDerWaalsContact C-N 3.3Å; G111-A113 PolarHBondContact O-N 3.41Å; A113-S116 PolarHBondContact O-OG 2.87Å
114L95.5Very high93.7Very high0 Ų021.9 Ų21.90%012%0.12CC..Hα-helixtrans-82.9-12.8-170.8-63.5179.6000114.7T22 A25 R26 Y60 A87 T110 G111 S116 S117T22-L114 HydrophobicContact CG2-CD1 4.38Å; T22-L114 HydrophobicContact CG2-CD2 3.85Å; T22-L114 HydrophobicContact CG2-CG 4.47Å; A25-L114 HydrophobicContact CB-CD1 3.82Å; R26-L114 HydrophobicContact CB-CD1 4.46Å; R26-L114 HydrophobicContact CG-CB 4.31Å; R26-L114 HydrophobicContact CG-CD1 3.63Å; Y60-L114 HydrophobicContact CD2-CB 4.35Å; Y60-L114 WeakPolarHBondContact CE2-O 3.39Å; A87-L114 HydrophobicContact CB-CD1 4.18Å; A87-L114 HydrophobicContact CB-CD2 3.42Å; A87-L114 VanDerWaalsContact CB-CD2 3.42Å; A87-L114 HydrophobicContact CB-CG 3.75Å; T110-L114 HydrophobicContact CG2-CD1 3.71Å; T110-L114 HydrophobicContact CG2-CG 4.31Å; T110-L114 WeakPolarHBondContact O-CB 3.31Å; T110-L114 VanDerWaalsContact O-CG 3.27Å; T110-L114 WeakPolarHBondContact O-CG 3.42Å; T110-L114 PolarHBondContact O-N 3.1Å; G111-L114 PolarHBondContact O-N 3.41Å; L114-S116 PolarHBondContact O-N 2.89Å; L114-S117 VanDerWaalsContact O-CB 3.28Å; L114-S117 WeakPolarHBondContact O-CB 3.5Å; L114-S117 PolarHBondContact O-N 3.16Å; L114-S117 VanDerWaalsContact O-N 3.07Å; L114-S117 PolarHBondContact O-OG 3.41Å
115G92.3Very high93.4Very high0 Ų019 Ų190%011%0.105CC..THydrogen-bonded Turntrans-57.9-34.4-179.600000113.9Y60 K64 G111 P119Y60-G115 WeakPolarHBondContact O-CA 2.94Å; K64-G115 VanDerWaalsContact CA-O 3.23Å; K64-G115 WeakPolarHBondContact CA-O 3.29Å; K64-G115 WeakPolarHBondContact CB-O 3.31Å; G111-G115 PolarHBondContact O-N 2.91Å; G115-P119 WeakPolarHBondContact O-CD 3.47Å
116S90.9Very high92.9Very high13 Ų1321.5 Ų21.59%0.09111%0.106CC..THydrogen-bonded Turntrans-79.1-14.2178.259.40000114.2A113 L114 W118 P119 A120A113-S116 PolarHBondContact O-OG 2.87Å; L114-S116 PolarHBondContact O-N 2.89Å; S116-W118 PolarHBondContact O-N 2.9Å; S116-P119 WeakPolarHBondContact O-CD 3.23Å; S116-A120 VanDerWaalsContact O-CB 3.28Å; S116-A120 WeakPolarHBondContact O-CB 3.16Å; S116-A120 PolarHBondContact O-N 3.27Å
117S93.8Very high92.5Very high1 Ų125.7 Ų25.71%0.00713%0.131CC..Hα-helixtrans-61.8-47.6-172.9-62.80000112.9S83 L114 A120 I121S83-S117 WeakPolarHBondContact CB-OG 3.41Å; S83-S117 PolarHBondContact OG-OG 3.44Å; L114-S117 VanDerWaalsContact O-CB 3.28Å; L114-S117 WeakPolarHBondContact O-CB 3.5Å; L114-S117 PolarHBondContact O-N 3.16Å; L114-S117 VanDerWaalsContact O-N 3.07Å; L114-S117 PolarHBondContact O-OG 3.41Å; S117-A120 PolarHBondContact O-N 3.28Å; S117-I121 WeakPolarHBondContact O-CD1 3.34Å; S117-I121 VanDerWaalsContact O-CG1 3.24Å; S117-I121 WeakPolarHBondContact O-CG1 3.45Å; S117-I121 PolarHBondContact O-N 3.48Å
118W90.9Very high92.1Very high38 Ų3826.7 Ų26.714%0.14414%0.139CC..Hα-helixtrans-67.4-47.7-179.9-176.5-105.2000113.1Y19 S116 A120 I121 S122 W138 I141 S142Y19-W118 HydrophobicContact CD1-CE3 4.26Å; Y19-W118 AromaticContact CD1-CZ3 3.91Å; Y19-W118 HydrophobicContact CD1-CZ3 3.91Å; Y19-W118 HydrophobicContact CD2-CE3 4.27Å; Y19-W118 AromaticContact CE1-CE3 3.67Å; Y19-W118 HydrophobicContact CE1-CE3 3.67Å; Y19-W118 AromaticContact CE1-CZ3 3.46Å; Y19-W118 HydrophobicContact CE1-CZ3 3.46Å; Y19-W118 VanDerWaalsContact CE1-CZ3 3.46Å; Y19-W118 AromaticContact CE2-CE3 3.66Å; Y19-W118 HydrophobicContact CE2-CE3 3.66Å; Y19-W118 HydrophobicContact CE2-CZ3 4.27Å; Y19-W118 AromaticContact CZ-CE3 3.33Å; Y19-W118 AromaticContact CZ-CZ3 3.68Å; S116-W118 PolarHBondContact O-N 2.9Å; W118-A120 VanDerWaalsContact C-N 3.28Å; W118-A120 PolarHBondContact O-N 3.23Å; W118-I121 HydrophobicContact CZ3-CG2 4.42Å; W118-I121 PolarHBondContact O-N 3.28Å; W118-S122 VanDerWaalsContact O-CB 3.31Å; W118-S122 WeakPolarHBondContact O-CB 3.38Å; W118-S122 PolarHBondContact O-N 2.79Å; W118-S122 PolarHBondContact O-OG 2.69Å; W118-W138 HydrophobicContact CZ2-CD2 4.37Å; W118-W138 AromaticContact CZ2-CE2 3.63Å; W118-W138 AromaticContact CZ2-CZ2 3.83Å; W118-W138 HydrophobicContact CZ2-CZ2 3.83Å; W118-W138 AromaticContact CZ2-NE1 3.55Å; W118-I141 HydrophobicContact CZ3-CG2 4.2Å; W118-S142 WeakPolarHBondContact CH2-OG 3.35Å
119P89.6Confident91.5Very high13 Ų1326.9 Ų26.98%0.08414%0.137CC..Hα-helixtrans-50.4-46.9170-29.935.3000113.3K64 M71 G115 S116 S122 K123K64-P119 HydrophobicContact CG-CG 4.25Å; M71-P119 HydrophobicContact CG-CB 3.83Å; G115-P119 WeakPolarHBondContact O-CD 3.47Å; S116-P119 WeakPolarHBondContact O-CD 3.23Å; P119-S122 PolarHBondContact O-N 3.28Å; P119-S122 PolarHBondContact O-OG 3.17Å; P119-K123 PolarHBondContact O-N 3.35Å
120A92.3Very high90.9Very high0 Ų025.8 Ų25.80%014%0.14CC..Hα-helixtrans-61.9-48.5179.500000112.9M71 P76 F80 S116 S117 W118 S122 K123 T124M71-A120 HydrophobicContact SD-CB 3.77Å; P76-A120 HydrophobicContact CB-CB 4.4Å; P76-A120 WeakPolarHBondContact CB-O 3.16Å; P76-A120 VanDerWaalsContact O-CB 3.32Å; P76-A120 WeakPolarHBondContact O-CB 3.4Å; F80-A120 HydrophobicContact CB-CB 3.86Å; S116-A120 VanDerWaalsContact O-CB 3.28Å; S116-A120 WeakPolarHBondContact O-CB 3.16Å; S116-A120 PolarHBondContact O-N 3.27Å; S117-A120 PolarHBondContact O-N 3.28Å; W118-A120 VanDerWaalsContact C-N 3.28Å; W118-A120 PolarHBondContact O-N 3.23Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.41Å; A120-K123 PolarHBondContact O-N 2.84Å; A120-T124 WeakPolarHBondContact O-CB 3.23Å; A120-T124 PolarHBondContact O-N 2.83Å; A120-T124 PolarHBondContact O-OG1 3.24Å
121I93.2Very high89.9Confident1 Ų131.3 Ų31.31%0.00518%0.178CC..Hα-helixtrans-59.9-46.3175.1-66.5161000110.2L15 Y19 F80 S117 W118 K123 T124 L125 I141L15-I121 HydrophobicContact CD2-CG1 4.28Å; Y19-I121 HydrophobicContact CD2-CD1 3.37Å; Y19-I121 HydrophobicContact CE2-CD1 4.17Å; Y19-I121 HydrophobicContact CG-CD1 3.74Å; F80-I121 HydrophobicContact CD1-CG1 3.98Å; F80-I121 HydrophobicContact CD2-CD1 4.37Å; F80-I121 HydrophobicContact CD2-CG1 4.31Å; F80-I121 HydrophobicContact CE1-CD1 4Å; F80-I121 HydrophobicContact CE1-CG1 3.84Å; F80-I121 HydrophobicContact CE2-CD1 3.84Å; F80-I121 HydrophobicContact CE2-CG1 4.22Å; F80-I121 HydrophobicContact CG-CG1 4.22Å; F80-I121 HydrophobicContact CZ-CD1 3.64Å; F80-I121 HydrophobicContact CZ-CG1 3.98Å; S117-I121 WeakPolarHBondContact O-CD1 3.34Å; S117-I121 VanDerWaalsContact O-CG1 3.24Å; S117-I121 WeakPolarHBondContact O-CG1 3.45Å; S117-I121 PolarHBondContact O-N 3.48Å; W118-I121 HydrophobicContact CZ3-CG2 4.42Å; W118-I121 PolarHBondContact O-N 3.28Å; I121-K123 VanDerWaalsContact C-N 3.31Å; I121-K123 PolarHBondContact O-N 3.46Å; I121-T124 PolarHBondContact O-N 2.91Å; I121-L125 WeakPolarHBondContact O-CB 3.39Å; I121-L125 PolarHBondContact O-N 3Å; I121-I141 HydrophobicContact CG2-CG2 3.98Å
122S88.6Confident88.9Confident8 Ų840.1 Ų40.16%0.05622%0.219CC..Hα-helixtrans-62.6-36.2-177.680.70000113.1W118 P119 A120 R126W118-S122 VanDerWaalsContact O-CB 3.31Å; W118-S122 WeakPolarHBondContact O-CB 3.38Å; W118-S122 PolarHBondContact O-N 2.79Å; W118-S122 PolarHBondContact O-OG 2.69Å; P119-S122 PolarHBondContact O-N 3.28Å; P119-S122 PolarHBondContact O-OG 3.17Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.41Å; S122-R126 WeakPolarHBondContact O-CG 3.47Å; S122-R126 PolarHBondContact O-N 2.98Å; S122-R126 PolarHBondContact O-NE 3.39Å; S122-R126 VanDerWaalsContact O-NE 3.08Å; S122-R126 PolarHBondContact OG-NH2 3.38Å
123K87Confident88.2Confident58 Ų5839.2 Ų39.225%0.25221%0.213SC..Hα-helixtrans-72.7-46.6176.6-174.972.3175.6-166.70110.2M71 D72 P76 P119 A120 I121 L125 R126 T127M71-K123 HydrophobicContact CB-CB 4.25Å; M71-K123 HydrophobicContact CB-CG 4.35Å; D72-K123 IonicContact OD1-NZ 2.7Å; D72-K123 PolarHBondContact OD1-NZ 3.38Å; P76-K123 HydrophobicContact CB-CB 3.92Å; P76-K123 HydrophobicContact CB-CG 4.07Å; P76-K123 HydrophobicContact CG-CB 4.19Å; P76-K123 HydrophobicContact CG-CG 3.92Å; P119-K123 PolarHBondContact O-N 3.35Å; A120-K123 PolarHBondContact O-N 2.84Å; I121-K123 VanDerWaalsContact C-N 3.31Å; I121-K123 PolarHBondContact O-N 3.46Å; K123-L125 VanDerWaalsContact C-N 3.29Å; K123-L125 PolarHBondContact O-N 3.43Å; K123-R126 PolarHBondContact O-N 3.19Å; K123-T127 PolarHBondContact O-N 3.34Å; K123-T127 VanDerWaalsContact O-N 3.14Å; K123-T127 PolarHBondContact O-OG1 3.46Å
124T91Very high87.4Confident6 Ų640.6 Ų40.64%0.03722%0.219CC..Hα-helixtrans-56.8-43.5176.7-56.90000111.5L11 L15 L77 A120 I121 T127 S128L11-T124 HydrophobicContact CD2-CG2 4.11Å; L15-T124 HydrophobicContact CD1-CG2 4.15Å; L77-T124 HydrophobicContact CD1-CG2 3.66Å; A120-T124 WeakPolarHBondContact O-CB 3.23Å; A120-T124 PolarHBondContact O-N 2.83Å; A120-T124 PolarHBondContact O-OG1 3.24Å; I121-T124 PolarHBondContact O-N 2.91Å; T124-T127 PolarHBondContact O-N 3.06Å; T124-T127 PolarHBondContact O-OG1 3.34Å; T124-S128 VanDerWaalsContact O-CB 3.23Å; T124-S128 WeakPolarHBondContact O-CB 3.49Å; T124-S128 PolarHBondContact O-N 3.11Å; T124-S128 VanDerWaalsContact O-N 3.11Å; T124-S128 PolarHBondContact O-OG 3.25Å
125L88.9Confident86.3Confident3 Ų344.4 Ų44.42%0.01625%0.25CC..Hα-helixtrans-64.3-47.4179.9-174.667.2000111.4L12 I121 K123 T127 S128 V129 L134 W137 W138 I141L12-L125 HydrophobicContact CD2-CD1 3.51Å; I121-L125 WeakPolarHBondContact O-CB 3.39Å; I121-L125 PolarHBondContact O-N 3Å; K123-L125 VanDerWaalsContact C-N 3.29Å; K123-L125 PolarHBondContact O-N 3.43Å; L125-T127 PolarHBondContact O-N 3.45Å; L125-S128 PolarHBondContact O-N 3.28Å; L125-S128 VanDerWaalsContact O-N 3.11Å; L125-V129 HydrophobicContact CD1-CB 4.42Å; L125-V129 HydrophobicContact CD1-CG2 3.62Å; L125-V129 HydrophobicContact CG-CG2 4.48Å; L125-V129 PolarHBondContact O-N 3.49Å; L125-V129 VanDerWaalsContact O-N 3.08Å; L125-L134 HydrophobicContact CD2-CD1 3.92Å; L125-L134 HydrophobicContact CG-CD1 3.79Å; L125-W137 HydrophobicContact CD1-CB 3.72Å; L125-W137 HydrophobicContact CD1-CG 4.5Å; L125-W137 HydrophobicContact CD2-CB 4.14Å; L125-W137 HydrophobicContact CG-CB 4.43Å; L125-W138 HydrophobicContact CD2-CB 4.05Å; L125-W138 HydrophobicContact CD2-CE3 4.24Å; L125-I141 HydrophobicContact CD1-CD1 3.93Å; L125-I141 HydrophobicContact CD2-CD1 4.32Å
126R85Confident85.8Confident133 Ų13349.1 Ų49.150%0.50228%0.279SS..Hα-helixtrans-58.4-32.3177.6-81.4-177.4-81.9-172-3.6113.6S122 K123 L134S122-R126 WeakPolarHBondContact O-CG 3.47Å; S122-R126 PolarHBondContact O-N 2.98Å; S122-R126 PolarHBondContact O-NE 3.39Å; S122-R126 VanDerWaalsContact O-NE 3.08Å; S122-R126 PolarHBondContact OG-NH2 3.38Å; K123-R126 PolarHBondContact O-N 3.19Å; R126-L134 HydrophobicContact CG-CD1 3.88Å; R126-L134 HydrophobicContact CG-CD2 3.8Å; R126-L134 HydrophobicContact CG-CG 4.5Å
127T87.4Confident85.6Confident94 Ų9450.4 Ų50.458%0.57728%0.282SS*.Hα-helixtrans-90.1-11.517957.40000113.9K123 T124 L125K123-T127 PolarHBondContact O-N 3.34Å; K123-T127 VanDerWaalsContact O-N 3.14Å; K123-T127 PolarHBondContact O-OG1 3.46Å; T124-T127 PolarHBondContact O-N 3.06Å; T124-T127 PolarHBondContact O-OG1 3.34Å; L125-T127 PolarHBondContact O-N 3.45Å
128S87.8Confident85.1Confident22 Ų2254.2 Ų54.215%0.15430%0.296CS..Hα-helixtrans-109.9-17-173-53.90000113.7P8 T124 L125P8-S128 WeakPolarHBondContact CG-O 3.03Å; T124-S128 VanDerWaalsContact O-CB 3.23Å; T124-S128 WeakPolarHBondContact O-CB 3.49Å; T124-S128 PolarHBondContact O-N 3.11Å; T124-S128 VanDerWaalsContact O-N 3.11Å; T124-S128 PolarHBondContact O-OG 3.25Å; L125-S128 PolarHBondContact O-N 3.28Å; L125-S128 VanDerWaalsContact O-N 3.11Å
129V84.6Confident84.7Confident15 Ų1554.1 Ų54.19%0.09131%0.307CS..SBendtrans-122.2144.4-175178.80000109.6L12 L125 E133 W137L12-V129 HydrophobicContact CD1-CG2 4.26Å; L12-V129 HydrophobicContact CD2-CG2 3.7Å; L125-V129 HydrophobicContact CD1-CB 4.42Å; L125-V129 HydrophobicContact CD1-CG2 3.62Å; L125-V129 HydrophobicContact CG-CG2 4.48Å; L125-V129 PolarHBondContact O-N 3.49Å; L125-V129 VanDerWaalsContact O-N 3.08Å; V129-E133 HydrophobicContact CG1-CB 3.73Å; V129-W137 VanDerWaalsContact CG1-CD1 3.49Å; V129-W137 HydrophobicContact CG1-CG 4.32Å; V129-W137 HydrophobicContact CG2-CG 4.43Å
130A84.4Confident84.6Confident54 Ų5457.4 Ų57.445%0.44632%0.323SS..  trans-60.3143.7174.600000111.4Q132 E133 L134A130-Q132 PolarHBondContact O-N 3.03Å; A130-E133 PolarHBondContact O-N 3.46Å; A130-L134 PolarHBondContact O-N 3.42Å
131S76.1Confident84.6Confident115 Ų11557.4 Ų57.480%0.80432%0.324SS*.THydrogen-bonded Turntrans-54-29.1-177.7-53.30000113.9
132Q75.5Confident84.4Confident186 Ų18658.8 Ų58.887%0.86933%0.333SS*.THydrogen-bonded Turntrans-69.8-33.1179.4-48.6177.41300112.9A130A130-Q132 PolarHBondContact O-N 3.03Å
133E81.9Confident84.4Confident52 Ų5259.3 Ų59.324%0.24334%0.337CS..THydrogen-bonded Turntrans-98.5-8.2-177.4-60.3-174.6174.700112.5R7 V129 A130 A135 T136 W137R7-E133 IonicContact CZ-OE1 2.7Å; R7-E133 VanDerWaalsContact CZ-OE1 3.24Å; R7-E133 IonicContact NE-OE1 3.43Å; R7-E133 PolarHBondContact NE-OE1 3.03Å; R7-E133 IonicContact NE-OE2 3.24Å; R7-E133 PolarHBondContact NE-OE2 3.06Å; R7-E133 IonicContact NH2-OE1 3.91Å; R7-E133 PolarHBondContact NH2-OE1 3.29Å; V129-E133 HydrophobicContact CG1-CB 3.73Å; A130-E133 PolarHBondContact O-N 3.46Å; E133-A135 VanDerWaalsContact C-N 3.34Å; E133-A135 PolarHBondContact O-N 3.46Å; E133-T136 WeakPolarHBondContact O-CB 3.27Å; E133-T136 PolarHBondContact O-N 3.49Å; E133-T136 VanDerWaalsContact O-N 3.15Å; E133-W137 VanDerWaalsContact O-CD1 3.3Å; E133-W137 PolarHBondContact O-N 3.42Å; E133-W137 PolarHBondContact OE2-NE1 3.28Å
134L79.5Confident84.7Confident41 Ų4156.6 Ų56.622%0.21533%0.325CS..Hα-helixtrans-55-45.1-172.117863.5000112.8L125 R126 A130 T136 W137 W138L125-L134 HydrophobicContact CD2-CD1 3.92Å; L125-L134 HydrophobicContact CG-CD1 3.79Å; R126-L134 HydrophobicContact CG-CD1 3.88Å; R126-L134 HydrophobicContact CG-CD2 3.8Å; R126-L134 HydrophobicContact CG-CG 4.5Å; A130-L134 PolarHBondContact O-N 3.42Å; L134-T136 VanDerWaalsContact C-N 3.34Å; L134-T136 PolarHBondContact O-N 2.88Å; L134-W137 PolarHBondContact O-N 3.05Å; L134-W138 HydrophobicContact CD1-CE3 4.5Å; L134-W138 WeakPolarHBondContact O-CB 3.4Å; L134-W138 PolarHBondContact O-N 2.89Å
135A72.2Confident84.9Confident79 Ų7957.2 Ų57.265%0.65333%0.33SS*.Hα-helixtrans-62.7-40.9-178.800000112.1E133 W138 G139E133-A135 VanDerWaalsContact C-N 3.34Å; E133-A135 PolarHBondContact O-N 3.46Å; A135-W138 PolarHBondContact O-N 2.91Å; A135-G139 PolarHBondContact O-N 3.08Å
136T82Confident85.1Confident100 Ų10057.6 Ų57.661%0.61333%0.332SS*.Hα-helixtrans-61.5-50.2177.9-53.60000111.1E133 L134 W138 G139 L140E133-T136 WeakPolarHBondContact O-CB 3.27Å; E133-T136 PolarHBondContact O-N 3.49Å; E133-T136 VanDerWaalsContact O-N 3.15Å; L134-T136 VanDerWaalsContact C-N 3.34Å; L134-T136 PolarHBondContact O-N 2.88Å; T136-W138 VanDerWaalsContact C-N 3.33Å; T136-W138 PolarHBondContact O-N 3.36Å; T136-G139 PolarHBondContact O-N 2.86Å; T136-L140 WeakPolarHBondContact O-CB 3.44Å; T136-L140 PolarHBondContact O-N 3.06Å
137W85Confident85.6Confident40 Ų4054 Ų5415%0.15232%0.322CS..Hα-helixtrans-69.5-32.1179.5-71.1104.2000112.8L9 L12 L125 V129 E133 L134 L140 I141L9-W137 HydrophobicContact CD1-CH2 3.96Å; L9-W137 HydrophobicContact CD1-CZ2 4.44Å; L12-W137 HydrophobicContact CB-CE3 3.89Å; L12-W137 HydrophobicContact CB-CH2 4.13Å; L12-W137 HydrophobicContact CB-CZ3 3.64Å; L12-W137 HydrophobicContact CD1-CD2 3.73Å; L12-W137 HydrophobicContact CD1-CE3 3.88Å; L12-W137 HydrophobicContact CD1-CG 4.47Å; L12-W137 HydrophobicContact CD1-CH2 3.72Å; L12-W137 HydrophobicContact CD1-CZ2 3.55Å; L12-W137 HydrophobicContact CD1-CZ3 3.87Å; L12-W137 HydrophobicContact CD2-CD2 4.06Å; L12-W137 HydrophobicContact CD2-CE3 4.01Å; L12-W137 HydrophobicContact CD2-CG 4.32Å; L12-W137 HydrophobicContact CG-CD2 4.33Å; L12-W137 HydrophobicContact CG-CE3 4.13Å; L12-W137 HydrophobicContact CG-CZ3 4.22Å; L125-W137 HydrophobicContact CD1-CB 3.72Å; L125-W137 HydrophobicContact CD1-CG 4.5Å; L125-W137 HydrophobicContact CD2-CB 4.14Å; L125-W137 HydrophobicContact CG-CB 4.43Å; V129-W137 VanDerWaalsContact CG1-CD1 3.49Å; V129-W137 HydrophobicContact CG1-CG 4.32Å; V129-W137 HydrophobicContact CG2-CG 4.43Å; E133-W137 VanDerWaalsContact O-CD1 3.3Å; E133-W137 PolarHBondContact O-N 3.42Å; E133-W137 PolarHBondContact OE2-NE1 3.28Å; L134-W137 PolarHBondContact O-N 3.05Å; W137-L140 HydrophobicContact CE3-CD2 3.87Å; W137-L140 HydrophobicContact CZ3-CD2 3.65Å; W137-L140 PolarHBondContact O-N 2.8Å; W137-I141 WeakPolarHBondContact O-CB 3.39Å; W137-I141 WeakPolarHBondContact O-CG1 3.3Å; W137-I141 PolarHBondContact O-N 3.2Å
138W84.9Confident86Confident80 Ų8049.5 Ų49.530%0.30330%0.295SS..Hα-helixtrans-62.4-48173.6-170.5-69.2000110.9W118 L125 L134 A135 T136 S142W118-W138 HydrophobicContact CZ2-CD2 4.37Å; W118-W138 AromaticContact CZ2-CE2 3.63Å; W118-W138 AromaticContact CZ2-CZ2 3.83Å; W118-W138 HydrophobicContact CZ2-CZ2 3.83Å; W118-W138 AromaticContact CZ2-NE1 3.55Å; L125-W138 HydrophobicContact CD2-CB 4.05Å; L125-W138 HydrophobicContact CD2-CE3 4.24Å; L134-W138 HydrophobicContact CD1-CE3 4.5Å; L134-W138 WeakPolarHBondContact O-CB 3.4Å; L134-W138 PolarHBondContact O-N 2.89Å; A135-W138 PolarHBondContact O-N 2.91Å; T136-W138 VanDerWaalsContact C-N 3.33Å; T136-W138 PolarHBondContact O-N 3.36Å; W138-S142 VanDerWaalsContact O-CB 3.24Å; W138-S142 WeakPolarHBondContact O-CB 3.4Å; W138-S142 PolarHBondContact O-N 2.95Å; W138-S142 PolarHBondContact O-OG 3.06Å
139G82.1Confident86.3Confident37 Ų3748.8 Ų48.838%0.38129%0.291SS..Hα-helixtrans-61.6-46.2176.100000112.2A135 T136 S142 S143A135-G139 PolarHBondContact O-N 3.08Å; T136-G139 PolarHBondContact O-N 2.86Å; G139-S142 PolarHBondContact O-N 3Å; G139-S143 PolarHBondContact O-N 2.92Å
140L88Confident86.8Confident81 Ų8148.8 Ų48.842%0.42429%0.291SS..Hα-helixtrans-63.2-46.8179.6-173.566.9000112.2F16 T136 W137 S142 S143F16-L140 HydrophobicContact CD2-CG 4.26Å; F16-L140 VanDerWaalsContact CD2-O 3.28Å; F16-L140 WeakPolarHBondContact CD2-O 3.25Å; F16-L140 HydrophobicContact CE2-CD1 4.44Å; F16-L140 HydrophobicContact CE2-CG 4.41Å; F16-L140 WeakPolarHBondContact CE2-O 3.3Å; T136-L140 WeakPolarHBondContact O-CB 3.44Å; T136-L140 PolarHBondContact O-N 3.06Å; W137-L140 HydrophobicContact CE3-CD2 3.87Å; W137-L140 HydrophobicContact CZ3-CD2 3.65Å; W137-L140 PolarHBondContact O-N 2.8Å; L140-S142 VanDerWaalsContact C-N 3.33Å; L140-S142 PolarHBondContact O-N 2.72Å; L140-S143 PolarHBondContact O-N 3.47Å; L140-S143 PolarHBondContact O-OG 3.33Å
141I91.5Very high87.3Confident1 Ų150 Ų501%0.00529%0.289CS..Hα-helixtrans-66.8-39.9177.4-65.8169.5000110L15 Y19 W118 I121 L125 W137 S143 S144L15-I141 HydrophobicContact CB-CD1 3.93Å; L15-I141 HydrophobicContact CD1-CD1 4.27Å; Y19-I141 HydrophobicContact CD1-CG2 4Å; Y19-I141 WeakPolarHBondContact CD1-O 3.04Å; Y19-I141 HydrophobicContact CG-CG2 4.37Å; W118-I141 HydrophobicContact CZ3-CG2 4.2Å; I121-I141 HydrophobicContact CG2-CG2 3.98Å; L125-I141 HydrophobicContact CD1-CD1 3.93Å; L125-I141 HydrophobicContact CD2-CD1 4.32Å; W137-I141 WeakPolarHBondContact O-CB 3.39Å; W137-I141 WeakPolarHBondContact O-CG1 3.3Å; W137-I141 PolarHBondContact O-N 3.2Å; I141-S143 VanDerWaalsContact C-N 3.29Å; I141-S143 PolarHBondContact O-N 2.9Å; I141-S144 WeakPolarHBondContact O-CB 3.49Å; I141-S144 PolarHBondContact O-N 3.04Å; I141-S144 PolarHBondContact O-OG 3.19Å
142S87.9Confident88.3Confident30 Ų3044.6 Ų44.621%0.2125%0.251CS..Hα-helixtrans-59.1-39.2177.2-60.10000112.6W118 W138 G139 L140 S144 S145W118-S142 WeakPolarHBondContact CH2-OG 3.35Å; W138-S142 VanDerWaalsContact O-CB 3.24Å; W138-S142 WeakPolarHBondContact O-CB 3.4Å; W138-S142 PolarHBondContact O-N 2.95Å; W138-S142 PolarHBondContact O-OG 3.06Å; G139-S142 PolarHBondContact O-N 3Å; L140-S142 VanDerWaalsContact C-N 3.33Å; L140-S142 PolarHBondContact O-N 2.72Å; S142-S144 PolarHBondContact O-N 2.91Å; S142-S145 WeakPolarHBondContact O-CB 3.34Å; S142-S145 PolarHBondContact O-N 3.38Å; S142-S145 PolarHBondContact O-OG 3.06Å
143S89.8Confident89.1Confident19 Ų1936.6 Ų36.613%0.13322%0.215CC..Hα-helixtrans-64.2-23.7-17875.30000113.1G139 L140 I141 S145 N146 L147G139-S143 PolarHBondContact O-N 2.92Å; L140-S143 PolarHBondContact O-N 3.47Å; L140-S143 PolarHBondContact O-OG 3.33Å; I141-S143 VanDerWaalsContact C-N 3.29Å; I141-S143 PolarHBondContact O-N 2.9Å; S143-S145 PolarHBondContact O-N 2.87Å; S143-N146 PolarHBondContact O-N 2.67Å; S143-N146 VanDerWaalsContact O-N 3.11Å; S143-L147 PolarHBondContact O-N 3.17Å
144S94Very high89.8Confident0 Ų038.2 Ų38.20%022%0.219CC..Hα-helixtrans-58.2-28.4172.772.70000112.9Y19 F20 I141 S142 L147 A148Y19-S144 WeakPolarHBondContact CD1-OG 3.29Å; F20-S144 WeakPolarHBondContact CD2-O 3.46Å; I141-S144 WeakPolarHBondContact O-CB 3.49Å; I141-S144 PolarHBondContact O-N 3.04Å; I141-S144 PolarHBondContact O-OG 3.19Å; S142-S144 PolarHBondContact O-N 2.91Å; S144-L147 PolarHBondContact O-N 2.86Å; S144-A148 WeakPolarHBondContact O-CB 3.42Å; S144-A148 PolarHBondContact O-N 3.47Å
145S93.3Very high90.6Very high19 Ų1938 Ų3813%0.13322%0.218CC..Hα-helixtrans-72-36.5177.169.90000113S23 S142 S143 G149S23-S145 WeakPolarHBondContact OG-CA 3.38Å; S23-S145 VanDerWaalsContact OG-CB 3.25Å; S23-S145 WeakPolarHBondContact OG-CB 3.2Å; S142-S145 WeakPolarHBondContact O-CB 3.34Å; S142-S145 PolarHBondContact O-N 3.38Å; S142-S145 PolarHBondContact O-OG 3.06Å; S143-S145 PolarHBondContact O-N 2.87Å; S145-G149 PolarHBondContact O-N 3.04Å
146N93.1Very high91.7Very high11 Ų1134.4 Ų34.46%0.05919%0.188CC..Hα-helixtrans-72.1-39.3171.6-70.195.2000111S143 A148 G149 C150 R333 E364 I368S143-N146 PolarHBondContact O-N 2.67Å; S143-N146 VanDerWaalsContact O-N 3.11Å; N146-A148 VanDerWaalsContact C-N 3.29Å; N146-A148 PolarHBondContact O-N 2.65Å; N146-G149 CarbonylContact O-C 3.34Å; N146-G149 VanDerWaalsContact O-CA 3.28Å; N146-G149 WeakPolarHBondContact O-CA 3.39Å; N146-G149 PolarHBondContact O-N 3.35Å; N146-C150 PolarHBondContact O-N 3.19Å; N146-C150 PolarHBondContact O-SG 3.38Å; N146-C150 VanDerWaalsContact O-SG 3.38Å; N146-R333 PolarHBondContact ND2-NH2 2.94Å; N146-E364 PolarHBondContact ND2-OE2 3.1Å; N146-E364 VanDerWaalsContact ND2-OE2 3.12Å; N146-I368 HydrophobicContact CB-CD1 4.11Å; N146-I368 HydrophobicContact CB-CG1 3.42Å; N146-I368 VanDerWaalsContact CB-CG1 3.42Å
147L95.6Very high92.2Very high57 Ų5731.9 Ų31.930%0.29817%0.17SC..Hα-helixtrans-59-42.2173.7-175.563.1000111.4F16 F20 S143 S144 G149 C150 M151F16-L147 HydrophobicContact CE1-CD2 4.35Å; F16-L147 HydrophobicContact CZ-CD2 4.06Å; F20-L147 HydrophobicContact CD2-CB 4.32Å; F20-L147 HydrophobicContact CD2-CD2 4.28Å; F20-L147 HydrophobicContact CD2-CG 4.21Å; F20-L147 HydrophobicContact CE2-CB 4.36Å; F20-L147 HydrophobicContact CE2-CD2 4.29Å; F20-L147 HydrophobicContact CE2-CG 3.94Å; S143-L147 PolarHBondContact O-N 3.17Å; S144-L147 PolarHBondContact O-N 2.86Å; L147-G149 PolarHBondContact O-N 3.33Å; L147-C150 WeakPolarHBondContact O-CB 3.42Å; L147-C150 PolarHBondContact O-N 3.35Å; L147-C150 VanDerWaalsContact O-N 3.15Å; L147-M151 HydrophobicContact CD1-CG 4.26Å; L147-M151 HydrophobicContact CD1-SD 3.83Å; L147-M151 HydrophobicContact CG-SD 3.99Å; L147-M151 WeakPolarHBondContact O-CG 3.18Å; L147-M151 PolarHBondContact O-N 3.39Å
148A96.3Very high92.7Very high1 Ų133.5 Ų33.51%0.00818%0.184CC..Hα-helixtrans-60.1-34.8171.900000111.9F20 L24 S144 N146 G152F20-A148 HydrophobicContact CD2-CB 3.73Å; F20-A148 HydrophobicContact CE2-CB 3.86Å; F20-A148 HydrophobicContact CG-CB 4.4Å; L24-A148 HydrophobicContact CD2-CB 3.88Å; L24-A148 WeakPolarHBondContact CD2-O 3.32Å; L24-A148 HydrophobicContact CG-CB 3.92Å; S144-A148 WeakPolarHBondContact O-CB 3.42Å; S144-A148 PolarHBondContact O-N 3.47Å; N146-A148 VanDerWaalsContact C-N 3.29Å; N146-A148 PolarHBondContact O-N 2.65Å; A148-G152 VanDerWaalsContact O-CA 3.31Å; A148-G152 WeakPolarHBondContact O-CA 3.37Å; A148-G152 PolarHBondContact O-N 3.05Å
149G94.2Very high93.3Very high6 Ų631.1 Ų31.16%0.06218%0.177CC..Hα-helixtrans-65.9-42.5171.500000114S145 N146 L147 M151S145-G149 PolarHBondContact O-N 3.04Å; N146-G149 CarbonylContact O-C 3.34Å; N146-G149 VanDerWaalsContact O-CA 3.28Å; N146-G149 WeakPolarHBondContact O-CA 3.39Å; N146-G149 PolarHBondContact O-N 3.35Å; L147-G149 PolarHBondContact O-N 3.33Å; G149-M151 VanDerWaalsContact C-N 3.34Å; G149-M151 PolarHBondContact O-N 2.93Å
150C95.4Very high93.9Very high16 Ų1629.8 Ų29.811%0.10816%0.162CC..Hα-helixtrans-62.8-42176.2-610000111.8N146 L147 S361 E364 F365N146-C150 PolarHBondContact O-N 3.19Å; N146-C150 PolarHBondContact O-SG 3.38Å; N146-C150 VanDerWaalsContact O-SG 3.38Å; L147-C150 WeakPolarHBondContact O-CB 3.42Å; L147-C150 PolarHBondContact O-N 3.35Å; L147-C150 VanDerWaalsContact O-N 3.15Å; C150-S361 PolarHBondContact O-OG 3.15Å; C150-S361 VanDerWaalsContact O-OG 3.05Å; C150-E364 HydrophobicContact CB-CB 4.49Å; C150-E364 WeakPolarHBondContact SG-CB 3.33Å; C150-F365 PolarHBondContact SG-N 2.94Å
151M95.8Very high94.2Very high80 Ų8029.7 Ų29.739%0.39417%0.168SC..Hα-helixtrans-97.1-19.2-168.9-60.5-179.273.300113.8F20 L147 G149 S153 W154 I155F20-M151 HydrophobicContact CE2-SD 4.24Å; F20-M151 HydrophobicContact CZ-CB 4.46Å; F20-M151 HydrophobicContact CZ-SD 4.25Å; L147-M151 HydrophobicContact CD1-CG 4.26Å; L147-M151 HydrophobicContact CD1-SD 3.83Å; L147-M151 HydrophobicContact CG-SD 3.99Å; L147-M151 WeakPolarHBondContact O-CG 3.18Å; L147-M151 PolarHBondContact O-N 3.39Å; G149-M151 VanDerWaalsContact C-N 3.34Å; G149-M151 PolarHBondContact O-N 2.93Å; M151-S153 PolarHBondContact O-N 3.5Å; M151-W154 PolarHBondContact O-N 2.74Å; M151-W154 VanDerWaalsContact O-N 3.15Å; M151-I155 HydrophobicContact CB-CD1 3.7Å; M151-I155 HydrophobicContact CB-CG1 4.22Å; M151-I155 HydrophobicContact CE-CD1 4.33Å; M151-I155 WeakPolarHBondContact O-CB 3.4Å; M151-I155 WeakPolarHBondContact O-CG1 3.17Å; M151-I155 PolarHBondContact O-N 3.17Å
152G95.3Very high94.4Very high0 Ų037.4 Ų37.40%020%0.198CC..Hα-helixtrans-58.3-48.6-166.200000114.9L24 N31 A148 S156L24-G152 VanDerWaalsContact CD2-CA 3.48Å; N31-G152 WeakPolarHBondContact ND2-CA 3.44Å; A148-G152 VanDerWaalsContact O-CA 3.31Å; A148-G152 WeakPolarHBondContact O-CA 3.37Å; A148-G152 PolarHBondContact O-N 3.05Å; G152-S156 WeakPolarHBondContact O-CB 3.49Å; G152-S156 PolarHBondContact O-N 3.48Å; G152-S156 PolarHBondContact O-OG 2.96Å
153S93.9Very high94.8Very high18 Ų1836.5 Ų36.513%0.12619%0.193CC..Hα-helixtrans-64.7-41.8176.9-57.30000111.8M151 S156 I157M151-S153 PolarHBondContact O-N 3.5Å; S153-S156 PolarHBondContact O-N 3.36Å; S153-I157 WeakPolarHBondContact O-CD1 3.2Å; S153-I157 WeakPolarHBondContact O-CG1 3.31Å; S153-I157 PolarHBondContact O-N 3.45Å
154W95.3Very high95Very high87 Ų8739.2 Ų39.233%0.3321%0.208SC..Hα-helixtrans-63.2-48178.4-67.1101.3000112.3M151 S156 I157 V158 L358 S361M151-W154 PolarHBondContact O-N 2.74Å; M151-W154 VanDerWaalsContact O-N 3.15Å; W154-S156 VanDerWaalsContact C-N 3.27Å; W154-S156 PolarHBondContact O-N 3.4Å; W154-I157 PolarHBondContact O-N 3.18Å; W154-V158 VanDerWaalsContact O-CG2 3.3Å; W154-V158 WeakPolarHBondContact O-CG2 3.45Å; W154-V158 PolarHBondContact O-N 2.98Å; W154-L358 HydrophobicContact CH2-CG 4.43Å; W154-L358 HydrophobicContact CZ2-CD2 3.82Å; W154-L358 HydrophobicContact CZ2-CG 3.88Å; W154-S361 PolarHBondContact NE1-OG 3.12Å; W154-S361 VanDerWaalsContact NE1-OG 3.14Å
155I96.1Very high95.1Very high35 Ų3545.4 Ų45.418%0.17924%0.24CC..Hα-helixtrans-56.8-45.9175.1-70.9170000109.6F20 L24 M151 I157 V158 I159 F178F20-I155 HydrophobicContact CE1-CD1 4.45Å; F20-I155 HydrophobicContact CZ-CD1 3.99Å; L24-I155 HydrophobicContact CD1-CD1 4.28Å; M151-I155 HydrophobicContact CB-CD1 3.7Å; M151-I155 HydrophobicContact CB-CG1 4.22Å; M151-I155 HydrophobicContact CE-CD1 4.33Å; M151-I155 WeakPolarHBondContact O-CB 3.4Å; M151-I155 WeakPolarHBondContact O-CG1 3.17Å; M151-I155 PolarHBondContact O-N 3.17Å; I155-I157 PolarHBondContact O-N 3.3Å; I155-V158 PolarHBondContact O-N 3.15Å; I155-I159 HydrophobicContact CG2-CD1 3.41Å; I155-I159 VanDerWaalsContact CG2-CD1 3.41Å; I155-I159 HydrophobicContact CG2-CG1 4.38Å; I155-I159 WeakPolarHBondContact O-CB 3.29Å; I155-I159 VanDerWaalsContact O-CD1 3.31Å; I155-I159 WeakPolarHBondContact O-CD1 3.34Å; I155-I159 VanDerWaalsContact O-CG1 3.23Å; I155-I159 WeakPolarHBondContact O-CG1 3.44Å; I155-I159 PolarHBondContact O-N 3.07Å; I155-F178 HydrophobicContact CG2-CD1 4.4Å; I155-F178 HydrophobicContact CG2-CE1 3.97Å
156S95.2Very high95.1Very high4 Ų453 Ų533%0.02827%0.271CS..Hα-helixtrans-62.8-41.9-179.3-58.70000112.7G152 S153 W154 S160 P175G152-S156 WeakPolarHBondContact O-CB 3.49Å; G152-S156 PolarHBondContact O-N 3.48Å; G152-S156 PolarHBondContact O-OG 2.96Å; S153-S156 PolarHBondContact O-N 3.36Å; W154-S156 VanDerWaalsContact C-N 3.27Å; W154-S156 PolarHBondContact O-N 3.4Å; S156-S160 VanDerWaalsContact O-CB 3.24Å; S156-S160 WeakPolarHBondContact O-CB 3.42Å; S156-S160 PolarHBondContact O-N 3.16Å; S156-P175 VanDerWaalsContact O-CG 3.29Å; S156-P175 WeakPolarHBondContact O-CG 3.05Å
157I93.5Very high95.1Very high47 Ų4756.3 Ų56.324%0.24129%0.288CS..Hα-helixtrans-66.3-46.3177.5-67.8159.1000110.8I35 S153 W154 I155 I159 S160 S161 Y357I35-I157 HydrophobicContact CD1-CB 4.47Å; I35-I157 HydrophobicContact CD1-CG1 3.78Å; I35-I157 HydrophobicContact CG1-CG1 4.47Å; S153-I157 WeakPolarHBondContact O-CD1 3.2Å; S153-I157 WeakPolarHBondContact O-CG1 3.31Å; S153-I157 PolarHBondContact O-N 3.45Å; W154-I157 PolarHBondContact O-N 3.18Å; I155-I157 PolarHBondContact O-N 3.3Å; I157-I159 PolarHBondContact O-N 2.83Å; I157-S160 PolarHBondContact O-N 3.49Å; I157-S161 VanDerWaalsContact O-CB 3.26Å; I157-S161 WeakPolarHBondContact O-CB 3.36Å; I157-S161 PolarHBondContact O-N 3.07Å; I157-Y357 HydrophobicContact CD1-CD2 3.35Å; I157-Y357 HydrophobicContact CD1-CE2 3.2Å; I157-Y357 HydrophobicContact CD1-CG 4.33Å; I157-Y357 HydrophobicContact CG1-CE2 4.4Å
158V95.4Very high95Very high74 Ų7455.2 Ų55.245%0.44829%0.291SS..Hα-helixtrans-60.5-48.6179.4170.90000110.2W154 I155 S161 Y162W154-V158 VanDerWaalsContact O-CG2 3.3Å; W154-V158 WeakPolarHBondContact O-CG2 3.45Å; W154-V158 PolarHBondContact O-N 2.98Å; I155-V158 PolarHBondContact O-N 3.15Å; V158-S161 WeakPolarHBondContact O-CB 3.29Å; V158-S161 PolarHBondContact O-N 3.14Å; V158-Y162 HydrophobicContact CG1-CD2 3.81Å; V158-Y162 HydrophobicContact CG1-CE2 3.7Å; V158-Y162 VanDerWaalsContact O-CD2 3.24Å; V158-Y162 WeakPolarHBondContact O-CD2 3.41Å; V158-Y162 PolarHBondContact O-N 3.44Å
159I96.8Very high94.6Very high31 Ų3161.7 Ų61.716%0.15933%0.326CS..Hα-helixtrans-62.6-46.4178.6-66.9159.2000111.1I155 I157 S161 Y162 A163 A174 P175 F178I155-I159 HydrophobicContact CG2-CD1 3.41Å; I155-I159 VanDerWaalsContact CG2-CD1 3.41Å; I155-I159 HydrophobicContact CG2-CG1 4.38Å; I155-I159 WeakPolarHBondContact O-CB 3.29Å; I155-I159 VanDerWaalsContact O-CD1 3.31Å; I155-I159 WeakPolarHBondContact O-CD1 3.34Å; I155-I159 VanDerWaalsContact O-CG1 3.23Å; I155-I159 WeakPolarHBondContact O-CG1 3.44Å; I155-I159 PolarHBondContact O-N 3.07Å; I157-I159 PolarHBondContact O-N 2.83Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 2.74Å; I159-Y162 PolarHBondContact O-N 3.05Å; I159-A163 WeakPolarHBondContact O-CB 3.4Å; I159-A163 PolarHBondContact O-N 3.17Å; I159-A174 HydrophobicContact CG2-CB 3.92Å; I159-P175 HydrophobicContact CB-CG 4.23Å; I159-P175 HydrophobicContact CG2-CB 4.41Å; I159-P175 HydrophobicContact CG2-CG 4.09Å; I159-F178 HydrophobicContact CD1-CB 3.81Å; I159-F178 HydrophobicContact CD1-CD1 3.14Å; I159-F178 HydrophobicContact CD1-CD2 3.92Å; I159-F178 HydrophobicContact CD1-CE1 3.56Å; I159-F178 HydrophobicContact CD1-CE2 4.27Å; I159-F178 HydrophobicContact CD1-CG 3.33Å; I159-F178 HydrophobicContact CD1-CZ 4.11Å; I159-F178 HydrophobicContact CG1-CD1 4.39Å; I159-F178 HydrophobicContact CG1-CD2 4.43Å; I159-F178 HydrophobicContact CG1-CG 4.23Å; I159-F178 HydrophobicContact CG2-CB 4.24Å
160S95.1Very high94.5Very high8 Ų864.6 Ų64.66%0.05634%0.34CS..Hα-helixtrans-61.9-39.1178.2-169.50000111.1S156 I157 A163 T164 A171S156-S160 VanDerWaalsContact O-CB 3.24Å; S156-S160 WeakPolarHBondContact O-CB 3.42Å; S156-S160 PolarHBondContact O-N 3.16Å; I157-S160 PolarHBondContact O-N 3.49Å; S160-A163 PolarHBondContact O-N 3.18Å; S160-T164 PolarHBondContact O-N 3.32Å; S160-T164 PolarHBondContact O-OG1 3.03Å; S160-A171 WeakPolarHBondContact O-CB 3.43Å; S160-A171 PolarHBondContact OG-O 2.88Å
161S94.6Very high94.5Very high79 Ų7964 Ų6455%0.55234%0.336SS*.Hα-helixtrans-61.6-50.9178.5-174.70000111.4I157 V158 I159 A163 T164I157-S161 VanDerWaalsContact O-CB 3.26Å; I157-S161 WeakPolarHBondContact O-CB 3.36Å; I157-S161 PolarHBondContact O-N 3.07Å; V158-S161 WeakPolarHBondContact O-CB 3.29Å; V158-S161 PolarHBondContact O-N 3.14Å; I159-S161 VanDerWaalsContact C-N 3.28Å; I159-S161 PolarHBondContact O-N 2.74Å; S161-A163 VanDerWaalsContact C-N 3.31Å; S161-A163 PolarHBondContact O-N 3.13Å; S161-T164 WeakPolarHBondContact O-CB 3.33Å; S161-T164 PolarHBondContact O-N 3.43Å; S161-T164 PolarHBondContact O-OG1 3.47Å
162Y95.7Very high94.4Very high164 Ų16460.5 Ų60.564%0.64332%0.318SS*.Hα-helixtrans-62.1-38.8175.1-79.7-68.4000112.6V158 I159 T164 I165V158-Y162 HydrophobicContact CG1-CD2 3.81Å; V158-Y162 HydrophobicContact CG1-CE2 3.7Å; V158-Y162 VanDerWaalsContact O-CD2 3.24Å; V158-Y162 WeakPolarHBondContact O-CD2 3.41Å; V158-Y162 PolarHBondContact O-N 3.44Å; I159-Y162 PolarHBondContact O-N 3.05Å; Y162-T164 VanDerWaalsContact C-N 3.25Å; Y162-T164 PolarHBondContact O-N 3.29Å; Y162-I165 PolarHBondContact O-N 3.16Å
163A96.6Very high94.4Very high11 Ų1162.6 Ų62.69%0.09133%0.326CS..Hα-helixtrans-66.7-25.2179.700000113.2I159 S160 S161 I165 F166 L167 A171 A174I159-A163 WeakPolarHBondContact O-CB 3.4Å; I159-A163 PolarHBondContact O-N 3.17Å; S160-A163 PolarHBondContact O-N 3.18Å; S161-A163 VanDerWaalsContact C-N 3.31Å; S161-A163 PolarHBondContact O-N 3.13Å; A163-I165 PolarHBondContact O-N 3.44Å; A163-F166 PolarHBondContact O-N 3.14Å; A163-L167 HydrophobicContact CB-CD1 4.29Å; A163-L167 WeakPolarHBondContact O-CB 3.3Å; A163-L167 PolarHBondContact O-N 3.47Å; A163-A171 HydrophobicContact CB-CB 4.06Å; A163-A174 HydrophobicContact CB-CB 3.38Å
164T94.7Very high94.5Very high75 Ų7562.3 Ų62.346%0.4633%0.325SS..Hα-helixtrans-55-33.7176.3-48.50000112.3S160 S161 Y162 F166 G168S160-T164 PolarHBondContact O-N 3.32Å; S160-T164 PolarHBondContact O-OG1 3.03Å; S161-T164 WeakPolarHBondContact O-CB 3.33Å; S161-T164 PolarHBondContact O-N 3.43Å; S161-T164 PolarHBondContact O-OG1 3.47Å; Y162-T164 VanDerWaalsContact C-N 3.25Å; Y162-T164 PolarHBondContact O-N 3.29Å; T164-F166 VanDerWaalsContact C-N 3.26Å; T164-F166 PolarHBondContact O-N 3.37Å; T164-G168 WeakPolarHBondContact O-CA 3.37Å; T164-G168 PolarHBondContact O-N 2.77Å
165I94.2Very high94.6Very high130 Ų13058.1 Ų58.167%0.66731%0.309SS*.Hα-helixtrans-60.9-36.9178.7-58.1172.1000111.4Y162 A163Y162-I165 PolarHBondContact O-N 3.16Å; A163-I165 PolarHBondContact O-N 3.44Å
166F94.4Very high94.6Very high178 Ų17856.5 Ų56.578%0.78130%0.301SS*.Hα-helixtrans-104.7-31.7-173.2-58-77.2000113.8A163 T164A163-F166 PolarHBondContact O-N 3.14Å; T164-F166 VanDerWaalsContact C-N 3.26Å; T164-F166 PolarHBondContact O-N 3.37Å
167L93.4Very high94.7Very high81 Ų8160 Ų6042%0.42432%0.318SS..Hα-helixtrans-111.6-7.1-171.7-69.7171.2000113.6A163 D169 L170 A174A163-L167 HydrophobicContact CB-CD1 4.29Å; A163-L167 WeakPolarHBondContact O-CB 3.3Å; A163-L167 PolarHBondContact O-N 3.47Å; L167-D169 PolarHBondContact O-N 3.11Å; L167-L170 HydrophobicContact CB-CB 4.32Å; L167-L170 WeakPolarHBondContact O-CB 3.36Å; L167-L170 PolarHBondContact O-N 3.42Å; L167-A174 HydrophobicContact CD1-CB 4.24Å
168G92.2Very high94.9Very high35 Ų3561.5 Ų61.536%0.36132%0.323SS..G310 helixtrans51.5-124.8-178.100000112.2T164 L170 A171T164-G168 WeakPolarHBondContact O-CA 3.37Å; T164-G168 PolarHBondContact O-N 2.77Å; G168-L170 PolarHBondContact O-N 3.49Å; G168-L170 VanDerWaalsContact O-N 3.08Å; G168-A171 WeakPolarHBondContact O-CB 3.38Å; G168-A171 PolarHBondContact O-N 3.33Å
169D88.1Confident95Very high137 Ų13758.2 Ų58.273%0.73330%0.303SS*.G310 helixtrans-63.6-14.7-178.6-63.4-25.8000114.6L167 A171 W172L167-D169 PolarHBondContact O-N 3.11Å; D169-A171 VanDerWaalsContact C-N 3.35Å; D169-W172 PolarHBondContact O-NE1 3.03Å
170L92.9Very high95Very high67 Ų6756.9 Ų56.935%0.35130%0.297SS..G310 helixtrans-90.31.9177.3-63.1174.3000112.7L167 G168 W172 R173L167-L170 HydrophobicContact CB-CB 4.32Å; L167-L170 WeakPolarHBondContact O-CB 3.36Å; L167-L170 PolarHBondContact O-N 3.42Å; G168-L170 PolarHBondContact O-N 3.49Å; G168-L170 VanDerWaalsContact O-N 3.08Å; L170-W172 PolarHBondContact O-N 3.25Å; L170-W172 VanDerWaalsContact O-N 3.13Å; L170-R173 WeakPolarHBondContact O-CB 3.41Å; L170-R173 WeakPolarHBondContact O-CG 3.47Å; L170-R173 PolarHBondContact O-N 2.97Å
171A95.2Very high95.2Very high4 Ų458.6 Ų58.63%0.03331%0.312CS..G310 helixtrans-57.6-29.5-176.300000114.6S160 A163 G168 D169 R173 A174S160-A171 WeakPolarHBondContact O-CB 3.43Å; S160-A171 PolarHBondContact OG-O 2.88Å; A163-A171 HydrophobicContact CB-CB 4.06Å; G168-A171 WeakPolarHBondContact O-CB 3.38Å; G168-A171 PolarHBondContact O-N 3.33Å; D169-A171 VanDerWaalsContact C-N 3.35Å; A171-R173 PolarHBondContact O-N 3.26Å; A171-A174 WeakPolarHBondContact O-CB 3.47Å; A171-A174 PolarHBondContact O-N 3.34Å
172W93.2Very high95.3Very high5 Ų555.5 Ų55.52%0.01929%0.29CS..G310 helixtrans-60-17.6175.567.7-92.3000113.2I32 I35 I36 Y40 W103 D169 L170 P175 F176I32-W172 WeakPolarHBondContact CG2-O 3.43Å; I35-W172 HydrophobicContact CG2-CB 4.3Å; I36-W172 HydrophobicContact CD1-CE3 4.11Å; I36-W172 HydrophobicContact CD1-CZ3 4.32Å; I36-W172 HydrophobicContact CG1-CD2 4.25Å; I36-W172 HydrophobicContact CG1-CE3 3.79Å; I36-W172 HydrophobicContact CG1-CZ3 4.45Å; Y40-W172 HydrophobicContact CD2-CZ2 4.07Å; Y40-W172 AromaticContact CD2-NE1 3.87Å; Y40-W172 AromaticContact CE2-CE2 3.96Å; Y40-W172 HydrophobicContact CE2-CZ2 4.09Å; Y40-W172 AromaticContact CE2-NE1 3.43Å; Y40-W172 HydrophobicContact CG-CZ2 4.39Å; W103-W172 HydrophobicContact CH2-CH2 4.23Å; W103-W172 HydrophobicContact CH2-CZ3 4.3Å; W103-W172 AromaticContact CZ2-CH2 3.51Å; W103-W172 HydrophobicContact CZ2-CH2 3.51Å; W103-W172 HydrophobicContact CZ2-CZ2 4.43Å; W103-W172 AromaticContact CZ2-CZ3 3.8Å; W103-W172 HydrophobicContact CZ2-CZ3 3.8Å; D169-W172 PolarHBondContact O-NE1 3.03Å; L170-W172 PolarHBondContact O-N 3.25Å; L170-W172 VanDerWaalsContact O-N 3.13Å; W172-P175 WeakPolarHBondContact O-CD 3.39Å; W172-F176 HydrophobicContact CE3-CE2 4.13Å; W172-F176 AromaticContact CZ3-CE2 3.97Å; W172-F176 HydrophobicContact CZ3-CE2 3.97Å
173R95.2Very high95.4Very high44 Ų4447.7 Ų47.717%0.16626%0.259CS..G310 helixtrans-77.4-25.4177.1-64.2179.5166.7-150.6-4.9113S95 V96 S98 L170 A171 F176S95-R173 WeakPolarHBondContact O-CD 3.39Å; S95-R173 VanDerWaalsContact O-CG 3.29Å; S95-R173 WeakPolarHBondContact O-CG 3.24Å; S95-R173 PolarHBondContact O-NE 3.07Å; S95-R173 PolarHBondContact O-NH1 3.12Å; S95-R173 WeakPolarHBondContact OG-CB 3.38Å; S95-R173 PolarHBondContact OG-O 3.34Å; V96-R173 VanDerWaalsContact O-CZ 3.26Å; V96-R173 PolarHBondContact O-NH1 3.38Å; V96-R173 PolarHBondContact O-NH2 2.89Å; S98-R173 PolarHBondContact OG-NH2 3.03Å; L170-R173 WeakPolarHBondContact O-CB 3.41Å; L170-R173 WeakPolarHBondContact O-CG 3.47Å; L170-R173 PolarHBondContact O-N 2.97Å; A171-R173 PolarHBondContact O-N 3.26Å; R173-F176 PolarHBondContact O-N 3.45Å
174A96.5Very high95.5Very high12 Ų1250 Ų5010%0.09927%0.269CS..Hα-helixtrans-62.5-39.2-17200000114.4I159 A163 L167 A171 F176 I177 F178I159-A174 HydrophobicContact CG2-CB 3.92Å; A163-A174 HydrophobicContact CB-CB 3.38Å; L167-A174 HydrophobicContact CD1-CB 4.24Å; A171-A174 WeakPolarHBondContact O-CB 3.47Å; A171-A174 PolarHBondContact O-N 3.34Å; A174-F176 VanDerWaalsContact C-N 3.29Å; A174-F176 PolarHBondContact O-N 3.19Å; A174-I177 PolarHBondContact O-N 3.46Å; A174-I177 VanDerWaalsContact O-N 3.14Å; A174-F178 PolarHBondContact O-N 3.36Å
175P97Very high95.7Very high0 Ų050.7 Ų50.70%027%0.269CS..Hα-helixtrans-65.5-29.9179.9-2032.5000113.5I32 S156 I159 W172 F178 V179I32-P175 HydrophobicContact CD1-CB 3.58Å; I32-P175 HydrophobicContact CD1-CG 4.25Å; I32-P175 HydrophobicContact CG1-CB 3.8Å; I32-P175 HydrophobicContact CG1-CG 4.17Å; S156-P175 VanDerWaalsContact O-CG 3.29Å; S156-P175 WeakPolarHBondContact O-CG 3.05Å; I159-P175 HydrophobicContact CB-CG 4.23Å; I159-P175 HydrophobicContact CG2-CB 4.41Å; I159-P175 HydrophobicContact CG2-CG 4.09Å; W172-P175 WeakPolarHBondContact O-CD 3.39Å; P175-F178 PolarHBondContact O-N 3.04Å; P175-V179 VanDerWaalsContact O-CG2 3.32Å; P175-V179 WeakPolarHBondContact O-CG2 3.34Å; P175-V179 PolarHBondContact O-N 3.2Å
176F96.8Very high95.8Very high1 Ų144.5 Ų44.50%0.00424%0.238CC..Hα-helixtrans-62.9-44.6171.8-67.1-64000111.9A28 I29 I32 L91 W172 R173 A174 G180A28-F176 HydrophobicContact CB-CD1 3.86Å; A28-F176 HydrophobicContact CB-CE1 3.88Å; I29-F176 HydrophobicContact CB-CE1 4.25Å; I29-F176 HydrophobicContact CB-CZ 4.32Å; I29-F176 HydrophobicContact CG1-CZ 4.17Å; I32-F176 HydrophobicContact CB-CZ 4.46Å; I32-F176 HydrophobicContact CD1-CD1 3.69Å; I32-F176 HydrophobicContact CD1-CD2 3.9Å; I32-F176 HydrophobicContact CD1-CE1 3.59Å; I32-F176 HydrophobicContact CD1-CE2 3.78Å; I32-F176 HydrophobicContact CD1-CG 3.85Å; I32-F176 HydrophobicContact CD1-CZ 3.62Å; I32-F176 HydrophobicContact CG2-CE2 4.44Å; L91-F176 HydrophobicContact CD2-CD1 4.19Å; W172-F176 HydrophobicContact CE3-CE2 4.13Å; W172-F176 AromaticContact CZ3-CE2 3.97Å; W172-F176 HydrophobicContact CZ3-CE2 3.97Å; R173-F176 PolarHBondContact O-N 3.45Å; A174-F176 VanDerWaalsContact C-N 3.29Å; A174-F176 PolarHBondContact O-N 3.19Å; F176-G180 PolarHBondContact O-N 3Å
177I96.8Very high96Very high76 Ų7636 Ų3639%0.3920%0.201SC..Hα-helixtrans-64.7-45.1178.4-56.9174.8000109.8S95 A174 G180 A181S95-I177 WeakPolarHBondContact OG-CD1 3.22Å; S95-I177 WeakPolarHBondContact OG-CG1 3.32Å; A174-I177 PolarHBondContact O-N 3.46Å; A174-I177 VanDerWaalsContact O-N 3.14Å; I177-G180 PolarHBondContact O-N 2.95Å; I177-A181 WeakPolarHBondContact O-CB 3.46Å; I177-A181 PolarHBondContact O-N 3.18Å
178F97.4Very high96.2Very high79 Ų7936.9 Ų36.935%0.34621%0.205SC..Hα-helixtrans-59.1-51.3178.6174.6-94.2000111.9F21 I155 I159 A174 P175 G180 A181 C182F21-F178 HydrophobicContact CE1-CE1 4.3Å; I155-F178 HydrophobicContact CG2-CD1 4.4Å; I155-F178 HydrophobicContact CG2-CE1 3.97Å; I159-F178 HydrophobicContact CD1-CB 3.81Å; I159-F178 HydrophobicContact CD1-CD1 3.14Å; I159-F178 HydrophobicContact CD1-CD2 3.92Å; I159-F178 HydrophobicContact CD1-CE1 3.56Å; I159-F178 HydrophobicContact CD1-CE2 4.27Å; I159-F178 HydrophobicContact CD1-CG 3.33Å; I159-F178 HydrophobicContact CD1-CZ 4.11Å; I159-F178 HydrophobicContact CG1-CD1 4.39Å; I159-F178 HydrophobicContact CG1-CD2 4.43Å; I159-F178 HydrophobicContact CG1-CG 4.23Å; I159-F178 HydrophobicContact CG2-CB 4.24Å; A174-F178 PolarHBondContact O-N 3.36Å; P175-F178 PolarHBondContact O-N 3.04Å; F178-G180 VanDerWaalsContact C-N 3.3Å; F178-G180 PolarHBondContact O-N 3.17Å; F178-A181 PolarHBondContact O-N 3.06Å; F178-C182 PolarHBondContact O-N 3.27Å; F178-C182 PolarHBondContact O-SG 3.11Å; F178-C182 VanDerWaalsContact O-SG 3.4Å
179V97.7Very high96.4Very high6 Ų639 Ų394%0.03621%0.208CC..Hα-helixtrans-62.7-40.3179.4174.80000110.8L24 A25 L91 P175 C182 C183L24-V179 HydrophobicContact CB-CG1 4Å; L24-V179 HydrophobicContact CB-CG2 4.27Å; A25-V179 HydrophobicContact CB-CG1 3.96Å; L91-V179 HydrophobicContact CD1-CB 4.34Å; L91-V179 HydrophobicContact CD1-CG1 3.88Å; P175-V179 VanDerWaalsContact O-CG2 3.32Å; P175-V179 WeakPolarHBondContact O-CG2 3.34Å; P175-V179 PolarHBondContact O-N 3.2Å; V179-C182 PolarHBondContact O-N 3.05Å; V179-C183 PolarHBondContact O-N 3.15Å; V179-C183 PolarHBondContact O-SG 3.36Å
180G97.8Very high96.8Very high2 Ų232.4 Ų32.42%0.02117%0.173CC..Hα-helixtrans-59.5-49.3173.500000112.6S88 F176 I177 F178 C182 C183 I184S88-G180 VanDerWaalsContact OG-C 3.27Å; S88-G180 WeakPolarHBondContact OG-CA 3.26Å; S88-G180 PolarHBondContact OG-O 3.27Å; F176-G180 PolarHBondContact O-N 3Å; I177-G180 PolarHBondContact O-N 2.95Å; F178-G180 VanDerWaalsContact C-N 3.3Å; F178-G180 PolarHBondContact O-N 3.17Å; G180-C182 VanDerWaalsContact C-N 3.34Å; G180-C182 PolarHBondContact O-N 3.26Å; G180-C183 WeakPolarHBondContact O-CA 3.35Å; G180-C183 WeakPolarHBondContact O-CB 3.39Å; G180-C183 PolarHBondContact O-N 3.19Å; G180-I184 PolarHBondContact O-N 2.73Å
181A98.1Very high97Very high45 Ų4532.8 Ų32.837%0.37217%0.174SC..Hα-helixtrans-59-43.6177.500000111.9I177 F178 C183 I184 I185I177-A181 WeakPolarHBondContact O-CB 3.46Å; I177-A181 PolarHBondContact O-N 3.18Å; F178-A181 PolarHBondContact O-N 3.06Å; A181-C183 VanDerWaalsContact C-N 3.31Å; A181-C183 PolarHBondContact O-N 3.32Å; A181-I184 PolarHBondContact O-N 2.86Å; A181-I185 WeakPolarHBondContact O-CG1 3.11Å; A181-I185 PolarHBondContact O-N 2.78Å
182C98Very high97.1Very high14 Ų1436.9 Ų36.910%0.09520%0.198CC..Hα-helixtrans-64.4-33.4174.7-67.10000112.9F21 F178 V179 G180 S186F21-C182 HydrophobicContact CD1-CB 3.28Å; F21-C182 HydrophobicContact CD2-CB 4.19Å; F21-C182 HydrophobicContact CE1-CB 3.3Å; F21-C182 VanDerWaalsContact CE1-SG 3.56Å; F21-C182 HydrophobicContact CE2-CB 4.26Å; F21-C182 HydrophobicContact CG-CB 3.75Å; F21-C182 HydrophobicContact CZ-CB 3.82Å; F178-C182 PolarHBondContact O-N 3.27Å; F178-C182 PolarHBondContact O-SG 3.11Å; F178-C182 VanDerWaalsContact O-SG 3.4Å; V179-C182 PolarHBondContact O-N 3.05Å; G180-C182 VanDerWaalsContact C-N 3.34Å; G180-C182 PolarHBondContact O-N 3.26Å; C182-S186 WeakPolarHBondContact O-CB 3.37Å; C182-S186 PolarHBondContact O-N 3.13Å; C182-S186 PolarHBondContact O-OG 3.47Å
183C97.9Very high97.1Very high0 Ų039 Ų390%021%0.207CC..Hα-helixtrans-65.1-41.5172-67.60000111.5L84 V179 G180 A181 S186 A187L84-C183 HydrophobicContact CD2-CB 4.16Å; V179-C183 PolarHBondContact O-N 3.15Å; V179-C183 PolarHBondContact O-SG 3.36Å; G180-C183 WeakPolarHBondContact O-CA 3.35Å; G180-C183 WeakPolarHBondContact O-CB 3.39Å; G180-C183 PolarHBondContact O-N 3.19Å; A181-C183 VanDerWaalsContact C-N 3.31Å; A181-C183 PolarHBondContact O-N 3.32Å; C183-S186 WeakPolarHBondContact O-CB 3.28Å; C183-S186 PolarHBondContact O-N 3Å; C183-A187 WeakPolarHBondContact O-CB 3.34Å; C183-A187 PolarHBondContact O-N 3.26Å
184I98.1Very high97Very high58 Ų5838.3 Ų38.330%0.29721%0.206SC..Hα-helixtrans-64.6-46.3174.9-67.8-66.7000111.3I85 S88 G180 A181 S186 A187 L188I85-I184 HydrophobicContact CB-CD1 4.26Å; I85-I184 HydrophobicContact CG1-CD1 4.05Å; I85-I184 HydrophobicContact CG2-CD1 4.15Å; S88-I184 VanDerWaalsContact OG-CG1 3.27Å; S88-I184 WeakPolarHBondContact OG-CG1 3.22Å; G180-I184 PolarHBondContact O-N 2.73Å; A181-I184 PolarHBondContact O-N 2.86Å; I184-S186 VanDerWaalsContact C-N 3.27Å; I184-S186 PolarHBondContact O-N 2.76Å; I184-A187 WeakPolarHBondContact O-CB 3.23Å; I184-A187 PolarHBondContact O-N 2.89Å; I184-A187 VanDerWaalsContact O-N 3.12Å; I184-L188 HydrophobicContact CG2-CD1 4.04Å; I184-L188 HydrophobicContact CG2-CG 4.34Å; I184-L188 WeakPolarHBondContact O-CG 3.28Å; I184-L188 PolarHBondContact O-N 3.33Å
185I98.2Very high96.8Very high90 Ų9043.2 Ų43.246%0.46223%0.227SC..Hα-helixtrans-58.2-44.4176.3-67.9164.9000110A181 A187 L188 L189A181-I185 WeakPolarHBondContact O-CG1 3.11Å; A181-I185 PolarHBondContact O-N 2.78Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.27Å; I185-L188 PolarHBondContact O-N 3.31Å; I185-L189 HydrophobicContact CG2-CD1 4.09Å; I185-L189 HydrophobicContact CG2-CG 4.44Å; I185-L189 WeakPolarHBondContact O-CG 3.28Å; I185-L189 PolarHBondContact O-N 3.01Å
186S97.3Very high96.5Very high0 Ų045.7 Ų45.70%024%0.244CC..Hα-helixtrans-60.5-43.3176.1-58.70000111.9W17 C182 C183 I184 L189 L190W17-S186 PolarHBondContact NE1-OG 3.07Å; C182-S186 WeakPolarHBondContact O-CB 3.37Å; C182-S186 PolarHBondContact O-N 3.13Å; C182-S186 PolarHBondContact O-OG 3.47Å; C183-S186 WeakPolarHBondContact O-CB 3.28Å; C183-S186 PolarHBondContact O-N 3Å; I184-S186 VanDerWaalsContact C-N 3.27Å; I184-S186 PolarHBondContact O-N 2.76Å; S186-L189 PolarHBondContact O-N 3.32Å; S186-L190 WeakPolarHBondContact O-CG 3.42Å; S186-L190 PolarHBondContact O-N 3.37Å
187A97.9Very high96.1Very high1 Ų151.1 Ų51.11%0.00827%0.265CS..Hα-helixtrans-62.2-43.8175.900000112.1I81 L84 I85 C183 I184 I185 L190 I191I81-A187 HydrophobicContact CG2-CB 4.23Å; L84-A187 HydrophobicContact CB-CB 4.02Å; L84-A187 HydrophobicContact CD1-CB 4.28Å; I85-A187 HydrophobicContact CD1-CB 4.28Å; I85-A187 HydrophobicContact CG1-CB 3.78Å; C183-A187 WeakPolarHBondContact O-CB 3.34Å; C183-A187 PolarHBondContact O-N 3.26Å; I184-A187 WeakPolarHBondContact O-CB 3.23Å; I184-A187 PolarHBondContact O-N 2.89Å; I184-A187 VanDerWaalsContact O-N 3.12Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.27Å; A187-L190 PolarHBondContact O-N 2.88Å; A187-I191 VanDerWaalsContact O-CG1 3.29Å; A187-I191 WeakPolarHBondContact O-CG1 3.32Å; A187-I191 PolarHBondContact O-N 3.13Å
188L97.9Very high95.6Very high99 Ų9950.4 Ų50.452%0.51826%0.264SS..Hα-helixtrans-62.6-45.2177.2-69.6173000111.8I184 I185 L190 I191 V192I184-L188 HydrophobicContact CG2-CD1 4.04Å; I184-L188 HydrophobicContact CG2-CG 4.34Å; I184-L188 WeakPolarHBondContact O-CG 3.28Å; I184-L188 PolarHBondContact O-N 3.33Å; I185-L188 PolarHBondContact O-N 3.31Å; L188-L190 VanDerWaalsContact C-N 3.29Å; L188-L190 PolarHBondContact O-N 3.14Å; L188-I191 WeakPolarHBondContact O-CB 3.47Å; L188-I191 PolarHBondContact O-N 3.37Å; L188-I191 VanDerWaalsContact O-N 3.16Å; L188-V192 WeakPolarHBondContact O-CG2 3.42Å; L188-V192 PolarHBondContact O-N 3.46Å
189L97.3Very high95Very high78 Ų7849.9 Ų49.941%0.40826%0.264SS..Hα-helixtrans-61.6-38.6176.7-69.2172.9000112L14 I185 S186 V192 Y193L14-L189 HydrophobicContact CD2-CB 3.62Å; L14-L189 HydrophobicContact CD2-CD1 4.07Å; L14-L189 HydrophobicContact CD2-CG 4.43Å; I185-L189 HydrophobicContact CG2-CD1 4.09Å; I185-L189 HydrophobicContact CG2-CG 4.44Å; I185-L189 WeakPolarHBondContact O-CG 3.28Å; I185-L189 PolarHBondContact O-N 3.01Å; S186-L189 PolarHBondContact O-N 3.32Å; L189-V192 PolarHBondContact O-N 2.94Å; L189-Y193 WeakPolarHBondContact O-CB 3.3Å; L189-Y193 PolarHBondContact O-N 2.84Å
190L96.6Very high94.4Very high0 Ų054.3 Ų54.30%029%0.287CS..Hα-helixtrans-68.2-36174.6-72.9171.1000112.7L14 L77 F80 I81 L84 S186 A187 L188 Y193 L194L14-L190 HydrophobicContact CB-CD2 3.96Å; L14-L190 HydrophobicContact CD1-CD2 4.49Å; L77-L190 HydrophobicContact CD1-CD2 4.26Å; F80-L190 HydrophobicContact CD1-CD1 3.78Å; F80-L190 HydrophobicContact CE1-CD1 3.86Å; I81-L190 HydrophobicContact CD1-CB 3.89Å; I81-L190 HydrophobicContact CG1-CB 3.67Å; I81-L190 HydrophobicContact CG1-CD1 4.21Å; L84-L190 HydrophobicContact CD1-CD1 3.89Å; S186-L190 WeakPolarHBondContact O-CG 3.42Å; S186-L190 PolarHBondContact O-N 3.37Å; A187-L190 PolarHBondContact O-N 2.88Å; L188-L190 VanDerWaalsContact C-N 3.29Å; L188-L190 PolarHBondContact O-N 3.14Å; L190-Y193 PolarHBondContact O-N 2.8Å; L190-L194 WeakPolarHBondContact O-CB 3.24Å; L190-L194 PolarHBondContact O-N 3.44Å
191I96.6Very high93.6Very high74 Ų7457.6 Ų57.638%0.37931%0.307SS..Hα-helixtrans-63.6-47.7173.3-70.1164.6000110.2I81 A187 L188 Y193 L194 H195I81-I191 HydrophobicContact CD1-CG1 3.88Å; I81-I191 HydrophobicContact CG1-CG1 4.4Å; I81-I191 HydrophobicContact CG2-CD1 3.81Å; I81-I191 HydrophobicContact CG2-CG1 3.74Å; A187-I191 VanDerWaalsContact O-CG1 3.29Å; A187-I191 WeakPolarHBondContact O-CG1 3.32Å; A187-I191 PolarHBondContact O-N 3.13Å; L188-I191 WeakPolarHBondContact O-CB 3.47Å; L188-I191 PolarHBondContact O-N 3.37Å; L188-I191 VanDerWaalsContact O-N 3.16Å; I191-Y193 VanDerWaalsContact C-N 3.33Å; I191-Y193 PolarHBondContact O-N 2.79Å; I191-L194 PolarHBondContact O-N 2.98Å; I191-H195 WeakPolarHBondContact O-CB 3.39Å; I191-H195 PolarHBondContact O-N 3.39Å
192V96Very high92.8Very high90 Ų9059.5 Ų59.555%0.54531%0.311SS..Hα-helixtrans-58.5-47.2176.8172.70000110.1L188 L189 L194 H195 S196L188-V192 WeakPolarHBondContact O-CG2 3.42Å; L188-V192 PolarHBondContact O-N 3.46Å; L189-V192 PolarHBondContact O-N 2.94Å; V192-L194 PolarHBondContact O-N 3.32Å; V192-H195 PolarHBondContact O-N 3.19Å; V192-S196 PolarHBondContact O-N 2.9Å; V192-S196 PolarHBondContact O-OG 3.07Å; V192-S196 VanDerWaalsContact O-OG 3.12Å
193Y94.6Very high91.9Very high50 Ų5062.6 Ų62.620%0.19633%0.326CS..Hα-helixtrans-58.3-45.6176176.5-92.5000112.5L11 L14 L77 L189 L190 I191 H195 S196 R197L11-Y193 HydrophobicContact CB-CE1 4.01Å; L11-Y193 HydrophobicContact CB-CE2 4.06Å; L11-Y193 HydrophobicContact CD1-CD1 4.01Å; L11-Y193 HydrophobicContact CD1-CE1 3.71Å; L11-Y193 HydrophobicContact CD2-CE1 4.14Å; L11-Y193 HydrophobicContact CG-CE1 4.16Å; L14-Y193 HydrophobicContact CD1-CD2 4.24Å; L14-Y193 HydrophobicContact CD1-CG 4.15Å; L77-Y193 HydrophobicContact CD2-CD1 4.3Å; L189-Y193 WeakPolarHBondContact O-CB 3.3Å; L189-Y193 PolarHBondContact O-N 2.84Å; L190-Y193 PolarHBondContact O-N 2.8Å; I191-Y193 VanDerWaalsContact C-N 3.33Å; I191-Y193 PolarHBondContact O-N 2.79Å; Y193-H195 VanDerWaalsContact C-N 3.31Å; Y193-H195 PolarHBondContact O-N 2.7Å; Y193-S196 PolarHBondContact O-N 2.97Å; Y193-R197 WeakPolarHBondContact O-CB 3.45Å; Y193-R197 PolarHBondContact O-N 3.27Å
194L92.2Very high90.9Very high29 Ų2968.5 Ų68.515%0.15235%0.354CS..Hα-helixtrans-63.8-39.8179.3-173.365.5000111.5L77 R78 L190 I191 V192 T198L77-L194 HydrophobicContact CD2-CB 4.17Å; L77-L194 HydrophobicContact CD2-CD1 4.01Å; R78-L194 HydrophobicContact CG-CD2 3.65Å; L190-L194 WeakPolarHBondContact O-CB 3.24Å; L190-L194 PolarHBondContact O-N 3.44Å; I191-L194 PolarHBondContact O-N 2.98Å; V192-L194 PolarHBondContact O-N 3.32Å; L194-T198 PolarHBondContact O-N 2.96Å; L194-T198 PolarHBondContact O-OG1 3.37Å
195H92.2Very high89.9Confident116 Ų11670.1 Ų70.154%0.53736%0.362SS..Hα-helixtrans-64.8-50.2177-177.164.6000111.5I191 V192 Y193 R197 T198 I199I191-H195 WeakPolarHBondContact O-CB 3.39Å; I191-H195 PolarHBondContact O-N 3.39Å; V192-H195 PolarHBondContact O-N 3.19Å; Y193-H195 VanDerWaalsContact C-N 3.31Å; Y193-H195 PolarHBondContact O-N 2.7Å; H195-R197 VanDerWaalsContact C-N 3.33Å; H195-R197 PolarHBondContact O-N 3.26Å; H195-T198 WeakPolarHBondContact O-CB 3.33Å; H195-T198 PolarHBondContact O-N 3.21Å; H195-T198 VanDerWaalsContact O-N 3.07Å; H195-I199 VanDerWaalsContact NE2-CD1 3.29Å; H195-I199 WeakPolarHBondContact NE2-CD1 3.25Å; H195-I199 PolarHBondContact O-N 3.07Å
196S91.4Very high88.4Confident52 Ų5270 Ų7036%0.36436%0.363SS..Hα-helixtrans-56.4-46.7176.4-61.10000111.7V192 Y193 T198 I199 D200V192-S196 PolarHBondContact O-N 2.9Å; V192-S196 PolarHBondContact O-OG 3.07Å; V192-S196 VanDerWaalsContact O-OG 3.12Å; Y193-S196 PolarHBondContact O-N 2.97Å; S196-T198 VanDerWaalsContact C-N 3.27Å; S196-T198 PolarHBondContact O-N 2.95Å; S196-I199 PolarHBondContact O-N 3.36Å; S196-D200 PolarHBondContact O-N 3.04Å
197R87.5Confident86.5Confident115 Ų11578.6 Ų78.643%0.43440%0.4SS..Hα-helixtrans-61-36.4177.4-175.6171.7177.8171-2.1112.7Y193 H195 T201Y193-R197 WeakPolarHBondContact O-CB 3.45Å; Y193-R197 PolarHBondContact O-N 3.27Å; H195-R197 VanDerWaalsContact C-N 3.33Å; H195-R197 PolarHBondContact O-N 3.26Å; R197-T201 PolarHBondContact O-N 2.63Å; R197-T201 VanDerWaalsContact O-N 3.16Å; R197-T201 PolarHBondContact O-OG1 3.36Å; R197-T201 VanDerWaalsContact O-OG1 3.12Å
198T86.1Confident84.7Confident60 Ų6086.6 Ų86.637%0.36844%0.435SS..Hα-helixtrans-67.6-42.3177.8-53.60000110.8L194 H195 S196 T201 L202L194-T198 PolarHBondContact O-N 2.96Å; L194-T198 PolarHBondContact O-OG1 3.37Å; H195-T198 WeakPolarHBondContact O-CB 3.33Å; H195-T198 PolarHBondContact O-N 3.21Å; H195-T198 VanDerWaalsContact O-N 3.07Å; S196-T198 VanDerWaalsContact C-N 3.27Å; S196-T198 PolarHBondContact O-N 2.95Å; T198-T201 WeakPolarHBondContact CA-OG1 3.49Å; T198-T201 PolarHBondContact O-N 2.88Å; T198-T201 PolarHBondContact O-OG1 3.39Å; T198-L202 HydrophobicContact CG2-CD1 4.07Å; T198-L202 WeakPolarHBondContact O-CD1 2.92Å; T198-L202 PolarHBondContact O-N 2.89Å
199I85.8Confident82.7Confident69 Ų6986.3 Ų86.335%0.35444%0.437SS..Hα-helixtrans-62-46175.7-69.5169.6000110.9H195 S196 T201 L202 N203H195-I199 VanDerWaalsContact NE2-CD1 3.29Å; H195-I199 WeakPolarHBondContact NE2-CD1 3.25Å; H195-I199 PolarHBondContact O-N 3.07Å; S196-I199 PolarHBondContact O-N 3.36Å; I199-T201 VanDerWaalsContact C-N 3.3Å; I199-T201 PolarHBondContact O-N 3.45Å; I199-L202 WeakPolarHBondContact O-CB 3.27Å; I199-L202 PolarHBondContact O-N 3.38Å; I199-L202 VanDerWaalsContact O-N 3.15Å; I199-N203 PolarHBondContact O-N 3.5Å; I199-N203 PolarHBondContact O-ND2 3.17Å
200D84.3Confident80.1Confident98 Ų9887.6 Ų87.652%0.52444%0.443SS..Hα-helixtrans-59.1-43.2179.3-68.6-23.1000111.4S196 L202 N203 E204S196-D200 PolarHBondContact O-N 3.04Å; D200-L202 PolarHBondContact O-N 2.88Å; D200-N203 PolarHBondContact O-N 2.81Å; D200-E204 PolarHBondContact O-N 3.39Å
201T82.4Confident77.3Confident71 Ų7192.6 Ų92.644%0.43648%0.476SS..Hα-helixtrans-65.1-38.5176.247.30000113.1R197 T198 I199 E204 I205R197-T201 PolarHBondContact O-N 2.63Å; R197-T201 VanDerWaalsContact O-N 3.16Å; R197-T201 PolarHBondContact O-OG1 3.36Å; R197-T201 VanDerWaalsContact O-OG1 3.12Å; T198-T201 WeakPolarHBondContact CA-OG1 3.49Å; T198-T201 PolarHBondContact O-N 2.88Å; T198-T201 PolarHBondContact O-OG1 3.39Å; I199-T201 VanDerWaalsContact C-N 3.3Å; I199-T201 PolarHBondContact O-N 3.45Å; T201-E204 PolarHBondContact O-N 2.92Å; T201-I205 WeakPolarHBondContact O-CD1 3.28Å; T201-I205 VanDerWaalsContact O-CG1 3.29Å; T201-I205 WeakPolarHBondContact O-CG1 3.42Å; T201-I205 PolarHBondContact O-N 3.17Å; T201-I205 VanDerWaalsContact O-N 3.17Å
202L81.2Confident74.5Confident86 Ų8695.9 Ų95.945%0.4550%0.5SS..Hα-helixtrans-64.9-41.2176.1-84.6153.2000111.5T198 I199 D200 I205 N206T198-L202 HydrophobicContact CG2-CD1 4.07Å; T198-L202 WeakPolarHBondContact O-CD1 2.92Å; T198-L202 PolarHBondContact O-N 2.89Å; I199-L202 WeakPolarHBondContact O-CB 3.27Å; I199-L202 PolarHBondContact O-N 3.38Å; I199-L202 VanDerWaalsContact O-N 3.15Å; D200-L202 PolarHBondContact O-N 2.88Å; L202-I205 PolarHBondContact O-N 3.15Å; L202-N206 PolarHBondContact O-N 2.66Å
203N79Confident71.4Confident79 Ų7999.8 Ų99.842%0.42251%0.509SS..Hα-helixtrans-64.6-43.5177.9-71.6-22.4000111.6I199 D200 I205 N206 F207I199-N203 PolarHBondContact O-N 3.5Å; I199-N203 PolarHBondContact O-ND2 3.17Å; D200-N203 PolarHBondContact O-N 2.81Å; N203-I205 VanDerWaalsContact C-N 3.31Å; N203-I205 PolarHBondContact O-N 3.36Å; N203-N206 PolarHBondContact O-N 3.43Å; N203-F207 WeakPolarHBondContact O-CD2 3.49Å; N203-F207 PolarHBondContact O-N 3.45Å; N203-F207 VanDerWaalsContact O-N 3.07Å
204E76.5Confident68.3Low123 Ų123108.1 Ų108.158%0.57554%0.542SS*.Hα-helixtrans-61.7-37.5175.5-78.6-165.7-175.200113.2D200 T201 K208D200-E204 PolarHBondContact O-N 3.39Å; T201-E204 PolarHBondContact O-N 2.92Å; E204-K208 PolarHBondContact O-N 3.45Å
205I76.1Confident65.5Low93 Ų93115.9 Ų115.948%0.47758%0.575SS.*Hα-helixtrans-65.8-48.7177.3-67.7165000109.9T201 L202 N203 F207 K208 T209T201-I205 WeakPolarHBondContact O-CD1 3.28Å; T201-I205 VanDerWaalsContact O-CG1 3.29Å; T201-I205 WeakPolarHBondContact O-CG1 3.42Å; T201-I205 PolarHBondContact O-N 3.17Å; T201-I205 VanDerWaalsContact O-N 3.17Å; L202-I205 PolarHBondContact O-N 3.15Å; N203-I205 VanDerWaalsContact C-N 3.31Å; N203-I205 PolarHBondContact O-N 3.36Å; I205-F207 VanDerWaalsContact C-N 3.3Å; I205-F207 PolarHBondContact O-N 3.35Å; I205-K208 PolarHBondContact O-N 2.99Å; I205-T209 PolarHBondContact O-N 3Å; I205-T209 PolarHBondContact O-OG1 3.06Å
206N67.6Low62.6Low87 Ų87114.8 Ų114.847%0.46558%0.58SS.*Hα-helixtrans-58.1-40.8179-81.4-17.8000112.2L202 N203 K208 T209 I210L202-N206 PolarHBondContact O-N 2.66Å; N203-N206 PolarHBondContact O-N 3.43Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 3.04Å; N206-T209 PolarHBondContact O-N 3.47Å; N206-I210 WeakPolarHBondContact O-CD1 3.21Å; N206-I210 VanDerWaalsContact O-CG1 3.3Å; N206-I210 WeakPolarHBondContact O-CG1 3.18Å; N206-I210 PolarHBondContact O-N 3.34Å
207F58.5Low59.8Low180 Ų180118 Ų11879%0.78960%0.6SS**Hα-helixtrans-67.7-29.9176.5-91-78.5000113.7N203 I205N203-F207 WeakPolarHBondContact O-CD2 3.49Å; N203-F207 PolarHBondContact O-N 3.45Å; N203-F207 VanDerWaalsContact O-N 3.07Å; I205-F207 VanDerWaalsContact C-N 3.3Å; I205-F207 PolarHBondContact O-N 3.35Å
208K60Low56.9Low170 Ų170116.9 Ų116.974%0.73961%0.61SS**Hα-helixtrans-85.4-19.2178.5-74.5175.5-178.8162.80114E204 I205 N206E204-K208 PolarHBondContact O-N 3.45Å; I205-K208 PolarHBondContact O-N 2.99Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 3.04Å
209T54.3Low54.2Low93 Ų93122.1 Ų122.157%0.57163%0.627SS**Hα-helixtrans-100.9-0-176.932.30000115.1I205 N206 P211I205-T209 PolarHBondContact O-N 3Å; I205-T209 PolarHBondContact O-OG1 3.06Å; N206-T209 PolarHBondContact O-N 3.47Å; T209-P211 WeakPolarHBondContact O-CD 3.33Å
210I42.4Very low51.8Low104 Ų104126.4 Ų126.453%0.53365%0.649SS.*  trans-102.998.9175.2-58.5165.8000109.5N206 T212N206-I210 WeakPolarHBondContact O-CD1 3.21Å; N206-I210 VanDerWaalsContact O-CG1 3.3Å; N206-I210 WeakPolarHBondContact O-CG1 3.18Å; N206-I210 PolarHBondContact O-N 3.34Å; I210-T212 PolarHBondContact O-N 3.4Å
211P39.7Very low49.2Very low106 Ų106128 Ų12869%0.68866%0.663SS**  trans-67.2129.615826.5-25000107.4T209 K213T209-P211 WeakPolarHBondContact O-CD 3.33Å; P211-K213 PolarHBondContact O-N 3.11Å
212T36.8Very low47Very low142 Ų142128.5 Ų128.587%0.87166%0.662SS**SBendtrans-65.174.1173.940.20000110.7I210I210-T212 PolarHBondContact O-N 3.4Å
213K31.4Very low44.7Very low172 Ų172127.8 Ų127.875%0.74866%0.664SS**SBendtrans-162120.2162.1-110.2168.6-175.9-179.20108P211P211-K213 PolarHBondContact O-N 3.11Å
214Y30Very low42.5Very low225 Ų225130.1 Ų130.188%0.88268%0.677SS**  trans8479.7179.2-53-76.3000116.7
215F33.1Very low40.5Very low193 Ų193132.2 Ų132.285%0.84669%0.686SS**  trans-90.8110.8152.5-134.4-93.6000107.7
216S29.6Very low38.5Very low93 Ų93132.6 Ų132.665%0.6569%0.689SS**  trans-118.9128.4163.5-179.90000108.2S218S216-S218 PolarHBondContact O-N 3.16Å
217P32.8Very low37Very low120 Ų120133.4 Ų133.478%0.77969%0.693SS**SBendtrans-87.378.5-169.435.3-32.4000110.1
218S27.4Very low35.7Very low91 Ų91127.1 Ų127.164%0.63668%0.679SS**  trans-16287.1164.551.50000111.2S216S216-S218 PolarHBondContact O-N 3.16Å
219K29.2Very low34.5Very low169 Ų169127.3 Ų127.374%0.73568%0.68SS**  trans172.168.7153.6-94.8157.4-175.3-173.20110.3I222K219-I222 HydrophobicContact CB-CD1 4.43Å; K219-I222 HydrophobicContact CD-CD1 3.8Å; K219-I222 HydrophobicContact CG-CD1 3.83Å; K219-I222 HydrophobicContact CG-CG1 4.4Å
220I34.7Very low33.5Very low159 Ų159128.1 Ų128.182%0.81568%0.677SS**SBendtrans-81-6.6168.5-71.5173000111.3
221T31.2Very low33.2Very low132 Ų132129.2 Ų129.281%0.8168%0.683SS**SBendtrans-96.4-0.9-171.7-28.60000115.2
222I36.1Very low32.8Very low81 Ų81130.7 Ų130.742%0.41569%0.685SS.*SBendtrans-98.4-10.1-177.6-60.5179.4000112.8K219 N224 Q225 L226K219-I222 HydrophobicContact CB-CD1 4.43Å; K219-I222 HydrophobicContact CD-CD1 3.8Å; K219-I222 HydrophobicContact CG-CD1 3.83Å; K219-I222 HydrophobicContact CG-CG1 4.4Å; I222-N224 VanDerWaalsContact C-N 3.29Å; I222-N224 PolarHBondContact O-N 2.97Å; I222-Q225 PolarHBondContact O-N 3.42Å; I222-L226 HydrophobicContact CG2-CD1 4.28Å
223S32.5Very low32.4Very low71 Ų71126.6 Ų126.650%0.49766%0.663SS.*Hα-helixtrans-65.5-28.5-177.764.20000113.6L227S223-L227 WeakPolarHBondContact O-CB 3.49Å; S223-L227 PolarHBondContact O-N 3.44Å
224N33.4Very low32.4Very low129 Ų129124.8 Ų124.869%0.6966%0.661SS**Hα-helixtrans-79.5-20.7-176-72.1-15.6000114.5I222I222-N224 VanDerWaalsContact C-N 3.29Å; I222-N224 PolarHBondContact O-N 2.97Å
225Q33.8Very low32.5Very low166 Ų166120.8 Ų120.878%0.77665%0.653SS**Hα-helixtrans-88.8-26.5176.4-80.4-175.2-2400113.2I222I222-Q225 PolarHBondContact O-N 3.42Å
226L33.4Very low32.2Very low101 Ų101120.7 Ų120.753%0.52965%0.653SS.*Hα-helixtrans-77.7-28.1172-92.9153.9000112.5I222 G228 K229 H230I222-L226 HydrophobicContact CG2-CD1 4.28Å; L226-G228 VanDerWaalsContact C-N 3.26Å; L226-G228 PolarHBondContact O-N 3.39Å; L226-K229 PolarHBondContact O-N 2.83Å; L226-H230 PolarHBondContact O-N 3.23Å
227L36.7Very low32.3Very low104 Ų104124.5 Ų124.555%0.54566%0.66SS.*Hα-helixtrans-59.2-35.8178.4-147.373.3000112.6S223 L231S223-L227 WeakPolarHBondContact O-CB 3.49Å; S223-L227 PolarHBondContact O-N 3.44Å; L227-L231 VanDerWaalsContact O-CD1 3.24Å; L227-L231 WeakPolarHBondContact O-CD1 3.36Å; L227-L231 WeakPolarHBondContact O-CG 3.39Å
228G32Very low32.1Very low49 Ų49127.7 Ų127.751%0.50566%0.661SS.*Hα-helixtrans-75.2-25.2179.500000115L226L226-G228 VanDerWaalsContact C-N 3.26Å; L226-G228 PolarHBondContact O-N 3.39Å
229K33.1Very low32Very low174 Ų174133.2 Ų133.276%0.75767%0.668SS**Hα-helixtrans-91.8-30.8-178.4-80.5-176.8175.9179.60113.3L226 L231L226-K229 PolarHBondContact O-N 2.83Å; K229-L231 VanDerWaalsContact C-N 3.34Å
230H33.2Very low31.9Very low110 Ų110129.5 Ų129.551%0.50966%0.663SS.*Hα-helixtrans-74.9-21.1174.6-101.8-72.4000114L226 N232 S233L226-H230 PolarHBondContact O-N 3.23Å; H230-N232 PolarHBondContact O-N 3.05Å; H230-S233 PolarHBondContact ND1-OG 3.32Å; H230-S233 PolarHBondContact O-N 2.94Å
231L36.5Very low31.5Very low127 Ų127128.8 Ų128.867%0.66566%0.661SS**THydrogen-bonded Turntrans-64.1-16.5175.1-87161.7000114.3L227 K229L227-L231 VanDerWaalsContact O-CD1 3.24Å; L227-L231 WeakPolarHBondContact O-CD1 3.36Å; L227-L231 WeakPolarHBondContact O-CG 3.39Å; K229-L231 VanDerWaalsContact C-N 3.34Å
232N31.1Very low31.2Very low136 Ų136128.6 Ų128.673%0.72765%0.654SS**THydrogen-bonded Turntrans-110.5-6.1177.2-85.7-15.9000114.3H230H230-N232 PolarHBondContact O-N 3.05Å
233S29.8Very low30.7Very low57 Ų57131.4 Ų131.440%0.39968%0.676SS.*THydrogen-bonded Turntrans-107.7-4.6-173.764.20000115.4H230 I235H230-S233 PolarHBondContact ND1-OG 3.32Å; H230-S233 PolarHBondContact O-N 2.94Å; S233-I235 PolarHBondContact O-N 3.5Å; S233-I235 VanDerWaalsContact O-N 3.13Å
234D31.5Very low30.4Very low134 Ų134133.4 Ų133.472%0.71769%0.689SS**SBendtrans-75.510.3169.2-76.2-17.3000113.3
235I30.6Very low30.1Very low140 Ų140136.4 Ų136.472%0.71870%0.698SS**  trans-100.259.8163.9-47.5176.7000108.7S233S233-I235 PolarHBondContact O-N 3.5Å; S233-I235 VanDerWaalsContact O-N 3.13Å
236K27.4Very low29.8Very low191 Ų191133.7 Ų133.783%0.8370%0.698SS**SBendtrans-129102.2151.3-89.2-174.8179.4176.70107.3K238K236-K238 PolarHBondContact O-N 2.94Å; K236-K238 VanDerWaalsContact O-N 3.16Å
237H32.5Very low29.4Very low174 Ų174136.2 Ų136.281%0.80671%0.711SS**  trans-32.5120165-97.5-83000110.8R239H237-R239 PolarHBondContact O-N 2.99Å
238K28.3Very low28.8Very low186 Ų186140.6 Ų140.681%0.80973%0.731SS**  trans-62.584.4147.2-158.9177-171-178.60105.9K236 C240K236-K238 PolarHBondContact O-N 2.94Å; K236-K238 VanDerWaalsContact O-N 3.16Å; K238-C240 PolarHBondContact O-N 3Å
239R25.1Very low28.5Very low207 Ų207143.2 Ų143.278%0.78174%0.742SS**  trans-78.266.7166.5-163.7-176.9-150.51736.2106.9H237H237-R239 PolarHBondContact O-N 2.99Å
240C27.1Very low28.2Very low92 Ų92141.8 Ų141.862%0.62275%0.747SS**  trans-97.5137.4151-93.60000105.1K238K238-C240 PolarHBondContact O-N 3Å
241D26.6Very low27.7Very low144 Ų144142.6 Ų142.677%0.7777%0.765SS**SBendtrans90.957.7178.5-46.5-20.5000115.1
242D25.2Very low27.3Very low127 Ų127145.6 Ų145.668%0.67977%0.773SS**SBendtrans-147.121.6152-92.2-27.4000112.2
243T26.2Very low26.9Very low140 Ų140146.4 Ų146.486%0.85978%0.777SS**SBendtrans-126.133.9175.7-27.10000111.6
244C26.2Very low26.8Very low114 Ų114149.2 Ų149.277%0.7779%0.791SS**SBendtrans-138.337.5177.3-129.50000112.3
245Q26.6Very low26.4Very low192 Ų192150.6 Ų150.690%0.89779%0.793SS**SBendtrans-131.616.9174.2-94-173.8-000114.8
246S26.6Very low26.1Very low108 Ų108150.8 Ų150.876%0.75580%0.796SS**SBendtrans-107.214167.871.70000114.3
247L25.5Very low25.9Very low155 Ų155146.6 Ų146.681%0.81279%0.786SS**SBendtrans-123.914.4-174.4-95.5158.1000115.8
248M24.9Very low25.4Very low196 Ų196148 Ų14897%0.96679%0.786SS**SBendtrans-124.253.2174.7-75.5-164.4-16700113.2
249S24.4Very low25.4Very low104 Ų104145.8 Ų145.873%0.72778%0.783SS**SBendtrans-144.950.7168.969.50000113.2
250T26.3Very low25.5Very low143 Ų143142.8 Ų142.888%0.87779%0.788SS**  trans-159.48415937.30000109.7
251S24.2Very low25.4Very low127 Ų127142.9 Ų142.989%0.88879%0.79SS**  trans-128.879.3152.172.70000108.3
252K26.3Very low25.5Very low191 Ų191143.1 Ų143.183%0.8379%0.791SS**  trans-109.6130.6158.7-86-171.4176.8-178.90107.8
253L24.4Very low25.7Very low152 Ų152146 Ų14680%0.79680%0.8SS**  trans78118152.4-94.281.1000120.4
254V26.9Very low25.9Very low117 Ų117148.2 Ų148.271%0.70980%0.801SS**  95.3124.6118.1169.20000119.5
255Q22.1Very low26Very low163 Ų163153 Ų15376%0.76280%0.803SS**  trans-41130.5160.3-69.1153.4-64.900113.4
256N24.7Very low26.2Very low143 Ų143148.5 Ų148.577%0.76579%0.791SS**  173.7121.6113.1-89.4-16.8000111.4
257T23Very low26.5Very low103 Ų103148 Ų14863%0.63279%0.787SS**  40.8130.4128.81.80000122.5
258Y23.4Very low26.7Very low203 Ų203146.4 Ų146.480%0.79678%0.779SS**  trans66.1106.9155.6-65.8-73.7000118.6
259D26.8Very low27.2Very low141 Ų141144 Ų14475%0.75477%0.766SS**  173.4116.891.7-102.5-25000111.2S261D259-S261 PolarHBondContact O-N 3.05Å
260T27Very low27.6Very low143 Ų143147.5 Ų147.588%0.87777%0.768SS**  trans-8094.1171.933.20000109.7
261S25.6Very low27.9Very low95 Ų95145.2 Ų145.266%0.66475%0.754SS**SBendtrans-179.762.7156.347.70000111.9D259D259-S261 PolarHBondContact O-N 3.05Å
262N28.4Very low28.1Very low148 Ų148144.3 Ų144.379%0.79174%0.739SS**  trans-164.716.5163.6-99.4-31.9000115.5
263Q30.1Very low28.3Very low187 Ų187145.5 Ų145.587%0.87474%0.738SS**THydrogen-bonded Turntrans-96.45.8-169.4-124.9169.8-9.600115.9
264E31.2Very low28.7Very low188 Ų188145.4 Ų145.488%0.87974%0.738SS**THydrogen-bonded Turntrans-101.2-1.4175.6-79.9-174.1152.800114.6
265R28.7Very low28.8Very low213 Ų213143.3 Ų143.380%0.80473%0.728SS**SBendtrans-107.1-3.5-176.3-149173.5-88.9175-6.1115.3
266C30.8Very low29.1Very low98 Ų98141.8 Ų141.866%0.66273%0.726SS**SBendtrans-107.5-4.3-177.3-150.10000114.6
267C31.7Very low29.4Very low98 Ų98142.1 Ų142.166%0.66273%0.727SS**SBendtrans-91.1-7176.7-82.90000114.8T271C267-T271 PolarHBondContact O-OG1 2.87Å
268N30.6Very low29.5Very low121 Ų121143 Ų14365%0.64774%0.736SS**SBendtrans-103.9-5-180-80.4-13.8000115
269E34.1Very low29.6Very low147 Ų147141.9 Ų141.969%0.68774%0.738SS**SBendtrans-97.3-12.8178.7-79.2-172.5148.200114.8
270K33.1Very low29.6Very low176 Ų176142.4 Ų142.477%0.76574%0.741SS**SBendtrans-92.1-17.5174.4-88.4178.4177174.10114.1
271T32.7Very low29.6Very low95 Ų95145.8 Ų145.858%0.58374%0.743SS**SBendtrans-85.3-23.5179-32.10000112.2C267C267-T271 PolarHBondContact O-OG1 2.87Å
272N29.6Very low29.7Very low108 Ų108148.5 Ų148.558%0.57875%0.751SS**THydrogen-bonded Turntrans-88.1-6.6177.3-78.8-9.1000115
273R30.6Very low29.4Very low216 Ų216151.1 Ų151.182%0.81576%0.755SS**THydrogen-bonded Turntrans-92.5-7.1172.9-74.8-170.6-176-175.93114
274L31.2Very low29.3Very low151 Ų151148.6 Ų148.679%0.79175%0.753SS**SBendtrans-104.8-12.6177.9-94.2140.1000113.6
275S29.8Very low29.1Very low73 Ų73148.1 Ų148.151%0.5175%0.751SS.*SBendtrans-95.4-10.417674.80000114.8
276N29Very low29Very low131 Ų131145 Ų14570%0.70175%0.75SS**THydrogen-bonded Turntrans-97.816.5-175.1-76.62.7000114.9
277N29.4Very low28.9Very low150 Ų150146.6 Ų146.680%0.80275%0.752SS**THydrogen-bonded Turntrans-116.414.3175.8-87.7-5.5000113.6
278C26Very low28.6Very low120 Ų120150 Ų15081%0.81176%0.764SS**SBendtrans-116.417.8-177.2-83.40000115
279Q26.3Very low28.4Very low180 Ų180153.1 Ų153.184%0.84177%0.771SS**SBendtrans-132.2140.5168-73.4-178.7-56.300108.8
280D25.3Very low28Very low153 Ų153148.9 Ų148.982%0.81877%0.767SS**  trans81.589-178.2-53.2-19.5000116.1
281K28.4Very low27.6Very low213 Ų213149.1 Ų149.193%0.92677%0.773SS**  -157.7112.9126.6-105.2165-167.4-176.20110.6
282D26.4Very low27.2Very low153 Ų153150.2 Ų150.282%0.81878%0.78SS**  trans-53.7156.2176.3-73.7-52.8000114.3T284D282-T284 PolarHBondContact O-N 2.94Å
283F23.7Very low27.1Very low202 Ų202152.3 Ų152.389%0.88679%0.79SS**  trans-38.5117.8164.9-88.9-105.7000113.5
284T27.6Very low26.9Very low134 Ų134149.7 Ų149.782%0.82279%0.787SS**  trans-140.8108.8142.647.80000108.3D282 N286D282-T284 PolarHBondContact O-N 2.94Å; T284-N286 PolarHBondContact O-N 3.45Å
285E26.4Very low27Very low179 Ų179147 Ų14784%0.83678%0.779SS**  trans-52122.6156-79.3174.2132.900108.3
286N26Very low27.5Very low148 Ų148150.7 Ų150.779%0.79179%0.792SS**  trans-169.7129.2145.8-93.9-26.4000111T284T284-N286 PolarHBondContact O-N 3.45Å
287D28.8Very low28.3Very low130 Ų130153.4 Ų153.470%0.69580%0.798SS**  trans63.288.6156.9-64.1-20.3000119K289D287-K289 PolarHBondContact O-N 3.19Å
288D25.1Very low29.5Very low171 Ų171150.4 Ų150.491%0.91479%0.785SS**  trans-54.269.7153.7-145.24.3000111.4G290D288-G290 PolarHBondContact O-N 3.22Å
289K27.7Very low31.6Very low185 Ų185148.8 Ų148.880%0.80477%0.768SS**  trans-83.695.3163.5-84.7-177.6-180170.20108.1D287 M291D287-K289 PolarHBondContact O-N 3.19Å; K289-M291 PolarHBondContact O-N 2.78Å
290G25.8Very low33.8Very low59 Ų59143.7 Ų143.761%0.60875%0.746SS**  trans-38.1112.4175.700000112.4D288 T292D288-G290 PolarHBondContact O-N 3.22Å; G290-T292 PolarHBondContact O-N 3.36Å
291M24.2Very low36.4Very low180 Ų180142.4 Ų142.489%0.88774%0.738SS**  trans-68.984.4166.8-170.1156.879.200107.4K289 I293K289-M291 PolarHBondContact O-N 2.78Å; M291-I293 PolarHBondContact O-N 2.81Å
292T23.6Very low38.9Very low118 Ų118136.3 Ų136.372%0.72471%0.714SS**  trans-56106168.844.40000107.7G290 Q294G290-T292 PolarHBondContact O-N 3.36Å; T292-Q294 PolarHBondContact O-N 3.06Å
293I28.3Very low41.4Very low152 Ų152132.3 Ų132.378%0.77969%0.691SS**  trans-60.993.5162.5-61.1171.2000105M291 P295M291-I293 PolarHBondContact O-N 2.81Å; I293-P295 VanDerWaalsContact O-CD 3.25Å; I293-P295 WeakPolarHBondContact O-CD 3.28Å; I293-P295 VanDerWaalsContact O-N 3.15Å
294Q25.3Very low44.3Very low162 Ų162125.3 Ų125.376%0.75766%0.662SS**  trans-61.6118.1167.7-78.9-139.25.600106.4T292 N296T292-Q294 PolarHBondContact O-N 3.06Å; Q294-N296 PolarHBondContact O-N 2.84Å
295P33.5Very low47.1Very low95 Ų95121.1 Ų121.162%0.61764%0.638SS**  trans-61.4120.4169.326.8-29.7000104.7I293 K297I293-P295 VanDerWaalsContact O-CD 3.25Å; I293-P295 WeakPolarHBondContact O-CD 3.28Å; I293-P295 VanDerWaalsContact O-N 3.15Å; P295-K297 PolarHBondContact O-N 3.33Å
296N41Very low49.9Very low149 Ų149118.2 Ų118.280%0.79762%0.623SS**  trans-57.287167.2-107.6-13.9000106.3Q294 V298Q294-N296 PolarHBondContact O-N 2.84Å; N296-V298 PolarHBondContact O-N 2.63Å
297K45.7Very low52.8Low189 Ų189111.2 Ų111.282%0.82259%0.585SS**  trans-66.488.9167.2-84.4-175.2176.31790103.8P295 N299P295-K297 PolarHBondContact O-N 3.33Å; K297-N299 PolarHBondContact O-N 3.04Å
298V54.8Low55.6Low87 Ų87108.4 Ų108.453%0.52757%0.567SS.*  trans-58.894.8166.6176.70000105.1N296 I300 Q303N296-V298 PolarHBondContact O-N 2.63Å; V298-I300 PolarHBondContact O-N 2.95Å; V298-Q303 HydrophobicContact CG1-CB 4.36Å
299N69.8Low58.7Low86 Ų86109.8 Ų109.846%0.4656%0.559SS.*  trans-71.9102.8179.4-166.3-10.8000105.3K297 I301 I302 Q303K297-N299 PolarHBondContact O-N 3.04Å; N299-I301 PolarHBondContact O-N 3Å; N299-I302 HydrophobicContact CB-CB 4.13Å; N299-I302 HydrophobicContact CB-CD1 3.69Å; N299-I302 HydrophobicContact CB-CG1 3.78Å; N299-I302 WeakPolarHBondContact O-CA 3.3Å; N299-I302 WeakPolarHBondContact O-CB 3.22Å; N299-I302 PolarHBondContact O-N 3.43Å; N299-Q303 PolarHBondContact O-N 2.98Å
300I73.1Confident61.6Low73 Ų73104.7 Ų104.737%0.37454%0.544SS..Hα-helixtrans-47.3-41-173.2-59.5153.5000110.6I69 V298 I302 Q303 I304I69-I300 HydrophobicContact CD1-CD1 3.3Å; I69-I300 HydrophobicContact CD1-CG1 3.88Å; I69-I300 HydrophobicContact CG1-CD1 4.38Å; I69-I300 HydrophobicContact CG1-CG1 4.49Å; V298-I300 PolarHBondContact O-N 2.95Å; I300-I302 VanDerWaalsContact C-N 3.34Å; I300-I302 PolarHBondContact O-N 3.41Å; I300-Q303 PolarHBondContact O-N 3.21Å; I300-Q303 VanDerWaalsContact O-N 3.16Å; I300-I304 HydrophobicContact CG2-CD1 3.8Å; I300-I304 HydrophobicContact CG2-CG1 4.38Å; I300-I304 WeakPolarHBondContact O-CG1 3.37Å; I300-I304 PolarHBondContact O-N 3.44Å
301I79Confident64.6Low125 Ų125102 Ų10264%0.64152%0.516SS*.Hα-helixtrans-60.8-43.5178.3-60.1173.8000111N299 Q303 S305N299-I301 PolarHBondContact O-N 3Å; I301-Q303 VanDerWaalsContact C-N 3.35Å; I301-S305 VanDerWaalsContact O-CB 3.24Å; I301-S305 WeakPolarHBondContact O-CB 3.32Å; I301-S305 PolarHBondContact O-N 3.13Å
302I81.6Confident67.8Low85 Ų8596.3 Ų96.344%0.43649%0.493SS..Hα-helixtrans-65.6-40.4176.6-60.4-178.1000110.2N299 I300 S305 K306N299-I302 HydrophobicContact CB-CB 4.13Å; N299-I302 HydrophobicContact CB-CD1 3.69Å; N299-I302 HydrophobicContact CB-CG1 3.78Å; N299-I302 WeakPolarHBondContact O-CA 3.3Å; N299-I302 WeakPolarHBondContact O-CB 3.22Å; N299-I302 PolarHBondContact O-N 3.43Å; I300-I302 VanDerWaalsContact C-N 3.34Å; I300-I302 PolarHBondContact O-N 3.41Å; I302-S305 PolarHBondContact O-N 3.31Å; I302-K306 HydrophobicContact CG2-CD 4.21Å; I302-K306 HydrophobicContact CG2-CG 4.4Å; I302-K306 WeakPolarHBondContact O-CB 3.46Å; I302-K306 VanDerWaalsContact O-CG 3.31Å; I302-K306 WeakPolarHBondContact O-CG 3.38Å; I302-K306 PolarHBondContact O-N 3.4Å
303Q79.6Confident70.9Confident69 Ų6996.5 Ų96.532%0.32249%0.489SS..Hα-helixtrans-66.9-43.7179.7-162.9175.213.900111.9V298 N299 I300 I301 K306 L307 T457V298-Q303 HydrophobicContact CG1-CB 4.36Å; N299-Q303 PolarHBondContact O-N 2.98Å; I300-Q303 PolarHBondContact O-N 3.21Å; I300-Q303 VanDerWaalsContact O-N 3.16Å; I301-Q303 VanDerWaalsContact C-N 3.35Å; Q303-K306 PolarHBondContact O-N 3.31Å; Q303-L307 PolarHBondContact O-N 3.34Å; Q303-T457 HydrophobicContact CG-CG2 4.45Å; Q303-T457 PolarHBondContact NE2-OG1 2.92Å
304I82.6Confident73.8Confident56 Ų5696.7 Ų96.729%0.28748%0.48SS..Hα-helixtrans-61.3-46.6173-67.8171.3000110.1I300 K306 L307 F308 T457I300-I304 HydrophobicContact CG2-CD1 3.8Å; I300-I304 HydrophobicContact CG2-CG1 4.38Å; I300-I304 WeakPolarHBondContact O-CG1 3.37Å; I300-I304 PolarHBondContact O-N 3.44Å; I304-K306 VanDerWaalsContact C-N 3.32Å; I304-K306 PolarHBondContact O-N 3.44Å; I304-L307 WeakPolarHBondContact O-CB 3.46Å; I304-L307 PolarHBondContact O-N 3.07Å; I304-F308 HydrophobicContact CG2-CD2 3.67Å; I304-F308 HydrophobicContact CG2-CE2 3.63Å; I304-F308 VanDerWaalsContact O-CD2 3.3Å; I304-F308 WeakPolarHBondContact O-CD2 3.48Å; I304-F308 PolarHBondContact O-N 3.27Å; I304-T457 HydrophobicContact CG1-CG2 4.15Å
305S86.4Confident76.9Confident46 Ų4692.8 Ų92.832%0.32246%0.462SS..Hα-helixtrans-59.5-42.8178.1-170.20000111.9I301 I302 F308 R309I301-S305 VanDerWaalsContact O-CB 3.24Å; I301-S305 WeakPolarHBondContact O-CB 3.32Å; I301-S305 PolarHBondContact O-N 3.13Å; I302-S305 PolarHBondContact O-N 3.31Å; S305-F308 PolarHBondContact O-N 3.04Å; S305-R309 WeakPolarHBondContact O-CB 3.3Å; S305-R309 VanDerWaalsContact O-CG 3.31Å; S305-R309 WeakPolarHBondContact O-CG 3.25Å; S305-R309 PolarHBondContact O-N 3.47Å
306K87Confident79.7Confident118 Ų11892.6 Ų92.651%0.51345%0.449SS..Hα-helixtrans-62.2-43.7175.1-77.7179.1178.9-1770112.1I302 Q303 I304 R309 T310 F454I302-K306 HydrophobicContact CG2-CD 4.21Å; I302-K306 HydrophobicContact CG2-CG 4.4Å; I302-K306 WeakPolarHBondContact O-CB 3.46Å; I302-K306 VanDerWaalsContact O-CG 3.31Å; I302-K306 WeakPolarHBondContact O-CG 3.38Å; I302-K306 PolarHBondContact O-N 3.4Å; Q303-K306 PolarHBondContact O-N 3.31Å; I304-K306 VanDerWaalsContact C-N 3.32Å; I304-K306 PolarHBondContact O-N 3.44Å; K306-R309 PolarHBondContact O-N 3.12Å; K306-T310 WeakPolarHBondContact O-CB 3.33Å; K306-T310 PolarHBondContact O-N 3.27Å; K306-T310 PolarHBondContact O-OG1 3.09Å; K306-F454 HydrophobicContact CB-CE1 4.04Å; K306-F454 HydrophobicContact CB-CZ 4.19Å
307L86.8Confident82.2Confident1 Ų190.2 Ų90.21%0.00544%0.436CS..Hα-helixtrans-56.6-54.2174.9168.565.4000110.5Q303 I304 R309 T310 L311 A450 F454 T457 A458Q303-L307 PolarHBondContact O-N 3.34Å; I304-L307 WeakPolarHBondContact O-CB 3.46Å; I304-L307 PolarHBondContact O-N 3.07Å; L307-R309 VanDerWaalsContact C-N 3.34Å; L307-R309 PolarHBondContact O-N 3.3Å; L307-T310 PolarHBondContact O-N 3.3Å; L307-T310 VanDerWaalsContact O-N 3.11Å; L307-L311 HydrophobicContact CD1-CD1 3.73Å; L307-L311 HydrophobicContact CD1-CG 3.99Å; L307-L311 HydrophobicContact CG-CD1 4.05Å; L307-L311 WeakPolarHBondContact O-CG 3.33Å; L307-L311 PolarHBondContact O-N 2.81Å; L307-L311 VanDerWaalsContact O-N 3.07Å; L307-A450 HydrophobicContact CD1-CB 3.95Å; L307-F454 HydrophobicContact CB-CB 4.38Å; L307-F454 HydrophobicContact CB-CD1 4.37Å; L307-F454 HydrophobicContact CB-CG 4.39Å; L307-F454 HydrophobicContact CD1-CB 3.62Å; L307-F454 HydrophobicContact CD1-CG 4.23Å; L307-F454 HydrophobicContact CG-CB 4.49Å; L307-T457 HydrophobicContact CD2-CG2 4.03Å; L307-A458 HydrophobicContact CD2-CB 4.16Å
308F87.9Confident84.4Confident70 Ų7081.9 Ų81.931%0.30740%0.4SS..Hα-helixtrans-60-44.4-179.5-82-75.8000111.3I304 S305 T310 L311 R316 L461I304-F308 HydrophobicContact CG2-CD2 3.67Å; I304-F308 HydrophobicContact CG2-CE2 3.63Å; I304-F308 VanDerWaalsContact O-CD2 3.3Å; I304-F308 WeakPolarHBondContact O-CD2 3.48Å; I304-F308 PolarHBondContact O-N 3.27Å; S305-F308 PolarHBondContact O-N 3.04Å; F308-T310 VanDerWaalsContact C-N 3.26Å; F308-T310 PolarHBondContact O-N 3.5Å; F308-L311 PolarHBondContact O-N 3.46Å; F308-R316 HydrophobicContact CD1-CB 4.49Å; F308-R316 HydrophobicContact CD1-CG 3.97Å; F308-R316 PolarHBondContact O-NE 2.97Å; F308-R316 PolarHBondContact O-NH2 3.39Å; F308-L461 HydrophobicContact CE2-CD2 3.89Å; F308-L461 HydrophobicContact CZ-CD2 3.74Å
309R89.7Confident86.2Confident200 Ų20077.9 Ų77.976%0.75538%0.376SS*.Hα-helixtrans-59.9-34.5176.9-74178.3-175.7-155.20.2113.4S305 K306 L307S305-R309 WeakPolarHBondContact O-CB 3.3Å; S305-R309 VanDerWaalsContact O-CG 3.31Å; S305-R309 WeakPolarHBondContact O-CG 3.25Å; S305-R309 PolarHBondContact O-N 3.47Å; K306-R309 PolarHBondContact O-N 3.12Å; L307-R309 VanDerWaalsContact C-N 3.34Å; L307-R309 PolarHBondContact O-N 3.3Å
310T89Confident87.3Confident79 Ų7975.9 Ų75.949%0.48538%0.375SS..Hα-helixtrans-75.4-33.4-179.7-50.50000112.3K306 L307 F308 P451 F454K306-T310 WeakPolarHBondContact O-CB 3.33Å; K306-T310 PolarHBondContact O-N 3.27Å; K306-T310 PolarHBondContact O-OG1 3.09Å; L307-T310 PolarHBondContact O-N 3.3Å; L307-T310 VanDerWaalsContact O-N 3.11Å; F308-T310 VanDerWaalsContact C-N 3.26Å; F308-T310 PolarHBondContact O-N 3.5Å; T310-P451 HydrophobicContact CG2-CG 4.1Å; T310-F454 HydrophobicContact CG2-CE2 4.39Å
311L88.2Confident88.3Confident3 Ų373.1 Ų73.12%0.01636%0.363CS..SBendtrans-76.5139.5179.9-67.8174.6000111.8L307 F308 Q315 R316 L319L307-L311 HydrophobicContact CD1-CD1 3.73Å; L307-L311 HydrophobicContact CD1-CG 3.99Å; L307-L311 HydrophobicContact CG-CD1 4.05Å; L307-L311 WeakPolarHBondContact O-CG 3.33Å; L307-L311 PolarHBondContact O-N 2.81Å; L307-L311 VanDerWaalsContact O-N 3.07Å; F308-L311 PolarHBondContact O-N 3.46Å; L311-Q315 HydrophobicContact CB-CB 4.16Å; L311-Q315 HydrophobicContact CD2-CB 3.97Å; L311-R316 HydrophobicContact CB-CG 3.78Å; L311-R316 VanDerWaalsContact O-CZ 3.31Å; L311-R316 PolarHBondContact O-NE 3.4Å; L311-R316 PolarHBondContact O-NH2 3.44Å; L311-L319 HydrophobicContact CD1-CD2 4.11Å
312S90.3Very high89.1Confident59 Ų5967.2 Ų67.241%0.41333%0.332SS..  trans-64.4157.7167.5650000111.4R314 Q315 R316S312-R314 PolarHBondContact O-N 2.97Å; S312-Q315 PolarHBondContact O-N 3.28Å; S312-Q315 VanDerWaalsContact O-N 3.07Å; S312-Q315 WeakPolarHBondContact OG-CG 3.42Å; S312-Q315 PolarHBondContact OG-N 3Å; S312-Q315 PolarHBondContact OG-OE1 2.74Å; S312-R316 WeakPolarHBondContact O-CG 3.41Å; S312-R316 PolarHBondContact O-N 2.94Å
313L90.2Very high89.7Confident123 Ų12363.6 Ų63.664%0.64432%0.315SS*.Hα-helixtrans-53.5-42.1178.1-176.566.7000112.1Q315 R316 L317L313-Q315 PolarHBondContact O-N 2.84Å; L313-R316 PolarHBondContact O-N 3.42Å; L313-L317 HydrophobicContact CG-CD1 4.27Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 3.3Å
314R89.6Confident90.5Very high156 Ų15661.5 Ų61.559%0.58931%0.312SS*.Hα-helixtrans-61.9-43.4178.2-164.6178.6-179.6-174.2-2.8112S312 L317 L318 F507S312-R314 PolarHBondContact O-N 2.97Å; R314-L317 PolarHBondContact O-N 3.39Å; R314-L318 WeakPolarHBondContact O-CB 3.34Å; R314-L318 PolarHBondContact O-N 3.12Å; R314-F507 HydrophobicContact CG-CD1 3.89Å; R314-F507 HydrophobicContact CG-CE1 3.59Å; R314-F507 WeakPolarHBondContact O-CE1 3.47Å
315Q89.5Confident91.2Very high79 Ų7958.9 Ų58.937%0.36930%0.299SS..Hα-helixtrans-67.7-37176.5-72.4165.5-46.700112.5L311 S312 L313 L318 L319L311-Q315 HydrophobicContact CB-CB 4.16Å; L311-Q315 HydrophobicContact CD2-CB 3.97Å; S312-Q315 PolarHBondContact O-N 3.28Å; S312-Q315 VanDerWaalsContact O-N 3.07Å; S312-Q315 WeakPolarHBondContact OG-CG 3.42Å; S312-Q315 PolarHBondContact OG-N 3Å; S312-Q315 PolarHBondContact OG-OE1 2.74Å; L313-Q315 PolarHBondContact O-N 2.84Å; Q315-L318 PolarHBondContact O-N 3.03Å; Q315-L319 WeakPolarHBondContact O-CB 3.18Å; Q315-L319 PolarHBondContact O-N 2.68Å
316R92.3Very high91.7Very high91 Ų9157.1 Ų57.134%0.34329%0.285SS..Hα-helixtrans-62.3-46.4175.5-64.8174.2-163.8176.44.4111.2F308 L311 S312 L313 L319 G320F308-R316 HydrophobicContact CD1-CB 4.49Å; F308-R316 HydrophobicContact CD1-CG 3.97Å; F308-R316 PolarHBondContact O-NE 2.97Å; F308-R316 PolarHBondContact O-NH2 3.39Å; L311-R316 HydrophobicContact CB-CG 3.78Å; L311-R316 VanDerWaalsContact O-CZ 3.31Å; L311-R316 PolarHBondContact O-NE 3.4Å; L311-R316 PolarHBondContact O-NH2 3.44Å; S312-R316 WeakPolarHBondContact O-CG 3.41Å; S312-R316 PolarHBondContact O-N 2.94Å; L313-R316 PolarHBondContact O-N 3.42Å; R316-L319 PolarHBondContact O-N 3.31Å; R316-G320 PolarHBondContact O-N 2.65Å
317L93.2Very high92.2Very high99 Ų9954.4 Ų54.452%0.51828%0.275SS..Hα-helixtrans-63.2-43.8177.7-69.1171.7000111.1L313 R314 G320 S321 F507L313-L317 HydrophobicContact CG-CD1 4.27Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 3.3Å; R314-L317 PolarHBondContact O-N 3.39Å; L317-G320 PolarHBondContact O-N 2.99Å; L317-S321 PolarHBondContact O-N 2.77Å; L317-S321 PolarHBondContact O-OG 3.21Å; L317-F507 HydrophobicContact CB-CE1 4.25Å; L317-F507 HydrophobicContact CB-CZ 3.61Å
318L92.8Very high92.7Very high14 Ų1455 Ų557%0.07328%0.28CS..Hα-helixtrans-62.5-41.6176.8-17953.5000112.8R314 Q315 G320 S321 S322 I394 L449 L504 F507R314-L318 WeakPolarHBondContact O-CB 3.34Å; R314-L318 PolarHBondContact O-N 3.12Å; Q315-L318 PolarHBondContact O-N 3.03Å; L318-G320 VanDerWaalsContact C-N 3.33Å; L318-S321 WeakPolarHBondContact CA-OG 3.43Å; L318-S321 PolarHBondContact O-OG 2.88Å; L318-S322 VanDerWaalsContact O-CB 3.25Å; L318-S322 WeakPolarHBondContact O-CB 3.36Å; L318-S322 PolarHBondContact O-N 3.16Å; L318-I394 HydrophobicContact CD1-CD1 3.84Å; L318-I394 HydrophobicContact CD2-CD1 4.24Å; L318-L449 HydrophobicContact CD2-CD1 4.43Å; L318-L449 HydrophobicContact CD2-CD2 3.4Å; L318-L449 HydrophobicContact CG-CD1 3.9Å; L318-L449 HydrophobicContact CG-CD2 3.82Å; L318-L504 HydrophobicContact CD1-CD1 3.54Å; L318-F507 HydrophobicContact CB-CD1 3.93Å; L318-F507 HydrophobicContact CB-CE1 3.97Å; L318-F507 HydrophobicContact CB-CG 4.26Å; L318-F507 HydrophobicContact CB-CZ 4.35Å; L318-F507 HydrophobicContact CD1-CB 3.83Å; L318-F507 HydrophobicContact CD1-CD1 4.26Å; L318-F507 HydrophobicContact CD1-CD2 3.97Å; L318-F507 HydrophobicContact CD1-CG 3.76Å; L318-F507 HydrophobicContact CD2-CB 4.47Å; L318-F507 HydrophobicContact CD2-CD1 4.38Å; L318-F507 HydrophobicContact CG-CD1 4.42Å; L318-F507 HydrophobicContact CG-CG 4.4Å
319L91.8Very high93.2Very high4 Ų451.7 Ų51.72%0.02127%0.265CS..Hα-helixtrans-64.3-40.5174.4-17764.4000111L311 Q315 R316 A323 A446 L449 A458L311-L319 HydrophobicContact CD1-CD2 4.11Å; Q315-L319 WeakPolarHBondContact O-CB 3.18Å; Q315-L319 PolarHBondContact O-N 2.68Å; R316-L319 PolarHBondContact O-N 3.31Å; L319-A323 WeakPolarHBondContact O-CB 3.47Å; L319-A323 PolarHBondContact O-N 3.25Å; L319-A446 HydrophobicContact CD1-CB 4.18Å; L319-L449 HydrophobicContact CB-CD1 4.4Å; L319-L449 HydrophobicContact CD1-CD1 4.25Å; L319-A458 HydrophobicContact CD1-CB 4.39Å; L319-A458 HydrophobicContact CD2-CB 4.39Å
320G93.5Very high93.5Very high43 Ų4342.7 Ų42.744%0.44323%0.232SC..Hα-helixtrans-64.2-47.5176.300000113.1R316 L317 L318 A323 G324R316-G320 PolarHBondContact O-N 2.65Å; L317-G320 PolarHBondContact O-N 2.99Å; L318-G320 VanDerWaalsContact C-N 3.33Å; G320-A323 PolarHBondContact O-N 3.15Å; G320-G324 PolarHBondContact O-N 3.36Å
321S94.3Very high94Very high16 Ų1640.3 Ų40.311%0.11222%0.215CC..Hα-helixtrans-66.6-39.5177.244.80000111.8L317 L318 G324 V325L317-S321 PolarHBondContact O-N 2.77Å; L317-S321 PolarHBondContact O-OG 3.21Å; L318-S321 WeakPolarHBondContact CA-OG 3.43Å; L318-S321 PolarHBondContact O-OG 2.88Å; S321-G324 PolarHBondContact O-N 3.14Å; S321-V325 WeakPolarHBondContact O-CG2 3.46Å; S321-V325 PolarHBondContact O-N 3.21Å
322S94.4Very high94.4Very high0 Ų040.1 Ų40.10%021%0.214CC..Hα-helixtrans-61.8-42.7171.8176.20000112.5L318 G324 V325 H326L318-S322 VanDerWaalsContact O-CB 3.25Å; L318-S322 WeakPolarHBondContact O-CB 3.36Å; L318-S322 PolarHBondContact O-N 3.16Å; S322-G324 VanDerWaalsContact C-N 3.3Å; S322-G324 PolarHBondContact O-N 3.27Å; S322-V325 PolarHBondContact O-N 3.46Å; S322-H326 WeakPolarHBondContact O-CB 3.27Å; S322-H326 PolarHBondContact O-N 2.84Å
323A95.1Very high94.8Very high9 Ų938.9 Ų38.97%0.07420%0.201CC..Hα-helixtrans-64.9-33.4176.900000112.6L319 G320 H326 M327 T465L319-A323 WeakPolarHBondContact O-CB 3.47Å; L319-A323 PolarHBondContact O-N 3.25Å; G320-A323 PolarHBondContact O-N 3.15Å; A323-H326 PolarHBondContact O-N 3.26Å; A323-M327 PolarHBondContact O-N 3.27Å; A323-T465 HydrophobicContact CB-CG2 4.22Å; A323-T465 PolarHBondContact O-OG1 3.03Å; A323-T465 VanDerWaalsContact O-OG1 3.1Å
324G96.5Very high95.1Very high26 Ų2636 Ų3627%0.26818%0.182SC..Hα-helixtrans-66.3-45.9172.200000112.7G320 S321 S322 H326 M327 C328G320-G324 PolarHBondContact O-N 3.36Å; S321-G324 PolarHBondContact O-N 3.14Å; S322-G324 VanDerWaalsContact C-N 3.3Å; S322-G324 PolarHBondContact O-N 3.27Å; G324-H326 VanDerWaalsContact C-N 3.29Å; G324-H326 PolarHBondContact O-N 3.34Å; G324-M327 WeakPolarHBondContact O-CB 3.28Å; G324-M327 PolarHBondContact O-N 3.08Å; G324-C328 PolarHBondContact O-N 3.25Å
325V97.1Very high95.4Very high0 Ų028.6 Ų28.60%015%0.154CC..Hα-helixtrans-61.9-39.3173.5176.70000110.9S321 S322 M327 C328 A329 I397 M401 S500 V501 L504S321-V325 WeakPolarHBondContact O-CG2 3.46Å; S321-V325 PolarHBondContact O-N 3.21Å; S322-V325 PolarHBondContact O-N 3.46Å; V325-M327 VanDerWaalsContact C-N 3.33Å; V325-M327 PolarHBondContact O-N 3.05Å; V325-C328 PolarHBondContact O-N 2.75Å; V325-A329 WeakPolarHBondContact O-CB 3.34Å; V325-A329 PolarHBondContact O-N 2.86Å; V325-I397 HydrophobicContact CG1-CG2 3.65Å; V325-M401 HydrophobicContact CG1-CG 3.89Å; V325-M401 HydrophobicContact CG1-SD 4.47Å; V325-S500 VanDerWaalsContact CG2-O 3.24Å; V325-S500 WeakPolarHBondContact CG2-O 3.31Å; V325-V501 HydrophobicContact CG2-CG1 4.46Å; V325-L504 HydrophobicContact CG2-CB 4.19Å; V325-L504 HydrophobicContact CG2-CD2 4.04Å
326H96.8Very high95.8Very high10 Ų1025 Ų255%0.04614%0.137CC..Hα-helixtrans-63-39.1176.7-163.4-173.9000112.3S322 A323 G324 T330 C442 S462S322-H326 WeakPolarHBondContact O-CB 3.27Å; S322-H326 PolarHBondContact O-N 2.84Å; A323-H326 PolarHBondContact O-N 3.26Å; G324-H326 VanDerWaalsContact C-N 3.29Å; G324-H326 PolarHBondContact O-N 3.34Å; H326-T330 VanDerWaalsContact O-CB 3.29Å; H326-T330 WeakPolarHBondContact O-CB 3.49Å; H326-T330 PolarHBondContact O-N 2.71Å; H326-T330 PolarHBondContact O-OG1 3.18Å; H326-C442 HydrophobicContact CB-CB 3.73Å; H326-S462 PolarHBondContact ND1-O 3.35Å; H326-S462 PolarHBondContact ND1-OG 3.35Å
327M97.2Very high95.9Very high60 Ų6021.2 Ų21.230%0.29613%0.126SC..Hα-helixtrans-59.8-49.7171.3-177.1-172.575.100111.4A323 G324 V325 T330 F331 T465 F468 G469A323-M327 PolarHBondContact O-N 3.27Å; G324-M327 WeakPolarHBondContact O-CB 3.28Å; G324-M327 PolarHBondContact O-N 3.08Å; V325-M327 VanDerWaalsContact C-N 3.33Å; V325-M327 PolarHBondContact O-N 3.05Å; M327-T330 PolarHBondContact O-N 2.72Å; M327-F331 WeakPolarHBondContact O-CB 3.33Å; M327-F331 PolarHBondContact O-N 3.43Å; M327-T465 WeakPolarHBondContact CB-O 3.44Å; M327-T465 VanDerWaalsContact CG-O 3.31Å; M327-T465 WeakPolarHBondContact CG-O 3.37Å; M327-F468 HydrophobicContact SD-CB 4.35Å; M327-G469 WeakPolarHBondContact O-CA 3.41Å
328C97.8Very high96Very high15 Ų1517.1 Ų17.110%0.10111%0.105CC..Hα-helixtrans-63.8-43.3178.9-72.10000112.8G324 V325 T330 F331 L332 M401 C497 S500G324-C328 PolarHBondContact O-N 3.25Å; V325-C328 PolarHBondContact O-N 2.75Å; C328-T330 VanDerWaalsContact C-N 3.31Å; C328-T330 PolarHBondContact O-N 3.35Å; C328-F331 WeakPolarHBondContact O-CB 3.3Å; C328-F331 PolarHBondContact O-N 2.97Å; C328-L332 PolarHBondContact O-N 2.67Å; C328-M401 HydrophobicContact CB-CE 4.28Å; C328-C497 HydrophobicContact CB-CB 4.12Å; C328-S500 WeakPolarHBondContact SG-CB 3.48Å
329A97.5Very high96.1Very high0 Ų016.5 Ų16.50%010%0.101CC..Hα-helixtrans-61.8-41.6175.800000111.2V325 L332 R333 M401 V435 A438 I439V325-A329 WeakPolarHBondContact O-CB 3.34Å; V325-A329 PolarHBondContact O-N 2.86Å; A329-L332 PolarHBondContact O-N 3.11Å; A329-R333 PolarHBondContact O-N 3.04Å; A329-M401 HydrophobicContact CB-CE 4.3Å; A329-M401 HydrophobicContact CB-SD 3.74Å; A329-V435 WeakPolarHBondContact O-CG1 3.38Å; A329-A438 HydrophobicContact CB-CB 4.38Å; A329-I439 HydrophobicContact CB-CG1 3.69Å
330T97.3Very high96.2Very high10 Ų1016.3 Ų16.36%0.06110%0.101CC..Hα-helixtrans-69.7-36.6176.9-54.60000112H326 M327 C328 R333 Y334 A466 A470H326-T330 VanDerWaalsContact O-CB 3.29Å; H326-T330 WeakPolarHBondContact O-CB 3.49Å; H326-T330 PolarHBondContact O-N 2.71Å; H326-T330 PolarHBondContact O-OG1 3.18Å; M327-T330 PolarHBondContact O-N 2.72Å; C328-T330 VanDerWaalsContact C-N 3.31Å; C328-T330 PolarHBondContact O-N 3.35Å; T330-R333 WeakPolarHBondContact O-CB 3.21Å; T330-R333 PolarHBondContact O-N 2.89Å; T330-Y334 HydrophobicContact CG2-CD2 3.81Å; T330-Y334 HydrophobicContact CG2-CE2 3.65Å; T330-Y334 VanDerWaalsContact O-CD2 3.28Å; T330-Y334 WeakPolarHBondContact O-CD2 3.34Å; T330-Y334 PolarHBondContact O-N 3.34Å; T330-A466 WeakPolarHBondContact CB-O 3.31Å; T330-A466 HydrophobicContact CG2-CB 4.26Å; T330-A466 WeakPolarHBondContact CG2-O 3.42Å; T330-A466 WeakPolarHBondContact OG1-CB 3.49Å; T330-A470 HydrophobicContact CG2-CB 4.21Å
331F98.2Very high96.2Very high29 Ų2914.8 Ų14.813%0.1279%0.085CC..Hα-helixtrans-57.3-50.9169.8166.7-96.1000111.1M327 C328 R333 Y334 A335 G469 L472 A473 F477 A493M327-F331 WeakPolarHBondContact O-CB 3.33Å; M327-F331 PolarHBondContact O-N 3.43Å; C328-F331 WeakPolarHBondContact O-CB 3.3Å; C328-F331 PolarHBondContact O-N 2.97Å; F331-R333 VanDerWaalsContact C-N 3.26Å; F331-R333 PolarHBondContact O-N 2.78Å; F331-Y334 PolarHBondContact O-N 3.22Å; F331-A335 HydrophobicContact CE1-CB 4.38Å; F331-A335 HydrophobicContact CZ-CB 4.3Å; F331-A335 WeakPolarHBondContact O-CB 3.35Å; F331-A335 PolarHBondContact O-N 3.16Å; F331-G469 WeakPolarHBondContact CA-O 3.35Å; F331-L472 HydrophobicContact CD2-CB 3.84Å; F331-L472 HydrophobicContact CE2-CB 4.22Å; F331-A473 HydrophobicContact CD2-CB 3.83Å; F331-A473 HydrophobicContact CE2-CB 4.19Å; F331-F477 HydrophobicContact CE2-CB 4.15Å; F331-F477 HydrophobicContact CE2-CD2 4.11Å; F331-F477 HydrophobicContact CE2-CG 4.28Å; F331-F477 HydrophobicContact CZ-CB 4.46Å; F331-F477 AromaticContact CZ-CD2 3.57Å; F331-F477 HydrophobicContact CZ-CD2 3.57Å; F331-F477 HydrophobicContact CZ-CE2 4.02Å; F331-F477 HydrophobicContact CZ-CG 4.13Å; F331-A493 HydrophobicContact CE1-CB 3.69Å; F331-A493 HydrophobicContact CZ-CB 4.25Å
332L98Very high96.1Very high0 Ų014.9 Ų14.90%08%0.084CC..Hα-helixtrans-59.4-38.4176.4-70.3-176.1000112.2C328 A329 Y334 A335 I336 M401 L408 V435 A493 C497C328-L332 PolarHBondContact O-N 2.67Å; A329-L332 PolarHBondContact O-N 3.11Å; L332-Y334 VanDerWaalsContact C-N 3.34Å; L332-Y334 PolarHBondContact O-N 3.22Å; L332-A335 PolarHBondContact O-N 3.38Å; L332-I336 HydrophobicContact CB-CD1 4.2Å; L332-I336 VanDerWaalsContact O-CB 3.3Å; L332-I336 WeakPolarHBondContact O-CB 3.39Å; L332-I336 WeakPolarHBondContact O-CD1 3.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.44Å; L332-I336 PolarHBondContact O-N 3.11Å; L332-M401 HydrophobicContact CD1-CE 4.36Å; L332-L408 HydrophobicContact CD2-CD2 3.63Å; L332-V435 HydrophobicContact CB-CG1 3.89Å; L332-V435 HydrophobicContact CB-CG2 4.15Å; L332-V435 HydrophobicContact CD1-CG2 4.22Å; L332-A493 HydrophobicContact CD2-CB 4.13Å; L332-C497 HydrophobicContact CD1-CB 3.66Å; L332-C497 HydrophobicContact CD2-CB 4.26Å; L332-C497 HydrophobicContact CG-CB 3.94Å
333R96.8Very high96Very high33 Ų3315.1 Ų15.113%0.1259%0.085CC..Hα-helixtrans-54.6-48.8178.4170.969.7177.9101.7-8.6113.1N146 A329 T330 F331 G337 Y363 E364 V435 I436 I439N146-R333 PolarHBondContact ND2-NH2 2.94Å; A329-R333 PolarHBondContact O-N 3.04Å; T330-R333 WeakPolarHBondContact O-CB 3.21Å; T330-R333 PolarHBondContact O-N 2.89Å; F331-R333 VanDerWaalsContact C-N 3.26Å; F331-R333 PolarHBondContact O-N 2.78Å; R333-G337 PolarHBondContact O-N 3.39Å; R333-G337 VanDerWaalsContact O-N 3.12Å; R333-Y363 WeakPolarHBondContact CA-OH 3.31Å; R333-E364 IonicContact CZ-OE1 2.68Å; R333-E364 IonicContact CZ-OE2 3.88Å; R333-E364 IonicContact NH1-OE1 3.05Å; R333-E364 PolarHBondContact NH1-OE1 2.94Å; R333-E364 IonicContact NH1-OE2 2.72Å; R333-E364 PolarHBondContact NH1-OE2 3.3Å; R333-E364 IonicContact NH2-OE1 3.54Å; R333-E364 PolarHBondContact NH2-OE1 3.49Å; R333-E364 IonicContact NH2-OE2 3.38Å; R333-E364 PolarHBondContact NH2-OE2 3.22Å; R333-V435 HydrophobicContact CB-CG1 4.09Å; R333-I436 VanDerWaalsContact CD-CG1 3.41Å; R333-I439 HydrophobicContact CB-CD1 3.55Å; R333-I439 HydrophobicContact CG-CD1 3.94Å
334Y96.9Very high95.9Very high63 Ų6314.7 Ų14.725%0.2478%0.081CC..Hα-helixtrans-82.7-37-179.1-72.7-77.8000111.1T330 F331 L332 I336 G337 D338 A470T330-Y334 HydrophobicContact CG2-CD2 3.81Å; T330-Y334 HydrophobicContact CG2-CE2 3.65Å; T330-Y334 VanDerWaalsContact O-CD2 3.28Å; T330-Y334 WeakPolarHBondContact O-CD2 3.34Å; T330-Y334 PolarHBondContact O-N 3.34Å; F331-Y334 PolarHBondContact O-N 3.22Å; L332-Y334 VanDerWaalsContact C-N 3.34Å; L332-Y334 PolarHBondContact O-N 3.22Å; Y334-I336 PolarHBondContact O-N 3.11Å; Y334-G337 PolarHBondContact O-N 2.94Å; Y334-D338 VanDerWaalsContact O-CB 3.3Å; Y334-D338 WeakPolarHBondContact O-CB 3.11Å; Y334-D338 PolarHBondContact O-N 3.48Å; Y334-A470 HydrophobicContact CD2-CB 3.31Å; Y334-A470 HydrophobicContact CE2-CB 3.4Å; Y334-A470 HydrophobicContact CG-CB 4.03Å
335A97.5Very high95.6Very high0 Ų015.7 Ų15.70%08%0.08CC..Hα-helixtrans-61.2-47.1178.800000111.5F331 L332 W339 A473 F477F331-A335 HydrophobicContact CE1-CB 4.38Å; F331-A335 HydrophobicContact CZ-CB 4.3Å; F331-A335 WeakPolarHBondContact O-CB 3.35Å; F331-A335 PolarHBondContact O-N 3.16Å; L332-A335 PolarHBondContact O-N 3.38Å; A335-W339 VanDerWaalsContact O-CB 3.28Å; A335-W339 WeakPolarHBondContact O-CB 3Å; A335-W339 VanDerWaalsContact O-CD1 3.25Å; A335-W339 PolarHBondContact O-N 3.31Å; A335-W339 VanDerWaalsContact O-N 3.14Å; A335-A473 HydrophobicContact CB-CB 4.15Å; A335-F477 HydrophobicContact CB-CD1 4.03Å; A335-F477 HydrophobicContact CB-CE1 3.91Å; A335-F477 HydrophobicContact CB-CG 4.48Å; A335-F477 HydrophobicContact CB-CZ 4.28Å
336I97Very high95.1Very high2 Ų219.7 Ų19.71%0.0110%0.102CC..Hα-helixtrans-71.9-47.8177.1-58.9165.9000109.9L332 Y334 D338 L340 Y363 L408 L431 V435 F490L332-I336 HydrophobicContact CB-CD1 4.2Å; L332-I336 VanDerWaalsContact O-CB 3.3Å; L332-I336 WeakPolarHBondContact O-CB 3.39Å; L332-I336 WeakPolarHBondContact O-CD1 3.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.44Å; L332-I336 PolarHBondContact O-N 3.11Å; Y334-I336 PolarHBondContact O-N 3.11Å; I336-D338 VanDerWaalsContact C-N 3.32Å; I336-D338 PolarHBondContact O-N 2.89Å; I336-L340 HydrophobicContact CG2-CB 4.03Å; I336-L340 HydrophobicContact CG2-CD2 3.79Å; I336-L340 HydrophobicContact CG2-CG 4.45Å; I336-L340 WeakPolarHBondContact O-CB 3.37Å; I336-L340 PolarHBondContact O-N 3.23Å; I336-Y363 HydrophobicContact CB-CD2 4.47Å; I336-Y363 HydrophobicContact CB-CE1 4.2Å; I336-Y363 HydrophobicContact CB-CE2 3.99Å; I336-Y363 HydrophobicContact CD1-CE2 4.09Å; I336-Y363 HydrophobicContact CG2-CD1 4.07Å; I336-Y363 HydrophobicContact CG2-CD2 3.55Å; I336-Y363 HydrophobicContact CG2-CE1 4.06Å; I336-Y363 HydrophobicContact CG2-CE2 3.54Å; I336-Y363 HydrophobicContact CG2-CG 3.84Å; I336-L408 HydrophobicContact CD1-CD1 3.91Å; I336-L408 HydrophobicContact CG1-CD1 3.98Å; I336-L431 HydrophobicContact CD1-CB 4.38Å; I336-L431 HydrophobicContact CD1-CD1 4.35Å; I336-L431 HydrophobicContact CD1-CD2 4.09Å; I336-V435 HydrophobicContact CD1-CG2 4.17Å; I336-F490 HydrophobicContact CG1-CE1 4.07Å
337G95.1Very high94.7Very high12 Ų1220.4 Ų20.412%0.12411%0.106CC..Hα-helixtrans-60.8-35.8-176.100000114.4R27 R333 Y334R27-G337 PolarHBondContact NH2-O 3.12Å; R333-G337 PolarHBondContact O-N 3.39Å; R333-G337 VanDerWaalsContact O-N 3.12Å; Y334-G337 PolarHBondContact O-N 2.94Å
338D94.5Very high94.1Very high14 Ų1427.8 Ų27.88%0.07514%0.136CC..Hα-helixtrans-96.6-29.7-175.8-66.2-18.6000112.7R27 Q30 I53 Y334 I336R27-D338 IonicContact NE-OD1 3.34Å; R27-D338 IonicContact NH2-OD1 3.35Å; Q30-D338 HydrophobicContact CG-CB 4.39Å; I53-D338 HydrophobicContact CD1-CB 4.47Å; Y334-D338 VanDerWaalsContact O-CB 3.3Å; Y334-D338 WeakPolarHBondContact O-CB 3.11Å; Y334-D338 PolarHBondContact O-N 3.48Å; I336-D338 VanDerWaalsContact C-N 3.32Å; I336-D338 PolarHBondContact O-N 2.89Å
339W95.4Very high93.4Very high0 Ų032.8 Ų32.80%015%0.153CC..Hα-helixtrans-113.2-14.9-171.4-51.7104.9000115.6N46 L49 I53 A335 G341 I342 M343 A473 F477 A478 W486 F490N46-W339 HydrophobicContact CB-CZ3 4.35Å; N46-W339 WeakPolarHBondContact O-CH2 3.19Å; L49-W339 HydrophobicContact CB-CH2 4.13Å; L49-W339 HydrophobicContact CB-CZ3 4.44Å; L49-W339 HydrophobicContact CD2-CH2 3.93Å; L49-W339 HydrophobicContact CD2-CZ3 3.74Å; L49-W339 HydrophobicContact CG-CH2 3.93Å; L49-W339 HydrophobicContact CG-CZ3 4.24Å; I53-W339 HydrophobicContact CD1-CH2 4.13Å; I53-W339 HydrophobicContact CD1-CZ2 3.86Å; A335-W339 VanDerWaalsContact O-CB 3.28Å; A335-W339 WeakPolarHBondContact O-CB 3Å; A335-W339 VanDerWaalsContact O-CD1 3.25Å; A335-W339 PolarHBondContact O-N 3.31Å; A335-W339 VanDerWaalsContact O-N 3.14Å; W339-G341 VanDerWaalsContact C-N 3.35Å; W339-G341 PolarHBondContact O-N 3.46Å; W339-I342 HydrophobicContact CE3-CB 4.42Å; W339-I342 HydrophobicContact CE3-CD1 3.64Å; W339-I342 HydrophobicContact CE3-CG2 4.35Å; W339-I342 HydrophobicContact CZ3-CD1 3.89Å; W339-I342 PolarHBondContact O-N 3.08Å; W339-I342 VanDerWaalsContact O-N 3.13Å; W339-M343 PolarHBondContact O-N 2.61Å; W339-A473 PolarHBondContact NE1-O 3.42Å; W339-F477 HydrophobicContact CB-CE1 4.35Å; W339-F477 AromaticContact CD1-CD1 3.55Å; W339-F477 AromaticContact CD1-CE1 3.93Å; W339-F477 HydrophobicContact CG-CD1 4.18Å; W339-F477 HydrophobicContact CG-CE1 4.3Å; W339-F477 AromaticContact NE1-CD1 3.93Å; W339-A478 HydrophobicContact CH2-CB 3.79Å; W339-A478 HydrophobicContact CZ2-CB 3.83Å; W339-A478 HydrophobicContact CZ3-CB 4.44Å; W339-W486 HydrophobicContact CB-CE3 4.21Å; W339-W486 HydrophobicContact CB-CH2 3.95Å; W339-W486 HydrophobicContact CB-CZ3 3.53Å; W339-W486 AromaticContact CD2-CH2 3.53Å; W339-W486 HydrophobicContact CD2-CH2 3.53Å; W339-W486 AromaticContact CD2-CZ3 3.91Å; W339-W486 HydrophobicContact CD2-CZ3 3.91Å; W339-W486 AromaticContact CE3-CH2 3.19Å; W339-W486 HydrophobicContact CE3-CH2 3.19Å; W339-W486 AromaticContact CE3-CZ2 3.83Å; W339-W486 HydrophobicContact CE3-CZ2 3.83Å; W339-W486 HydrophobicContact CE3-CZ3 4.01Å; W339-W486 AromaticContact CG-CH2 3.86Å; W339-W486 HydrophobicContact CG-CH2 3.86Å; W339-W486 AromaticContact CG-CZ3 3.72Å; W339-W486 HydrophobicContact CG-CZ3 3.72Å; W339-W486 AromaticContact CZ3-CH2 3.83Å; W339-W486 HydrophobicContact CZ3-CH2 3.83Å; W339-W486 HydrophobicContact CZ3-CZ2 4.27Å; W339-F490 HydrophobicContact CB-CZ 4.06Å
340L94.5Very high92.8Very high1 Ų135.5 Ų35.51%0.00518%0.181CC..Hα-helixtrans-59.8-44.8-17817961.7000112.1I336 M343 L344 V359 L411I336-L340 HydrophobicContact CG2-CB 4.03Å; I336-L340 HydrophobicContact CG2-CD2 3.79Å; I336-L340 HydrophobicContact CG2-CG 4.45Å; I336-L340 WeakPolarHBondContact O-CB 3.37Å; I336-L340 PolarHBondContact O-N 3.23Å; L340-M343 HydrophobicContact CD1-CE 3.63Å; L340-M343 PolarHBondContact O-N 3.43Å; L340-L344 WeakPolarHBondContact O-CG 3.49Å; L340-L344 PolarHBondContact O-N 3.25Å; L340-V359 HydrophobicContact CD2-CG1 3.66Å; L340-V359 HydrophobicContact CG-CG1 4.03Å; L340-L411 HydrophobicContact CD1-CD2 3.58Å
341G92.9Very high92.5Very high10 Ų1036.4 Ų36.410%0.10318%0.184CC..Hα-helixtrans-62.8-42.5175.300000112W339 L344 L345W339-G341 VanDerWaalsContact C-N 3.35Å; W339-G341 PolarHBondContact O-N 3.46Å; G341-L344 PolarHBondContact O-N 3.31Å; G341-L345 WeakPolarHBondContact O-CG 3.44Å; G341-L345 PolarHBondContact O-N 3.16Å
342I91.2Very high92.2Very high19 Ų1938 Ų3810%0.09720%0.198CC..Hα-helixtrans-65.1-40.2179.1-67.1175.6000111.4L49 W339 L344 L345 N346 W486L49-I342 HydrophobicContact CD2-CD1 3.66Å; W339-I342 HydrophobicContact CE3-CB 4.42Å; W339-I342 HydrophobicContact CE3-CD1 3.64Å; W339-I342 HydrophobicContact CE3-CG2 4.35Å; W339-I342 HydrophobicContact CZ3-CD1 3.89Å; W339-I342 PolarHBondContact O-N 3.08Å; W339-I342 VanDerWaalsContact O-N 3.13Å; I342-L344 VanDerWaalsContact C-N 3.33Å; I342-L344 PolarHBondContact O-N 3.04Å; I342-L345 PolarHBondContact O-N 3.3Å; I342-N346 WeakPolarHBondContact CG2-ND2 3.36Å; I342-N346 VanDerWaalsContact O-CB 3.3Å; I342-N346 WeakPolarHBondContact O-CB 3.23Å; I342-N346 VanDerWaalsContact O-CG 3.3Å; I342-N346 PolarHBondContact O-N 3.07Å; I342-N346 PolarHBondContact O-ND2 3.27Å; I342-W486 HydrophobicContact CG2-CZ2 3.96Å
343M92.3Very high91.8Very high5 Ų543.4 Ų43.43%0.02522%0.224CC..Hα-helixtrans-58.2-46.5174.2169.8-164.582.500111W339 L340 N346 N347 L411 T415 W486 F490W339-M343 PolarHBondContact O-N 2.61Å; L340-M343 HydrophobicContact CD1-CE 3.63Å; L340-M343 PolarHBondContact O-N 3.43Å; M343-N346 PolarHBondContact O-N 3.45Å; M343-N347 PolarHBondContact O-N 3.41Å; M343-L411 HydrophobicContact CE-CD2 4.39Å; M343-L411 HydrophobicContact CE-CG 4.47Å; M343-T415 HydrophobicContact CE-CG2 3.59Å; M343-W486 HydrophobicContact CB-CB 3.86Å; M343-W486 HydrophobicContact CB-CD2 4.28Å; M343-W486 HydrophobicContact CB-CG 3.95Å; M343-W486 HydrophobicContact CG-CB 3.53Å; M343-W486 HydrophobicContact CG-CG 4.14Å; M343-W486 HydrophobicContact SD-CB 4.4Å; M343-F490 HydrophobicContact CB-CE2 4.01Å; M343-F490 HydrophobicContact CG-CD2 4.5Å; M343-F490 HydrophobicContact CG-CE2 4.37Å; M343-F490 HydrophobicContact SD-CD2 3.54Å; M343-F490 VanDerWaalsContact SD-CD2 3.54Å; M343-F490 HydrophobicContact SD-CE2 3.75Å
344L92.8Very high91.6Very high0 Ų046.4 Ų46.40%024%0.242CC..Hα-helixtrans-64.5-43.9-179.5-68.8174.7000111.3L340 G341 I342 N346 N347 Y351 A356 V359 T415 L424L340-L344 WeakPolarHBondContact O-CG 3.49Å; L340-L344 PolarHBondContact O-N 3.25Å; G341-L344 PolarHBondContact O-N 3.31Å; I342-L344 VanDerWaalsContact C-N 3.33Å; I342-L344 PolarHBondContact O-N 3.04Å; L344-N346 VanDerWaalsContact C-N 3.33Å; L344-N346 PolarHBondContact O-N 2.89Å; L344-N347 VanDerWaalsContact O-CB 3.27Å; L344-N347 WeakPolarHBondContact O-CB 3.45Å; L344-N347 PolarHBondContact O-N 3.33Å; L344-Y351 HydrophobicContact CB-CD2 4.43Å; L344-Y351 HydrophobicContact CD2-CD2 3.94Å; L344-Y351 HydrophobicContact CD2-CE2 4.05Å; L344-Y351 HydrophobicContact CD2-CG 4.39Å; L344-A356 HydrophobicContact CB-CB 4.06Å; L344-V359 HydrophobicContact CD1-CB 3.75Å; L344-V359 HydrophobicContact CD1-CG1 3.65Å; L344-V359 HydrophobicContact CD1-CG2 4.04Å; L344-T415 HydrophobicContact CD2-CG2 4.2Å; L344-L424 HydrophobicContact CD1-CD1 4.49Å; L344-L424 HydrophobicContact CD2-CD1 4.06Å; L344-L424 HydrophobicContact CD2-CD2 4.39Å
345L90.1Very high91.4Very high46 Ų4644.4 Ų44.424%0.24124%0.237CC..Hα-helixtrans-62.1-38.6176.4-69.9172.5000112.9H34 G341 I342 N347 Q353 A356 Y357H34-L345 HydrophobicContact CB-CD1 3.94Å; G341-L345 WeakPolarHBondContact O-CG 3.44Å; G341-L345 PolarHBondContact O-N 3.16Å; I342-L345 PolarHBondContact O-N 3.3Å; L345-N347 VanDerWaalsContact C-N 3.28Å; L345-N347 PolarHBondContact O-N 3.06Å; L345-Q353 HydrophobicContact CD2-CB 4.37Å; L345-Q353 HydrophobicContact CD2-CG 3.88Å; L345-A356 HydrophobicContact CD1-CB 4.42Å; L345-A356 HydrophobicContact CD2-CB 3.86Å; L345-A356 HydrophobicContact CG-CB 3.73Å; L345-Y357 HydrophobicContact CD1-CE1 4.29Å
346N88.3Confident91.2Very high84 Ų8444.4 Ų44.445%0.44924%0.237SC..THydrogen-bonded Turntrans-86.83.5-179.7-68-23000113.2N46 I342 M343 L344N46-N346 PolarHBondContact ND2-ND2 3.18Å; N46-N346 VanDerWaalsContact ND2-ND2 3.16Å; I342-N346 WeakPolarHBondContact CG2-ND2 3.36Å; I342-N346 VanDerWaalsContact O-CB 3.3Å; I342-N346 WeakPolarHBondContact O-CB 3.23Å; I342-N346 VanDerWaalsContact O-CG 3.3Å; I342-N346 PolarHBondContact O-N 3.07Å; I342-N346 PolarHBondContact O-ND2 3.27Å; M343-N346 PolarHBondContact O-N 3.45Å; L344-N346 VanDerWaalsContact C-N 3.33Å; L344-N346 PolarHBondContact O-N 2.89Å
347N88.2Confident91Very high25 Ų2544.7 Ų44.713%0.13424%0.238CC..  trans-70.2137.2-179.3-166.5-46.9000109.9M343 L344 L345 R349 G350 Y351 T415M343-N347 PolarHBondContact O-N 3.41Å; L344-N347 VanDerWaalsContact O-CB 3.27Å; L344-N347 WeakPolarHBondContact O-CB 3.45Å; L344-N347 PolarHBondContact O-N 3.33Å; L345-N347 VanDerWaalsContact C-N 3.28Å; L345-N347 PolarHBondContact O-N 3.06Å; N347-R349 PolarHBondContact O-N 2.92Å; N347-R349 PolarHBondContact OD1-N 3.15Å; N347-R349 VanDerWaalsContact OD1-N 3.07Å; N347-G350 PolarHBondContact O-N 2.9Å; N347-Y351 HydrophobicContact CB-CD2 3.84Å; N347-Y351 HydrophobicContact CB-CE2 4.19Å; N347-T415 PolarHBondContact ND2-O 2.81Å
348K83.7Confident91.1Very high216 Ų21647.5 Ų47.594%0.93925%0.25SC*.THydrogen-bonded Turntrans-54.6-24.1178.2-64.2-175.3179.4-177.80113.7G350K348-G350 VanDerWaalsContact C-N 3.35Å
349R83.8Confident91.2Very high119 Ų11946.9 Ų46.945%0.44925%0.246SC..THydrogen-bonded Turntrans-81-9.7179.1-60.5-151.7-176.3-147.96114.6N347 N416 N418N347-R349 PolarHBondContact O-N 2.92Å; N347-R349 PolarHBondContact OD1-N 3.15Å; N347-R349 VanDerWaalsContact OD1-N 3.07Å; R349-N416 PolarHBondContact NE-O 3.41Å; R349-N416 PolarHBondContact NH2-O 3.29Å; R349-N418 WeakPolarHBondContact CD-OD1 3.46Å; R349-N418 PolarHBondContact NH1-ND2 3.35Å; R349-N418 VanDerWaalsContact NH1-ND2 3.16Å
350G85.1Confident91.1Very high58 Ų5847.8 Ų47.860%0.59825%0.254SS*.  trans72.356.7173.500000114.4N347 K348N347-G350 PolarHBondContact O-N 2.9Å; K348-G350 VanDerWaalsContact C-N 3.35Å
351Y90.8Very high91.2Very high29 Ų2948.7 Ų48.711%0.11426%0.26CS..  trans-61.9142.9172.3-73-78.3000111.4L344 N347 T355 A419 L424L344-Y351 HydrophobicContact CB-CD2 4.43Å; L344-Y351 HydrophobicContact CD2-CD2 3.94Å; L344-Y351 HydrophobicContact CD2-CE2 4.05Å; L344-Y351 HydrophobicContact CD2-CG 4.39Å; N347-Y351 HydrophobicContact CB-CD2 3.84Å; N347-Y351 HydrophobicContact CB-CE2 4.19Å; Y351-T355 HydrophobicContact CD1-CG2 3.87Å; Y351-T355 HydrophobicContact CG-CG2 4.5Å; Y351-A419 WeakPolarHBondContact OH-CB 3.45Å; Y351-A419 PolarHBondContact OH-N 3.47Å; Y351-A419 PolarHBondContact OH-O 3.16Å; Y351-L424 HydrophobicContact CD1-CD1 4.35Å; Y351-L424 HydrophobicContact CE1-CD1 3.83Å
352S92.1Very high91.4Very high62 Ų6249.1 Ų49.143%0.43426%0.262SS..  trans-66.2154.9177.881.60000112.2N354 T355 A356S352-N354 VanDerWaalsContact C-N 3.3Å; S352-N354 PolarHBondContact O-N 3.27Å; S352-T355 WeakPolarHBondContact O-CB 3.22Å; S352-T355 PolarHBondContact O-N 3.38Å; S352-T355 VanDerWaalsContact O-N 3.17Å; S352-T355 WeakPolarHBondContact OG-CB 3.2Å; S352-T355 PolarHBondContact OG-N 3.05Å; S352-T355 VanDerWaalsContact OG-N 3.07Å; S352-T355 PolarHBondContact OG-OG1 2.88Å; S352-A356 PolarHBondContact O-N 3.2Å; S352-A356 VanDerWaalsContact O-N 3.1Å
353Q90Very high91.7Very high113 Ų11348.3 Ų48.353%0.52826%0.257SS..Hα-helixtrans-57.5-43174.2-69.9-177.4-6.600112.3L345 T355 A356 Y357L345-Q353 HydrophobicContact CD2-CB 4.37Å; L345-Q353 HydrophobicContact CD2-CG 3.88Å; Q353-T355 VanDerWaalsContact C-N 3.31Å; Q353-T355 PolarHBondContact O-N 2.76Å; Q353-A356 PolarHBondContact O-N 2.75Å; Q353-Y357 HydrophobicContact CB-CE2 3.83Å; Q353-Y357 WeakPolarHBondContact O-CD2 3.44Å; Q353-Y357 WeakPolarHBondContact O-CE2 3.45Å; Q353-Y357 PolarHBondContact O-N 2.98Å
354N92.2Very high91.9Very high97 Ų9748.1 Ų48.152%0.51926%0.256SS..Hα-helixtrans-60.3-41.8177.3-71-4.8000111.7S352 Y357 L358S352-N354 VanDerWaalsContact C-N 3.3Å; S352-N354 PolarHBondContact O-N 3.27Å; N354-Y357 PolarHBondContact O-N 2.88Å; N354-L358 WeakPolarHBondContact O-CB 3.33Å; N354-L358 VanDerWaalsContact O-CG 3.3Å; N354-L358 WeakPolarHBondContact O-CG 3.35Å; N354-L358 PolarHBondContact O-N 2.78Å
355T93.2Very high92.1Very high21 Ų2153.6 Ų53.613%0.12928%0.28CS..Hα-helixtrans-59.5-48175.5-59.10000111.1Y351 S352 Q353 Y357 V359 L421 L424Y351-T355 HydrophobicContact CD1-CG2 3.87Å; Y351-T355 HydrophobicContact CG-CG2 4.5Å; S352-T355 WeakPolarHBondContact O-CB 3.22Å; S352-T355 PolarHBondContact O-N 3.38Å; S352-T355 VanDerWaalsContact O-N 3.17Å; S352-T355 WeakPolarHBondContact OG-CB 3.2Å; S352-T355 PolarHBondContact OG-N 3.05Å; S352-T355 VanDerWaalsContact OG-N 3.07Å; S352-T355 PolarHBondContact OG-OG1 2.88Å; Q353-T355 VanDerWaalsContact C-N 3.31Å; Q353-T355 PolarHBondContact O-N 2.76Å; T355-Y357 PolarHBondContact O-N 3.16Å; T355-V359 WeakPolarHBondContact O-CB 3.38Å; T355-V359 WeakPolarHBondContact O-CG2 3.11Å; T355-V359 PolarHBondContact O-N 3.23Å; T355-L421 HydrophobicContact CG2-CD1 3.72Å; T355-L424 HydrophobicContact CG2-CD1 4.24Å
356A93.2Very high92.3Very high0 Ų051.4 Ų51.40%027%0.269CS..Hα-helixtrans-60.8-43.9-179.400000112.6L344 L345 S352 Q353 A360L344-A356 HydrophobicContact CB-CB 4.06Å; L345-A356 HydrophobicContact CD1-CB 4.42Å; L345-A356 HydrophobicContact CD2-CB 3.86Å; L345-A356 HydrophobicContact CG-CB 3.73Å; S352-A356 PolarHBondContact O-N 3.2Å; S352-A356 VanDerWaalsContact O-N 3.1Å; Q353-A356 PolarHBondContact O-N 2.75Å; A356-A360 PolarHBondContact O-N 3.11Å
357Y92.6Very high92.6Very high8 Ų847.4 Ų47.43%0.03125%0.248CC..Hα-helixtrans-76.2-37.3-178.9-53.8-36.4000113.6H34 I157 L345 Q353 N354 T355 V359 A360 S361H34-Y357 AromaticContact CD2-CZ 3.58Å; H34-Y357 PolarHBondContact CD2-OH 3.31Å; H34-Y357 AromaticContact CE1-CE1 3.7Å; H34-Y357 AromaticContact CE1-CE2 3.98Å; H34-Y357 AromaticContact CE1-CZ 3.35Å; H34-Y357 PolarHBondContact CE1-OH 3.34Å; H34-Y357 VanDerWaalsContact CE1-OH 3.29Å; H34-Y357 AromaticContact CG-CZ 3.77Å; H34-Y357 AromaticContact ND1-CE1 3.77Å; H34-Y357 AromaticContact ND1-CZ 3.67Å; H34-Y357 PolarHBondContact ND1-OH 2.96Å; H34-Y357 AromaticContact NE2-CE2 3.66Å; H34-Y357 AromaticContact NE2-CZ 3.26Å; H34-Y357 VanDerWaalsContact NE2-CZ 3.26Å; H34-Y357 PolarHBondContact NE2-OH 2.91Å; I157-Y357 HydrophobicContact CD1-CD2 3.35Å; I157-Y357 HydrophobicContact CD1-CE2 3.2Å; I157-Y357 HydrophobicContact CD1-CG 4.33Å; I157-Y357 HydrophobicContact CG1-CE2 4.4Å; L345-Y357 HydrophobicContact CD1-CE1 4.29Å; Q353-Y357 HydrophobicContact CB-CE2 3.83Å; Q353-Y357 WeakPolarHBondContact O-CD2 3.44Å; Q353-Y357 WeakPolarHBondContact O-CE2 3.45Å; Q353-Y357 PolarHBondContact O-N 2.98Å; N354-Y357 PolarHBondContact O-N 2.88Å; T355-Y357 PolarHBondContact O-N 3.16Å; Y357-V359 VanDerWaalsContact C-N 3.26Å; Y357-V359 PolarHBondContact O-N 3.44Å; Y357-A360 PolarHBondContact O-N 3.2Å; Y357-S361 VanDerWaalsContact O-CB 3.3Å; Y357-S361 WeakPolarHBondContact O-CB 3.43Å; Y357-S361 PolarHBondContact O-N 3.46Å; Y357-S361 PolarHBondContact O-OG 3.06Å
358L96.3Very high92.7Very high71 Ų7147.6 Ų47.637%0.37225%0.248SC..Hα-helixtrans-60.1-41.9172.7-76.4173.2000110.7W154 N354 S361 S362 L421 L425W154-L358 HydrophobicContact CH2-CG 4.43Å; W154-L358 HydrophobicContact CZ2-CD2 3.82Å; W154-L358 HydrophobicContact CZ2-CG 3.88Å; N354-L358 WeakPolarHBondContact O-CB 3.33Å; N354-L358 VanDerWaalsContact O-CG 3.3Å; N354-L358 WeakPolarHBondContact O-CG 3.35Å; N354-L358 PolarHBondContact O-N 2.78Å; L358-S361 PolarHBondContact O-N 3.38Å; L358-S362 VanDerWaalsContact O-CB 3.32Å; L358-S362 WeakPolarHBondContact O-CB 3.46Å; L358-S362 PolarHBondContact O-N 2.79Å; L358-L421 HydrophobicContact CD1-CD2 4.4Å; L358-L425 HydrophobicContact CB-CD2 4.13Å
359V96.1Very high93.1Very high1 Ų139.3 Ų39.31%0.00622%0.216CC..Hα-helixtrans-64.4-48176.5169.40000111.3L340 L344 T355 Y357 S361 S362 Y363 L421 L424 L425 S428L340-V359 HydrophobicContact CD2-CG1 3.66Å; L340-V359 HydrophobicContact CG-CG1 4.03Å; L344-V359 HydrophobicContact CD1-CB 3.75Å; L344-V359 HydrophobicContact CD1-CG1 3.65Å; L344-V359 HydrophobicContact CD1-CG2 4.04Å; T355-V359 WeakPolarHBondContact O-CB 3.38Å; T355-V359 WeakPolarHBondContact O-CG2 3.11Å; T355-V359 PolarHBondContact O-N 3.23Å; Y357-V359 VanDerWaalsContact C-N 3.26Å; Y357-V359 PolarHBondContact O-N 3.44Å; V359-S361 VanDerWaalsContact C-N 3.31Å; V359-S361 PolarHBondContact O-N 3.33Å; V359-S362 PolarHBondContact O-N 3.49Å; V359-Y363 PolarHBondContact O-N 2.91Å; V359-Y363 VanDerWaalsContact O-N 3.16Å; V359-L421 HydrophobicContact CG2-CD1 4.21Å; V359-L424 HydrophobicContact CG2-CB 3.6Å; V359-L424 HydrophobicContact CG2-CD1 4.42Å; V359-L425 HydrophobicContact CG2-CD2 4.08Å; V359-S428 PolarHBondContact O-OG 2.82Å
360A94.7Very high93.3Very high19 Ų1933.7 Ų33.716%0.15719%0.194CC..Hα-helixtrans-61.5-37.2175.500000112.8A356 Y357 Y363 E364A356-A360 PolarHBondContact O-N 3.11Å; Y357-A360 PolarHBondContact O-N 3.2Å; A360-Y363 WeakPolarHBondContact O-CB 3.18Å; A360-Y363 PolarHBondContact O-N 3.39Å; A360-E364 PolarHBondContact O-N 3.22Å
361S96.2Very high93.2Very high19 Ų1932.9 Ų32.913%0.13318%0.179CC..Hα-helixtrans-68.8-39177.6-52.90000111.7C150 W154 Y357 L358 V359 Y363 E364 F365C150-S361 PolarHBondContact O-OG 3.15Å; C150-S361 VanDerWaalsContact O-OG 3.05Å; W154-S361 PolarHBondContact NE1-OG 3.12Å; W154-S361 VanDerWaalsContact NE1-OG 3.14Å; Y357-S361 VanDerWaalsContact O-CB 3.3Å; Y357-S361 WeakPolarHBondContact O-CB 3.43Å; Y357-S361 PolarHBondContact O-N 3.46Å; Y357-S361 PolarHBondContact O-OG 3.06Å; L358-S361 PolarHBondContact O-N 3.38Å; V359-S361 VanDerWaalsContact C-N 3.31Å; V359-S361 PolarHBondContact O-N 3.33Å; S361-Y363 VanDerWaalsContact C-N 3.31Å; S361-Y363 PolarHBondContact O-N 2.83Å; S361-E364 PolarHBondContact O-N 2.74Å; S361-F365 WeakPolarHBondContact O-CB 3.36Å; S361-F365 PolarHBondContact O-N 3.33Å
362S97.2Very high92.8Very high20 Ų2037.3 Ų37.314%0.1420%0.203CC..Hα-helixtrans-62.8-37.4176.8-1790000112L358 V359 F365 G366 L425L358-S362 VanDerWaalsContact O-CB 3.32Å; L358-S362 WeakPolarHBondContact O-CB 3.46Å; L358-S362 PolarHBondContact O-N 2.79Å; V359-S362 PolarHBondContact O-N 3.49Å; S362-F365 PolarHBondContact O-N 3.27Å; S362-G366 PolarHBondContact O-N 3.37Å; S362-L425 PolarHBondContact OG-O 2.95Å
363Y97.3Very high92.2Very high1 Ų138.6 Ų38.60%0.00420%0.204CC..Hα-helixtrans-59-49.9172.6175.3-109.1000111.4R333 I336 V359 A360 S361 F365 G366 G367 S428 L431 G432R333-Y363 WeakPolarHBondContact CA-OH 3.31Å; I336-Y363 HydrophobicContact CB-CD2 4.47Å; I336-Y363 HydrophobicContact CB-CE1 4.2Å; I336-Y363 HydrophobicContact CB-CE2 3.99Å; I336-Y363 HydrophobicContact CD1-CE2 4.09Å; I336-Y363 HydrophobicContact CG2-CD1 4.07Å; I336-Y363 HydrophobicContact CG2-CD2 3.55Å; I336-Y363 HydrophobicContact CG2-CE1 4.06Å; I336-Y363 HydrophobicContact CG2-CE2 3.54Å; I336-Y363 HydrophobicContact CG2-CG 3.84Å; V359-Y363 PolarHBondContact O-N 2.91Å; V359-Y363 VanDerWaalsContact O-N 3.16Å; A360-Y363 WeakPolarHBondContact O-CB 3.18Å; A360-Y363 PolarHBondContact O-N 3.39Å; S361-Y363 VanDerWaalsContact C-N 3.31Å; S361-Y363 PolarHBondContact O-N 2.83Å; Y363-F365 PolarHBondContact O-N 3.44Å; Y363-G366 PolarHBondContact O-N 3.12Å; Y363-G367 PolarHBondContact O-N 3Å; Y363-S428 WeakPolarHBondContact CA-O 3.28Å; Y363-S428 WeakPolarHBondContact CA-OG 3.31Å; Y363-S428 WeakPolarHBondContact CB-OG 3.41Å; Y363-S428 PolarHBondContact N-OG 3.32Å; Y363-S428 VanDerWaalsContact N-OG 3.07Å; Y363-L431 HydrophobicContact CD2-CB 3.92Å; Y363-L431 HydrophobicContact CE2-CB 3.96Å; Y363-G432 WeakPolarHBondContact O-CA 3.41Å
364E96.2Very high91.5Very high2 Ų233.7 Ų33.71%0.00918%0.182CC..Hα-helixtrans-66.7-38.2-178.6-69.9-68.6175.500112.4R27 N146 C150 R333 A360 S361 G367 I368R27-E364 IonicContact CZ-OE1 3.75Å; R27-E364 VanDerWaalsContact NH1-CD 3.31Å; R27-E364 IonicContact NH1-OE1 3.36Å; R27-E364 PolarHBondContact NH1-OE1 3.45Å; R27-E364 IonicContact NH1-OE2 3.19Å; R27-E364 IonicContact NH2-OE1 3.84Å; R27-E364 PolarHBondContact NH2-OE1 3.29Å; N146-E364 PolarHBondContact ND2-OE2 3.1Å; N146-E364 VanDerWaalsContact ND2-OE2 3.12Å; C150-E364 HydrophobicContact CB-CB 4.49Å; C150-E364 WeakPolarHBondContact SG-CB 3.33Å; R333-E364 IonicContact CZ-OE1 2.68Å; R333-E364 IonicContact CZ-OE2 3.88Å; R333-E364 IonicContact NH1-OE1 3.05Å; R333-E364 PolarHBondContact NH1-OE1 2.94Å; R333-E364 IonicContact NH1-OE2 2.72Å; R333-E364 PolarHBondContact NH1-OE2 3.3Å; R333-E364 IonicContact NH2-OE1 3.54Å; R333-E364 PolarHBondContact NH2-OE1 3.49Å; R333-E364 IonicContact NH2-OE2 3.38Å; R333-E364 PolarHBondContact NH2-OE2 3.22Å; A360-E364 PolarHBondContact O-N 3.22Å; S361-E364 PolarHBondContact O-N 2.74Å; E364-G367 WeakPolarHBondContact O-CA 3.34Å; E364-G367 PolarHBondContact O-N 3.3Å; E364-G367 VanDerWaalsContact O-N 3.08Å; E364-I368 PolarHBondContact O-N 2.81Å
365F96.1Very high90.4Very high115 Ų11530.5 Ų30.550%0.50417%0.173SC..Hα-helixtrans-64.8-43.4174.5-176.3-101.2000111.5C150 S361 S362 Y363 G367 I368 V369 L429C150-F365 PolarHBondContact SG-N 2.94Å; S361-F365 WeakPolarHBondContact O-CB 3.36Å; S361-F365 PolarHBondContact O-N 3.33Å; S362-F365 PolarHBondContact O-N 3.27Å; Y363-F365 PolarHBondContact O-N 3.44Å; F365-G367 PolarHBondContact O-N 3.23Å; F365-I368 HydrophobicContact CD2-CD1 4.43Å; F365-I368 WeakPolarHBondContact O-CB 3.42Å; F365-I368 PolarHBondContact O-N 3.46Å; F365-V369 HydrophobicContact CD1-CG2 4.37Å; F365-V369 HydrophobicContact CE1-CG2 3.97Å; F365-V369 HydrophobicContact CZ-CG2 4.28Å; F365-V369 PolarHBondContact O-N 2.92Å; F365-L429 HydrophobicContact CD1-CD1 3.86Å
366G95.7Very high89.5Confident0 Ų034.1 Ų34.10%019%0.19CC..Hα-helixtrans-55.8-33.917100000111.8S362 Y363 V369 G370 G432 I433S362-G366 PolarHBondContact O-N 3.37Å; Y363-G366 PolarHBondContact O-N 3.12Å; G366-V369 PolarHBondContact O-N 3.14Å; G366-G370 PolarHBondContact O-N 3.04Å; G366-G432 VanDerWaalsContact C-C 3.43Å; G366-G432 CarbonylContact O-C 3.55Å; G366-I433 VanDerWaalsContact O-CA 3.3Å; G366-I433 WeakPolarHBondContact O-CA 3.32Å; G366-I433 VanDerWaalsContact O-CG1 3.26Å; G366-I433 WeakPolarHBondContact O-CG1 3.46Å; G366-I433 PolarHBondContact O-N 3.41Å
367G93.3Very high88.6Confident0 Ų037.2 Ų37.20%021%0.209CC..Hα-helixtrans-60.4-44.4172.400000115.6Y363 E364 F365 V369 G370 S371 I436Y363-G367 PolarHBondContact O-N 3Å; E364-G367 WeakPolarHBondContact O-CA 3.34Å; E364-G367 PolarHBondContact O-N 3.3Å; E364-G367 VanDerWaalsContact O-N 3.08Å; F365-G367 PolarHBondContact O-N 3.23Å; G367-V369 VanDerWaalsContact C-N 3.35Å; G367-G370 PolarHBondContact O-N 2.93Å; G367-S371 WeakPolarHBondContact O-CB 3.32Å; G367-S371 PolarHBondContact O-N 3.5Å; G367-S371 PolarHBondContact O-OG 3.11Å; G367-I436 WeakPolarHBondContact O-CG2 3.36Å
368I91.9Very high87.4Confident29 Ų2937.1 Ų37.115%0.14921%0.21CC..Hα-helixtrans-58.5-52.7174.9-59.5173.1000108.7N146 E364 F365 G370 S371 M372N146-I368 HydrophobicContact CB-CD1 4.11Å; N146-I368 HydrophobicContact CB-CG1 3.42Å; N146-I368 VanDerWaalsContact CB-CG1 3.42Å; E364-I368 PolarHBondContact O-N 2.81Å; F365-I368 HydrophobicContact CD2-CD1 4.43Å; F365-I368 WeakPolarHBondContact O-CB 3.42Å; F365-I368 PolarHBondContact O-N 3.46Å; I368-G370 PolarHBondContact O-N 3.4Å; I368-S371 PolarHBondContact O-N 3.05Å; I368-S371 PolarHBondContact O-OG 3.25Å; I368-M372 HydrophobicContact CG2-SD 4.29Å; I368-M372 WeakPolarHBondContact O-CG 3.31Å; I368-M372 PolarHBondContact O-N 3.18Å
369V91.5Very high86.1Confident42 Ų4238.9 Ų38.926%0.25522%0.219SC..Hα-helixtrans-60.7-45.7-179.2176.40000111.5F365 G366 G367 M372 L373 I433F365-V369 HydrophobicContact CD1-CG2 4.37Å; F365-V369 HydrophobicContact CE1-CG2 3.97Å; F365-V369 HydrophobicContact CZ-CG2 4.28Å; F365-V369 PolarHBondContact O-N 2.92Å; G366-V369 PolarHBondContact O-N 3.14Å; G367-V369 VanDerWaalsContact C-N 3.35Å; V369-M372 PolarHBondContact O-N 2.92Å; V369-L373 HydrophobicContact CG1-CD1 3.44Å; V369-L373 VanDerWaalsContact CG1-CD1 3.44Å; V369-L373 HydrophobicContact CG1-CG 3.97Å; V369-L373 WeakPolarHBondContact O-CB 3.45Å; V369-L373 WeakPolarHBondContact O-CG 3.34Å; V369-L373 PolarHBondContact O-N 3.01Å; V369-I433 HydrophobicContact CB-CG1 4.32Å; V369-I433 HydrophobicContact CG1-CD1 4.22Å; V369-I433 HydrophobicContact CG1-CG1 4.24Å
370G88.2Confident84.7Confident0 Ų043.2 Ų43.20%024%0.242CC..Hα-helixtrans-63.1-43.7-179.200000113.2G366 G367 I368 M372 V374G366-G370 PolarHBondContact O-N 3.04Å; G367-G370 PolarHBondContact O-N 2.93Å; I368-G370 PolarHBondContact O-N 3.4Å; G370-M372 PolarHBondContact O-N 3.42Å; G370-V374 VanDerWaalsContact O-CB 3.25Å; G370-V374 WeakPolarHBondContact O-CB 3.37Å; G370-V374 VanDerWaalsContact O-CG2 3.25Å; G370-V374 WeakPolarHBondContact O-CG2 3.42Å; G370-V374 PolarHBondContact O-N 2.99Å; G370-V374 VanDerWaalsContact O-N 3.1Å
371S82.9Confident82.8Confident41 Ų4148 Ų4829%0.28727%0.265SS..Hα-helixtrans-61.6-33.6177.570.20000112.9G367 I368G367-S371 WeakPolarHBondContact O-CB 3.32Å; G367-S371 PolarHBondContact O-N 3.5Å; G367-S371 PolarHBondContact O-OG 3.11Å; I368-S371 PolarHBondContact O-N 3.05Å; I368-S371 PolarHBondContact O-OG 3.25Å
372M81.6Confident80.9Confident122 Ų12255.2 Ų55.260%0.60130%0.299SS*.Hα-helixtrans-80.7-52.6178.8-65178.47100112.3I368 V369 G370 V374 G375 I376I368-M372 HydrophobicContact CG2-SD 4.29Å; I368-M372 WeakPolarHBondContact O-CG 3.31Å; I368-M372 PolarHBondContact O-N 3.18Å; V369-M372 PolarHBondContact O-N 2.92Å; G370-M372 PolarHBondContact O-N 3.42Å; M372-V374 PolarHBondContact O-N 3.14Å; M372-G375 PolarHBondContact O-N 3.22Å; M372-I376 WeakPolarHBondContact O-CG1 3.48Å; M372-I376 PolarHBondContact O-N 2.8Å
373L79.5Confident78.7Confident89 Ų8956.1 Ų56.147%0.46630%0.302SS..Hα-helixtrans-63.9-40.8-174.9-73.1-179.6000112.2V369 G375 I376 V377V369-L373 HydrophobicContact CG1-CD1 3.44Å; V369-L373 VanDerWaalsContact CG1-CD1 3.44Å; V369-L373 HydrophobicContact CG1-CG 3.97Å; V369-L373 WeakPolarHBondContact O-CB 3.45Å; V369-L373 WeakPolarHBondContact O-CG 3.34Å; V369-L373 PolarHBondContact O-N 3.01Å; L373-G375 VanDerWaalsContact C-N 3.34Å; L373-G375 PolarHBondContact O-N 3.28Å; L373-I376 PolarHBondContact O-N 3.28Å; L373-V377 WeakPolarHBondContact O-CB 3.38Å; L373-V377 VanDerWaalsContact O-CG2 3.29Å; L373-V377 WeakPolarHBondContact O-CG2 3.37Å; L373-V377 PolarHBondContact O-N 3.36Å
374V75.6Confident76.6Confident10 Ų1058.5 Ų58.56%0.06132%0.318CS..Hα-helixtrans-70.2-33.8-175.8174.10000111.8G370 M372 A378 L441G370-V374 VanDerWaalsContact O-CB 3.25Å; G370-V374 WeakPolarHBondContact O-CB 3.37Å; G370-V374 VanDerWaalsContact O-CG2 3.25Å; G370-V374 WeakPolarHBondContact O-CG2 3.42Å; G370-V374 PolarHBondContact O-N 2.99Å; G370-V374 VanDerWaalsContact O-N 3.1Å; M372-V374 PolarHBondContact O-N 3.14Å; V374-A378 VanDerWaalsContact O-CB 3.25Å; V374-A378 WeakPolarHBondContact O-CB 3.45Å; V374-A378 PolarHBondContact O-N 3.33Å; V374-L441 HydrophobicContact CG1-CD1 3.33Å; V374-L441 HydrophobicContact CG1-CD2 3.65Å; V374-L441 HydrophobicContact CG1-CG 3.32Å
375G68.5Low74.6Confident31 Ų3169.8 Ų69.832%0.3236%0.361SS..Hα-helixtrans-59.2-50.3171.500000111M372 L373 A378 D379M372-G375 PolarHBondContact O-N 3.22Å; L373-G375 VanDerWaalsContact C-N 3.34Å; L373-G375 PolarHBondContact O-N 3.28Å; G375-A378 PolarHBondContact O-N 3.4Å; G375-D379 VanDerWaalsContact O-CG 3.3Å; G375-D379 PolarHBondContact O-N 3.06Å
376I74.7Confident72.8Confident96 Ų9669.9 Ų69.949%0.49237%0.365SS..Hα-helixtrans-60-51.4177.8-61.6167000110.6M372 L373 A378 D379 L380M372-I376 WeakPolarHBondContact O-CG1 3.48Å; M372-I376 PolarHBondContact O-N 2.8Å; L373-I376 PolarHBondContact O-N 3.28Å; I376-A378 VanDerWaalsContact C-N 3.3Å; I376-A378 PolarHBondContact O-N 2.83Å; I376-D379 PolarHBondContact O-N 3.05Å; I376-D379 VanDerWaalsContact O-N 3.07Å; I376-L380 HydrophobicContact CG2-CD1 3.99Å; I376-L380 HydrophobicContact CG2-CG 4.12Å; I376-L380 VanDerWaalsContact O-CG 3.31Å; I376-L380 WeakPolarHBondContact O-CG 3.35Å; I376-L380 PolarHBondContact O-N 3.24Å
377V74.6Confident70.7Confident66 Ų6671.2 Ų71.240%0.438%0.375SS..Hα-helixtrans-61.9-37.1-177.5171.60000112.3L373 D379 L380 L396L373-V377 WeakPolarHBondContact O-CB 3.38Å; L373-V377 VanDerWaalsContact O-CG2 3.29Å; L373-V377 WeakPolarHBondContact O-CG2 3.37Å; L373-V377 PolarHBondContact O-N 3.36Å; V377-D379 VanDerWaalsContact C-N 3.26Å; V377-D379 PolarHBondContact O-N 3.25Å; V377-L380 PolarHBondContact O-N 3.44Å; V377-L396 HydrophobicContact CG1-CD2 4.33Å
378A67.9Low69.1Low6 Ų674.6 Ų74.65%0.0540%0.399CS..Hα-helixtrans-67.2-29.8177.400000112.7V374 G375 I376 L396 L441V374-A378 VanDerWaalsContact O-CB 3.25Å; V374-A378 WeakPolarHBondContact O-CB 3.45Å; V374-A378 PolarHBondContact O-N 3.33Å; G375-A378 PolarHBondContact O-N 3.4Å; I376-A378 VanDerWaalsContact C-N 3.3Å; I376-A378 PolarHBondContact O-N 2.83Å; A378-L396 HydrophobicContact CB-CD1 3.87Å; A378-L441 HydrophobicContact CB-CD2 3.88Å
379D67.6Low67.4Low107 Ų10779.5 Ų79.557%0.57242%0.415SS*.Hα-helixtrans-88.7-21.9-179.8-64.2-17.4000112.5G375 I376 V377 N381 R393G375-D379 VanDerWaalsContact O-CG 3.3Å; G375-D379 PolarHBondContact O-N 3.06Å; I376-D379 PolarHBondContact O-N 3.05Å; I376-D379 VanDerWaalsContact O-N 3.07Å; V377-D379 VanDerWaalsContact C-N 3.26Å; V377-D379 PolarHBondContact O-N 3.25Å; D379-N381 PolarHBondContact O-N 2.96Å; D379-R393 IonicContact OD1-NH2 2.75Å
380L68.5Low66.1Low92 Ų9279.8 Ų79.848%0.48242%0.418SS..SBendtrans-64.9129.9175.9-73.2175000111.4I376 V377 M382I376-L380 HydrophobicContact CG2-CD1 3.99Å; I376-L380 HydrophobicContact CG2-CG 4.12Å; I376-L380 VanDerWaalsContact O-CG 3.31Å; I376-L380 WeakPolarHBondContact O-CG 3.35Å; I376-L380 PolarHBondContact O-N 3.24Å; V377-L380 PolarHBondContact O-N 3.44Å; L380-M382 PolarHBondContact O-N 3.38Å
381N53.9Low65.3Low120 Ų12085.9 Ų85.964%0.64244%0.441SS*.G310 helixtrans-64.10.2177.7-88.2-8.8000114.6D379 L383 S384D379-N381 PolarHBondContact O-N 2.96Å; N381-L383 PolarHBondContact O-N 2.86Å; N381-S384 WeakPolarHBondContact O-CB 3.42Å; N381-S384 PolarHBondContact O-N 2.87Å; N381-S384 PolarHBondContact O-OG 3.25Å
382M55.9Low64.9Low171 Ų17185.7 Ų85.784%0.84243%0.434SS*.G310 helixtrans-60.4-32.1-178.9-151.1175.3109.700112.4L380L380-M382 PolarHBondContact O-N 3.38Å
383L52Low65Low39 Ų3981 Ų8120%0.20441%0.409CS..G310 helixtrans-89.9-2.6173.8-74.5165.7000114N381 R385 I386 S387 L396N381-L383 PolarHBondContact O-N 2.86Å; L383-R385 PolarHBondContact O-N 3.08Å; L383-I386 HydrophobicContact CD2-CD1 3.99Å; L383-I386 PolarHBondContact O-N 2.88Å; L383-S387 PolarHBondContact O-N 3.37Å; L383-L396 HydrophobicContact CD1-CD1 4.1Å; L383-L396 HydrophobicContact CD1-CD2 3.83Å; L383-L396 HydrophobicContact CD1-CG 4.04Å
384S53.2Low65.5Low50 Ų5077 Ų7735%0.3539%0.389SS..THydrogen-bonded Turntrans-62.9-27.4-178.170.70000113.1N381N381-S384 WeakPolarHBondContact O-CB 3.42Å; N381-S384 PolarHBondContact O-N 2.87Å; N381-S384 PolarHBondContact O-OG 3.25Å
385R54.5Low66.2Low240 Ų24079.4 Ų79.491%0.90640%0.401SS*.THydrogen-bonded Turntrans-75.4-22.5175.1-85.2-176.5173.6179.9-2.1114L383L383-R385 PolarHBondContact O-N 3.08Å
386I56.8Low67.2Low116 Ų11679 Ų7960%0.59539%0.391SS*.THydrogen-bonded Turntrans-97.9-27.3-169.8-67.1160.3000111.7L383L383-I386 HydrophobicContact CD2-CD1 3.99Å; L383-I386 PolarHBondContact O-N 2.88Å
387S53.3Low68Low28 Ų2874.5 Ų74.520%0.19637%0.368CS..  trans-154.6137.1-178.8-133.80000114.4L383 R391 R392L383-S387 PolarHBondContact O-N 3.37Å; S387-R391 WeakPolarHBondContact OG-CB 3.5Å; S387-R392 VanDerWaalsContact O-CG 3.25Å; S387-R392 WeakPolarHBondContact O-CG 3.34Å; S387-R392 PolarHBondContact O-NE 2.65Å; S387-R392 VanDerWaalsContact O-NE 3.16Å
388S59Low69Low72 Ų7272.5 Ų72.550%0.50336%0.355SS..  trans-68.6149170.654.20000111.1R391S388-R391 VanDerWaalsContact O-CB 3.25Å; S388-R391 WeakPolarHBondContact O-CB 3.12Å; S388-R391 PolarHBondContact O-N 3.42Å
389W55.8Low70.2Confident131 Ų13176 Ų7650%0.49637%0.372SS..THydrogen-bonded Turntrans-58.4138.1170.8-91.777.6000110.2E448W389-E448 VanDerWaalsContact CH2-OE1 3.3Å; W389-E448 WeakPolarHBondContact CH2-OE1 3.29Å; W389-E448 HydrophobicContact CZ3-CG 4.32Å; W389-E448 VanDerWaalsContact CZ3-OE1 3.26Å; W389-E448 WeakPolarHBondContact CZ3-OE1 3.36Å; W389-E448 VanDerWaalsContact CZ3-OE2 3.32Å; W389-E448 WeakPolarHBondContact CZ3-OE2 3.47Å
390P64.2Low71.5Confident48 Ų4872.1 Ų72.131%0.31235%0.35SS..THydrogen-bonded Turncis-91.77.71.535.7-35.3000115.4R392 R393 L445P390-R392 PolarHBondContact O-N 3.47Å; P390-R392 VanDerWaalsContact O-N 3.09Å; P390-R393 PolarHBondContact O-N 3.46Å; P390-L445 HydrophobicContact CB-CD1 4.47Å
391R71.1Confident72.8Confident128 Ų12867.8 Ų67.848%0.48333%0.328SS..Hα-helixtrans-61.3-23.6-171.7-59-177.5-158-156.93.6113.9S387 S388 I394 L395S387-R391 WeakPolarHBondContact OG-CB 3.5Å; S388-R391 VanDerWaalsContact O-CB 3.25Å; S388-R391 WeakPolarHBondContact O-CB 3.12Å; S388-R391 PolarHBondContact O-N 3.42Å; R391-I394 PolarHBondContact O-N 3.35Å; R391-L395 WeakPolarHBondContact O-CB 3.42Å; R391-L395 PolarHBondContact O-N 3.06Å
392R75.8Confident74.9Confident38 Ų3866.4 Ų66.414%0.14332%0.32CS..Hα-helixtrans-60.1-48.4177-58.9-172.7-142.1171.52.1112.8S387 P390 L395 L396S387-R392 VanDerWaalsContact O-CG 3.25Å; S387-R392 WeakPolarHBondContact O-CG 3.34Å; S387-R392 PolarHBondContact O-NE 2.65Å; S387-R392 VanDerWaalsContact O-NE 3.16Å; P390-R392 PolarHBondContact O-N 3.47Å; P390-R392 VanDerWaalsContact O-N 3.09Å; R392-L395 PolarHBondContact O-N 3Å; R392-L396 WeakPolarHBondContact O-CG 3.27Å; R392-L396 PolarHBondContact O-N 3.32Å; R392-L396 VanDerWaalsContact O-N 3.11Å
393R83.6Confident76.8Confident22 Ų2261.8 Ų61.88%0.08330%0.298CS..Hα-helixtrans-68.7-38.8-178.8-66.4-164.6-169.5-80.72.5111.2D379 P390 L395 L396 I397 L445 E448D379-R393 IonicContact OD1-NH2 2.75Å; P390-R393 PolarHBondContact O-N 3.46Å; R393-L395 VanDerWaalsContact C-N 3.34Å; R393-L395 PolarHBondContact O-N 3.46Å; R393-L396 PolarHBondContact O-N 2.94Å; R393-I397 VanDerWaalsContact O-CG1 3.26Å; R393-I397 WeakPolarHBondContact O-CG1 3.37Å; R393-I397 PolarHBondContact O-N 3.38Å; R393-L445 HydrophobicContact CB-CD1 4.47Å; R393-E448 WeakPolarHBondContact CD-OE2 3.25Å; R393-E448 IonicContact CZ-OE1 2.78Å; R393-E448 IonicContact CZ-OE2 2.83Å; R393-E448 IonicContact NE-OE1 3.74Å; R393-E448 PolarHBondContact NE-OE1 3.32Å; R393-E448 IonicContact NE-OE2 3.19Å; R393-E448 PolarHBondContact NE-OE2 3.32Å; R393-E448 IonicContact NH2-OE1 2.84Å; R393-E448 PolarHBondContact NH2-OE1 3.27Å
394I89.3Confident79Confident6 Ų660 Ų603%0.03129%0.288CS..Hα-helixtrans-57.3-49.5175.1-67.2169.8000110.2L318 R391 L396 I397 I398 L445 L504L318-I394 HydrophobicContact CD1-CD1 3.84Å; L318-I394 HydrophobicContact CD2-CD1 4.24Å; R391-I394 PolarHBondContact O-N 3.35Å; I394-L396 PolarHBondContact O-N 2.83Å; I394-I397 PolarHBondContact O-N 2.96Å; I394-I398 HydrophobicContact CG2-CD1 3.69Å; I394-I398 HydrophobicContact CG2-CG1 4.42Å; I394-I398 VanDerWaalsContact O-CG1 3.29Å; I394-I398 WeakPolarHBondContact O-CG1 3.29Å; I394-I398 PolarHBondContact O-N 3.34Å; I394-L445 HydrophobicContact CG1-CD1 4.37Å; I394-L445 HydrophobicContact CG1-CD2 3.9Å; I394-L504 HydrophobicContact CG1-CD1 4.39Å; I394-L504 HydrophobicContact CG2-CD1 4.38Å; I394-L504 HydrophobicContact CG2-CD2 4.31Å; I394-L504 HydrophobicContact CG2-CG 3.91Å
395L89.5Confident81.1Confident61 Ų6158.1 Ų58.132%0.31928%0.276SS..Hα-helixtrans-59.1-45.2178-17765000112.1R391 R392 R393 I397 I398 I399R391-L395 WeakPolarHBondContact O-CB 3.42Å; R391-L395 PolarHBondContact O-N 3.06Å; R392-L395 PolarHBondContact O-N 3Å; R393-L395 VanDerWaalsContact C-N 3.34Å; R393-L395 PolarHBondContact O-N 3.46Å; L395-I397 PolarHBondContact O-N 3.21Å; L395-I398 PolarHBondContact O-N 3.38Å; L395-I399 HydrophobicContact CD1-CD1 4.1Å; L395-I399 HydrophobicContact CD1-CG1 4.41Å; L395-I399 HydrophobicContact CG-CD1 3.9Å; L395-I399 WeakPolarHBondContact O-CG1 3.42Å; L395-I399 PolarHBondContact O-N 3.43Å
396L89.5Confident83.1Confident23 Ų2348.5 Ų48.512%0.1225%0.251CS..Hα-helixtrans-62.7-41.9177.4-71.7174.4000112.3V377 A378 L383 R392 R393 I394 I399 Q400 L441V377-L396 HydrophobicContact CG1-CD2 4.33Å; A378-L396 HydrophobicContact CB-CD1 3.87Å; L383-L396 HydrophobicContact CD1-CD1 4.1Å; L383-L396 HydrophobicContact CD1-CD2 3.83Å; L383-L396 HydrophobicContact CD1-CG 4.04Å; R392-L396 WeakPolarHBondContact O-CG 3.27Å; R392-L396 PolarHBondContact O-N 3.32Å; R392-L396 VanDerWaalsContact O-N 3.11Å; R393-L396 PolarHBondContact O-N 2.94Å; I394-L396 PolarHBondContact O-N 2.83Å; L396-I399 PolarHBondContact O-N 3.31Å; L396-Q400 WeakPolarHBondContact O-CB 3.42Å; L396-Q400 WeakPolarHBondContact O-CG 3.42Å; L396-Q400 PolarHBondContact O-N 2.9Å; L396-L441 HydrophobicContact CB-CD1 3.65Å
397I92.5Very high85.1Confident0 Ų044.2 Ų44.20%023%0.23CC..Hα-helixtrans-60.6-46.9175.6-69.5163.1000110.3V325 R393 I394 L395 Q400 M401 L441 L445 L504V325-I397 HydrophobicContact CG1-CG2 3.65Å; R393-I397 VanDerWaalsContact O-CG1 3.26Å; R393-I397 WeakPolarHBondContact O-CG1 3.37Å; R393-I397 PolarHBondContact O-N 3.38Å; I394-I397 PolarHBondContact O-N 2.96Å; L395-I397 PolarHBondContact O-N 3.21Å; I397-Q400 PolarHBondContact O-N 2.77Å; I397-M401 HydrophobicContact CG2-CG 4.4Å; I397-M401 WeakPolarHBondContact O-CB 3.33Å; I397-M401 WeakPolarHBondContact O-CG 3.48Å; I397-M401 PolarHBondContact O-N 3.26Å; I397-L441 HydrophobicContact CD1-CB 3.92Å; I397-L441 HydrophobicContact CG1-CB 3.46Å; I397-L441 VanDerWaalsContact CG1-CB 3.46Å; I397-L441 HydrophobicContact CG1-CD1 3.93Å; I397-L441 HydrophobicContact CG1-CG 4.35Å; I397-L445 HydrophobicContact CD1-CB 4.28Å; I397-L445 HydrophobicContact CD1-CD2 3.6Å; I397-L504 HydrophobicContact CB-CD2 4.43Å; I397-L504 HydrophobicContact CG2-CD2 3.92Å
398I94.3Very high87.1Confident25 Ų2542.9 Ų42.913%0.12822%0.221CC..Hα-helixtrans-60-50.8179.6-67.7166.1000110.2I394 L395 Q400 M401 L402 V501 L504I394-I398 HydrophobicContact CG2-CD1 3.69Å; I394-I398 HydrophobicContact CG2-CG1 4.42Å; I394-I398 VanDerWaalsContact O-CG1 3.29Å; I394-I398 WeakPolarHBondContact O-CG1 3.29Å; I394-I398 PolarHBondContact O-N 3.34Å; L395-I398 PolarHBondContact O-N 3.38Å; I398-Q400 PolarHBondContact O-N 3.21Å; I398-M401 PolarHBondContact O-N 2.98Å; I398-L402 HydrophobicContact CG2-CD1 3.81Å; I398-L402 HydrophobicContact CG2-CG 4.29Å; I398-L402 WeakPolarHBondContact O-CB 3.41Å; I398-L402 VanDerWaalsContact O-CG 3.3Å; I398-L402 WeakPolarHBondContact O-CG 3.44Å; I398-L402 PolarHBondContact O-N 2.91Å; I398-V501 HydrophobicContact CG1-CB 4.24Å; I398-V501 HydrophobicContact CG2-CG2 4.19Å; I398-L504 HydrophobicContact CG1-CD2 4.44Å
399I94.1Very high88.8Confident78 Ų7843 Ų4340%0.421%0.214SC..Hα-helixtrans-58.9-48.1-179.9-69.3169.5000110.7L395 L396 M401 L402 I403L395-I399 HydrophobicContact CD1-CD1 4.1Å; L395-I399 HydrophobicContact CD1-CG1 4.41Å; L395-I399 HydrophobicContact CG-CD1 3.9Å; L395-I399 WeakPolarHBondContact O-CG1 3.42Å; L395-I399 PolarHBondContact O-N 3.43Å; L396-I399 PolarHBondContact O-N 3.31Å; I399-M401 PolarHBondContact O-N 2.87Å; I399-L402 PolarHBondContact O-N 2.91Å; I399-I403 HydrophobicContact CG2-CD1 3.71Å; I399-I403 HydrophobicContact CG2-CG1 4.41Å; I399-I403 VanDerWaalsContact O-CG1 3.29Å; I399-I403 WeakPolarHBondContact O-CG1 3.43Å; I399-I403 PolarHBondContact O-N 3.37Å
400Q94.4Very high90.6Very high26 Ų2639.3 Ų39.312%0.12121%0.208CC..Hα-helixtrans-60.5-44.3-180-70.4-74.927.100112L396 I397 I398 I403 A404 T434 A438L396-Q400 WeakPolarHBondContact O-CB 3.42Å; L396-Q400 WeakPolarHBondContact O-CG 3.42Å; L396-Q400 PolarHBondContact O-N 2.9Å; I397-Q400 PolarHBondContact O-N 2.77Å; I398-Q400 PolarHBondContact O-N 3.21Å; Q400-I403 PolarHBondContact O-N 3.41Å; Q400-A404 WeakPolarHBondContact O-CB 3.27Å; Q400-A404 PolarHBondContact O-N 3.16Å; Q400-T434 VanDerWaalsContact OE1-CA 3.23Å; Q400-A438 HydrophobicContact CB-CB 4.12Å
401M96.6Very high92.1Very high1 Ų137.1 Ų37.11%0.00519%0.193CC..Hα-helixtrans-69-35179.4-73.9-62.2-65.100112.9V325 C328 A329 L332 I397 I398 I399 A404 S405 A438 C497 V501V325-M401 HydrophobicContact CG1-CG 3.89Å; V325-M401 HydrophobicContact CG1-SD 4.47Å; C328-M401 HydrophobicContact CB-CE 4.28Å; A329-M401 HydrophobicContact CB-CE 4.3Å; A329-M401 HydrophobicContact CB-SD 3.74Å; L332-M401 HydrophobicContact CD1-CE 4.36Å; I397-M401 HydrophobicContact CG2-CG 4.4Å; I397-M401 WeakPolarHBondContact O-CB 3.33Å; I397-M401 WeakPolarHBondContact O-CG 3.48Å; I397-M401 PolarHBondContact O-N 3.26Å; I398-M401 PolarHBondContact O-N 2.98Å; I399-M401 PolarHBondContact O-N 2.87Å; M401-A404 PolarHBondContact O-N 3.49Å; M401-S405 WeakPolarHBondContact O-CB 3.16Å; M401-S405 PolarHBondContact O-N 3.41Å; M401-A438 HydrophobicContact CG-CB 4.07Å; M401-A438 HydrophobicContact SD-CB 3.85Å; M401-C497 HydrophobicContact CE-CB 4.02Å; M401-V501 HydrophobicContact CB-CG1 3.45Å; M401-V501 VanDerWaalsContact CB-CG1 3.45Å; M401-V501 HydrophobicContact CG-CG1 4.05Å
402L97.1Very high93.1Very high91 Ų9131.1 Ų31.148%0.47617%0.171SC..Hα-helixtrans-68.5-41.8174.5-70.5176.7000111.8I398 I399 S405 G406 V501I398-L402 HydrophobicContact CG2-CD1 3.81Å; I398-L402 HydrophobicContact CG2-CG 4.29Å; I398-L402 WeakPolarHBondContact O-CB 3.41Å; I398-L402 VanDerWaalsContact O-CG 3.3Å; I398-L402 WeakPolarHBondContact O-CG 3.44Å; I398-L402 PolarHBondContact O-N 2.91Å; I399-L402 PolarHBondContact O-N 2.91Å; L402-S405 PolarHBondContact O-N 3.45Å; L402-G406 PolarHBondContact O-N 2.94Å; L402-V501 HydrophobicContact CD2-CG2 4.16Å; L402-V501 HydrophobicContact CG-CG2 4.45Å
403I97.2Very high93.8Very high75 Ų7537.1 Ų37.139%0.38519%0.194SC..Hα-helixtrans-62.8-45.4173.6-64.1168.1000109.9I399 Q400 S405 G406 T407 T430 T434I399-I403 HydrophobicContact CG2-CD1 3.71Å; I399-I403 HydrophobicContact CG2-CG1 4.41Å; I399-I403 VanDerWaalsContact O-CG1 3.29Å; I399-I403 WeakPolarHBondContact O-CG1 3.43Å; I399-I403 PolarHBondContact O-N 3.37Å; Q400-I403 PolarHBondContact O-N 3.41Å; I403-S405 VanDerWaalsContact C-N 3.35Å; I403-S405 PolarHBondContact O-N 3.49Å; I403-G406 PolarHBondContact O-N 3.17Å; I403-T407 HydrophobicContact CG2-CG2 4.16Å; I403-T407 WeakPolarHBondContact O-CB 3.29Å; I403-T407 VanDerWaalsContact O-CG2 3.29Å; I403-T407 WeakPolarHBondContact O-CG2 3.48Å; I403-T407 PolarHBondContact O-N 2.98Å; I403-T407 PolarHBondContact O-OG1 2.75Å; I403-T430 HydrophobicContact CG2-CG2 4.05Å; I403-T434 HydrophobicContact CB-CG2 3.99Å; I403-T434 HydrophobicContact CG2-CG2 3.59Å
404A97.5Very high94.2Very high0 Ų037.4 Ų37.40%020%0.197CC..Hα-helixtrans-58.8-44.7176.200000111.9Q400 M401 T407 L408 L431 V435Q400-A404 WeakPolarHBondContact O-CB 3.27Å; Q400-A404 PolarHBondContact O-N 3.16Å; M401-A404 PolarHBondContact O-N 3.49Å; A404-T407 WeakPolarHBondContact CA-OG1 3.35Å; A404-T407 PolarHBondContact O-OG1 3.16Å; A404-L408 VanDerWaalsContact O-CB 3.29Å; A404-L408 WeakPolarHBondContact O-CB 3.46Å; A404-L408 PolarHBondContact O-N 3.29Å; A404-L431 WeakPolarHBondContact O-CD2 3.24Å; A404-V435 HydrophobicContact CB-CG2 3.76Å
405S97.1Very high94Very high12 Ų1237.2 Ų37.28%0.08420%0.196CC..Hα-helixtrans-60.5-53.6176178.80000111.6M401 L402 I403 T407 L408 M409 G494M401-S405 WeakPolarHBondContact O-CB 3.16Å; M401-S405 PolarHBondContact O-N 3.41Å; L402-S405 PolarHBondContact O-N 3.45Å; I403-S405 VanDerWaalsContact C-N 3.35Å; I403-S405 PolarHBondContact O-N 3.49Å; S405-T407 VanDerWaalsContact C-N 3.34Å; S405-T407 PolarHBondContact O-N 3.19Å; S405-L408 PolarHBondContact O-N 2.85Å; S405-M409 VanDerWaalsContact O-CG 3.24Å; S405-M409 WeakPolarHBondContact O-CG 3.42Å; S405-M409 PolarHBondContact O-N 2.8Å; S405-G494 PolarHBondContact OG-O 3.43Å
406G96.8Very high93.7Very high37 Ų3738 Ų3838%0.38120%0.2SC..Hα-helixtrans-61.5-40.5-178.900000112.8L402 I403 M409 C410L402-G406 PolarHBondContact O-N 2.94Å; I403-G406 PolarHBondContact O-N 3.17Å; G406-M409 PolarHBondContact O-N 2.97Å; G406-C410 VanDerWaalsContact O-CB 3.31Å; G406-C410 WeakPolarHBondContact O-CB 3.38Å; G406-C410 PolarHBondContact O-N 3.05Å
407T97.3Very high93.5Very high27 Ų2742 Ų4217%0.16622%0.218CC..Hα-helixtrans-68-36.5176.949.80000112.6I403 A404 S405 C410 L411 T430 L431I403-T407 HydrophobicContact CG2-CG2 4.16Å; I403-T407 WeakPolarHBondContact O-CB 3.29Å; I403-T407 VanDerWaalsContact O-CG2 3.29Å; I403-T407 WeakPolarHBondContact O-CG2 3.48Å; I403-T407 PolarHBondContact O-N 2.98Å; I403-T407 PolarHBondContact O-OG1 2.75Å; A404-T407 WeakPolarHBondContact CA-OG1 3.35Å; A404-T407 PolarHBondContact O-OG1 3.16Å; S405-T407 VanDerWaalsContact C-N 3.34Å; S405-T407 PolarHBondContact O-N 3.19Å; T407-C410 WeakPolarHBondContact O-CB 3.48Å; T407-C410 PolarHBondContact O-N 3.35Å; T407-L411 WeakPolarHBondContact O-CB 3.24Å; T407-L411 PolarHBondContact O-N 3.37Å; T407-T430 HydrophobicContact CG2-CG2 3.87Å; T407-L431 WeakPolarHBondContact OG1-CD2 3.45Å
408L96Very high92.9Very high0 Ų046.7 Ų46.70%024%0.243CC..Hα-helixtrans-71.3-37176.5-159.769.5000112.4L332 I336 A404 S405 C410 L411 S412 L431 F490 A493L332-L408 HydrophobicContact CD2-CD2 3.63Å; I336-L408 HydrophobicContact CD1-CD1 3.91Å; I336-L408 HydrophobicContact CG1-CD1 3.98Å; A404-L408 VanDerWaalsContact O-CB 3.29Å; A404-L408 WeakPolarHBondContact O-CB 3.46Å; A404-L408 PolarHBondContact O-N 3.29Å; S405-L408 PolarHBondContact O-N 2.85Å; L408-C410 VanDerWaalsContact C-N 3.35Å; L408-L411 HydrophobicContact CD1-CD2 4.07Å; L408-L411 WeakPolarHBondContact O-CB 3.4Å; L408-L411 PolarHBondContact O-N 2.82Å; L408-S412 PolarHBondContact O-N 3.34Å; L408-S412 PolarHBondContact O-OG 3.05Å; L408-L431 HydrophobicContact CB-CD2 4.11Å; L408-L431 HydrophobicContact CD1-CD1 3.86Å; L408-L431 HydrophobicContact CD1-CD2 4.08Å; L408-F490 HydrophobicContact CD1-CD1 3.86Å; L408-F490 HydrophobicContact CD2-CD1 4.21Å; L408-F490 WeakPolarHBondContact CD2-O 3.33Å; L408-F490 HydrophobicContact CG-CB 4.35Å; L408-F490 HydrophobicContact CG-CD1 4.26Å; L408-A493 HydrophobicContact CD2-CB 4.15Å
409M94.7Very high92.6Very high73 Ų7346 Ų4636%0.3624%0.242SC..Hα-helixtrans-63.3-43.5171.3-66173.969.800110.8S405 G406 S412 W413 L491 I495S405-M409 VanDerWaalsContact O-CG 3.24Å; S405-M409 WeakPolarHBondContact O-CG 3.42Å; S405-M409 PolarHBondContact O-N 2.8Å; G406-M409 PolarHBondContact O-N 2.97Å; M409-S412 WeakPolarHBondContact O-CB 3.46Å; M409-S412 PolarHBondContact O-N 2.99Å; M409-W413 PolarHBondContact O-N 3.39Å; M409-W413 VanDerWaalsContact O-N 3.14Å; M409-L491 HydrophobicContact CB-CD1 4.11Å; M409-L491 HydrophobicContact CE-CD1 4.31Å; M409-L491 HydrophobicContact CG-CD1 3.97Å; M409-I495 HydrophobicContact CE-CG1 4.09Å; M409-I495 HydrophobicContact SD-CG1 4.15Å
410C95Very high92.4Very high54 Ų5445 Ų4537%0.36524%0.242SC..Hα-helixtrans-61-45.3175.1-172.40000112G406 T407 L408 S412 W413 I414G406-C410 VanDerWaalsContact O-CB 3.31Å; G406-C410 WeakPolarHBondContact O-CB 3.38Å; G406-C410 PolarHBondContact O-N 3.05Å; T407-C410 WeakPolarHBondContact O-CB 3.48Å; T407-C410 PolarHBondContact O-N 3.35Å; L408-C410 VanDerWaalsContact C-N 3.35Å; C410-S412 VanDerWaalsContact C-N 3.32Å; C410-S412 PolarHBondContact O-N 3.19Å; C410-W413 PolarHBondContact O-N 3.43Å; C410-I414 WeakPolarHBondContact O-CB 3.37Å; C410-I414 WeakPolarHBondContact O-CG1 3.22Å; C410-I414 PolarHBondContact O-N 2.85Å; C410-I414 WeakPolarHBondContact SG-CD1 3.3Å
411L95Very high92.4Very high2 Ų247 Ų471%0.0125%0.253CS..Hα-helixtrans-55.7-47.3174.2179.469000111.6L340 M343 T407 L408 W413 I414 T415 L424 I427 L431L340-L411 HydrophobicContact CD1-CD2 3.58Å; M343-L411 HydrophobicContact CE-CD2 4.39Å; M343-L411 HydrophobicContact CE-CG 4.47Å; T407-L411 WeakPolarHBondContact O-CB 3.24Å; T407-L411 PolarHBondContact O-N 3.37Å; L408-L411 HydrophobicContact CD1-CD2 4.07Å; L408-L411 WeakPolarHBondContact O-CB 3.4Å; L408-L411 PolarHBondContact O-N 2.82Å; L411-W413 PolarHBondContact O-N 3.33Å; L411-I414 PolarHBondContact O-N 2.87Å; L411-T415 HydrophobicContact CD1-CG2 3.75Å; L411-T415 HydrophobicContact CG-CG2 4.14Å; L411-T415 WeakPolarHBondContact O-CB 3.39Å; L411-T415 WeakPolarHBondContact O-CG2 3.35Å; L411-T415 PolarHBondContact O-N 2.89Å; L411-T415 PolarHBondContact O-OG1 3.1Å; L411-L424 HydrophobicContact CD1-CD2 3.85Å; L411-I427 HydrophobicContact CB-CG2 3.93Å; L411-I427 HydrophobicContact CD1-CG2 3.96Å; L411-I427 HydrophobicContact CG-CG2 4.39Å; L411-L431 HydrophobicContact CD2-CD1 4.21Å
412S91.6Very high92.3Very high3 Ų351.4 Ų51.42%0.02128%0.28CS..Hα-helixtrans-59.8-38.5-178.3-57.80000111.2L408 M409 C410 T415 N416 S487 F490 L491L408-S412 PolarHBondContact O-N 3.34Å; L408-S412 PolarHBondContact O-OG 3.05Å; M409-S412 WeakPolarHBondContact O-CB 3.46Å; M409-S412 PolarHBondContact O-N 2.99Å; C410-S412 VanDerWaalsContact C-N 3.32Å; C410-S412 PolarHBondContact O-N 3.19Å; S412-T415 PolarHBondContact O-OG1 3.03Å; S412-N416 PolarHBondContact O-ND2 3.44Å; S412-S487 WeakPolarHBondContact CB-O 3.25Å; S412-S487 PolarHBondContact O-OG 3.07Å; S412-S487 PolarHBondContact OG-O 3.2Å; S412-F490 WeakPolarHBondContact OG-CB 3.35Å; S412-L491 PolarHBondContact OG-N 3.49Å; S412-L491 VanDerWaalsContact OG-N 3.11Å
413W90.7Very high92.2Very high163 Ų16350.7 Ų50.762%0.61728%0.276SS*.Hα-helixtrans-73.6-52.2175.6-174.273000112.6M409 C410 L411 T415 N416 H417M409-W413 PolarHBondContact O-N 3.39Å; M409-W413 VanDerWaalsContact O-N 3.14Å; C410-W413 PolarHBondContact O-N 3.43Å; L411-W413 PolarHBondContact O-N 3.33Å; W413-T415 VanDerWaalsContact C-N 3.3Å; W413-T415 PolarHBondContact O-N 2.98Å; W413-N416 WeakPolarHBondContact O-CB 3.41Å; W413-N416 PolarHBondContact O-N 3.42Å; W413-H417 AromaticContact CD2-CD2 3.94Å; W413-H417 AromaticContact CE2-CD2 3.56Å; W413-H417 AromaticContact CE2-NE2 3.58Å; W413-H417 AromaticContact CZ2-CD2 3.79Å; W413-H417 AromaticContact CZ2-NE2 3.76Å; W413-H417 AromaticContact NE1-CD2 3.76Å; W413-H417 AromaticContact NE1-NE2 3.44Å; W413-H417 PolarHBondContact NE1-NE2 3Å; W413-H417 PolarHBondContact O-CD2 3.36Å
414I91.1Very high92.2Very high29 Ų2947.1 Ų47.115%0.14926%0.257CS..Hα-helixtrans-62.3-34-174.7-76.4-179.7000112.7C410 L411 N416 H417 A419 I423 I427C410-I414 WeakPolarHBondContact O-CB 3.37Å; C410-I414 WeakPolarHBondContact O-CG1 3.22Å; C410-I414 PolarHBondContact O-N 2.85Å; C410-I414 WeakPolarHBondContact SG-CD1 3.3Å; L411-I414 PolarHBondContact O-N 2.87Å; I414-N416 PolarHBondContact O-N 3.21Å; I414-H417 CarbonylContact O-C 3.36Å; I414-H417 WeakPolarHBondContact O-CA 3.26Å; I414-H417 PolarHBondContact O-N 2.95Å; I414-A419 HydrophobicContact CG2-CB 3.21Å; I414-I423 HydrophobicContact CD1-CG2 4.18Å; I414-I423 HydrophobicContact CG2-CG2 4.31Å; I414-I427 HydrophobicContact CD1-CD1 4.01Å
415T86.4Confident92.1Very high1 Ų149.6 Ų49.61%0.00627%0.27CS..THydrogen-bonded Turntrans-65-17.8177.948.80000113.3M343 L344 N347 L411 S412 W413 L424M343-T415 HydrophobicContact CE-CG2 3.59Å; L344-T415 HydrophobicContact CD2-CG2 4.2Å; N347-T415 PolarHBondContact ND2-O 2.81Å; L411-T415 HydrophobicContact CD1-CG2 3.75Å; L411-T415 HydrophobicContact CG-CG2 4.14Å; L411-T415 WeakPolarHBondContact O-CB 3.39Å; L411-T415 WeakPolarHBondContact O-CG2 3.35Å; L411-T415 PolarHBondContact O-N 2.89Å; L411-T415 PolarHBondContact O-OG1 3.1Å; S412-T415 PolarHBondContact O-OG1 3.03Å; W413-T415 VanDerWaalsContact C-N 3.3Å; W413-T415 PolarHBondContact O-N 2.98Å; T415-L424 HydrophobicContact CG2-CD2 4.13Å
416N82.9Confident92.1Very high77 Ų7753.9 Ų53.941%0.41229%0.292SS..THydrogen-bonded Turntrans-84.6-12.3171-63.7-38.6000112.9R349 S412 W413 I414 S487R349-N416 PolarHBondContact NE-O 3.41Å; R349-N416 PolarHBondContact NH2-O 3.29Å; S412-N416 PolarHBondContact O-ND2 3.44Å; W413-N416 WeakPolarHBondContact O-CB 3.41Å; W413-N416 PolarHBondContact O-N 3.42Å; I414-N416 PolarHBondContact O-N 3.21Å; N416-S487 PolarHBondContact ND2-OG 3.4Å
417H85.7Confident92.1Very high107 Ų10753 Ų5350%0.49528%0.278SS..THydrogen-bonded Turntrans-117.631.8-170.5-70.3-71.9000115.1W413 I414W413-H417 AromaticContact CD2-CD2 3.94Å; W413-H417 AromaticContact CE2-CD2 3.56Å; W413-H417 AromaticContact CE2-NE2 3.58Å; W413-H417 AromaticContact CZ2-CD2 3.79Å; W413-H417 AromaticContact CZ2-NE2 3.76Å; W413-H417 AromaticContact NE1-CD2 3.76Å; W413-H417 AromaticContact NE1-NE2 3.44Å; W413-H417 PolarHBondContact NE1-NE2 3Å; W413-H417 PolarHBondContact O-CD2 3.36Å; I414-H417 CarbonylContact O-C 3.36Å; I414-H417 WeakPolarHBondContact O-CA 3.26Å; I414-H417 PolarHBondContact O-N 2.95Å
418N79.5Confident92.1Very high99 Ų9951.7 Ų51.753%0.52927%0.27SS..THydrogen-bonded Turntrans51.763.4-178.6-107.8-2.2000113.6R349 S420R349-N418 WeakPolarHBondContact CD-OD1 3.46Å; R349-N418 PolarHBondContact NH1-ND2 3.35Å; R349-N418 VanDerWaalsContact NH1-ND2 3.16Å; N418-S420 PolarHBondContact O-N 3.41Å
419A87Confident92.2Very high11 Ų1154.5 Ų54.59%0.09129%0.285CS..  trans-56.8133.7170.300000111.5Y351 I414 L424Y351-A419 WeakPolarHBondContact OH-CB 3.45Å; Y351-A419 PolarHBondContact OH-N 3.47Å; Y351-A419 PolarHBondContact OH-O 3.16Å; I414-A419 HydrophobicContact CG2-CB 3.21Å; A419-L424 HydrophobicContact CB-CD1 4.1Å; A419-L424 HydrophobicContact CB-CD2 3.68Å; A419-L424 HydrophobicContact CB-CG 3.68Å
420S91.5Very high92.3Very high58 Ų5853.1 Ų53.141%0.40628%0.28SS..  trans-68.3153166.968.80000110.5N418 T422 I423 L424N418-S420 PolarHBondContact O-N 3.41Å; S420-T422 PolarHBondContact O-N 3.04Å; S420-I423 PolarHBondContact O-N 3.45Å; S420-I423 WeakPolarHBondContact OG-CD1 3.43Å; S420-I423 WeakPolarHBondContact OG-CG1 3.44Å; S420-L424 PolarHBondContact O-N 3.48Å; S420-L424 VanDerWaalsContact O-N 3.16Å
421L93.5Very high92.4Very high66 Ų6650.5 Ų50.535%0.34626%0.263SS..Hα-helixtrans-53.4-43.7177.317464.4000111.4T355 L358 V359 I423 L424 L425T355-L421 HydrophobicContact CG2-CD1 3.72Å; L358-L421 HydrophobicContact CD1-CD2 4.4Å; V359-L421 HydrophobicContact CG2-CD1 4.21Å; L421-I423 VanDerWaalsContact C-N 3.33Å; L421-I423 PolarHBondContact O-N 2.96Å; L421-L424 PolarHBondContact O-N 2.97Å; L421-L424 VanDerWaalsContact O-N 3.16Å; L421-L425 HydrophobicContact CD1-CD1 4.17Å; L421-L425 HydrophobicContact CD1-CD2 4.36Å; L421-L425 HydrophobicContact CD1-CG 4.04Å; L421-L425 HydrophobicContact CG-CD1 3.95Å; L421-L425 HydrophobicContact CG-CG 4.25Å; L421-L425 WeakPolarHBondContact O-CG 3.29Å; L421-L425 PolarHBondContact O-N 3.27Å
422T95.3Very high92.5Very high95 Ų9550.4 Ų50.458%0.58326%0.262SS*.Hα-helixtrans-59.1-43.4-178.6-440000112.2S420 L425 I426S420-T422 PolarHBondContact O-N 3.04Å; T422-L425 PolarHBondContact O-N 3.31Å; T422-I426 HydrophobicContact CG2-CD1 4.31Å; T422-I426 WeakPolarHBondContact O-CG1 3.35Å; T422-I426 PolarHBondContact O-N 3.05Å
423I95.3Very high92.7Very high75 Ų7552.3 Ų52.339%0.38527%0.272SS..Hα-helixtrans-64.8-44177.5-67.5170000110.2I414 S420 L421 L425 I426 I427I414-I423 HydrophobicContact CD1-CG2 4.18Å; I414-I423 HydrophobicContact CG2-CG2 4.31Å; S420-I423 PolarHBondContact O-N 3.45Å; S420-I423 WeakPolarHBondContact OG-CD1 3.43Å; S420-I423 WeakPolarHBondContact OG-CG1 3.44Å; L421-I423 VanDerWaalsContact C-N 3.33Å; L421-I423 PolarHBondContact O-N 2.96Å; I423-L425 VanDerWaalsContact C-N 3.31Å; I423-L425 PolarHBondContact O-N 3.38Å; I423-I426 PolarHBondContact O-N 3.01Å; I423-I427 HydrophobicContact CG2-CD1 3.75Å; I423-I427 HydrophobicContact CG2-CG1 4.4Å; I423-I427 WeakPolarHBondContact O-CG1 3.43Å; I423-I427 PolarHBondContact O-N 3.21Å
424L95.7Very high92.9Very high0 Ų044.8 Ų44.80%024%0.243CC..Hα-helixtrans-61.7-39.1177.6-67.1174000112.1L344 Y351 T355 V359 L411 T415 A419 S420 L421 S428L344-L424 HydrophobicContact CD1-CD1 4.49Å; L344-L424 HydrophobicContact CD2-CD1 4.06Å; L344-L424 HydrophobicContact CD2-CD2 4.39Å; Y351-L424 HydrophobicContact CD1-CD1 4.35Å; Y351-L424 HydrophobicContact CE1-CD1 3.83Å; T355-L424 HydrophobicContact CG2-CD1 4.24Å; V359-L424 HydrophobicContact CG2-CB 3.6Å; V359-L424 HydrophobicContact CG2-CD1 4.42Å; L411-L424 HydrophobicContact CD1-CD2 3.85Å; T415-L424 HydrophobicContact CG2-CD2 4.13Å; A419-L424 HydrophobicContact CB-CD1 4.1Å; A419-L424 HydrophobicContact CB-CD2 3.68Å; A419-L424 HydrophobicContact CB-CG 3.68Å; S420-L424 PolarHBondContact O-N 3.48Å; S420-L424 VanDerWaalsContact O-N 3.16Å; L421-L424 PolarHBondContact O-N 2.97Å; L421-L424 VanDerWaalsContact O-N 3.16Å; L424-S428 WeakPolarHBondContact O-CB 3.24Å; L424-S428 PolarHBondContact O-N 3.44Å
425L96.9Very high93.2Very high52 Ų5243.4 Ų43.427%0.27224%0.236SC..Hα-helixtrans-64.9-44.5176.1-67.7174.4000111.8L358 V359 S362 L421 T422 I423 S428 L429L358-L425 HydrophobicContact CB-CD2 4.13Å; V359-L425 HydrophobicContact CG2-CD2 4.08Å; S362-L425 PolarHBondContact OG-O 2.95Å; L421-L425 HydrophobicContact CD1-CD1 4.17Å; L421-L425 HydrophobicContact CD1-CD2 4.36Å; L421-L425 HydrophobicContact CD1-CG 4.04Å; L421-L425 HydrophobicContact CG-CD1 3.95Å; L421-L425 HydrophobicContact CG-CG 4.25Å; L421-L425 WeakPolarHBondContact O-CG 3.29Å; L421-L425 PolarHBondContact O-N 3.27Å; T422-L425 PolarHBondContact O-N 3.31Å; I423-L425 VanDerWaalsContact C-N 3.31Å; I423-L425 PolarHBondContact O-N 3.38Å; L425-S428 PolarHBondContact O-N 2.9Å; L425-L429 VanDerWaalsContact O-CB 3.29Å; L425-L429 WeakPolarHBondContact O-CB 3.3Å; L425-L429 PolarHBondContact O-N 2.62Å
426I97.1Very high93.5Very high103 Ų10344 Ų4453%0.52824%0.239SC..Hα-helixtrans-63.2-45.7178.3-67.5166.3000111T422 I423 S428 L429 T430T422-I426 HydrophobicContact CG2-CD1 4.31Å; T422-I426 WeakPolarHBondContact O-CG1 3.35Å; T422-I426 PolarHBondContact O-N 3.05Å; I423-I426 PolarHBondContact O-N 3.01Å; I426-S428 VanDerWaalsContact C-N 3.35Å; I426-L429 PolarHBondContact O-N 3.27Å; I426-T430 WeakPolarHBondContact O-CB 3.37Å; I426-T430 PolarHBondContact O-N 2.84Å; I426-T430 PolarHBondContact O-OG1 2.81Å
427I96.6Very high93.9Very high17 Ų1740.3 Ų40.39%0.08722%0.22CC..Hα-helixtrans-61.2-47.3177.7-70.8172.8000110.2L411 I414 I423 T430 L431L411-I427 HydrophobicContact CB-CG2 3.93Å; L411-I427 HydrophobicContact CD1-CG2 3.96Å; L411-I427 HydrophobicContact CG-CG2 4.39Å; I414-I427 HydrophobicContact CD1-CD1 4.01Å; I423-I427 HydrophobicContact CG2-CD1 3.75Å; I423-I427 HydrophobicContact CG2-CG1 4.4Å; I423-I427 WeakPolarHBondContact O-CG1 3.43Å; I423-I427 PolarHBondContact O-N 3.21Å; I427-T430 PolarHBondContact O-N 3.41Å; I427-L431 HydrophobicContact CG2-CD1 3.92Å; I427-L431 HydrophobicContact CG2-CG 4.45Å; I427-L431 WeakPolarHBondContact O-CG 3.2Å; I427-L431 PolarHBondContact O-N 2.95Å
428S96.9Very high94.3Very high1 Ų135.2 Ų35.21%0.00720%0.196CC..Hα-helixtrans-61.3-46.7-179.9-168.90000112.5V359 Y363 L424 L425 I426 T430 L431 G432V359-S428 PolarHBondContact O-OG 2.82Å; Y363-S428 WeakPolarHBondContact CA-O 3.28Å; Y363-S428 WeakPolarHBondContact CA-OG 3.31Å; Y363-S428 WeakPolarHBondContact CB-OG 3.41Å; Y363-S428 PolarHBondContact N-OG 3.32Å; Y363-S428 VanDerWaalsContact N-OG 3.07Å; L424-S428 WeakPolarHBondContact O-CB 3.24Å; L424-S428 PolarHBondContact O-N 3.44Å; L425-S428 PolarHBondContact O-N 2.9Å; I426-S428 VanDerWaalsContact C-N 3.35Å; S428-T430 VanDerWaalsContact C-N 3.32Å; S428-T430 PolarHBondContact O-N 3.35Å; S428-L431 PolarHBondContact O-N 2.92Å; S428-G432 PolarHBondContact O-N 3.41Å
429L97.2Very high95Very high59 Ų5932.2 Ų32.231%0.30918%0.18SC..Hα-helixtrans-58.9-44.1175.5-172.474.1000111.5F365 L425 I426 G432 I433F365-L429 HydrophobicContact CD1-CD1 3.86Å; L425-L429 VanDerWaalsContact O-CB 3.29Å; L425-L429 WeakPolarHBondContact O-CB 3.3Å; L425-L429 PolarHBondContact O-N 2.62Å; I426-L429 PolarHBondContact O-N 3.27Å; L429-G432 PolarHBondContact O-N 3.42Å; L429-I433 HydrophobicContact CG-CD1 4.2Å; L429-I433 WeakPolarHBondContact O-CG1 3.45Å; L429-I433 PolarHBondContact O-N 3.16Å
430T97.3Very high95Very high43 Ų4333.7 Ų33.726%0.26419%0.192SC..Hα-helixtrans-64.5-44179.3-54.50000111.3I403 T407 I426 I427 S428 G432 I433 T434I403-T430 HydrophobicContact CG2-CG2 4.05Å; T407-T430 HydrophobicContact CG2-CG2 3.87Å; I426-T430 WeakPolarHBondContact O-CB 3.37Å; I426-T430 PolarHBondContact O-N 2.84Å; I426-T430 PolarHBondContact O-OG1 2.81Å; I427-T430 PolarHBondContact O-N 3.41Å; S428-T430 VanDerWaalsContact C-N 3.32Å; S428-T430 PolarHBondContact O-N 3.35Å; T430-G432 VanDerWaalsContact C-N 3.29Å; T430-G432 PolarHBondContact O-N 3.27Å; T430-I433 PolarHBondContact O-N 3.5Å; T430-T434 HydrophobicContact CG2-CG2 4.19Å; T430-T434 WeakPolarHBondContact O-CB 3.39Å; T430-T434 WeakPolarHBondContact O-CG2 3.49Å; T430-T434 PolarHBondContact O-N 3.37Å; T430-T434 PolarHBondContact O-OG1 2.92Å
431L97.5Very high94.9Very high0 Ų031.1 Ų31.10%017%0.174CC..Hα-helixtrans-59.4-41.5173.2-75.3169.8000111.4I336 Y363 A404 T407 L408 L411 I427 S428 T434 V435I336-L431 HydrophobicContact CD1-CB 4.38Å; I336-L431 HydrophobicContact CD1-CD1 4.35Å; I336-L431 HydrophobicContact CD1-CD2 4.09Å; Y363-L431 HydrophobicContact CD2-CB 3.92Å; Y363-L431 HydrophobicContact CE2-CB 3.96Å; A404-L431 WeakPolarHBondContact O-CD2 3.24Å; T407-L431 WeakPolarHBondContact OG1-CD2 3.45Å; L408-L431 HydrophobicContact CB-CD2 4.11Å; L408-L431 HydrophobicContact CD1-CD1 3.86Å; L408-L431 HydrophobicContact CD1-CD2 4.08Å; L411-L431 HydrophobicContact CD2-CD1 4.21Å; I427-L431 HydrophobicContact CG2-CD1 3.92Å; I427-L431 HydrophobicContact CG2-CG 4.45Å; I427-L431 WeakPolarHBondContact O-CG 3.2Å; I427-L431 PolarHBondContact O-N 2.95Å; S428-L431 PolarHBondContact O-N 2.92Å; L431-T434 WeakPolarHBondContact CA-OG1 3.37Å; L431-T434 PolarHBondContact O-OG1 3.02Å; L431-V435 VanDerWaalsContact O-CB 3.24Å; L431-V435 WeakPolarHBondContact O-CB 3.46Å; L431-V435 VanDerWaalsContact O-CG2 3.27Å; L431-V435 WeakPolarHBondContact O-CG2 3.49Å; L431-V435 PolarHBondContact O-N 3.08Å
432G96.6Very high94.9Very high0 Ų028 Ų280%016%0.157CC..Hα-helixtrans-59.5-51.9176.400000112.4Y363 G366 S428 L429 T430 T434 I436Y363-G432 WeakPolarHBondContact O-CA 3.41Å; G366-G432 VanDerWaalsContact C-C 3.43Å; G366-G432 CarbonylContact O-C 3.55Å; S428-G432 PolarHBondContact O-N 3.41Å; L429-G432 PolarHBondContact O-N 3.42Å; T430-G432 VanDerWaalsContact C-N 3.29Å; T430-G432 PolarHBondContact O-N 3.27Å; G432-T434 PolarHBondContact O-N 3.13Å; G432-I436 WeakPolarHBondContact O-CB 3.35Å; G432-I436 PolarHBondContact O-N 3.35Å
433I95.2Very high94.4Very high43 Ų4323.8 Ų23.822%0.22113%0.133CC..Hα-helixtrans-59.9-47.2-179.8-69.4168.2000110.9G366 V369 L429 T430 G437G366-I433 VanDerWaalsContact O-CA 3.3Å; G366-I433 WeakPolarHBondContact O-CA 3.32Å; G366-I433 VanDerWaalsContact O-CG1 3.26Å; G366-I433 WeakPolarHBondContact O-CG1 3.46Å; G366-I433 PolarHBondContact O-N 3.41Å; V369-I433 HydrophobicContact CB-CG1 4.32Å; V369-I433 HydrophobicContact CG1-CD1 4.22Å; V369-I433 HydrophobicContact CG1-CG1 4.24Å; L429-I433 HydrophobicContact CG-CD1 4.2Å; L429-I433 WeakPolarHBondContact O-CG1 3.45Å; L429-I433 PolarHBondContact O-N 3.16Å; T430-I433 PolarHBondContact O-N 3.5Å; I433-G437 WeakPolarHBondContact O-CA 3.49Å; I433-G437 PolarHBondContact O-N 3.36Å
434T95.9Very high94Very high4 Ų423 Ų233%0.02513%0.132CC..Hα-helixtrans-75.6-48.9-170.854.50000112.5Q400 I403 T430 L431 G432 A438Q400-T434 VanDerWaalsContact OE1-CA 3.23Å; I403-T434 HydrophobicContact CB-CG2 3.99Å; I403-T434 HydrophobicContact CG2-CG2 3.59Å; T430-T434 HydrophobicContact CG2-CG2 4.19Å; T430-T434 WeakPolarHBondContact O-CB 3.39Å; T430-T434 WeakPolarHBondContact O-CG2 3.49Å; T430-T434 PolarHBondContact O-N 3.37Å; T430-T434 PolarHBondContact O-OG1 2.92Å; L431-T434 WeakPolarHBondContact CA-OG1 3.37Å; L431-T434 PolarHBondContact O-OG1 3.02Å; G432-T434 PolarHBondContact O-N 3.13Å; T434-A438 WeakPolarHBondContact O-CB 3.36Å; T434-A438 PolarHBondContact O-N 2.88Å
435V96.8Very high93.7Very high0 Ų023 Ų230%013%0.132CC..Hα-helixtrans-67.4-47.8-177.5174.50000111.2A329 L332 R333 I336 A404 L431 A438 I439A329-V435 WeakPolarHBondContact O-CG1 3.38Å; L332-V435 HydrophobicContact CB-CG1 3.89Å; L332-V435 HydrophobicContact CB-CG2 4.15Å; L332-V435 HydrophobicContact CD1-CG2 4.22Å; R333-V435 HydrophobicContact CB-CG1 4.09Å; I336-V435 HydrophobicContact CD1-CG2 4.17Å; A404-V435 HydrophobicContact CB-CG2 3.76Å; L431-V435 VanDerWaalsContact O-CB 3.24Å; L431-V435 WeakPolarHBondContact O-CB 3.46Å; L431-V435 VanDerWaalsContact O-CG2 3.27Å; L431-V435 WeakPolarHBondContact O-CG2 3.49Å; L431-V435 PolarHBondContact O-N 3.08Å; V435-A438 PolarHBondContact O-N 3.44Å; V435-I439 HydrophobicContact CG1-CD1 4.44Å; V435-I439 WeakPolarHBondContact O-CG1 3.24Å; V435-I439 PolarHBondContact O-N 3.47Å; V435-I439 VanDerWaalsContact O-N 3.13Å
436I93.2Very high93.3Very high13 Ų1320.6 Ų20.67%0.06712%0.119CC..Hα-helixtrans-74.4-33.8-177.8-68.1159.6000110.9R333 G367 G432 I439 A440R333-I436 VanDerWaalsContact CD-CG1 3.41Å; G367-I436 WeakPolarHBondContact O-CG2 3.36Å; G432-I436 WeakPolarHBondContact O-CB 3.35Å; G432-I436 PolarHBondContact O-N 3.35Å; I436-I439 PolarHBondContact O-N 2.96Å; I436-A440 PolarHBondContact O-N 3.38Å; I436-A440 VanDerWaalsContact O-N 3.08Å
437G92Very high92.7Very high0 Ų018.3 Ų18.30%011%0.11CC..Hα-helixtrans-58.7-44.3169.100000112.6I433 I439 A440 L441I433-G437 WeakPolarHBondContact O-CA 3.49Å; I433-G437 PolarHBondContact O-N 3.36Å; G437-I439 PolarHBondContact O-N 3.24Å; G437-A440 PolarHBondContact O-N 3.4Å; G437-L441 PolarHBondContact O-N 3.39Å; G437-L441 VanDerWaalsContact O-N 3.09Å
438A93.7Very high92.1Very high0 Ų020.5 Ų20.50%012%0.12CC..Hα-helixtrans-62.9-41.517700000112.5A329 Q400 M401 T434 V435 L441 C442A329-A438 HydrophobicContact CB-CB 4.38Å; Q400-A438 HydrophobicContact CB-CB 4.12Å; M401-A438 HydrophobicContact CG-CB 4.07Å; M401-A438 HydrophobicContact SD-CB 3.85Å; T434-A438 WeakPolarHBondContact O-CB 3.36Å; T434-A438 PolarHBondContact O-N 2.88Å; V435-A438 PolarHBondContact O-N 3.44Å; A438-L441 PolarHBondContact O-N 2.98Å; A438-C442 WeakPolarHBondContact O-CB 3.49Å; A438-C442 PolarHBondContact O-N 2.97Å; A438-C442 PolarHBondContact O-SG 3.09Å
439I93.2Very high91.6Very high36 Ų3621.1 Ų21.119%0.18512%0.123CC..Hα-helixtrans-59.5-47.6175.3-69.1170.7000110.9A329 R333 V435 I436 G437 L441 C442 G443A329-I439 HydrophobicContact CB-CG1 3.69Å; R333-I439 HydrophobicContact CB-CD1 3.55Å; R333-I439 HydrophobicContact CG-CD1 3.94Å; V435-I439 HydrophobicContact CG1-CD1 4.44Å; V435-I439 WeakPolarHBondContact O-CG1 3.24Å; V435-I439 PolarHBondContact O-N 3.47Å; V435-I439 VanDerWaalsContact O-N 3.13Å; I436-I439 PolarHBondContact O-N 2.96Å; G437-I439 PolarHBondContact O-N 3.24Å; I439-L441 VanDerWaalsContact C-N 3.33Å; I439-L441 PolarHBondContact O-N 2.94Å; I439-C442 PolarHBondContact O-N 2.91Å; I439-G443 PolarHBondContact O-N 3.34Å; I439-G443 VanDerWaalsContact O-N 3.08Å
440A88.8Confident91.1Very high42 Ų4218.8 Ų18.835%0.34711%0.112SC..Hα-helixtrans-58.5-45.5179.100000111.5I436 G437 G443 V444I436-A440 PolarHBondContact O-N 3.38Å; I436-A440 VanDerWaalsContact O-N 3.08Å; G437-A440 PolarHBondContact O-N 3.4Å; A440-G443 PolarHBondContact O-N 3.08Å; A440-V444 WeakPolarHBondContact O-CG2 3.31Å; A440-V444 PolarHBondContact O-N 2.92Å
441L89.3Confident90.4Very high4 Ų418.9 Ų18.92%0.02111%0.114CC..Hα-helixtrans-65.2-41.2177.2-71.8173.3000113.2V374 A378 L396 I397 G437 A438 I439 G443 V444 L445V374-L441 HydrophobicContact CG1-CD1 3.33Å; V374-L441 HydrophobicContact CG1-CD2 3.65Å; V374-L441 HydrophobicContact CG1-CG 3.32Å; A378-L441 HydrophobicContact CB-CD2 3.88Å; L396-L441 HydrophobicContact CB-CD1 3.65Å; I397-L441 HydrophobicContact CD1-CB 3.92Å; I397-L441 HydrophobicContact CG1-CB 3.46Å; I397-L441 VanDerWaalsContact CG1-CB 3.46Å; I397-L441 HydrophobicContact CG1-CD1 3.93Å; I397-L441 HydrophobicContact CG1-CG 4.35Å; G437-L441 PolarHBondContact O-N 3.39Å; G437-L441 VanDerWaalsContact O-N 3.09Å; A438-L441 PolarHBondContact O-N 2.98Å; I439-L441 VanDerWaalsContact C-N 3.33Å; I439-L441 PolarHBondContact O-N 2.94Å; L441-G443 VanDerWaalsContact C-N 3.29Å; L441-G443 PolarHBondContact O-N 3.33Å; L441-V444 PolarHBondContact O-N 3.03Å; L441-L445 WeakPolarHBondContact O-CB 3.18Å; L441-L445 PolarHBondContact O-N 3.46Å
442C92.4Very high89.5Confident0 Ų024.6 Ų24.60%015%0.151CC..Hα-helixtrans-61.4-39.6178.4-70.60000111.8H326 A438 I439 A446H326-C442 HydrophobicContact CB-CB 3.73Å; A438-C442 WeakPolarHBondContact O-CB 3.49Å; A438-C442 PolarHBondContact O-N 2.97Å; A438-C442 PolarHBondContact O-SG 3.09Å; I439-C442 PolarHBondContact O-N 2.91Å; C442-A446 PolarHBondContact O-N 2.98Å; C442-A446 VanDerWaalsContact O-N 3.1Å
443G86Confident88.6Confident8 Ų828.6 Ų28.68%0.08218%0.184CC..Hα-helixtrans-62.3-41.1176.700000113.1I439 A440 L441 H459I439-G443 PolarHBondContact O-N 3.34Å; I439-G443 VanDerWaalsContact O-N 3.08Å; A440-G443 PolarHBondContact O-N 3.08Å; L441-G443 VanDerWaalsContact C-N 3.29Å; L441-G443 PolarHBondContact O-N 3.33Å; G443-H459 PolarHBondContact O-ND1 3.11Å
444V85Confident88Confident59 Ų5928.4 Ų28.436%0.35818%0.181SC..Hα-helixtrans-73.2-43.8178178.30000111.1A440 L441 A446 V447 E448A440-V444 WeakPolarHBondContact O-CG2 3.31Å; A440-V444 PolarHBondContact O-N 2.92Å; L441-V444 PolarHBondContact O-N 3.03Å; V444-A446 VanDerWaalsContact C-N 3.26Å; V444-A446 PolarHBondContact O-N 2.73Å; V444-V447 WeakPolarHBondContact O-CB 3.38Å; V444-V447 PolarHBondContact O-N 2.89Å; V444-E448 HydrophobicContact CG1-CG 4.33Å; V444-E448 WeakPolarHBondContact CG1-OE1 3.37Å; V444-E448 WeakPolarHBondContact O-CG 3.4Å; V444-E448 PolarHBondContact O-N 2.89Å; V444-E448 VanDerWaalsContact O-N 3.12Å
445L89.3Confident87.2Confident0 Ų029.8 Ų29.80%019%0.191CC..Hα-helixtrans-56.5-42.2177.6-18060.4000111.1P390 R393 I394 I397 L441 V447 E448 L449P390-L445 HydrophobicContact CB-CD1 4.47Å; R393-L445 HydrophobicContact CB-CD1 4.47Å; I394-L445 HydrophobicContact CG1-CD1 4.37Å; I394-L445 HydrophobicContact CG1-CD2 3.9Å; I397-L445 HydrophobicContact CD1-CB 4.28Å; I397-L445 HydrophobicContact CD1-CD2 3.6Å; L441-L445 WeakPolarHBondContact O-CB 3.18Å; L441-L445 PolarHBondContact O-N 3.46Å; L445-V447 VanDerWaalsContact C-N 3.29Å; L445-V447 PolarHBondContact O-N 2.71Å; L445-E448 PolarHBondContact O-N 3.28Å; L445-L449 HydrophobicContact CD1-CD1 4.17Å; L445-L449 HydrophobicContact CD1-CD2 4.16Å; L445-L449 HydrophobicContact CD1-CG 3.94Å; L445-L449 HydrophobicContact CG-CD1 3.91Å; L445-L449 HydrophobicContact CG-CG 4.15Å; L445-L449 WeakPolarHBondContact O-CG 3.25Å; L445-L449 PolarHBondContact O-N 3.43Å
446A89.1Confident86Confident0 Ų032.1 Ų32.10%022%0.216CC..Hα-helixtrans-59.5-37177.700000113.6L319 C442 V444 A458L319-A446 HydrophobicContact CD1-CB 4.18Å; C442-A446 PolarHBondContact O-N 2.98Å; C442-A446 VanDerWaalsContact O-N 3.1Å; V444-A446 VanDerWaalsContact C-N 3.26Å; V444-A446 PolarHBondContact O-N 2.73Å; A446-A458 WeakPolarHBondContact O-CB 3.42Å
447V84.2Confident85.5Confident55 Ų5532.4 Ų32.433%0.33322%0.218SC..Hα-helixtrans-67.7-43.9176.7174.60000110.2V444 L445 A450 H459V444-V447 WeakPolarHBondContact O-CB 3.38Å; V444-V447 PolarHBondContact O-N 2.89Å; L445-V447 VanDerWaalsContact C-N 3.29Å; L445-V447 PolarHBondContact O-N 2.71Å; V447-A450 PolarHBondContact O-N 3.1Å; V447-H459 HydrophobicContact CG2-CB 3.7Å
448E84.8Confident85.3Confident64 Ų6432.4 Ų32.430%0.29922%0.218SC..Hα-helixtrans-73.5-26.7-175.6-67.7175.5171.100113.6W389 R393 V444 L445 A450W389-E448 VanDerWaalsContact CH2-OE1 3.3Å; W389-E448 WeakPolarHBondContact CH2-OE1 3.29Å; W389-E448 HydrophobicContact CZ3-CG 4.32Å; W389-E448 VanDerWaalsContact CZ3-OE1 3.26Å; W389-E448 WeakPolarHBondContact CZ3-OE1 3.36Å; W389-E448 VanDerWaalsContact CZ3-OE2 3.32Å; W389-E448 WeakPolarHBondContact CZ3-OE2 3.47Å; R393-E448 WeakPolarHBondContact CD-OE2 3.25Å; R393-E448 IonicContact CZ-OE1 2.78Å; R393-E448 IonicContact CZ-OE2 2.83Å; R393-E448 IonicContact NE-OE1 3.74Å; R393-E448 PolarHBondContact NE-OE1 3.32Å; R393-E448 IonicContact NE-OE2 3.19Å; R393-E448 PolarHBondContact NE-OE2 3.32Å; R393-E448 IonicContact NH2-OE1 2.84Å; R393-E448 PolarHBondContact NH2-OE1 3.27Å; V444-E448 HydrophobicContact CG1-CG 4.33Å; V444-E448 WeakPolarHBondContact CG1-OE1 3.37Å; V444-E448 WeakPolarHBondContact O-CG 3.4Å; V444-E448 PolarHBondContact O-N 2.89Å; V444-E448 VanDerWaalsContact O-N 3.12Å; L445-E448 PolarHBondContact O-N 3.28Å; E448-A450 PolarHBondContact O-N 3.45Å
449L86.7Confident84.9Confident13 Ų1336 Ų367%0.06823%0.234CC..THydrogen-bonded Turntrans-72.5-16.5177.3-71.6175.8000113.5L318 L319 L445L318-L449 HydrophobicContact CD2-CD1 4.43Å; L318-L449 HydrophobicContact CD2-CD2 3.4Å; L318-L449 HydrophobicContact CG-CD1 3.9Å; L318-L449 HydrophobicContact CG-CD2 3.82Å; L319-L449 HydrophobicContact CB-CD1 4.4Å; L319-L449 HydrophobicContact CD1-CD1 4.25Å; L445-L449 HydrophobicContact CD1-CD1 4.17Å; L445-L449 HydrophobicContact CD1-CD2 4.16Å; L445-L449 HydrophobicContact CD1-CG 3.94Å; L445-L449 HydrophobicContact CG-CD1 3.91Å; L445-L449 HydrophobicContact CG-CG 4.15Å; L445-L449 WeakPolarHBondContact O-CG 3.25Å; L445-L449 PolarHBondContact O-N 3.43Å
450A85.4Confident84.4Confident11 Ų1137 Ų379%0.09125%0.249CC..SBendtrans-108.7149.7-177.700000112L307 V447 E448 A458L307-A450 HydrophobicContact CD1-CB 3.95Å; V447-A450 PolarHBondContact O-N 3.1Å; E448-A450 PolarHBondContact O-N 3.45Å; A450-A458 HydrophobicContact CB-CB 3.51Å
451P83.4Confident84.4Confident45 Ų4537.1 Ų37.129%0.29224%0.243SC..  trans-55.7150.7171.7-23.132.6000111.4T310 A453 F454 S455T310-P451 HydrophobicContact CG2-CG 4.1Å; P451-A453 PolarHBondContact O-N 2.96Å; P451-F454 HydrophobicContact CB-CD2 4.36Å; P451-F454 HydrophobicContact CG-CD2 4.42Å; P451-F454 CarbonylContact O-C 3.57Å; P451-F454 PolarHBondContact O-N 3Å; P451-S455 PolarHBondContact O-N 3.33Å
452P78.3Confident84.5Confident120 Ų12037 Ų3778%0.77924%0.242SC*.G310 helixtrans-50.2-39.4-175.5-30.135.2000114.2F454 S455P452-F454 PolarHBondContact O-N 3.15Å; P452-S455 PolarHBondContact O-N 2.88Å; P452-S455 PolarHBondContact O-OG 3.2Å
453A78.5Confident84.3Confident84 Ų8437.8 Ų37.869%0.69425%0.249SC*.G310 helixtrans-63.4-21.1178.500000114.8P451P451-A453 PolarHBondContact O-N 2.96Å
454F82.8Confident84.5Confident38 Ų3839.9 Ų39.917%0.16726%0.258CS..G310 helixtrans-121.73.9-178.4-55.7-74000114K306 L307 T310 P451 P452 G456 T457 A458K306-F454 HydrophobicContact CB-CE1 4.04Å; K306-F454 HydrophobicContact CB-CZ 4.19Å; L307-F454 HydrophobicContact CB-CB 4.38Å; L307-F454 HydrophobicContact CB-CD1 4.37Å; L307-F454 HydrophobicContact CB-CG 4.39Å; L307-F454 HydrophobicContact CD1-CB 3.62Å; L307-F454 HydrophobicContact CD1-CG 4.23Å; L307-F454 HydrophobicContact CG-CB 4.49Å; T310-F454 HydrophobicContact CG2-CE2 4.39Å; P451-F454 HydrophobicContact CB-CD2 4.36Å; P451-F454 HydrophobicContact CG-CD2 4.42Å; P451-F454 CarbonylContact O-C 3.57Å; P451-F454 PolarHBondContact O-N 3Å; P452-F454 PolarHBondContact O-N 3.15Å; F454-G456 VanDerWaalsContact C-N 3.3Å; F454-G456 PolarHBondContact O-N 2.7Å; F454-T457 WeakPolarHBondContact O-CA 3.45Å; F454-T457 WeakPolarHBondContact O-CB 3.47Å; F454-T457 PolarHBondContact O-N 3.05Å; F454-A458 PolarHBondContact O-N 3.4Å
455S78.8Confident84.8Confident34 Ų3439 Ų3924%0.23825%0.253CS..Hα-helixtrans-52.2-44.1-179.162.20000113.3P451 P452 T457 A458 H459P451-S455 PolarHBondContact O-N 3.33Å; P452-S455 PolarHBondContact O-N 2.88Å; P452-S455 PolarHBondContact O-OG 3.2Å; S455-T457 PolarHBondContact O-N 2.71Å; S455-A458 PolarHBondContact O-N 3.38Å; S455-H459 PolarHBondContact O-N 3.07Å
456G71.7Confident85.1Confident49 Ų4939.2 Ų39.251%0.50526%0.255SS..Hα-helixtrans-65-36175.100000113.8F454 A460F454-G456 VanDerWaalsContact C-N 3.3Å; F454-G456 PolarHBondContact O-N 2.7Å; G456-A460 WeakPolarHBondContact O-CB 3.43Å; G456-A460 PolarHBondContact O-N 2.92Å
457T83.3Confident85.4Confident19 Ų1939.9 Ų39.912%0.11726%0.258CS..Hα-helixtrans-67.3-42.3176.3-50.90000111.2Q303 I304 L307 F454 S455 A460 L461Q303-T457 HydrophobicContact CG-CG2 4.45Å; Q303-T457 PolarHBondContact NE2-OG1 2.92Å; I304-T457 HydrophobicContact CG1-CG2 4.15Å; L307-T457 HydrophobicContact CD2-CG2 4.03Å; F454-T457 WeakPolarHBondContact O-CA 3.45Å; F454-T457 WeakPolarHBondContact O-CB 3.47Å; F454-T457 PolarHBondContact O-N 3.05Å; S455-T457 PolarHBondContact O-N 2.71Å; T457-A460 PolarHBondContact O-N 2.99Å; T457-L461 PolarHBondContact O-N 3.37Å
458A86.8Confident85.9Confident0 Ų042.7 Ų42.70%027%0.266CS..Hα-helixtrans-65-42.6177.100000112.1L307 L319 A446 A450 F454 S455 L461 S462L307-A458 HydrophobicContact CD2-CB 4.16Å; L319-A458 HydrophobicContact CD1-CB 4.39Å; L319-A458 HydrophobicContact CD2-CB 4.39Å; A446-A458 WeakPolarHBondContact O-CB 3.42Å; A450-A458 HydrophobicContact CB-CB 3.51Å; F454-A458 PolarHBondContact O-N 3.4Å; S455-A458 PolarHBondContact O-N 3.38Å; A458-L461 PolarHBondContact O-N 2.84Å; A458-S462 PolarHBondContact O-N 3.4Å
459H85.3Confident86.5Confident74 Ų7439.7 Ų39.734%0.34325%0.252SS..Hα-helixtrans-60.1-45.3172.4-176.277.1000112.3G443 V447 S455 L461 S462 A463G443-H459 PolarHBondContact O-ND1 3.11Å; V447-H459 HydrophobicContact CG2-CB 3.7Å; S455-H459 PolarHBondContact O-N 3.07Å; H459-L461 VanDerWaalsContact C-N 3.32Å; H459-L461 PolarHBondContact O-N 3.3Å; H459-S462 PolarHBondContact O-N 3.02Å; H459-A463 WeakPolarHBondContact O-CB 3.31Å; H459-A463 PolarHBondContact O-N 3.08Å
460A83.2Confident87Confident59 Ų5939.2 Ų39.249%0.48825%0.25SS..Hα-helixtrans-61.7-39.8178.600000112.3G456 T457 A463 L464G456-A460 WeakPolarHBondContact O-CB 3.43Å; G456-A460 PolarHBondContact O-N 2.92Å; T457-A460 PolarHBondContact O-N 2.99Å; A460-A463 PolarHBondContact O-N 3.05Å; A460-L464 WeakPolarHBondContact O-CB 3.46Å; A460-L464 PolarHBondContact O-N 3.42Å
461L87.2Confident87.5Confident43 Ų4339.8 Ų39.823%0.22525%0.251CS..Hα-helixtrans-65-45.1176.5-172.765.1000111.7F308 T457 A458 H459 A463 L464 T465F308-L461 HydrophobicContact CE2-CD2 3.89Å; F308-L461 HydrophobicContact CZ-CD2 3.74Å; T457-L461 PolarHBondContact O-N 3.37Å; A458-L461 PolarHBondContact O-N 2.84Å; H459-L461 VanDerWaalsContact C-N 3.32Å; H459-L461 PolarHBondContact O-N 3.3Å; L461-A463 VanDerWaalsContact C-N 3.34Å; L461-A463 PolarHBondContact O-N 2.93Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 3.2Å; L461-T465 PolarHBondContact O-N 2.88Å; L461-T465 VanDerWaalsContact O-N 3.11Å
462S91.8Very high88.2Confident1 Ų141.4 Ų41.41%0.00726%0.257CS..Hα-helixtrans-63.9-37.9175.3-175.60000112.2H326 A458 H459 L464 T465 A466H326-S462 PolarHBondContact ND1-O 3.35Å; H326-S462 PolarHBondContact ND1-OG 3.35Å; A458-S462 PolarHBondContact O-N 3.4Å; H459-S462 PolarHBondContact O-N 3.02Å; S462-L464 VanDerWaalsContact C-N 3.33Å; S462-T465 PolarHBondContact O-OG1 2.87Å; S462-A466 WeakPolarHBondContact O-CB 3.41Å; S462-A466 PolarHBondContact O-N 3.18Å
463A88.8Confident89.1Confident18 Ų1835.7 Ų35.715%0.14922%0.22CC..Hα-helixtrans-70.2-29.7175.200000112.8H459 A460 L461 A466 N467H459-A463 WeakPolarHBondContact O-CB 3.31Å; H459-A463 PolarHBondContact O-N 3.08Å; A460-A463 PolarHBondContact O-N 3.05Å; L461-A463 VanDerWaalsContact C-N 3.34Å; L461-A463 PolarHBondContact O-N 2.93Å; A463-A466 WeakPolarHBondContact O-CB 3.24Å; A463-N467 VanDerWaalsContact O-CG 3.29Å; A463-N467 PolarHBondContact O-N 3.12Å; A463-N467 VanDerWaalsContact O-N 3.12Å; A463-N467 PolarHBondContact O-ND2 3.31Å
464L89.2Confident90Very high51 Ų5131.7 Ų31.727%0.26719%0.187SC..Hα-helixtrans-68.6-45.8174.4-178.962.2000111T61 L65 A460 L461 S462 A466 N467 F468T61-L464 HydrophobicContact CG2-CD1 4.23Å; L65-L464 HydrophobicContact CD1-CD1 3.81Å; L65-L464 HydrophobicContact CD1-CD2 3.97Å; L65-L464 HydrophobicContact CD1-CG 4.48Å; A460-L464 WeakPolarHBondContact O-CB 3.46Å; A460-L464 PolarHBondContact O-N 3.42Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 3.2Å; S462-L464 VanDerWaalsContact C-N 3.33Å; L464-A466 VanDerWaalsContact C-N 3.3Å; L464-A466 PolarHBondContact O-N 3.05Å; L464-N467 PolarHBondContact O-N 3.22Å; L464-F468 WeakPolarHBondContact O-CD2 3.25Å; L464-F468 PolarHBondContact O-N 3.06Å
465T93.4Very high90.7Very high40 Ų4034.7 Ų34.725%0.24520%0.198CC..Hα-helixtrans-63.7-37.8174.559.80000111.3A323 M327 L461 S462 N467 F468 G469A323-T465 HydrophobicContact CB-CG2 4.22Å; A323-T465 PolarHBondContact O-OG1 3.03Å; A323-T465 VanDerWaalsContact O-OG1 3.1Å; M327-T465 WeakPolarHBondContact CB-O 3.44Å; M327-T465 VanDerWaalsContact CG-O 3.31Å; M327-T465 WeakPolarHBondContact CG-O 3.37Å; L461-T465 PolarHBondContact O-N 2.88Å; L461-T465 VanDerWaalsContact O-N 3.11Å; S462-T465 PolarHBondContact O-OG1 2.87Å; T465-N467 VanDerWaalsContact C-N 3.32Å; T465-N467 PolarHBondContact O-N 2.84Å; T465-F468 WeakPolarHBondContact O-CB 3.47Å; T465-F468 PolarHBondContact O-N 3.28Å; T465-F468 VanDerWaalsContact O-N 3.13Å; T465-G469 PolarHBondContact O-N 3.31Å
466A95.3Very high91.6Very high5 Ų535.7 Ų35.74%0.04120%0.204CC..Hα-helixtrans-54.9-44.5171.800000112.9T330 S462 A463 L464 F468 G469 A470T330-A466 WeakPolarHBondContact CB-O 3.31Å; T330-A466 HydrophobicContact CG2-CB 4.26Å; T330-A466 WeakPolarHBondContact CG2-O 3.42Å; T330-A466 WeakPolarHBondContact OG1-CB 3.49Å; S462-A466 WeakPolarHBondContact O-CB 3.41Å; S462-A466 PolarHBondContact O-N 3.18Å; A463-A466 WeakPolarHBondContact O-CB 3.24Å; L464-A466 VanDerWaalsContact C-N 3.3Å; L464-A466 PolarHBondContact O-N 3.05Å; A466-F468 VanDerWaalsContact C-N 3.27Å; A466-F468 PolarHBondContact O-N 3.1Å; A466-G469 WeakPolarHBondContact O-CA 3.49Å; A466-G469 PolarHBondContact O-N 2.97Å; A466-A470 PolarHBondContact O-N 3.43Å
467N93.8Very high92.8Very high14 Ų1433.5 Ų33.58%0.07518%0.181CC..Hα-helixtrans-62.7-31.4178.4-67.2-32.3000112.8T61 A463 L464 T465 G469 A470 I471T61-N467 HydrophobicContact CG2-CB 3.72Å; A463-N467 VanDerWaalsContact O-CG 3.29Å; A463-N467 PolarHBondContact O-N 3.12Å; A463-N467 VanDerWaalsContact O-N 3.12Å; A463-N467 PolarHBondContact O-ND2 3.31Å; L464-N467 PolarHBondContact O-N 3.22Å; T465-N467 VanDerWaalsContact C-N 3.32Å; T465-N467 PolarHBondContact O-N 2.84Å; N467-G469 VanDerWaalsContact C-N 3.26Å; N467-G469 PolarHBondContact O-N 3.43Å; N467-A470 WeakPolarHBondContact O-CB 3.26Å; N467-A470 PolarHBondContact O-N 2.93Å; N467-A470 VanDerWaalsContact O-N 3.12Å; N467-I471 WeakPolarHBondContact O-CG1 3.34Å; N467-I471 PolarHBondContact O-N 3.31Å
468F95.5Very high93.4Very high115 Ų11532.7 Ų32.750%0.50418%0.176SC..Hα-helixtrans-61.5-36.8171.5-82.7-81.2000112.1M327 L464 T465 A466 A470 I471 L472M327-F468 HydrophobicContact SD-CB 4.35Å; L464-F468 WeakPolarHBondContact O-CD2 3.25Å; L464-F468 PolarHBondContact O-N 3.06Å; T465-F468 WeakPolarHBondContact O-CB 3.47Å; T465-F468 PolarHBondContact O-N 3.28Å; T465-F468 VanDerWaalsContact O-N 3.13Å; A466-F468 VanDerWaalsContact C-N 3.27Å; A466-F468 PolarHBondContact O-N 3.1Å; F468-A470 VanDerWaalsContact C-N 3.3Å; F468-A470 PolarHBondContact O-N 2.86Å; F468-I471 HydrophobicContact CD1-CD1 4.39Å; F468-I471 PolarHBondContact O-N 3.31Å; F468-L472 WeakPolarHBondContact O-CG 3.2Å; F468-L472 PolarHBondContact O-N 3.27Å
469G97.3Very high93.8Very high0 Ų035.2 Ų35.20%019%0.189CC..Hα-helixtrans-59.1-42.4171.900000112.2M327 F331 T465 A466 N467 I471 L472 A473M327-G469 WeakPolarHBondContact O-CA 3.41Å; F331-G469 WeakPolarHBondContact CA-O 3.35Å; T465-G469 PolarHBondContact O-N 3.31Å; A466-G469 WeakPolarHBondContact O-CA 3.49Å; A466-G469 PolarHBondContact O-N 2.97Å; N467-G469 VanDerWaalsContact C-N 3.26Å; N467-G469 PolarHBondContact O-N 3.43Å; G469-I471 PolarHBondContact O-N 3.47Å; G469-L472 PolarHBondContact O-N 2.96Å; G469-A473 PolarHBondContact O-N 3.38Å; G469-A473 VanDerWaalsContact O-N 3.09Å
470A96.7Very high94.4Very high3 Ų334.6 Ų34.63%0.02519%0.188CC..Hα-helixtrans-62.7-39.5175.600000112.7T57 T330 Y334 A466 N467 F468 A473T57-A470 HydrophobicContact CG2-CB 3.66Å; T330-A470 HydrophobicContact CG2-CB 4.21Å; Y334-A470 HydrophobicContact CD2-CB 3.31Å; Y334-A470 HydrophobicContact CE2-CB 3.4Å; Y334-A470 HydrophobicContact CG-CB 4.03Å; A466-A470 PolarHBondContact O-N 3.43Å; N467-A470 WeakPolarHBondContact O-CB 3.26Å; N467-A470 PolarHBondContact O-N 2.93Å; N467-A470 VanDerWaalsContact O-N 3.12Å; F468-A470 VanDerWaalsContact C-N 3.3Å; F468-A470 PolarHBondContact O-N 2.86Å; A470-A473 PolarHBondContact O-N 3.41Å
471I97.2Very high95Very high23 Ų2332 Ų3212%0.11817%0.167CC..Hα-helixtrans-63.5-45.7176.6-66165.1000110.4T54 T57 L58 N467 F468 G469 A473 G474T54-I471 HydrophobicContact CG2-CG2 3.87Å; T57-I471 HydrophobicContact CG2-CG1 3.76Å; L58-I471 HydrophobicContact CD2-CD1 3.57Å; L58-I471 HydrophobicContact CD2-CG1 4.17Å; L58-I471 HydrophobicContact CD2-CG2 4.37Å; L58-I471 HydrophobicContact CG-CD1 4.27Å; L58-I471 HydrophobicContact CG-CG1 4.35Å; L58-I471 HydrophobicContact CG-CG2 4.49Å; N467-I471 WeakPolarHBondContact O-CG1 3.34Å; N467-I471 PolarHBondContact O-N 3.31Å; F468-I471 HydrophobicContact CD1-CD1 4.39Å; F468-I471 PolarHBondContact O-N 3.31Å; G469-I471 PolarHBondContact O-N 3.47Å; I471-A473 PolarHBondContact O-N 3.43Å; I471-G474 PolarHBondContact O-N 2.97Å; I471-G474 VanDerWaalsContact O-N 3.11Å
472L97.7Very high95.2Very high79 Ų7933.9 Ų33.941%0.41417%0.174SC..Hα-helixtrans-63.1-31178.5-69.3176000112.7F331 F468 G469 G474 P476 F477F331-L472 HydrophobicContact CD2-CB 3.84Å; F331-L472 HydrophobicContact CE2-CB 4.22Å; F468-L472 WeakPolarHBondContact O-CG 3.2Å; F468-L472 PolarHBondContact O-N 3.27Å; G469-L472 PolarHBondContact O-N 2.96Å; L472-G474 PolarHBondContact O-N 3.23Å; L472-P476 HydrophobicContact CD2-CB 4.35Å; L472-P476 HydrophobicContact CD2-CG 4.15Å; L472-F477 WeakPolarHBondContact O-CB 3.4Å; L472-F477 PolarHBondContact O-N 3.43Å; L472-F477 VanDerWaalsContact O-N 3.12Å
473A97.9Very high95.3Very high1 Ų140.6 Ų40.61%0.00821%0.205CC..THydrogen-bonded Turntrans-70.4-12.217700000113.8F331 A335 W339 G469 A470 I471F331-A473 HydrophobicContact CD2-CB 3.83Å; F331-A473 HydrophobicContact CE2-CB 4.19Å; A335-A473 HydrophobicContact CB-CB 4.15Å; W339-A473 PolarHBondContact NE1-O 3.42Å; G469-A473 PolarHBondContact O-N 3.38Å; G469-A473 VanDerWaalsContact O-N 3.09Å; A470-A473 PolarHBondContact O-N 3.41Å; I471-A473 PolarHBondContact O-N 3.43Å
474G96.7Very high95.6Very high0 Ų043.1 Ų43.10%022%0.216CC..THydrogen-bonded Turntrans-82.2-111.9175.400000112.6I471 L472 F477 A478I471-G474 PolarHBondContact O-N 2.97Å; I471-G474 VanDerWaalsContact O-N 3.11Å; L472-G474 PolarHBondContact O-N 3.23Å; G474-F477 PolarHBondContact O-N 2.87Å; G474-A478 WeakPolarHBondContact O-CB 3.3Å; G474-A478 PolarHBondContact O-N 2.8Å
475Y97.1Very high95.7Very high100 Ų10045.1 Ų45.139%0.39223%0.226SC..Hα-helixtrans-61.6-46.5-174.4175.8-103.6000113.2T47 G50 T54 F477 A478 L479T47-Y475 WeakPolarHBondContact O-CD2 3.42Å; G50-Y475 PolarHBondContact O-N 3.4Å; G50-Y475 VanDerWaalsContact O-N 3.14Å; T54-Y475 VanDerWaalsContact OG1-CB 3.31Å; T54-Y475 WeakPolarHBondContact OG1-CB 3.48Å; T54-Y475 PolarHBondContact OG1-N 3.48Å; Y475-F477 VanDerWaalsContact C-N 3.3Å; Y475-F477 PolarHBondContact O-N 3.28Å; Y475-A478 PolarHBondContact O-N 2.88Å; Y475-L479 HydrophobicContact CE1-CD2 4.26Å; Y475-L479 WeakPolarHBondContact O-CB 3.38Å; Y475-L479 PolarHBondContact O-N 2.75Å
476P97.3Very high95.7Very high56 Ų5644.3 Ų44.336%0.36422%0.219SC..Hα-helixtrans-59.9-41.4-179.4-25.337.2000112.5L472 L479 L480L472-P476 HydrophobicContact CD2-CB 4.35Å; L472-P476 HydrophobicContact CD2-CG 4.15Å; P476-L479 PolarHBondContact O-N 3.26Å; P476-L480 PolarHBondContact O-N 2.94Å
477F97.6Very high95.7Very high3 Ų344.8 Ų44.81%0.01322%0.222CC..Hα-helixtrans-70.1-41.1177.3-170.6-115.1000112.9F331 A335 W339 L472 G474 Y475 L479 L480 A481 W486 A489 F490 A493F331-F477 HydrophobicContact CE2-CB 4.15Å; F331-F477 HydrophobicContact CE2-CD2 4.11Å; F331-F477 HydrophobicContact CE2-CG 4.28Å; F331-F477 HydrophobicContact CZ-CB 4.46Å; F331-F477 AromaticContact CZ-CD2 3.57Å; F331-F477 HydrophobicContact CZ-CD2 3.57Å; F331-F477 HydrophobicContact CZ-CE2 4.02Å; F331-F477 HydrophobicContact CZ-CG 4.13Å; A335-F477 HydrophobicContact CB-CD1 4.03Å; A335-F477 HydrophobicContact CB-CE1 3.91Å; A335-F477 HydrophobicContact CB-CG 4.48Å; A335-F477 HydrophobicContact CB-CZ 4.28Å; W339-F477 HydrophobicContact CB-CE1 4.35Å; W339-F477 AromaticContact CD1-CD1 3.55Å; W339-F477 AromaticContact CD1-CE1 3.93Å; W339-F477 HydrophobicContact CG-CD1 4.18Å; W339-F477 HydrophobicContact CG-CE1 4.3Å; W339-F477 AromaticContact NE1-CD1 3.93Å; L472-F477 WeakPolarHBondContact O-CB 3.4Å; L472-F477 PolarHBondContact O-N 3.43Å; L472-F477 VanDerWaalsContact O-N 3.12Å; G474-F477 PolarHBondContact O-N 2.87Å; Y475-F477 VanDerWaalsContact C-N 3.3Å; Y475-F477 PolarHBondContact O-N 3.28Å; F477-L479 VanDerWaalsContact C-N 3.29Å; F477-L479 PolarHBondContact O-N 3.48Å; F477-L480 HydrophobicContact CD2-CD2 4.43Å; F477-L480 WeakPolarHBondContact O-CB 3.14Å; F477-L480 PolarHBondContact O-N 3.29Å; F477-A481 PolarHBondContact O-N 2.98Å; F477-W486 HydrophobicContact CD1-CZ3 4.29Å; F477-W486 HydrophobicContact CE1-CE3 4.48Å; F477-W486 AromaticContact CE1-CZ3 4Å; F477-W486 HydrophobicContact CE1-CZ3 4Å; F477-A489 HydrophobicContact CE2-CB 3.85Å; F477-A489 HydrophobicContact CZ-CB 3.99Å; F477-F490 HydrophobicContact CE1-CD1 4.49Å; F477-F490 HydrophobicContact CE1-CE1 4.04Å; F477-F490 HydrophobicContact CE1-CE2 4.47Å; F477-F490 HydrophobicContact CE1-CZ 4.03Å; F477-F490 AromaticContact CZ-CD1 3.91Å; F477-F490 HydrophobicContact CZ-CD1 3.91Å; F477-F490 AromaticContact CZ-CE1 3.92Å; F477-F490 HydrophobicContact CZ-CE1 3.92Å; F477-F490 HydrophobicContact CZ-CG 4.23Å; F477-F490 HydrophobicContact CZ-CZ 4.23Å; F477-A493 HydrophobicContact CE2-CB 3.98Å; F477-A493 HydrophobicContact CZ-CB 4.48Å
478A96.1Very high95.7Very high1 Ų144.9 Ų44.91%0.00823%0.226CC..Hα-helixtrans-61.3-39.2174.900000112.1T47 W339 G474 Y475 A481 E482T47-A478 HydrophobicContact CG2-CB 4.25Å; W339-A478 HydrophobicContact CH2-CB 3.79Å; W339-A478 HydrophobicContact CZ2-CB 3.83Å; W339-A478 HydrophobicContact CZ3-CB 4.44Å; G474-A478 WeakPolarHBondContact O-CB 3.3Å; G474-A478 PolarHBondContact O-N 2.8Å; Y475-A478 PolarHBondContact O-N 2.88Å; A478-A481 PolarHBondContact O-N 3.07Å; A478-E482 PolarHBondContact O-N 3.47Å
479L95.9Very high95.8Very high54 Ų5439.4 Ų39.428%0.28320%0.202SC..Hα-helixtrans-65.7-42.4176.1-175.268.2000111.3T47 Y475 P476 F477 A481 E482 H483T47-L479 HydrophobicContact CG2-CB 4.18Å; T47-L479 HydrophobicContact CG2-CD1 4.13Å; Y475-L479 HydrophobicContact CE1-CD2 4.26Å; Y475-L479 WeakPolarHBondContact O-CB 3.38Å; Y475-L479 PolarHBondContact O-N 2.75Å; P476-L479 PolarHBondContact O-N 3.26Å; F477-L479 VanDerWaalsContact C-N 3.29Å; F477-L479 PolarHBondContact O-N 3.48Å; L479-A481 VanDerWaalsContact C-N 3.33Å; L479-A481 PolarHBondContact O-N 2.95Å; L479-E482 WeakPolarHBondContact O-CB 3.29Å; L479-E482 PolarHBondContact O-N 2.88Å; L479-H483 PolarHBondContact O-CD2 2.99Å; L479-H483 PolarHBondContact O-N 3.27Å
480L96.6Very high95.7Very high60 Ų6039.4 Ų39.431%0.31420%0.202SC..Hα-helixtrans-58-47.4173.7-179.164.3000110.9P476 F477 E482 H483 I484 A489 V492P476-L480 PolarHBondContact O-N 2.94Å; F477-L480 HydrophobicContact CD2-CD2 4.43Å; F477-L480 WeakPolarHBondContact O-CB 3.14Å; F477-L480 PolarHBondContact O-N 3.29Å; L480-E482 VanDerWaalsContact C-N 3.27Å; L480-E482 PolarHBondContact O-N 3.42Å; L480-H483 PolarHBondContact O-N 2.99Å; L480-H483 VanDerWaalsContact O-N 3.11Å; L480-I484 HydrophobicContact CD1-CD1 3.87Å; L480-I484 HydrophobicContact CD1-CG1 4.14Å; L480-I484 HydrophobicContact CG-CD1 4.05Å; L480-I484 HydrophobicContact CG-CG1 4.23Å; L480-I484 WeakPolarHBondContact O-CG1 3.29Å; L480-I484 PolarHBondContact O-N 3.22Å; L480-A489 HydrophobicContact CD2-CB 4.27Å; L480-A489 HydrophobicContact CG-CB 4.18Å; L480-V492 HydrophobicContact CD2-CB 4.41Å; L480-V492 HydrophobicContact CD2-CG1 4.23Å
481A95.2Very high95.7Very high6 Ų642.5 Ų42.55%0.0522%0.218CC..Hα-helixtrans-63.1-30.7177.800000113.4F477 A478 L479 N485 W486 A489F477-A481 PolarHBondContact O-N 2.98Å; A478-A481 PolarHBondContact O-N 3.07Å; L479-A481 VanDerWaalsContact C-N 3.33Å; L479-A481 PolarHBondContact O-N 2.95Å; A481-N485 CarbonylContact O-C 3.6Å; A481-N485 WeakPolarHBondContact O-CA 3.25Å; A481-N485 PolarHBondContact O-N 2.93Å; A481-W486 HydrophobicContact CB-CD2 3.67Å; A481-W486 HydrophobicContact CB-CE3 3.42Å; A481-W486 VanDerWaalsContact CB-CE3 3.42Å; A481-W486 HydrophobicContact CB-CG 4.35Å; A481-W486 HydrophobicContact CB-CH2 3.82Å; A481-W486 HydrophobicContact CB-CZ2 4.11Å; A481-W486 HydrophobicContact CB-CZ3 3.48Å; A481-W486 VanDerWaalsContact CB-CZ3 3.48Å; A481-A489 HydrophobicContact CB-CB 3.84Å
482E92.8Very high95.7Very high81 Ų8144.1 Ų44.138%0.37923%0.229SC..Hα-helixtrans-66-38.2173.4-166.8177.9146.600111.6K44 T47 A478 L479 L480K44-E482 WeakPolarHBondContact CD-OE1 3.43Å; K44-E482 WeakPolarHBondContact CE-OE1 3.44Å; K44-E482 IonicContact NZ-OE1 2.71Å; K44-E482 PolarHBondContact NZ-OE1 3.37Å; T47-E482 WeakPolarHBondContact CB-OE2 3.38Å; T47-E482 HydrophobicContact CG2-CB 4.26Å; T47-E482 WeakPolarHBondContact CG2-OE2 3.37Å; T47-E482 PolarHBondContact OG1-OE2 3.24Å; A478-E482 PolarHBondContact O-N 3.47Å; L479-E482 WeakPolarHBondContact O-CB 3.29Å; L479-E482 PolarHBondContact O-N 2.88Å; L480-E482 VanDerWaalsContact C-N 3.27Å; L480-E482 PolarHBondContact O-N 3.42Å
483H93.8Very high95.7Very high142 Ų14240.6 Ų40.666%0.65721%0.211SC*.Hα-helixtrans-78.1-43.8-178.4-74.1-62.4000114.3L479 L480L479-H483 PolarHBondContact O-CD2 2.99Å; L479-H483 PolarHBondContact O-N 3.27Å; L480-H483 PolarHBondContact O-N 2.99Å; L480-H483 VanDerWaalsContact O-N 3.11Å
484I94Very high95.7Very high72 Ų7240.5 Ų40.537%0.36921%0.21SC..Hα-helixtrans-112.2-0.5-172.863.8169.8000114.7L480 A489 V492L480-I484 HydrophobicContact CD1-CD1 3.87Å; L480-I484 HydrophobicContact CD1-CG1 4.14Å; L480-I484 HydrophobicContact CG-CD1 4.05Å; L480-I484 HydrophobicContact CG-CG1 4.23Å; L480-I484 WeakPolarHBondContact O-CG1 3.29Å; L480-I484 PolarHBondContact O-N 3.22Å; I484-A489 HydrophobicContact CG1-CB 4.5Å; I484-V492 HydrophobicContact CD1-CG2 3.93Å
485N92.6Very high95.7Very high92 Ų9244 Ų4449%0.49223%0.229SC..  trans77.8162.4-167.183.943.5000114.9A481 S487 G488 A489A481-N485 CarbonylContact O-C 3.6Å; A481-N485 WeakPolarHBondContact O-CA 3.25Å; A481-N485 PolarHBondContact O-N 2.93Å; N485-S487 PolarHBondContact OD1-N 3.05Å; N485-G488 PolarHBondContact O-N 3.43Å; N485-G488 PolarHBondContact OD1-N 2.98Å; N485-A489 WeakPolarHBondContact O-CB 3.44Å; N485-A489 PolarHBondContact O-N 2.94Å
486W93.6Very high95.7Very high23 Ų2343.1 Ų43.19%0.08723%0.233CC..Hα-helixtrans-63.3-42.1-177.1-73109.6000114.1N46 W339 I342 M343 F477 A481 G488 A489 F490N46-W486 HydrophobicContact CB-CZ2 4Å; W339-W486 HydrophobicContact CB-CE3 4.21Å; W339-W486 HydrophobicContact CB-CH2 3.95Å; W339-W486 HydrophobicContact CB-CZ3 3.53Å; W339-W486 AromaticContact CD2-CH2 3.53Å; W339-W486 HydrophobicContact CD2-CH2 3.53Å; W339-W486 AromaticContact CD2-CZ3 3.91Å; W339-W486 HydrophobicContact CD2-CZ3 3.91Å; W339-W486 AromaticContact CE3-CH2 3.19Å; W339-W486 HydrophobicContact CE3-CH2 3.19Å; W339-W486 AromaticContact CE3-CZ2 3.83Å; W339-W486 HydrophobicContact CE3-CZ2 3.83Å; W339-W486 HydrophobicContact CE3-CZ3 4.01Å; W339-W486 AromaticContact CG-CH2 3.86Å; W339-W486 HydrophobicContact CG-CH2 3.86Å; W339-W486 AromaticContact CG-CZ3 3.72Å; W339-W486 HydrophobicContact CG-CZ3 3.72Å; W339-W486 AromaticContact CZ3-CH2 3.83Å; W339-W486 HydrophobicContact CZ3-CH2 3.83Å; W339-W486 HydrophobicContact CZ3-CZ2 4.27Å; I342-W486 HydrophobicContact CG2-CZ2 3.96Å; M343-W486 HydrophobicContact CB-CB 3.86Å; M343-W486 HydrophobicContact CB-CD2 4.28Å; M343-W486 HydrophobicContact CB-CG 3.95Å; M343-W486 HydrophobicContact CG-CB 3.53Å; M343-W486 HydrophobicContact CG-CG 4.14Å; M343-W486 HydrophobicContact SD-CB 4.4Å; F477-W486 HydrophobicContact CD1-CZ3 4.29Å; F477-W486 HydrophobicContact CE1-CE3 4.48Å; F477-W486 AromaticContact CE1-CZ3 4Å; F477-W486 HydrophobicContact CE1-CZ3 4Å; A481-W486 HydrophobicContact CB-CD2 3.67Å; A481-W486 HydrophobicContact CB-CE3 3.42Å; A481-W486 VanDerWaalsContact CB-CE3 3.42Å; A481-W486 HydrophobicContact CB-CG 4.35Å; A481-W486 HydrophobicContact CB-CH2 3.82Å; A481-W486 HydrophobicContact CB-CZ2 4.11Å; A481-W486 HydrophobicContact CB-CZ3 3.48Å; A481-W486 VanDerWaalsContact CB-CZ3 3.48Å; W486-G488 VanDerWaalsContact C-N 3.35Å; W486-A489 PolarHBondContact O-N 2.83Å; W486-F490 HydrophobicContact CE3-CE2 4.13Å; W486-F490 VanDerWaalsContact O-CD2 3.27Å; W486-F490 WeakPolarHBondContact O-CD2 3.39Å; W486-F490 PolarHBondContact O-N 3.23Å
487S93.6Very high95.6Very high16 Ų1640.6 Ų40.611%0.11222%0.217CC..Hα-helixtrans-62.1-44.6178.6165.20000110.5S412 N416 N485 F490 L491S412-S487 WeakPolarHBondContact CB-O 3.25Å; S412-S487 PolarHBondContact O-OG 3.07Å; S412-S487 PolarHBondContact OG-O 3.2Å; N416-S487 PolarHBondContact ND2-OG 3.4Å; N485-S487 PolarHBondContact OD1-N 3.05Å; S487-F490 PolarHBondContact O-N 2.9Å; S487-L491 WeakPolarHBondContact O-CB 3.37Å; S487-L491 PolarHBondContact O-N 2.65Å
488G94.8Very high95.6Very high16 Ų1640.8 Ų40.817%0.16522%0.22CC..Hα-helixtrans-62.8-42.7174.100000112.8N485 W486 F490 L491 V492N485-G488 PolarHBondContact O-N 3.43Å; N485-G488 PolarHBondContact OD1-N 2.98Å; W486-G488 VanDerWaalsContact C-N 3.35Å; G488-F490 PolarHBondContact O-N 3.5Å; G488-L491 WeakPolarHBondContact O-CB 3.38Å; G488-L491 PolarHBondContact O-N 2.99Å; G488-V492 WeakPolarHBondContact O-CG2 3.49Å; G488-V492 PolarHBondContact O-N 3.41Å
489A96.5Very high95.6Very high0 Ų045.5 Ų45.50%024%0.244CC..Hα-helixtrans-62.6-43.7178.300000112.4F477 L480 A481 I484 N485 W486 L491 V492 A493F477-A489 HydrophobicContact CE2-CB 3.85Å; F477-A489 HydrophobicContact CZ-CB 3.99Å; L480-A489 HydrophobicContact CD2-CB 4.27Å; L480-A489 HydrophobicContact CG-CB 4.18Å; A481-A489 HydrophobicContact CB-CB 3.84Å; I484-A489 HydrophobicContact CG1-CB 4.5Å; N485-A489 WeakPolarHBondContact O-CB 3.44Å; N485-A489 PolarHBondContact O-N 2.94Å; W486-A489 PolarHBondContact O-N 2.83Å; A489-L491 VanDerWaalsContact C-N 3.34Å; A489-V492 PolarHBondContact O-N 2.95Å; A489-A493 WeakPolarHBondContact O-CB 3.32Å; A489-A493 PolarHBondContact O-N 3.46Å
490F96.5Very high95.6Very high0 Ų044 Ų440%024%0.238CC..Hα-helixtrans-67.6-32.7175.1-80.9-65.8000112.9I336 W339 M343 L408 S412 F477 W486 S487 G488 A493 G494I336-F490 HydrophobicContact CG1-CE1 4.07Å; W339-F490 HydrophobicContact CB-CZ 4.06Å; M343-F490 HydrophobicContact CB-CE2 4.01Å; M343-F490 HydrophobicContact CG-CD2 4.5Å; M343-F490 HydrophobicContact CG-CE2 4.37Å; M343-F490 HydrophobicContact SD-CD2 3.54Å; M343-F490 VanDerWaalsContact SD-CD2 3.54Å; M343-F490 HydrophobicContact SD-CE2 3.75Å; L408-F490 HydrophobicContact CD1-CD1 3.86Å; L408-F490 HydrophobicContact CD2-CD1 4.21Å; L408-F490 WeakPolarHBondContact CD2-O 3.33Å; L408-F490 HydrophobicContact CG-CB 4.35Å; L408-F490 HydrophobicContact CG-CD1 4.26Å; S412-F490 WeakPolarHBondContact OG-CB 3.35Å; F477-F490 HydrophobicContact CE1-CD1 4.49Å; F477-F490 HydrophobicContact CE1-CE1 4.04Å; F477-F490 HydrophobicContact CE1-CE2 4.47Å; F477-F490 HydrophobicContact CE1-CZ 4.03Å; F477-F490 AromaticContact CZ-CD1 3.91Å; F477-F490 HydrophobicContact CZ-CD1 3.91Å; F477-F490 AromaticContact CZ-CE1 3.92Å; F477-F490 HydrophobicContact CZ-CE1 3.92Å; F477-F490 HydrophobicContact CZ-CG 4.23Å; F477-F490 HydrophobicContact CZ-CZ 4.23Å; W486-F490 HydrophobicContact CE3-CE2 4.13Å; W486-F490 VanDerWaalsContact O-CD2 3.27Å; W486-F490 WeakPolarHBondContact O-CD2 3.39Å; W486-F490 PolarHBondContact O-N 3.23Å; S487-F490 PolarHBondContact O-N 2.9Å; G488-F490 PolarHBondContact O-N 3.5Å; F490-A493 PolarHBondContact O-N 3.31Å; F490-G494 PolarHBondContact O-N 3.11Å
491L96.6Very high95.6Very high67 Ų6741.4 Ų41.435%0.35123%0.225SC..Hα-helixtrans-62.1-49.6172.9-178.969.5000111M409 S412 S487 G488 A489 A493 G494 I495M409-L491 HydrophobicContact CB-CD1 4.11Å; M409-L491 HydrophobicContact CE-CD1 4.31Å; M409-L491 HydrophobicContact CG-CD1 3.97Å; S412-L491 PolarHBondContact OG-N 3.49Å; S412-L491 VanDerWaalsContact OG-N 3.11Å; S487-L491 WeakPolarHBondContact O-CB 3.37Å; S487-L491 PolarHBondContact O-N 2.65Å; G488-L491 WeakPolarHBondContact O-CB 3.38Å; G488-L491 PolarHBondContact O-N 2.99Å; A489-L491 VanDerWaalsContact C-N 3.34Å; L491-A493 PolarHBondContact O-N 2.78Å; L491-G494 PolarHBondContact O-N 3.4Å; L491-I495 HydrophobicContact CD1-CD1 4.39Å; L491-I495 HydrophobicContact CG-CD1 4.14Å; L491-I495 WeakPolarHBondContact O-CG1 3.49Å; L491-I495 PolarHBondContact O-N 3.4Å
492V97.2Very high95.6Very high58 Ų5845.4 Ų45.435%0.35225%0.245SC..Hα-helixtrans-61.2-45.2177.3172.90000110.8L480 I484 G488 A489 G494 I495 V496L480-V492 HydrophobicContact CD2-CB 4.41Å; L480-V492 HydrophobicContact CD2-CG1 4.23Å; I484-V492 HydrophobicContact CD1-CG2 3.93Å; G488-V492 WeakPolarHBondContact O-CG2 3.49Å; G488-V492 PolarHBondContact O-N 3.41Å; A489-V492 PolarHBondContact O-N 2.95Å; V492-G494 VanDerWaalsContact C-N 3.3Å; V492-G494 PolarHBondContact O-N 3.46Å; V492-I495 PolarHBondContact O-N 3.28Å; V492-V496 HydrophobicContact CG1-CG2 4.17Å; V492-V496 WeakPolarHBondContact O-CB 3.21Å; V492-V496 WeakPolarHBondContact O-CG2 3.4Å; V492-V496 PolarHBondContact O-N 2.95Å
493A97.5Very high95.6Very high4 Ų444.8 Ų44.83%0.03325%0.248CC..Hα-helixtrans-55.8-44.5175.400000112.1F331 L332 L408 F477 A489 F490 L491 C497F331-A493 HydrophobicContact CE1-CB 3.69Å; F331-A493 HydrophobicContact CZ-CB 4.25Å; L332-A493 HydrophobicContact CD2-CB 4.13Å; L408-A493 HydrophobicContact CD2-CB 4.15Å; F477-A493 HydrophobicContact CE2-CB 3.98Å; F477-A493 HydrophobicContact CZ-CB 4.48Å; A489-A493 WeakPolarHBondContact O-CB 3.32Å; A489-A493 PolarHBondContact O-N 3.46Å; F490-A493 PolarHBondContact O-N 3.31Å; L491-A493 PolarHBondContact O-N 2.78Å; A493-C497 VanDerWaalsContact O-CB 3.27Å; A493-C497 WeakPolarHBondContact O-CB 3.18Å; A493-C497 PolarHBondContact O-N 2.84Å; A493-C497 PolarHBondContact O-SG 3.36Å
494G97Very high95.5Very high0 Ų038 Ų380%022%0.216CC..Hα-helixtrans-59.3-54.9177.300000111.3S405 F490 L491 V492 V496 C497 G498S405-G494 PolarHBondContact OG-O 3.43Å; F490-G494 PolarHBondContact O-N 3.11Å; L491-G494 PolarHBondContact O-N 3.4Å; V492-G494 VanDerWaalsContact C-N 3.3Å; V492-G494 PolarHBondContact O-N 3.46Å; G494-V496 PolarHBondContact O-N 3.33Å; G494-C497 PolarHBondContact O-N 3.4Å; G494-G498 PolarHBondContact O-N 3.43Å
495I97.3Very high95.3Very high74 Ų7437.8 Ų37.838%0.37922%0.221SC..Hα-helixtrans-58-51.3-178.9-64.9166.6000111.2M409 L491 V492 C497 G498 L499M409-I495 HydrophobicContact CE-CG1 4.09Å; M409-I495 HydrophobicContact SD-CG1 4.15Å; L491-I495 HydrophobicContact CD1-CD1 4.39Å; L491-I495 HydrophobicContact CG-CD1 4.14Å; L491-I495 WeakPolarHBondContact O-CG1 3.49Å; L491-I495 PolarHBondContact O-N 3.4Å; V492-I495 PolarHBondContact O-N 3.28Å; I495-C497 VanDerWaalsContact C-N 3.35Å; I495-C497 PolarHBondContact O-N 2.85Å; I495-G498 PolarHBondContact O-N 3.3Å; I495-L499 HydrophobicContact CG2-CD1 3.97Å; I495-L499 HydrophobicContact CG2-CG 4.47Å; I495-L499 VanDerWaalsContact O-CG 3.31Å; I495-L499 WeakPolarHBondContact O-CG 3.3Å; I495-L499 PolarHBondContact O-N 3.07Å
496V96.8Very high95.1Very high81 Ų8138 Ų3849%0.49123%0.229SC..Hα-helixtrans-61.6-43.7-177.5172.80000111.2V492 G494 L499 S500V492-V496 HydrophobicContact CG1-CG2 4.17Å; V492-V496 WeakPolarHBondContact O-CB 3.21Å; V492-V496 WeakPolarHBondContact O-CG2 3.4Å; V492-V496 PolarHBondContact O-N 2.95Å; G494-V496 PolarHBondContact O-N 3.33Å; V496-L499 PolarHBondContact O-N 3.46Å; V496-S500 PolarHBondContact O-N 2.92Å; V496-S500 VanDerWaalsContact O-N 3.16Å
497C96.7Very high94.7Very high2 Ų239.4 Ų39.41%0.01424%0.235CC..Hα-helixtrans-72.8-32.3179.9-63.40000112.4C328 L332 M401 A493 G494 I495 S500C328-C497 HydrophobicContact CB-CB 4.12Å; L332-C497 HydrophobicContact CD1-CB 3.66Å; L332-C497 HydrophobicContact CD2-CB 4.26Å; L332-C497 HydrophobicContact CG-CB 3.94Å; M401-C497 HydrophobicContact CE-CB 4.02Å; A493-C497 VanDerWaalsContact O-CB 3.27Å; A493-C497 WeakPolarHBondContact O-CB 3.18Å; A493-C497 PolarHBondContact O-N 2.84Å; A493-C497 PolarHBondContact O-SG 3.36Å; G494-C497 PolarHBondContact O-N 3.4Å; I495-C497 VanDerWaalsContact C-N 3.35Å; I495-C497 PolarHBondContact O-N 2.85Å; C497-S500 WeakPolarHBondContact O-CB 3.49Å; C497-S500 PolarHBondContact O-N 3.09Å; C497-S500 PolarHBondContact O-OG 3.16Å
498G96.2Very high94.7Very high8 Ų840.6 Ų40.68%0.08224%0.241CC..Hα-helixtrans-63.2-43.3171.300000112.1G494 I495 S500 V501G494-G498 PolarHBondContact O-N 3.43Å; I495-G498 PolarHBondContact O-N 3.3Å; G498-S500 VanDerWaalsContact C-N 3.26Å; G498-S500 PolarHBondContact O-N 3.27Å; G498-V501 VanDerWaalsContact O-CG2 3.25Å; G498-V501 WeakPolarHBondContact O-CG2 3.29Å
499L96.8Very high94.7Very high99 Ų9941.8 Ų41.852%0.51825%0.245SC..Hα-helixtrans-68.4-23.8177.3-66.9173.9000113.2I495 V496 V501 I502I495-L499 HydrophobicContact CG2-CD1 3.97Å; I495-L499 HydrophobicContact CG2-CG 4.47Å; I495-L499 VanDerWaalsContact O-CG 3.31Å; I495-L499 WeakPolarHBondContact O-CG 3.3Å; I495-L499 PolarHBondContact O-N 3.07Å; V496-L499 PolarHBondContact O-N 3.46Å; L499-V501 PolarHBondContact O-N 3.29Å; L499-I502 HydrophobicContact CB-CD1 4.35Å; L499-I502 HydrophobicContact CD2-CD1 3.58Å; L499-I502 WeakPolarHBondContact O-CB 3.33Å; L499-I502 WeakPolarHBondContact O-CG1 3.26Å; L499-I502 PolarHBondContact O-N 2.9Å; L499-I502 VanDerWaalsContact O-N 3.08Å
500S95.7Very high94.6Very high22 Ų2244.2 Ų44.215%0.15426%0.259CS..THydrogen-bonded Turntrans-59.1-20.8-18078.70000114V325 C328 V496 C497 G498 P503V325-S500 VanDerWaalsContact CG2-O 3.24Å; V325-S500 WeakPolarHBondContact CG2-O 3.31Å; C328-S500 WeakPolarHBondContact SG-CB 3.48Å; V496-S500 PolarHBondContact O-N 2.92Å; V496-S500 VanDerWaalsContact O-N 3.16Å; C497-S500 WeakPolarHBondContact O-CB 3.49Å; C497-S500 PolarHBondContact O-N 3.09Å; C497-S500 PolarHBondContact O-OG 3.16Å; G498-S500 VanDerWaalsContact C-N 3.26Å; G498-S500 PolarHBondContact O-N 3.27Å; S500-P503 WeakPolarHBondContact O-CD 3.34Å
501V96Very high94.5Very high7 Ų746.8 Ų46.84%0.04227%0.274CS..THydrogen-bonded Turntrans-80.8-15.9-179.7-49.60000113.5V325 I398 M401 L402 G498 L499 L504 S505V325-V501 HydrophobicContact CG2-CG1 4.46Å; I398-V501 HydrophobicContact CG1-CB 4.24Å; I398-V501 HydrophobicContact CG2-CG2 4.19Å; M401-V501 HydrophobicContact CB-CG1 3.45Å; M401-V501 VanDerWaalsContact CB-CG1 3.45Å; M401-V501 HydrophobicContact CG-CG1 4.05Å; L402-V501 HydrophobicContact CD2-CG2 4.16Å; L402-V501 HydrophobicContact CG-CG2 4.45Å; G498-V501 VanDerWaalsContact O-CG2 3.25Å; G498-V501 WeakPolarHBondContact O-CG2 3.29Å; L499-V501 PolarHBondContact O-N 3.29Å; V501-L504 WeakPolarHBondContact O-CA 3.49Å; V501-L504 WeakPolarHBondContact O-CB 3.25Å; V501-L504 PolarHBondContact O-N 3.32Å; V501-S505 PolarHBondContact O-N 2.63Å
502I95.6Very high94.4Very high90 Ų9045.5 Ų45.546%0.46227%0.27SS..Hα-helixtrans-57.7-50.8-176.1-65169.9000111.4L499 L504 S505L499-I502 HydrophobicContact CB-CD1 4.35Å; L499-I502 HydrophobicContact CD2-CD1 3.58Å; L499-I502 WeakPolarHBondContact O-CB 3.33Å; L499-I502 WeakPolarHBondContact O-CG1 3.26Å; L499-I502 PolarHBondContact O-N 2.9Å; L499-I502 VanDerWaalsContact O-N 3.08Å; I502-L504 PolarHBondContact O-N 3.23Å; I502-S505 WeakPolarHBondContact O-CB 3.25Å; I502-S505 PolarHBondContact O-N 2.91Å; I502-S505 PolarHBondContact O-OG 3.24Å
503P94Very high94.2Very high68 Ų6844.7 Ų44.744%0.44226%0.264SS..Hα-helixtrans-61.1-29.4177.3-22.734.9000113.3S500 F507S500-P503 WeakPolarHBondContact O-CD 3.34Å; P503-F507 WeakPolarHBondContact O-CD2 3.07Å; P503-F507 WeakPolarHBondContact O-CE2 3.17Å
504L91.5Very high93.9Very high0 Ų047.6 Ų47.60%028%0.281CS..Hα-helixtrans-74.5-32.9177.8-173.164.2000111.6L318 V325 I394 I397 I398 V501 I502 C506 F507L318-L504 HydrophobicContact CD1-CD1 3.54Å; V325-L504 HydrophobicContact CG2-CB 4.19Å; V325-L504 HydrophobicContact CG2-CD2 4.04Å; I394-L504 HydrophobicContact CG1-CD1 4.39Å; I394-L504 HydrophobicContact CG2-CD1 4.38Å; I394-L504 HydrophobicContact CG2-CD2 4.31Å; I394-L504 HydrophobicContact CG2-CG 3.91Å; I397-L504 HydrophobicContact CB-CD2 4.43Å; I397-L504 HydrophobicContact CG2-CD2 3.92Å; I398-L504 HydrophobicContact CG1-CD2 4.44Å; V501-L504 WeakPolarHBondContact O-CA 3.49Å; V501-L504 WeakPolarHBondContact O-CB 3.25Å; V501-L504 PolarHBondContact O-N 3.32Å; I502-L504 PolarHBondContact O-N 3.23Å; L504-C506 PolarHBondContact O-N 2.92Å; L504-F507 PolarHBondContact O-N 3.05Å
505S89.8Confident93.7Very high66 Ų6651.2 Ų51.246%0.46230%0.302SS..Hα-helixtrans-69.1-15.2179.974.20000114.6V501 I502 F507V501-S505 PolarHBondContact O-N 2.63Å; I502-S505 WeakPolarHBondContact O-CB 3.25Å; I502-S505 PolarHBondContact O-N 2.91Å; I502-S505 PolarHBondContact O-OG 3.24Å; S505-F507 PolarHBondContact O-N 3.29Å
506C88.3Confident93.4Very high97 Ų9749.3 Ų49.366%0.65530%0.296SS*.THydrogen-bonded Turntrans-74.9-3.1177.7-60.80000114L504L504-C506 PolarHBondContact O-N 2.92Å
507F83.7Confident93.1Very high52 Ų5246.5 Ų46.523%0.22828%0.278CS..  trans-113.60-174.8-67-92.5000112.3R314 L317 L318 P503 L504 S505R314-F507 HydrophobicContact CG-CD1 3.89Å; R314-F507 HydrophobicContact CG-CE1 3.59Å; R314-F507 WeakPolarHBondContact O-CE1 3.47Å; L317-F507 HydrophobicContact CB-CE1 4.25Å; L317-F507 HydrophobicContact CB-CZ 3.61Å; L318-F507 HydrophobicContact CB-CD1 3.93Å; L318-F507 HydrophobicContact CB-CE1 3.97Å; L318-F507 HydrophobicContact CB-CG 4.26Å; L318-F507 HydrophobicContact CB-CZ 4.35Å; L318-F507 HydrophobicContact CD1-CB 3.83Å; L318-F507 HydrophobicContact CD1-CD1 4.26Å; L318-F507 HydrophobicContact CD1-CD2 3.97Å; L318-F507 HydrophobicContact CD1-CG 3.76Å; L318-F507 HydrophobicContact CD2-CB 4.47Å; L318-F507 HydrophobicContact CD2-CD1 4.38Å; L318-F507 HydrophobicContact CG-CD1 4.42Å; L318-F507 HydrophobicContact CG-CG 4.4Å; P503-F507 WeakPolarHBondContact O-CD2 3.07Å; P503-F507 WeakPolarHBondContact O-CE2 3.17Å; L504-F507 PolarHBondContact O-N 3.05Å; S505-F507 PolarHBondContact O-N 3.29Å

Retrieved 507 of 507 residues in 552.3 ms (Link to these results)

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