A0A087X6B1_POEFO Loading...

Alpha-1,3-glucosyltransferase

AlphaFold DB , UniProt , Accession A0A087X6B1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 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
1M33.5Very low59Low242 Ų24297.5 Ų97.5100%1.19259%0.587SS**  0107.50-82.1170.268.400108A3M1-A3 PolarHBondContact O-N 3.2Å
2A29.6Very low61.9Low107 Ų10796 Ų9688%0.88458%0.578SS**  trans-58.3118.3178.100000108.9Q4A2-Q4 PolarHBondContact O-N 3.12Å; A2-Q4 VanDerWaalsContact O-N 3.12Å
3A36.3Very low64.4Low96 Ų9693.8 Ų93.879%0.79358%0.576SS**  trans-61116.1169.800000106.9M1 A5M1-A3 PolarHBondContact O-N 3.2Å; A3-A5 PolarHBondContact O-N 3.2Å; A3-A5 VanDerWaalsContact O-N 3.1Å
4Q39.3Very low66.6Low187 Ų18789.1 Ų89.187%0.87455%0.546SS*.  trans-44.6120.5165.7-142.1161.1-6.600106.7A2 E6A2-Q4 PolarHBondContact O-N 3.12Å; A2-Q4 VanDerWaalsContact O-N 3.12Å; Q4-E6 PolarHBondContact O-N 3.49Å
5A41.5Very low68.5Low100 Ų10083.7 Ų83.783%0.82651%0.514SS*.  trans-63.789.1-177.300000108.4A3 S7A3-A5 PolarHBondContact O-N 3.2Å; A3-A5 VanDerWaalsContact O-N 3.1Å; A5-S7 PolarHBondContact O-N 2.95Å; A5-S7 VanDerWaalsContact O-N 3.08Å
6E55Low70.2Confident88 Ų8883.4 Ų83.441%0.41151%0.512SS..  trans-52.2119.2168-89.9-175.8154.600106.7Q4 W8Q4-E6 PolarHBondContact O-N 3.49Å; E6-W8 PolarHBondContact O-N 3.41Å
7S64.2Low71.7Confident85 Ų8580.7 Ų80.759%0.59450%0.504SS*.  trans-68.1100.5175.269.20000107.8A5 S9A5-S7 PolarHBondContact O-N 2.95Å; A5-S7 VanDerWaalsContact O-N 3.08Å; S7-S9 PolarHBondContact O-N 3.05Å; S7-S9 PolarHBondContact O-OG 3.26Å; S7-S9 PolarHBondContact OG-OG 3.27Å
8W80.4Confident73Confident53 Ų5376.3 Ų76.320%0.20148%0.477CS..THydrogen-bonded Turntrans-69.220.4171.1-72.182.6000112.5E6 W10 F11 T12 C122 R123E6-W8 PolarHBondContact O-N 3.41Å; W8-W10 VanDerWaalsContact C-N 3.27Å; W8-W10 HydrophobicContact CE3-CH2 4.35Å; W8-W10 AromaticContact CE3-CZ2 3.8Å; W8-W10 HydrophobicContact CE3-CZ2 3.8Å; W8-W10 HydrophobicContact CH2-CZ2 4.44Å; W8-W10 HydrophobicContact CZ3-CH2 4.04Å; W8-W10 AromaticContact CZ3-CZ2 3.69Å; W8-W10 HydrophobicContact CZ3-CZ2 3.69Å; W8-W10 PolarHBondContact O-N 3.36Å; W8-F11 HydrophobicContact CE3-CB 3.97Å; W8-F11 HydrophobicContact CE3-CD2 4.44Å; W8-F11 HydrophobicContact CE3-CG 4.3Å; W8-F11 HydrophobicContact CZ3-CD2 4.41Å; W8-F11 WeakPolarHBondContact O-CB 3.27Å; W8-F11 PolarHBondContact O-N 2.96Å; W8-F11 VanDerWaalsContact O-N 3.17Å; W8-T12 PolarHBondContact O-N 3.14Å; W8-C122 HydrophobicContact CH2-CB 3.91Å; W8-C122 HydrophobicContact CZ3-CB 3.92Å; W8-R123 HydrophobicContact CH2-CG 3.89Å; W8-R123 HydrophobicContact CZ2-CG 3.85Å
9S83.9Confident74.1Confident75 Ų7573.7 Ų73.752%0.52446%0.461SS..Hα-helixtrans-59.4-39.7176.452.60000111.1S7 F11 T12 A13S7-S9 PolarHBondContact O-N 3.05Å; S7-S9 PolarHBondContact O-OG 3.26Å; S7-S9 PolarHBondContact OG-OG 3.27Å; S9-F11 VanDerWaalsContact C-N 3.26Å; S9-F11 PolarHBondContact O-N 3.1Å; S9-T12 PolarHBondContact O-N 3.26Å; S9-A13 PolarHBondContact O-N 2.9Å
10W91.1Very high75.2Confident36 Ų3675.8 Ų75.814%0.13647%0.469CS..Hα-helixtrans-57.9-36.7175.867.1-101.3000112.6W8 A13 L14 V134 F140 A143W8-W10 VanDerWaalsContact C-N 3.27Å; W8-W10 HydrophobicContact CE3-CH2 4.35Å; W8-W10 AromaticContact CE3-CZ2 3.8Å; W8-W10 HydrophobicContact CE3-CZ2 3.8Å; W8-W10 HydrophobicContact CH2-CZ2 4.44Å; W8-W10 HydrophobicContact CZ3-CH2 4.04Å; W8-W10 AromaticContact CZ3-CZ2 3.69Å; W8-W10 HydrophobicContact CZ3-CZ2 3.69Å; W8-W10 PolarHBondContact O-N 3.36Å; W10-A13 PolarHBondContact O-N 2.94Å; W10-L14 HydrophobicContact CZ3-CD2 4.38Å; W10-L14 WeakPolarHBondContact O-CB 3.3Å; W10-L14 PolarHBondContact O-N 2.92Å; W10-V134 HydrophobicContact CB-CG1 4.34Å; W10-V134 HydrophobicContact CD2-CG1 4.29Å; W10-V134 HydrophobicContact CG-CG1 3.94Å; W10-F140 AromaticContact CD2-CD2 3.96Å; W10-F140 HydrophobicContact CD2-CD2 3.96Å; W10-F140 AromaticContact CE3-CD2 3.4Å; W10-F140 HydrophobicContact CE3-CD2 3.4Å; W10-F140 VanDerWaalsContact CE3-CD2 3.4Å; W10-F140 AromaticContact CE3-CE2 3.93Å; W10-F140 HydrophobicContact CE3-CE2 3.93Å; W10-F140 HydrophobicContact CE3-CG 4.44Å; W10-F140 HydrophobicContact CH2-CB 4.31Å; W10-F140 HydrophobicContact CH2-CD2 4.45Å; W10-F140 HydrophobicContact CZ3-CB 4.3Å; W10-F140 AromaticContact CZ3-CD2 3.69Å; W10-F140 HydrophobicContact CZ3-CD2 3.69Å; W10-F140 HydrophobicContact CZ3-CE2 4.43Å; W10-F140 HydrophobicContact CZ3-CG 4.37Å; W10-A143 HydrophobicContact CH2-CB 3.96Å; W10-A143 HydrophobicContact CZ3-CB 3.68Å
11F94.1Very high76.1Confident4 Ų474.6 Ų74.62%0.01846%0.457CS..Hα-helixtrans-69.5-40.9-178.6-176.5-83.9000110.5W8 S9 L14 A15 I115 A118 R119 A143 L147W8-F11 HydrophobicContact CE3-CB 3.97Å; W8-F11 HydrophobicContact CE3-CD2 4.44Å; W8-F11 HydrophobicContact CE3-CG 4.3Å; W8-F11 HydrophobicContact CZ3-CD2 4.41Å; W8-F11 WeakPolarHBondContact O-CB 3.27Å; W8-F11 PolarHBondContact O-N 2.96Å; W8-F11 VanDerWaalsContact O-N 3.17Å; S9-F11 VanDerWaalsContact C-N 3.26Å; S9-F11 PolarHBondContact O-N 3.1Å; F11-L14 PolarHBondContact O-N 2.67Å; F11-A15 HydrophobicContact CE1-CB 4.42Å; F11-A15 WeakPolarHBondContact O-CB 3.46Å; F11-A15 PolarHBondContact O-N 3.1Å; F11-I115 HydrophobicContact CE1-CG2 3.9Å; F11-I115 HydrophobicContact CZ-CG2 4.3Å; F11-I115 WeakPolarHBondContact CZ-O 3.43Å; F11-A118 HydrophobicContact CZ-CB 4.43Å; F11-R119 HydrophobicContact CD1-CB 4.32Å; F11-R119 HydrophobicContact CD1-CG 4.15Å; F11-R119 HydrophobicContact CE1-CB 3.64Å; F11-R119 HydrophobicContact CE1-CG 3.96Å; F11-R119 HydrophobicContact CE2-CB 4.04Å; F11-R119 HydrophobicContact CE2-CG 4.42Å; F11-R119 HydrophobicContact CG-CG 4.49Å; F11-R119 HydrophobicContact CZ-CB 3.48Å; F11-R119 VanDerWaalsContact CZ-CB 3.48Å; F11-R119 HydrophobicContact CZ-CG 4.12Å; F11-A143 HydrophobicContact CD2-CB 3.97Å; F11-A143 HydrophobicContact CE2-CB 3.89Å; F11-L147 HydrophobicContact CE2-CD1 4.22Å; F11-L147 HydrophobicContact CZ-CD1 4.11Å
12T93.6Very high79Confident79 Ų7963.6 Ų63.649%0.48540%0.403SS..Hα-helixtrans-65-45.2177.3-50.50000110.3W8 S9 L14 A15 V16W8-T12 PolarHBondContact O-N 3.14Å; S9-T12 PolarHBondContact O-N 3.26Å; T12-L14 PolarHBondContact O-N 3.47Å; T12-A15 PolarHBondContact O-N 2.89Å; T12-V16 HydrophobicContact CG2-CG2 4.49Å; T12-V16 WeakPolarHBondContact O-CB 3.45Å; T12-V16 VanDerWaalsContact O-CG2 3.3Å; T12-V16 WeakPolarHBondContact O-CG2 3.42Å; T12-V16 PolarHBondContact O-N 3.08Å
13A94.4Very high82.1Confident67 Ų6760.6 Ų60.655%0.55438%0.375SS*.Hα-helixtrans-59.8-44.3175.400000112.1S9 W10 G17S9-A13 PolarHBondContact O-N 2.9Å; W10-A13 PolarHBondContact O-N 2.94Å; A13-G17 PolarHBondContact O-N 2.83Å
14L94.9Very high84.8Confident28 Ų2862.2 Ų62.215%0.14737%0.369CS..Hα-helixtrans-61.5-47.9176.3179.965.5000111.7W10 F11 T12 G17 V18 A143 V144 L147W10-L14 HydrophobicContact CZ3-CD2 4.38Å; W10-L14 WeakPolarHBondContact O-CB 3.3Å; W10-L14 PolarHBondContact O-N 2.92Å; F11-L14 PolarHBondContact O-N 2.67Å; T12-L14 PolarHBondContact O-N 3.47Å; L14-G17 PolarHBondContact O-N 2.73Å; L14-V18 HydrophobicContact CD1-CG2 4.36Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.16Å; L14-A143 HydrophobicContact CD2-CB 3.79Å; L14-V144 HydrophobicContact CD1-CG2 4.19Å; L14-V144 HydrophobicContact CD2-CG2 3.8Å; L14-L147 HydrophobicContact CD2-CD1 4.1Å; L14-L147 HydrophobicContact CG-CD1 4.17Å
15A95.8Very high87.4Confident9 Ų953.9 Ų53.97%0.07433%0.33CS..Hα-helixtrans-63.3-42-179.700000112.5F11 T12 S19 I115 L147F11-A15 HydrophobicContact CE1-CB 4.42Å; F11-A15 WeakPolarHBondContact O-CB 3.46Å; F11-A15 PolarHBondContact O-N 3.1Å; T12-A15 PolarHBondContact O-N 2.89Å; A15-S19 WeakPolarHBondContact O-CB 3.01Å; A15-S19 PolarHBondContact O-N 2.63Å; A15-S19 PolarHBondContact O-OG 3.49Å; A15-I115 HydrophobicContact CB-CD1 4.42Å; A15-I115 HydrophobicContact CB-CG2 3.67Å; A15-L147 HydrophobicContact CB-CD1 4.29Å
16V95.2Very high89.9Confident79 Ų7950.7 Ų50.748%0.47930%0.299SS..Hα-helixtrans-64.7-47175.1171.80000110.4T12 V18 S19 L20T12-V16 HydrophobicContact CG2-CG2 4.49Å; T12-V16 WeakPolarHBondContact O-CB 3.45Å; T12-V16 VanDerWaalsContact O-CG2 3.3Å; T12-V16 WeakPolarHBondContact O-CG2 3.42Å; T12-V16 PolarHBondContact O-N 3.08Å; V16-V18 PolarHBondContact O-N 3.3Å; V16-S19 PolarHBondContact O-N 3.3Å; V16-S19 VanDerWaalsContact O-N 3.11Å; V16-L20 HydrophobicContact CG1-CD1 3.97Å; V16-L20 HydrophobicContact CG1-CG 4.34Å; V16-L20 WeakPolarHBondContact O-CG 3.29Å; V16-L20 PolarHBondContact O-N 3.27Å
17G95.6Very high91.7Very high37 Ų3753.9 Ų53.938%0.38132%0.318SS..Hα-helixtrans-58.5-44.6178.500000112.9A13 L14 S19 L20 F21A13-G17 PolarHBondContact O-N 2.83Å; L14-G17 PolarHBondContact O-N 2.73Å; G17-S19 PolarHBondContact O-N 2.92Å; G17-L20 PolarHBondContact O-N 3.47Å; G17-F21 WeakPolarHBondContact O-CB 3.46Å; G17-F21 PolarHBondContact O-N 3.47Å
18V94.9Very high93.1Very high2 Ų250.5 Ų50.51%0.01230%0.296CS..Hα-helixtrans-61.3-43.9174.2172.70000111.2L14 V16 F21 K22 L147 W148L14-V18 HydrophobicContact CD1-CG2 4.36Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.16Å; V16-V18 PolarHBondContact O-N 3.3Å; V18-F21 WeakPolarHBondContact O-CB 3.43Å; V18-F21 PolarHBondContact O-N 2.86Å; V18-K22 HydrophobicContact CG1-CD 4.12Å; V18-K22 HydrophobicContact CG1-CG 4.49Å; V18-K22 VanDerWaalsContact O-CG 3.28Å; V18-K22 WeakPolarHBondContact O-CG 3.46Å; V18-K22 PolarHBondContact O-N 2.83Å; V18-L147 HydrophobicContact CG1-CB 4.48Å; V18-L147 WeakPolarHBondContact CG1-O 3.49Å; V18-L147 HydrophobicContact CG2-CB 4.02Å; V18-W148 HydrophobicContact CG2-CG 4.2Å; V18-W148 VanDerWaalsContact CG2-NE1 3.25Å
19S94.5Very high93.7Very high26 Ų2650.2 Ų50.218%0.18230%0.295CS..Hα-helixtrans-64.9-41.3-178.3-56.30000111.6A15 V16 G17 K22 C23A15-S19 WeakPolarHBondContact O-CB 3.01Å; A15-S19 PolarHBondContact O-N 2.63Å; A15-S19 PolarHBondContact O-OG 3.49Å; V16-S19 PolarHBondContact O-N 3.3Å; V16-S19 VanDerWaalsContact O-N 3.11Å; G17-S19 PolarHBondContact O-N 2.92Å; S19-K22 WeakPolarHBondContact O-CB 3.5Å; S19-K22 PolarHBondContact O-N 2.78Å; S19-C23 PolarHBondContact O-N 3.2Å; S19-C23 PolarHBondContact O-SG 3.38Å; S19-C23 VanDerWaalsContact O-SG 3.37Å
20L95.3Very high94Very high115 Ų11549.9 Ų49.960%0.60229%0.285SS*.Hα-helixtrans-65.9-39.3173.5-67.4174.5000111.9V16 G17 K22 C23V16-L20 HydrophobicContact CG1-CD1 3.97Å; V16-L20 HydrophobicContact CG1-CG 4.34Å; V16-L20 WeakPolarHBondContact O-CG 3.29Å; V16-L20 PolarHBondContact O-N 3.27Å; G17-L20 PolarHBondContact O-N 3.47Å; L20-K22 VanDerWaalsContact C-N 3.31Å; L20-K22 PolarHBondContact O-N 3.43Å; L20-C23 WeakPolarHBondContact O-CB 3.33Å; L20-C23 PolarHBondContact O-N 3.15Å; L20-C23 VanDerWaalsContact O-N 3.16Å
21F94.9Very high94Very high51 Ų5148.5 Ų48.522%0.22428%0.281CS..Hα-helixtrans-62.3-38.9175.4-174.8-105.6000111.9G17 V18 C23 L24 F25 W148 L430G17-F21 WeakPolarHBondContact O-CB 3.46Å; G17-F21 PolarHBondContact O-N 3.47Å; V18-F21 WeakPolarHBondContact O-CB 3.43Å; V18-F21 PolarHBondContact O-N 2.86Å; F21-C23 VanDerWaalsContact C-N 3.25Å; F21-C23 PolarHBondContact O-N 3.07Å; F21-L24 HydrophobicContact CD2-CD1 3.68Å; F21-L24 HydrophobicContact CE2-CD1 4Å; F21-L24 VanDerWaalsContact O-CB 3.27Å; F21-L24 WeakPolarHBondContact O-CB 3.26Å; F21-L24 WeakPolarHBondContact O-CG 3.4Å; F21-L24 PolarHBondContact O-N 3.48Å; F21-L24 VanDerWaalsContact O-N 3.07Å; F21-F25 AromaticContact CD1-CE2 3.92Å; F21-F25 HydrophobicContact CD1-CE2 3.92Å; F21-F25 HydrophobicContact CD1-CZ 4.21Å; F21-F25 AromaticContact CE1-CE2 3.66Å; F21-F25 HydrophobicContact CE1-CE2 3.66Å; F21-F25 AromaticContact CE1-CZ 3.53Å; F21-F25 HydrophobicContact CE1-CZ 3.53Å; F21-F25 HydrophobicContact CZ-CE2 4.31Å; F21-F25 AromaticContact CZ-CZ 3.76Å; F21-F25 HydrophobicContact CZ-CZ 3.76Å; F21-W148 AromaticContact CD1-CH2 3.9Å; F21-W148 HydrophobicContact CD1-CH2 3.9Å; F21-W148 HydrophobicContact CD1-CZ2 4.15Å; F21-W148 HydrophobicContact CD1-CZ3 4.4Å; F21-W148 HydrophobicContact CD2-CH2 4.31Å; F21-W148 AromaticContact CE1-CH2 3.72Å; F21-W148 HydrophobicContact CE1-CH2 3.72Å; F21-W148 HydrophobicContact CE1-CZ2 4.43Å; F21-W148 AromaticContact CE1-CZ3 3.95Å; F21-W148 HydrophobicContact CE1-CZ3 3.95Å; F21-W148 HydrophobicContact CE2-CH2 4.16Å; F21-W148 HydrophobicContact CG-CH2 4.19Å; F21-W148 HydrophobicContact CG-CZ2 4.23Å; F21-W148 AromaticContact CZ-CH2 3.87Å; F21-W148 HydrophobicContact CZ-CH2 3.87Å; F21-W148 HydrophobicContact CZ-CZ3 4.26Å; F21-L430 HydrophobicContact CE1-CD2 3.59Å; F21-L430 HydrophobicContact CZ-CD2 3.65Å
22K95Very high93.9Very high12 Ų1252.4 Ų52.45%0.05231%0.305CS..Hα-helixtrans-59.7-34.6174.1-70.5164.7169-162.10112.6V18 S19 L20 L24 F25 V108 D111 L153 H157V18-K22 HydrophobicContact CG1-CD 4.12Å; V18-K22 HydrophobicContact CG1-CG 4.49Å; V18-K22 VanDerWaalsContact O-CG 3.28Å; V18-K22 WeakPolarHBondContact O-CG 3.46Å; V18-K22 PolarHBondContact O-N 2.83Å; S19-K22 WeakPolarHBondContact O-CB 3.5Å; S19-K22 PolarHBondContact O-N 2.78Å; L20-K22 VanDerWaalsContact C-N 3.31Å; L20-K22 PolarHBondContact O-N 3.43Å; K22-L24 PolarHBondContact O-N 2.86Å; K22-F25 PolarHBondContact O-N 2.69Å; K22-F25 VanDerWaalsContact O-N 3.08Å; K22-V108 HydrophobicContact CB-CG2 4.15Å; K22-D111 IonicContact NZ-OD2 3.47Å; K22-D111 PolarHBondContact NZ-OD2 3.07Å; K22-L153 HydrophobicContact CD-CD2 4.41Å; K22-L153 HydrophobicContact CG-CD2 3.78Å; K22-H157 WeakPolarHBondContact CD-NE2 3.47Å; K22-H157 WeakPolarHBondContact CE-NE2 3.26Å; K22-H157 PolarHBondContact NZ-NE2 3.13Å; K22-H157 VanDerWaalsContact NZ-NE2 3.16Å
23C94.1Very high93.8Very high44 Ų4450.1 Ų50.130%0.29729%0.29SS..Hα-helixtrans-64.4-20.3176.8-62.40000113.4S19 L20 F21 F25 I26S19-C23 PolarHBondContact O-N 3.2Å; S19-C23 PolarHBondContact O-SG 3.38Å; S19-C23 VanDerWaalsContact O-SG 3.37Å; L20-C23 WeakPolarHBondContact O-CB 3.33Å; L20-C23 PolarHBondContact O-N 3.15Å; L20-C23 VanDerWaalsContact O-N 3.16Å; F21-C23 VanDerWaalsContact C-N 3.25Å; F21-C23 PolarHBondContact O-N 3.07Å; C23-F25 PolarHBondContact O-N 3.3Å; C23-I26 HydrophobicContact CB-CD1 4.02Å; C23-I26 VanDerWaalsContact O-CD1 3.31Å; C23-I26 WeakPolarHBondContact O-CD1 3.35Å; C23-I26 VanDerWaalsContact O-CG1 3.23Å; C23-I26 WeakPolarHBondContact O-CG1 3.45Å; C23-I26 PolarHBondContact O-N 3.18Å
24L93.8Very high93.9Very high129 Ų12947.1 Ų47.168%0.67526%0.264SS*.THydrogen-bonded Turntrans-66.3-17.5174.2-58177.6000112.6F21 K22F21-L24 HydrophobicContact CD2-CD1 3.68Å; F21-L24 HydrophobicContact CE2-CD1 4Å; F21-L24 VanDerWaalsContact O-CB 3.27Å; F21-L24 WeakPolarHBondContact O-CB 3.26Å; F21-L24 WeakPolarHBondContact O-CG 3.4Å; F21-L24 PolarHBondContact O-N 3.48Å; F21-L24 VanDerWaalsContact O-N 3.07Å; K22-L24 PolarHBondContact O-N 2.86Å
25F93.8Very high94Very high13 Ų1346.1 Ų46.16%0.05726%0.259CS..THydrogen-bonded Turntrans-96.17.1-179.7-52.5-56.3000114.1F21 K22 C23 N27 A28 H157 I158 I426 L430F21-F25 AromaticContact CD1-CE2 3.92Å; F21-F25 HydrophobicContact CD1-CE2 3.92Å; F21-F25 HydrophobicContact CD1-CZ 4.21Å; F21-F25 AromaticContact CE1-CE2 3.66Å; F21-F25 HydrophobicContact CE1-CE2 3.66Å; F21-F25 AromaticContact CE1-CZ 3.53Å; F21-F25 HydrophobicContact CE1-CZ 3.53Å; F21-F25 HydrophobicContact CZ-CE2 4.31Å; F21-F25 AromaticContact CZ-CZ 3.76Å; F21-F25 HydrophobicContact CZ-CZ 3.76Å; K22-F25 PolarHBondContact O-N 2.69Å; K22-F25 VanDerWaalsContact O-N 3.08Å; C23-F25 PolarHBondContact O-N 3.3Å; F25-N27 VanDerWaalsContact C-N 3.26Å; F25-N27 PolarHBondContact O-N 3.28Å; F25-A28 HydrophobicContact CB-CB 4.21Å; F25-A28 VanDerWaalsContact O-CB 3.32Å; F25-A28 WeakPolarHBondContact O-CB 3.33Å; F25-A28 PolarHBondContact O-N 3.38Å; F25-H157 HydrophobicContact CB-CB 4.42Å; F25-H157 WeakPolarHBondContact CB-O 3.29Å; F25-H157 HydrophobicContact CD2-CB 4.23Å; F25-I158 HydrophobicContact CB-CG1 4.24Å; F25-I158 HydrophobicContact CD1-CD1 4.23Å; F25-I158 HydrophobicContact CD1-CG1 4.25Å; F25-I158 HydrophobicContact CE1-CD1 4.46Å; F25-I158 HydrophobicContact CG-CG1 4.13Å; F25-I426 HydrophobicContact CD1-CG2 4.42Å; F25-I426 HydrophobicContact CE1-CG2 3.68Å; F25-I426 HydrophobicContact CZ-CG2 4.41Å; F25-L430 HydrophobicContact CE1-CD1 4.49Å; F25-L430 HydrophobicContact CZ-CD1 3.99Å; F25-L430 HydrophobicContact CZ-CD2 4.36Å
26I94.2Very high93.9Very high32 Ų3246.5 Ų46.516%0.16426%0.26CS..THydrogen-bonded Turntrans-53.6-45.1-177.8-73.7166.4000111.5C23 L101 R104C23-I26 HydrophobicContact CB-CD1 4.02Å; C23-I26 VanDerWaalsContact O-CD1 3.31Å; C23-I26 WeakPolarHBondContact O-CD1 3.35Å; C23-I26 VanDerWaalsContact O-CG1 3.23Å; C23-I26 WeakPolarHBondContact O-CG1 3.45Å; C23-I26 PolarHBondContact O-N 3.18Å; I26-L101 HydrophobicContact CD1-CD1 3.91Å; I26-L101 HydrophobicContact CG2-CD1 3.94Å; I26-R104 HydrophobicContact CG1-CB 4.09Å; I26-R104 HydrophobicContact CG2-CB 4.48Å; I26-R104 HydrophobicContact CG2-CG 4.4Å; I26-R104 PolarHBondContact O-NE 3.42Å
27N92.2Very high94Very high155 Ų15542.9 Ų42.983%0.82924%0.238SC*.THydrogen-bonded Turntrans-93.68.7-178.9-64.4-32.7000114F25F25-N27 VanDerWaalsContact C-N 3.26Å; F25-N27 PolarHBondContact O-N 3.28Å
28A93Very high94.1Very high14 Ų1441.1 Ų41.112%0.11622%0.22CC..SBendtrans-72.6165.4175.700000111.2F25 R104 I158F25-A28 HydrophobicContact CB-CB 4.21Å; F25-A28 VanDerWaalsContact O-CB 3.32Å; F25-A28 WeakPolarHBondContact O-CB 3.33Å; F25-A28 PolarHBondContact O-N 3.38Å; A28-R104 PolarHBondContact O-NH2 2.95Å; A28-I158 HydrophobicContact CB-CG2 4.19Å
29Y92.9Very high94.2Very high48 Ų4841.2 Ų41.219%0.18822%0.221CC..  trans-41142.2170.3166.5-99.3000112.5R104 I158 L418 F419 T420 E423Y29-R104 PolarHBondContact O-NH2 3.28Å; Y29-I158 HydrophobicContact CD1-CG2 4.27Å; Y29-I158 CarbonylContact O-C 3.24Å; Y29-I158 VanDerWaalsContact O-C 3.24Å; Y29-I158 WeakPolarHBondContact O-CG2 3.21Å; Y29-L418 HydrophobicContact CD1-CD2 3.62Å; Y29-L418 HydrophobicContact CE1-CD2 3.83Å; Y29-F419 HydrophobicContact CE2-CE1 4.23Å; Y29-F419 HydrophobicContact CE2-CZ 4.26Å; Y29-F419 AromaticContact CZ-CE1 3.99Å; Y29-F419 WeakPolarHBondContact OH-CE1 3.38Å; Y29-T420 HydrophobicContact CD2-CG2 3.71Å; Y29-T420 HydrophobicContact CE2-CG2 4.17Å; Y29-T420 HydrophobicContact CG-CG2 4.22Å; Y29-E423 VanDerWaalsContact CB-CD 3.42Å; Y29-E423 VanDerWaalsContact CB-OE1 3.26Å; Y29-E423 WeakPolarHBondContact CB-OE1 3.45Å; Y29-E423 PolarHBondContact N-OE1 3.05Å
30H90.9Very high94.3Very high67 Ų6740.2 Ų40.231%0.3121%0.213SC..  trans-130.5145.6168.952.9-90.6000109.6F34 F160H30-F34 HydrophobicContact CB-CB 3.98Å; H30-F34 HydrophobicContact CB-CD2 4.02Å; H30-F34 HydrophobicContact CB-CG 4.18Å; H30-F34 AromaticContact CD2-CD1 3.88Å; H30-F34 AromaticContact CD2-CG 3.6Å; H30-F34 AromaticContact CG-CG 3.96Å; H30-F160 HydrophobicContact CB-CB 4.28Å
31S91.8Very high94.4Very high8 Ų834.8 Ų34.86%0.05618%0.184CC..  trans-85.6-178.3-18076.40000112.5D33 F34 H159S31-D33 PolarHBondContact O-N 2.76Å; S31-D33 VanDerWaalsContact O-N 3.14Å; S31-D33 WeakPolarHBondContact OG-CB 2.92Å; S31-D33 PolarHBondContact OG-N 3.24Å; S31-D33 VanDerWaalsContact OG-N 3.14Å; S31-F34 VanDerWaalsContact O-CB 3.24Å; S31-F34 WeakPolarHBondContact O-CB 3.46Å; S31-F34 PolarHBondContact O-N 2.91Å; S31-H159 WeakPolarHBondContact CB-CE1 3.22Å; S31-H159 WeakPolarHBondContact CB-ND1 3.47Å; S31-H159 VanDerWaalsContact CB-O 3.25Å; S31-H159 WeakPolarHBondContact CB-O 3.48Å; S31-H159 PolarHBondContact N-O 3.45Å; S31-H159 PolarHBondContact OG-CD2 3.31Å; S31-H159 PolarHBondContact OG-CE1 2.91Å; S31-H159 PolarHBondContact OG-NE2 3.31Å; S31-H159 PolarHBondContact OG-O 3.48Å
32T91.1Very high94.6Very high86 Ų8632.3 Ų32.353%0.52817%0.174SC..Hα-helixtrans-56-24.3170.152.50000113F34 E35 V36 W60T32-F34 PolarHBondContact O-N 2.86Å; T32-F34 VanDerWaalsContact O-N 3.16Å; T32-E35 PolarHBondContact O-N 2.89Å; T32-E35 VanDerWaalsContact O-N 3.08Å; T32-V36 WeakPolarHBondContact O-CG2 3.43Å; T32-V36 PolarHBondContact O-N 3.28Å; T32-W60 HydrophobicContact CG2-CH2 4.3Å
33D92.3Very high94.7Very high31 Ų3131.8 Ų31.817%0.16617%0.171CC..Hα-helixtrans-60.4-24.4175.9-70.6-19.6000111.9S31 V36 H37 H159 F160 Q161 K380S31-D33 PolarHBondContact O-N 2.76Å; S31-D33 VanDerWaalsContact O-N 3.14Å; S31-D33 WeakPolarHBondContact OG-CB 2.92Å; S31-D33 PolarHBondContact OG-N 3.24Å; S31-D33 VanDerWaalsContact OG-N 3.14Å; D33-V36 PolarHBondContact O-N 3.24Å; D33-H37 PolarHBondContact O-CD2 3.32Å; D33-H37 PolarHBondContact O-N 2.95Å; D33-H159 IonicContact OD2-CD2 3.55Å; D33-H159 IonicContact OD2-NE2 3.45Å; D33-H159 PolarHBondContact OD2-NE2 2.98Å; D33-F160 VanDerWaalsContact CB-O 3.28Å; D33-F160 WeakPolarHBondContact CB-O 3.49Å; D33-Q161 HydrophobicContact CB-CG 4.36Å; D33-Q161 PolarHBondContact OD2-NE2 3.23Å; D33-K380 IonicContact OD2-NZ 3.87Å; D33-K380 PolarHBondContact OD2-NZ 2.74Å
34F96.1Very high94.8Very high3 Ų329.8 Ų29.81%0.01316%0.157CC..Hα-helixtrans-61.1-49.5171.7-175.4-85.2000112.2H30 S31 T32 V36 H37 R38 A95 T99 V100 Q103 F160H30-F34 HydrophobicContact CB-CB 3.98Å; H30-F34 HydrophobicContact CB-CD2 4.02Å; H30-F34 HydrophobicContact CB-CG 4.18Å; H30-F34 AromaticContact CD2-CD1 3.88Å; H30-F34 AromaticContact CD2-CG 3.6Å; H30-F34 AromaticContact CG-CG 3.96Å; S31-F34 VanDerWaalsContact O-CB 3.24Å; S31-F34 WeakPolarHBondContact O-CB 3.46Å; S31-F34 PolarHBondContact O-N 2.91Å; T32-F34 PolarHBondContact O-N 2.86Å; T32-F34 VanDerWaalsContact O-N 3.16Å; F34-V36 VanDerWaalsContact C-N 3.33Å; F34-H37 PolarHBondContact O-N 3.37Å; F34-R38 PolarHBondContact O-N 3.18Å; F34-A95 HydrophobicContact CE1-CB 4.07Å; F34-T99 HydrophobicContact CE1-CG2 4.28Å; F34-T99 HydrophobicContact CZ-CG2 4.11Å; F34-V100 HydrophobicContact CE2-CG2 4.37Å; F34-V100 HydrophobicContact CZ-CB 4.36Å; F34-V100 HydrophobicContact CZ-CG2 3.84Å; F34-Q103 HydrophobicContact CE2-CB 3.78Å; F34-Q103 HydrophobicContact CE2-CG 4.24Å; F34-Q103 HydrophobicContact CZ-CB 4.25Å; F34-Q103 HydrophobicContact CZ-CG 4.31Å; F34-Q103 PolarHBondContact O-OE1 3.36Å; F34-F160 VanDerWaalsContact CA-CD1 3.47Å; F34-F160 HydrophobicContact CB-CB 4.28Å; F34-F160 HydrophobicContact CB-CD1 4.06Å; F34-F160 HydrophobicContact CB-CG 4.13Å; F34-F160 HydrophobicContact CD2-CB 4.47Å; F34-F160 HydrophobicContact CD2-CD1 4.19Å; F34-F160 AromaticContact CD2-CD2 3.74Å; F34-F160 HydrophobicContact CD2-CD2 3.74Å; F34-F160 HydrophobicContact CD2-CE1 4.45Å; F34-F160 HydrophobicContact CD2-CE2 4.04Å; F34-F160 AromaticContact CD2-CG 3.84Å; F34-F160 HydrophobicContact CD2-CG 3.84Å; F34-F160 HydrophobicContact CD2-CZ 4.39Å; F34-F160 HydrophobicContact CE2-CD2 4.38Å; F34-F160 HydrophobicContact CE2-CE2 4.35Å; F34-F160 HydrophobicContact CG-CG 4.46Å
35E95.8Very high95Very high8 Ų826.3 Ų26.34%0.03714%0.138CC..Hα-helixtrans-68.6-34.7176.917756.1-158.700111.4T32 H37 R38 N39 W60 N93T32-E35 PolarHBondContact O-N 2.89Å; T32-E35 VanDerWaalsContact O-N 3.08Å; E35-H37 PolarHBondContact O-N 3.24Å; E35-R38 VanDerWaalsContact CD-NE 3.3Å; E35-R38 PolarHBondContact O-N 3.42Å; E35-R38 IonicContact OE1-CZ 3.36Å; E35-R38 IonicContact OE1-NE 2.74Å; E35-R38 PolarHBondContact OE1-NE 3.29Å; E35-R38 IonicContact OE1-NH2 3.53Å; E35-R38 PolarHBondContact OE1-NH2 2.82Å; E35-R38 WeakPolarHBondContact OE2-CD 3.23Å; E35-R38 IonicContact OE2-NE 3.47Å; E35-R38 PolarHBondContact OE2-NE 2.65Å; E35-R38 VanDerWaalsContact OE2-NE 3.07Å; E35-N39 WeakPolarHBondContact O-CB 3.46Å; E35-N39 PolarHBondContact O-N 3.19Å; E35-W60 HydrophobicContact CG-CG 4.47Å; E35-N93 PolarHBondContact OE1-N 2.86Å; E35-N93 VanDerWaalsContact OE2-CA 3.28Å; E35-N93 WeakPolarHBondContact OE2-CA 3.4Å; E35-N93 PolarHBondContact OE2-N 2.78Å; E35-N93 VanDerWaalsContact OE2-N 3.14Å
36V95.6Very high95.1Very high16 Ų1628.3 Ų28.310%0.09715%0.153CC..Hα-helixtrans-56-52.3173.9172.70000110.7T32 D33 F34 N39 W40 W60T32-V36 WeakPolarHBondContact O-CG2 3.43Å; T32-V36 PolarHBondContact O-N 3.28Å; D33-V36 PolarHBondContact O-N 3.24Å; F34-V36 VanDerWaalsContact C-N 3.33Å; V36-N39 PolarHBondContact O-N 3.31Å; V36-W40 HydrophobicContact CG1-CD2 4.05Å; V36-W40 HydrophobicContact CG1-CH2 4.01Å; V36-W40 HydrophobicContact CG1-CZ2 3.37Å; V36-W40 VanDerWaalsContact O-CG 3.23Å; V36-W40 PolarHBondContact O-N 2.88Å; V36-W60 HydrophobicContact CG2-CB 4.2Å; V36-W60 HydrophobicContact CG2-CD2 3.73Å; V36-W60 HydrophobicContact CG2-CE3 3.37Å; V36-W60 HydrophobicContact CG2-CG 4.09Å; V36-W60 HydrophobicContact CG2-CZ3 4.03Å
37H96.6Very high95.2Very high3 Ų327.5 Ų27.51%0.01415%0.149CC..Hα-helixtrans-68.1-37.3178.6-77.4-68.7000112.3D33 F34 E35 N39 W40 L41 F68 E72 F160 Y162D33-H37 PolarHBondContact O-CD2 3.32Å; D33-H37 PolarHBondContact O-N 2.95Å; F34-H37 PolarHBondContact O-N 3.37Å; E35-H37 PolarHBondContact O-N 3.24Å; H37-N39 VanDerWaalsContact C-N 3.3Å; H37-N39 PolarHBondContact O-N 3.02Å; H37-W40 AromaticContact CE1-CE3 3.77Å; H37-W40 AromaticContact CE1-CZ3 3.48Å; H37-W40 VanDerWaalsContact CE1-CZ3 3.48Å; H37-W40 WeakPolarHBondContact CE1-CZ3 3.14Å; H37-W40 AromaticContact ND1-CE3 3.55Å; H37-W40 AromaticContact ND1-CZ3 3.78Å; H37-W40 PolarHBondContact O-N 2.93Å; H37-L41 WeakPolarHBondContact O-CG 3.18Å; H37-L41 PolarHBondContact O-N 2.87Å; H37-F68 AromaticContact CE1-CE1 3.71Å; H37-F68 AromaticContact CE1-CZ 3.81Å; H37-E72 IonicContact CE1-OE1 3.33Å; H37-E72 IonicContact CG-OE1 2.89Å; H37-E72 IonicContact ND1-OE1 2.89Å; H37-E72 PolarHBondContact ND1-OE1 3.36Å; H37-F160 HydrophobicContact CB-CE1 3.72Å; H37-F160 AromaticContact CD2-CE1 3.77Å; H37-F160 AromaticContact CG-CE1 3.95Å; H37-Y162 HydrophobicContact CB-CE2 4.38Å; H37-Y162 AromaticContact CE1-CD2 3.54Å; H37-Y162 AromaticContact CE1-CE2 3.93Å; H37-Y162 AromaticContact CG-CE2 3.84Å; H37-Y162 AromaticContact ND1-CD2 3.75Å; H37-Y162 AromaticContact ND1-CE2 3.64Å; H37-Y162 AromaticContact NE2-CD2 3.78Å
38R97.3Very high95.4Very high0 Ų023 Ų230%013%0.129CC..Hα-helixtrans-56.5-46.7171.4-169.1-133.354.994.9-8111.3F34 E35 W40 L41 A42 M86 R88 Q103F34-R38 PolarHBondContact O-N 3.18Å; E35-R38 VanDerWaalsContact CD-NE 3.3Å; E35-R38 PolarHBondContact O-N 3.42Å; E35-R38 IonicContact OE1-CZ 3.36Å; E35-R38 IonicContact OE1-NE 2.74Å; E35-R38 PolarHBondContact OE1-NE 3.29Å; E35-R38 IonicContact OE1-NH2 3.53Å; E35-R38 PolarHBondContact OE1-NH2 2.82Å; E35-R38 WeakPolarHBondContact OE2-CD 3.23Å; E35-R38 IonicContact OE2-NE 3.47Å; E35-R38 PolarHBondContact OE2-NE 2.65Å; E35-R38 VanDerWaalsContact OE2-NE 3.07Å; R38-W40 VanDerWaalsContact C-N 3.33Å; R38-W40 PolarHBondContact O-N 3.39Å; R38-L41 WeakPolarHBondContact O-CB 3.42Å; R38-L41 PolarHBondContact O-N 2.82Å; R38-A42 PolarHBondContact O-N 2.89Å; R38-A42 VanDerWaalsContact O-N 3.07Å; R38-M86 HydrophobicContact CG-CB 4.3Å; R38-M86 PolarHBondContact NH1-O 3.15Å; R38-R88 PolarHBondContact NH1-O 3.15Å; R38-Q103 VanDerWaalsContact CA-NE2 3.27Å
39N96.9Very high95.5Very high5 Ų524.1 Ų24.13%0.02713%0.132CC..Hα-helixtrans-66.7-35.9179.6-165.150.6000111.8E35 V36 H37 A42 I43 W60E35-N39 WeakPolarHBondContact O-CB 3.46Å; E35-N39 PolarHBondContact O-N 3.19Å; V36-N39 PolarHBondContact O-N 3.31Å; H37-N39 VanDerWaalsContact C-N 3.3Å; H37-N39 PolarHBondContact O-N 3.02Å; N39-A42 WeakPolarHBondContact O-CB 3.38Å; N39-A42 PolarHBondContact O-N 3.42Å; N39-I43 VanDerWaalsContact O-CG1 3.28Å; N39-I43 WeakPolarHBondContact O-CG1 3.46Å; N39-I43 PolarHBondContact O-N 3.33Å; N39-W60 HydrophobicContact CB-CB 4.1Å; N39-W60 PolarHBondContact ND2-O 3.34Å
40W97.4Very high95.7Very high5 Ų524.2 Ų24.22%0.01914%0.14CC..Hα-helixtrans-65.2-38.4174.4-65.7-0.8000112.8V36 H37 R38 A42 I43 T44 T61 D63 Y64 F68 E72V36-W40 HydrophobicContact CG1-CD2 4.05Å; V36-W40 HydrophobicContact CG1-CH2 4.01Å; V36-W40 HydrophobicContact CG1-CZ2 3.37Å; V36-W40 VanDerWaalsContact O-CG 3.23Å; V36-W40 PolarHBondContact O-N 2.88Å; H37-W40 AromaticContact CE1-CE3 3.77Å; H37-W40 AromaticContact CE1-CZ3 3.48Å; H37-W40 VanDerWaalsContact CE1-CZ3 3.48Å; H37-W40 WeakPolarHBondContact CE1-CZ3 3.14Å; H37-W40 AromaticContact ND1-CE3 3.55Å; H37-W40 AromaticContact ND1-CZ3 3.78Å; H37-W40 PolarHBondContact O-N 2.93Å; R38-W40 VanDerWaalsContact C-N 3.33Å; R38-W40 PolarHBondContact O-N 3.39Å; W40-A42 VanDerWaalsContact C-N 3.33Å; W40-I43 PolarHBondContact O-N 2.75Å; W40-T44 WeakPolarHBondContact O-CB 3.42Å; W40-T44 VanDerWaalsContact O-CG2 3.31Å; W40-T44 WeakPolarHBondContact O-CG2 3.35Å; W40-T44 PolarHBondContact O-N 3.45Å; W40-T44 PolarHBondContact O-OG1 2.91Å; W40-T61 PolarHBondContact NE1-O 2.9Å; W40-D63 HydrophobicContact CZ2-CB 4.43Å; W40-Y64 AromaticContact CH2-CD1 3.45Å; W40-Y64 HydrophobicContact CH2-CD1 3.45Å; W40-Y64 VanDerWaalsContact CH2-CD1 3.45Å; W40-Y64 HydrophobicContact CH2-CD2 4.16Å; W40-Y64 AromaticContact CH2-CE1 3.58Å; W40-Y64 HydrophobicContact CH2-CE1 3.58Å; W40-Y64 HydrophobicContact CH2-CE2 4.26Å; W40-Y64 AromaticContact CH2-CG 3.73Å; W40-Y64 HydrophobicContact CH2-CG 3.73Å; W40-Y64 AromaticContact CH2-CZ 3.96Å; W40-Y64 HydrophobicContact CZ2-CD1 4.34Å; W40-Y64 HydrophobicContact CZ3-CD1 4.08Å; W40-Y64 AromaticContact CZ3-CD2 3.94Å; W40-Y64 HydrophobicContact CZ3-CD2 3.94Å; W40-Y64 HydrophobicContact CZ3-CE1 4.26Å; W40-Y64 HydrophobicContact CZ3-CE2 4.12Å; W40-Y64 AromaticContact CZ3-CG 3.87Å; W40-Y64 HydrophobicContact CZ3-CG 3.87Å; W40-F68 HydrophobicContact CE3-CD1 4.1Å; W40-F68 AromaticContact CE3-CE1 3.83Å; W40-F68 HydrophobicContact CE3-CE1 3.83Å; W40-F68 AromaticContact CZ3-CD1 3.9Å; W40-F68 HydrophobicContact CZ3-CD1 3.9Å; W40-F68 AromaticContact CZ3-CE1 3.6Å; W40-F68 HydrophobicContact CZ3-CE1 3.6Å; W40-E72 HydrophobicContact CB-CB 4.47Å; W40-E72 HydrophobicContact CB-CG 4Å; W40-E72 HydrophobicContact CE3-CG 4.22Å
41L97.7Very high95.9Very high0 Ų027 Ų270%015%0.148CC..Hα-helixtrans-58.8-46.3170.2-65.3171.1000110.6H37 R38 T44 H45 E72 L75 A76 M86 L87 F102H37-L41 WeakPolarHBondContact O-CG 3.18Å; H37-L41 PolarHBondContact O-N 2.87Å; R38-L41 WeakPolarHBondContact O-CB 3.42Å; R38-L41 PolarHBondContact O-N 2.82Å; L41-T44 PolarHBondContact O-OG1 2.88Å; L41-H45 WeakPolarHBondContact O-CB 3.3Å; L41-H45 PolarHBondContact O-N 3.37Å; L41-E72 VanDerWaalsContact CD2-O 3.31Å; L41-E72 WeakPolarHBondContact CD2-O 3.46Å; L41-E72 WeakPolarHBondContact CD2-OE2 3.21Å; L41-E72 WeakPolarHBondContact CG-OE2 3.29Å; L41-L75 HydrophobicContact CD2-CB 3.57Å; L41-A76 HydrophobicContact CB-CB 4.15Å; L41-A76 HydrophobicContact CD2-CB 3.92Å; L41-M86 HydrophobicContact CD1-SD 4.34Å; L41-L87 HydrophobicContact CB-CD2 3.84Å; L41-F102 HydrophobicContact CD1-CE1 4.06Å
42A97.4Very high96.1Very high0 Ų026.6 Ų26.60%015%0.145CC..Hα-helixtrans-63.3-45.9178.400000112.8R38 N39 W40 S46 L87 L89R38-A42 PolarHBondContact O-N 2.89Å; R38-A42 VanDerWaalsContact O-N 3.07Å; N39-A42 WeakPolarHBondContact O-CB 3.38Å; N39-A42 PolarHBondContact O-N 3.42Å; W40-A42 VanDerWaalsContact C-N 3.33Å; A42-S46 WeakPolarHBondContact O-CB 3.13Å; A42-S46 PolarHBondContact O-N 3.46Å; A42-S46 PolarHBondContact O-OG 3.5Å; A42-L87 WeakPolarHBondContact CB-O 3.2Å; A42-L89 HydrophobicContact CB-CD2 3.97Å
43I97.3Very high96.4Very high1 Ų122.5 Ų22.51%0.00512%0.12CC..Hα-helixtrans-57.1-53176.4-72169.2000110.6N39 W40 H45 L47 W52 E55 L62 L89N39-I43 VanDerWaalsContact O-CG1 3.28Å; N39-I43 WeakPolarHBondContact O-CG1 3.46Å; N39-I43 PolarHBondContact O-N 3.33Å; W40-I43 PolarHBondContact O-N 2.75Å; I43-H45 VanDerWaalsContact C-N 3.32Å; I43-H45 PolarHBondContact O-N 2.8Å; I43-L47 HydrophobicContact CG2-CD1 4.34Å; I43-L47 WeakPolarHBondContact O-CB 3.14Å; I43-L47 PolarHBondContact O-N 3.24Å; I43-L47 VanDerWaalsContact O-N 3.11Å; I43-W52 HydrophobicContact CG2-CB 4.38Å; I43-W52 HydrophobicContact CG2-CG 4.46Å; I43-E55 HydrophobicContact CD1-CG 4.32Å; I43-E55 HydrophobicContact CG1-CG 4.13Å; I43-L62 HydrophobicContact CG2-CD1 4.32Å; I43-L89 HydrophobicContact CB-CD2 4.45Å; I43-L89 HydrophobicContact CG1-CD2 3.81Å
44T97.3Very high96.5Very high1 Ų125 Ų251%0.00613%0.131CC..Hα-helixtrans-74.3-24.5-171.757.60000113.2W40 L41 W52 L62 A69 E72 R73W40-T44 WeakPolarHBondContact O-CB 3.42Å; W40-T44 VanDerWaalsContact O-CG2 3.31Å; W40-T44 WeakPolarHBondContact O-CG2 3.35Å; W40-T44 PolarHBondContact O-N 3.45Å; W40-T44 PolarHBondContact O-OG1 2.91Å; L41-T44 PolarHBondContact O-OG1 2.88Å; T44-W52 HydrophobicContact CG2-CD2 4.2Å; T44-W52 HydrophobicContact CG2-CE3 4.3Å; T44-W52 HydrophobicContact CG2-CH2 4.42Å; T44-W52 HydrophobicContact CG2-CZ2 4.32Å; T44-W52 HydrophobicContact CG2-CZ3 4.42Å; T44-L62 HydrophobicContact CG2-CD1 3.87Å; T44-A69 HydrophobicContact CG2-CB 4.28Å; T44-A69 WeakPolarHBondContact CG2-O 3.39Å; T44-E72 HydrophobicContact CG2-CB 4.13Å; T44-R73 WeakPolarHBondContact OG1-CA 3.31Å; T44-R73 PolarHBondContact OG1-N 3.39Å
45H97.1Very high96.3Very high56 Ų5626.4 Ų26.426%0.25914%0.137SC..Hα-helixtrans-80.9-48.9173.3177.1-91.7000113L41 I43 A76 L87L41-H45 WeakPolarHBondContact O-CB 3.3Å; L41-H45 PolarHBondContact O-N 3.37Å; I43-H45 VanDerWaalsContact C-N 3.32Å; I43-H45 PolarHBondContact O-N 2.8Å; H45-A76 HydrophobicContact CB-CB 3.79Å; H45-L87 HydrophobicContact CB-CD1 4.42Å; H45-L87 HydrophobicContact CB-CD2 4.38Å
46S96.3Very high96.1Very high55 Ų5531.5 Ų31.539%0.38517%0.165SC..Hα-helixtrans-92.5-16.5-164.2-59.10000113.3A42 L87A42-S46 WeakPolarHBondContact O-CB 3.13Å; A42-S46 PolarHBondContact O-N 3.46Å; A42-S46 PolarHBondContact O-OG 3.5Å; S46-L87 PolarHBondContact OG-O 2.86Å
47L96.8Very high95.7Very high16 Ų1635.3 Ų35.38%0.08419%0.192CC..SBendtrans-111.9146.5-178.9-58.8177.4000112.9I43 R51 W52 E55 L89I43-L47 HydrophobicContact CG2-CD1 4.34Å; I43-L47 WeakPolarHBondContact O-CB 3.14Å; I43-L47 PolarHBondContact O-N 3.24Å; I43-L47 VanDerWaalsContact O-N 3.11Å; L47-R51 HydrophobicContact CB-CB 4.16Å; L47-R51 HydrophobicContact CD1-CB 4.27Å; L47-W52 PolarHBondContact O-NE1 3.39Å; L47-E55 HydrophobicContact CD1-CB 3.79Å; L47-E55 HydrophobicContact CD1-CG 3.73Å; L47-E55 WeakPolarHBondContact CD1-OE2 3.27Å; L47-L89 HydrophobicContact CD1-CD1 4.07Å; L47-L89 HydrophobicContact CD1-CD2 4.49Å; L47-L89 HydrophobicContact CD2-CD1 3.74Å; L47-L89 HydrophobicContact CG-CD1 3.85Å
48P96.1Very high95.4Very high61 Ų6136 Ų3640%0.39620%0.197SC..  trans-63.5156167.930.3-36000110.6S50 R51 W52P48-S50 PolarHBondContact O-N 3.15Å; P48-S50 VanDerWaalsContact O-N 3.07Å; P48-R51 VanDerWaalsContact CD-NH2 3.3Å; P48-R51 HydrophobicContact CG-CB 4.44Å; P48-R51 HydrophobicContact CG-CG 4.21Å; P48-R51 PolarHBondContact O-N 3.45Å; P48-W52 VanDerWaalsContact O-CD1 3.26Å
49L95.7Very high94.9Very high36 Ų3642.9 Ų42.919%0.18823%0.229CC..G310 helixtrans-51.4-37.1-176.9-172.366.3000113.2R51 W52 W70 P252 F253 M256L49-R51 PolarHBondContact O-N 2.86Å; L49-R51 VanDerWaalsContact O-N 3.15Å; L49-W52 HydrophobicContact CD1-CD2 3.73Å; L49-W52 HydrophobicContact CD1-CE3 3.5Å; L49-W52 HydrophobicContact CD1-CH2 3.8Å; L49-W52 HydrophobicContact CD1-CZ2 4.02Å; L49-W52 HydrophobicContact CD1-CZ3 3.53Å; L49-W52 PolarHBondContact O-N 3.04Å; L49-W70 HydrophobicContact CD1-CH2 4.08Å; L49-W70 HydrophobicContact CD1-CZ2 3.67Å; L49-W70 HydrophobicContact CD2-CH2 4.46Å; L49-W70 HydrophobicContact CD2-CZ2 4.1Å; L49-P252 HydrophobicContact CD2-CB 3.7Å; L49-F253 HydrophobicContact CD1-CE1 3.99Å; L49-F253 HydrophobicContact CD1-CE2 4.19Å; L49-F253 HydrophobicContact CD1-CZ 3.45Å; L49-F253 VanDerWaalsContact CD1-CZ 3.45Å; L49-F253 HydrophobicContact CG-CE1 4.17Å; L49-F253 HydrophobicContact CG-CZ 4.04Å; L49-M256 HydrophobicContact CB-CE 4.47Å; L49-M256 HydrophobicContact CD2-CE 4Å; L49-M256 HydrophobicContact CG-CE 3.85Å
50S95.4Very high94.6Very high50 Ų5045.3 Ų45.335%0.3524%0.238SC..G310 helixtrans-64.6-13.1178.557.30000114.4P48 H54 Q258P48-S50 PolarHBondContact O-N 3.15Å; P48-S50 VanDerWaalsContact O-N 3.07Å; S50-H54 PolarHBondContact O-CD2 2.96Å; S50-Q258 PolarHBondContact O-NE2 3.41Å
51R96.3Very high94.3Very high125 Ų12545.6 Ų45.647%0.47224%0.24SC..G310 helixtrans-108.3-9.3-179.9-69.1-165.7-70.3173.20.1114L47 P48 L49 Y53 H54 E55L47-R51 HydrophobicContact CB-CB 4.16Å; L47-R51 HydrophobicContact CD1-CB 4.27Å; P48-R51 VanDerWaalsContact CD-NH2 3.3Å; P48-R51 HydrophobicContact CG-CB 4.44Å; P48-R51 HydrophobicContact CG-CG 4.21Å; P48-R51 PolarHBondContact O-N 3.45Å; L49-R51 PolarHBondContact O-N 2.86Å; L49-R51 VanDerWaalsContact O-N 3.15Å; R51-Y53 VanDerWaalsContact C-N 3.34Å; R51-Y53 PolarHBondContact O-N 2.78Å; R51-H54 PolarHBondContact O-N 2.91Å; R51-H54 VanDerWaalsContact O-N 3.1Å; R51-E55 PolarHBondContact O-N 3.09Å
52W96.6Very high94.2Very high0 Ų045.6 Ų45.60%024%0.24CC..THydrogen-bonded Turntrans-54.5-44-173.2-737.1000114.4I43 T44 L47 P48 L49 A69 W70 R73 F253I43-W52 HydrophobicContact CG2-CB 4.38Å; I43-W52 HydrophobicContact CG2-CG 4.46Å; T44-W52 HydrophobicContact CG2-CD2 4.2Å; T44-W52 HydrophobicContact CG2-CE3 4.3Å; T44-W52 HydrophobicContact CG2-CH2 4.42Å; T44-W52 HydrophobicContact CG2-CZ2 4.32Å; T44-W52 HydrophobicContact CG2-CZ3 4.42Å; L47-W52 PolarHBondContact O-NE1 3.39Å; P48-W52 VanDerWaalsContact O-CD1 3.26Å; L49-W52 HydrophobicContact CD1-CD2 3.73Å; L49-W52 HydrophobicContact CD1-CE3 3.5Å; L49-W52 HydrophobicContact CD1-CH2 3.8Å; L49-W52 HydrophobicContact CD1-CZ2 4.02Å; L49-W52 HydrophobicContact CD1-CZ3 3.53Å; L49-W52 PolarHBondContact O-N 3.04Å; W52-A69 HydrophobicContact CE3-CB 3.67Å; W52-A69 HydrophobicContact CZ3-CB 3.64Å; W52-W70 AromaticContact CH2-CD2 3.96Å; W52-W70 HydrophobicContact CH2-CD2 3.96Å; W52-W70 AromaticContact CH2-CE3 3.81Å; W52-W70 HydrophobicContact CH2-CE3 3.81Å; W52-W70 HydrophobicContact CH2-CH2 4.19Å; W52-W70 HydrophobicContact CH2-CZ2 4.32Å; W52-W70 AromaticContact CH2-CZ3 3.95Å; W52-W70 HydrophobicContact CH2-CZ3 3.95Å; W52-W70 HydrophobicContact CZ3-CD2 4.09Å; W52-W70 HydrophobicContact CZ3-CE3 4.4Å; W52-W70 HydrophobicContact CZ3-CG 4.46Å; W52-W70 HydrophobicContact CZ3-CZ2 4.44Å; W52-R73 HydrophobicContact CH2-CB 4.08Å; W52-R73 HydrophobicContact CH2-CG 4.39Å; W52-R73 HydrophobicContact CZ2-CB 4.35Å; W52-R73 HydrophobicContact CZ2-CG 4.29Å; W52-F253 HydrophobicContact CE3-CZ 4.07Å
53Y96.3Very high93.9Very high1 Ų147.6 Ų47.60%0.00425%0.251CS..THydrogen-bonded Turntrans-97.2-4.5-179.1-70.7-84.7000114R51 L62 Y64 P65 P66 F253 Q261 V262 R265 L266R51-Y53 VanDerWaalsContact C-N 3.34Å; R51-Y53 PolarHBondContact O-N 2.78Å; Y53-L62 HydrophobicContact CD1-CB 4.37Å; Y53-L62 HydrophobicContact CD1-CD2 4.26Å; Y53-L62 WeakPolarHBondContact CD1-O 3.39Å; Y53-L62 HydrophobicContact CE1-CB 4.35Å; Y53-L62 HydrophobicContact CE1-CD2 3.43Å; Y53-L62 VanDerWaalsContact CE1-CD2 3.43Å; Y53-L62 HydrophobicContact CE1-CG 4.4Å; Y53-L62 WeakPolarHBondContact CE1-O 3.41Å; Y53-L62 HydrophobicContact CE2-CD2 4.47Å; Y53-L62 WeakPolarHBondContact OH-CD2 3.49Å; Y53-Y64 WeakPolarHBondContact CE1-O 3.24Å; Y53-Y64 PolarHBondContact OH-O 3.35Å; Y53-P65 VanDerWaalsContact OH-C 3.3Å; Y53-P66 HydrophobicContact CE2-CG 4.44Å; Y53-P66 VanDerWaalsContact OH-CA 3.29Å; Y53-P66 WeakPolarHBondContact OH-CA 3.42Å; Y53-F253 AromaticContact CD2-CD1 3.92Å; Y53-F253 HydrophobicContact CD2-CD1 3.92Å; Y53-F253 AromaticContact CD2-CE1 3.46Å; Y53-F253 HydrophobicContact CD2-CE1 3.46Å; Y53-F253 VanDerWaalsContact CD2-CE1 3.46Å; Y53-F253 HydrophobicContact CD2-CZ 4Å; Y53-F253 HydrophobicContact CE2-CD1 4.18Å; Y53-F253 AromaticContact CE2-CE1 3.59Å; Y53-F253 HydrophobicContact CE2-CE1 3.59Å; Y53-F253 HydrophobicContact CE2-CE2 4.27Å; Y53-F253 AromaticContact CE2-CZ 3.62Å; Y53-F253 HydrophobicContact CE2-CZ 3.62Å; Y53-Q261 PolarHBondContact O-NE2 3.22Å; Y53-V262 HydrophobicContact CD1-CG1 4.39Å; Y53-V262 HydrophobicContact CD1-CG2 4.31Å; Y53-V262 HydrophobicContact CD2-CG2 3.69Å; Y53-V262 HydrophobicContact CE1-CG1 4.11Å; Y53-V262 HydrophobicContact CE2-CG1 4.4Å; Y53-V262 HydrophobicContact CE2-CG2 4.07Å; Y53-V262 HydrophobicContact CG-CG2 3.82Å; Y53-R265 HydrophobicContact CD1-CB 4.2Å; Y53-R265 HydrophobicContact CD1-CG 4.22Å; Y53-R265 PolarHBondContact O-NE 3.4Å; Y53-L266 HydrophobicContact CE1-CD1 4.04Å
54H94.4Very high93.9Very high84 Ų8449.1 Ų49.139%0.38926%0.257SS..THydrogen-bonded Turntrans-93.7-27176.2-76.8-79.7000112.2S50 R51 N56 Q258S50-H54 PolarHBondContact O-CD2 2.96Å; R51-H54 PolarHBondContact O-N 2.91Å; R51-H54 VanDerWaalsContact O-N 3.1Å; H54-N56 PolarHBondContact O-N 2.95Å; H54-Q258 PolarHBondContact CD2-NE2 3.44Å; H54-Q258 VanDerWaalsContact CD2-NE2 3.34Å; H54-Q258 PolarHBondContact NE2-NE2 3.06Å
55E92.5Very high93.9Very high31 Ų3149.1 Ų49.115%0.14526%0.257CS..  trans-54.4129.7177.1-172.949.6-115.400111.6I43 L47 R51 S57 R265I43-E55 HydrophobicContact CD1-CG 4.32Å; I43-E55 HydrophobicContact CG1-CG 4.13Å; L47-E55 HydrophobicContact CD1-CB 3.79Å; L47-E55 HydrophobicContact CD1-CG 3.73Å; L47-E55 WeakPolarHBondContact CD1-OE2 3.27Å; R51-E55 PolarHBondContact O-N 3.09Å; E55-S57 WeakPolarHBondContact OE1-CB 3.28Å; E55-S57 PolarHBondContact OE1-N 2.9Å; E55-S57 PolarHBondContact OE1-OG 2.89Å; E55-R265 PolarHBondContact O-NH2 3.19Å
56N90.9Very high93.9Very high116 Ų11646.4 Ų46.462%0.6225%0.245SC*.  trans-149.515.1-174.271.4-16.4000113.4H54 S58H54-N56 PolarHBondContact O-N 2.95Å; N56-S58 PolarHBondContact O-N 3.34Å
57S88.3Confident93.9Very high96 Ų9645.2 Ų45.267%0.67123%0.234SC*.SBendtrans-63.9-22.3177.1-53.50000112.4E55E55-S57 WeakPolarHBondContact OE1-CB 3.28Å; E55-S57 PolarHBondContact OE1-N 2.9Å; E55-S57 PolarHBondContact OE1-OG 2.89Å
58S88.7Confident94Very high16 Ų1644.5 Ų44.511%0.11223%0.23CC..SBendtrans-118.3156172.5-179.60000110.5N56 W60 T61N56-S58 PolarHBondContact O-N 3.34Å; S58-W60 PolarHBondContact O-N 3.15Å; S58-W60 VanDerWaalsContact OG-CD1 3.24Å; S58-W60 PolarHBondContact OG-N 3.28Å; S58-T61 WeakPolarHBondContact O-CG2 3.22Å
59E87Confident94.1Very high146 Ų14641.6 Ų41.668%0.68221%0.211SC*.SBendtrans-65.1-21.9169.165.5-175.9158.900112.7T61E59-T61 VanDerWaalsContact C-N 3.28Å; E59-T61 PolarHBondContact O-N 2.93Å
60W90.9Very high94.1Very high55 Ų5544.3 Ų44.321%0.20822%0.219CC..  trans-82.963.7-178.2-47.8127.5000112.7T32 E35 V36 N39 S58T32-W60 HydrophobicContact CG2-CH2 4.3Å; E35-W60 HydrophobicContact CG-CG 4.47Å; V36-W60 HydrophobicContact CG2-CB 4.2Å; V36-W60 HydrophobicContact CG2-CD2 3.73Å; V36-W60 HydrophobicContact CG2-CE3 3.37Å; V36-W60 HydrophobicContact CG2-CG 4.09Å; V36-W60 HydrophobicContact CG2-CZ3 4.03Å; N39-W60 HydrophobicContact CB-CB 4.1Å; N39-W60 PolarHBondContact ND2-O 3.34Å; S58-W60 PolarHBondContact O-N 3.15Å; S58-W60 VanDerWaalsContact OG-CD1 3.24Å; S58-W60 PolarHBondContact OG-N 3.28Å
61T92.4Very high94.2Very high11 Ų1143.7 Ų43.77%0.06721%0.211CC..  trans-76.9162.7-177.963.40000113.2W40 S58 E59 D63 R265W40-T61 PolarHBondContact NE1-O 2.9Å; S58-T61 WeakPolarHBondContact O-CG2 3.22Å; E59-T61 VanDerWaalsContact C-N 3.28Å; E59-T61 PolarHBondContact O-N 2.93Å; T61-D63 PolarHBondContact O-N 2.7Å; T61-D63 VanDerWaalsContact O-N 3.15Å; T61-D63 PolarHBondContact OG1-OD1 2.7Å; T61-R265 VanDerWaalsContact CG2-NH1 3.32Å; T61-R265 PolarHBondContact OG1-NH1 2.61Å
62L93.8Very high94.3Very high1 Ų137.7 Ų37.71%0.00519%0.189CC..  trans-74.7105178.5-151.8161000110.2I43 T44 Y53 Y64 A69I43-L62 HydrophobicContact CG2-CD1 4.32Å; T44-L62 HydrophobicContact CG2-CD1 3.87Å; Y53-L62 HydrophobicContact CD1-CB 4.37Å; Y53-L62 HydrophobicContact CD1-CD2 4.26Å; Y53-L62 WeakPolarHBondContact CD1-O 3.39Å; Y53-L62 HydrophobicContact CE1-CB 4.35Å; Y53-L62 HydrophobicContact CE1-CD2 3.43Å; Y53-L62 VanDerWaalsContact CE1-CD2 3.43Å; Y53-L62 HydrophobicContact CE1-CG 4.4Å; Y53-L62 WeakPolarHBondContact CE1-O 3.41Å; Y53-L62 HydrophobicContact CE2-CD2 4.47Å; Y53-L62 WeakPolarHBondContact OH-CD2 3.49Å; L62-Y64 VanDerWaalsContact CD2-O 3.3Å; L62-Y64 WeakPolarHBondContact CD2-O 3.29Å; L62-A69 HydrophobicContact CD1-CB 3.62Å; L62-A69 HydrophobicContact CD2-CB 3.91Å; L62-A69 HydrophobicContact CG-CB 4.4Å
63D92.6Very high94.3Very high42 Ų4242.3 Ų42.323%0.22521%0.206CC..  trans-109-4.3-171.3-64.5-13.6000113.3W40 T61W40-D63 HydrophobicContact CZ2-CB 4.43Å; T61-D63 PolarHBondContact O-N 2.7Å; T61-D63 VanDerWaalsContact O-N 3.15Å; T61-D63 PolarHBondContact OG1-OD1 2.7Å
64Y95.8Very high94.4Very high32 Ų3244.5 Ų44.513%0.12523%0.229CC..SBendtrans-94.9156.9178.4-78.825.8000111.7W40 Y53 L62 F68 K196W40-Y64 AromaticContact CH2-CD1 3.45Å; W40-Y64 HydrophobicContact CH2-CD1 3.45Å; W40-Y64 VanDerWaalsContact CH2-CD1 3.45Å; W40-Y64 HydrophobicContact CH2-CD2 4.16Å; W40-Y64 AromaticContact CH2-CE1 3.58Å; W40-Y64 HydrophobicContact CH2-CE1 3.58Å; W40-Y64 HydrophobicContact CH2-CE2 4.26Å; W40-Y64 AromaticContact CH2-CG 3.73Å; W40-Y64 HydrophobicContact CH2-CG 3.73Å; W40-Y64 AromaticContact CH2-CZ 3.96Å; W40-Y64 HydrophobicContact CZ2-CD1 4.34Å; W40-Y64 HydrophobicContact CZ3-CD1 4.08Å; W40-Y64 AromaticContact CZ3-CD2 3.94Å; W40-Y64 HydrophobicContact CZ3-CD2 3.94Å; W40-Y64 HydrophobicContact CZ3-CE1 4.26Å; W40-Y64 HydrophobicContact CZ3-CE2 4.12Å; W40-Y64 AromaticContact CZ3-CG 3.87Å; W40-Y64 HydrophobicContact CZ3-CG 3.87Å; Y53-Y64 WeakPolarHBondContact CE1-O 3.24Å; Y53-Y64 PolarHBondContact OH-O 3.35Å; L62-Y64 VanDerWaalsContact CD2-O 3.3Å; L62-Y64 WeakPolarHBondContact CD2-O 3.29Å; Y64-F68 HydrophobicContact CD2-CB 4.09Å; Y64-F68 AromaticContact CD2-CD1 3.54Å; Y64-F68 HydrophobicContact CD2-CD1 3.54Å; Y64-F68 AromaticContact CD2-CD2 3.72Å; Y64-F68 HydrophobicContact CD2-CD2 3.72Å; Y64-F68 AromaticContact CD2-CE1 3.82Å; Y64-F68 HydrophobicContact CD2-CE1 3.82Å; Y64-F68 AromaticContact CD2-CE2 3.98Å; Y64-F68 HydrophobicContact CD2-CE2 3.98Å; Y64-F68 AromaticContact CD2-CG 3.5Å; Y64-F68 HydrophobicContact CD2-CG 3.5Å; Y64-F68 VanDerWaalsContact CD2-CG 3.5Å; Y64-F68 HydrophobicContact CD2-CZ 4.04Å; Y64-F68 HydrophobicContact CE2-CD1 4.32Å; Y64-F68 HydrophobicContact CE2-CD2 4.27Å; Y64-F68 HydrophobicContact CE2-CE1 4.15Å; Y64-F68 HydrophobicContact CE2-CE2 4.09Å; Y64-F68 HydrophobicContact CE2-CG 4.39Å; Y64-F68 HydrophobicContact CE2-CZ 4.03Å; Y64-F68 HydrophobicContact CG-CB 4.5Å; Y64-F68 HydrophobicContact CG-CD1 4.19Å; Y64-F68 HydrophobicContact CG-CG 4.27Å; Y64-K196 HydrophobicContact CD2-CG 4.29Å; Y64-K196 HydrophobicContact CE2-CD 3.75Å; Y64-K196 HydrophobicContact CE2-CG 4Å; Y64-K196 WeakPolarHBondContact OH-CE 3.34Å; Y64-K196 PolarHBondContact OH-NZ 3.1Å
65P97.2Very high94.6Very high1 Ų141.7 Ų41.71%0.00622%0.217CC..  trans-66.4163.2179-7.221.3000112.6Y53 L67 F68 N194 L195 H197 F250 L266Y53-P65 VanDerWaalsContact OH-C 3.3Å; P65-L67 PolarHBondContact O-N 3.3Å; P65-L67 VanDerWaalsContact O-N 3.14Å; P65-F68 WeakPolarHBondContact O-CB 3.42Å; P65-F68 PolarHBondContact O-N 2.97Å; P65-N194 CarbonylContact C-O 3.57Å; P65-N194 WeakPolarHBondContact CB-O 3.35Å; P65-L195 WeakPolarHBondContact CD-O 3.3Å; P65-H197 HydrophobicContact CG-CB 4.23Å; P65-F250 HydrophobicContact CB-CZ 4.18Å; P65-L266 HydrophobicContact CB-CD2 3.85Å; P65-L266 HydrophobicContact CG-CD2 3.93Å; P65-L266 HydrophobicContact CG-CG 4.43Å
66P97.5Very high94.8Very high0 Ų040.2 Ų40.20%021%0.21CC..Hα-helixtrans-57.2-34.5-164.7-31.937.3000117.1Y53 F68 A69 W70 S249 F250 F253 V262Y53-P66 HydrophobicContact CE2-CG 4.44Å; Y53-P66 VanDerWaalsContact OH-CA 3.29Å; Y53-P66 WeakPolarHBondContact OH-CA 3.42Å; P66-F68 PolarHBondContact O-N 3.41Å; P66-A69 WeakPolarHBondContact O-CB 3.48Å; P66-A69 PolarHBondContact O-N 3.03Å; P66-A69 VanDerWaalsContact O-N 3.08Å; P66-W70 PolarHBondContact O-N 3Å; P66-S249 WeakPolarHBondContact CB-O 3.44Å; P66-F250 HydrophobicContact CG-CD1 3.97Å; P66-F250 HydrophobicContact CG-CE1 4.04Å; P66-F250 HydrophobicContact CG-CG 4.29Å; P66-F250 HydrophobicContact CG-CZ 4.42Å; P66-F253 HydrophobicContact CB-CD2 4.12Å; P66-F253 HydrophobicContact CB-CE2 3.63Å; P66-F253 HydrophobicContact CB-CZ 4.48Å; P66-F253 HydrophobicContact CG-CD2 3.86Å; P66-F253 HydrophobicContact CG-CE2 3.82Å; P66-V262 HydrophobicContact CG-CG1 4.46Å
67L97.8Very high95.1Very high30 Ų3038.9 Ų38.916%0.15720%0.2CC..Hα-helixtrans-63.8-27.7179.3-63.2-178000112.3P65 W70 L71 V191 N194 L195 V245P65-L67 PolarHBondContact O-N 3.3Å; P65-L67 VanDerWaalsContact O-N 3.14Å; L67-W70 PolarHBondContact O-N 2.94Å; L67-L71 PolarHBondContact O-N 3.43Å; L67-V191 HydrophobicContact CD1-CG1 4.1Å; L67-N194 HydrophobicContact CB-CB 4.29Å; L67-N194 VanDerWaalsContact CB-O 3.3Å; L67-N194 WeakPolarHBondContact CB-O 3.36Å; L67-N194 HydrophobicContact CD1-CB 3.45Å; L67-N194 VanDerWaalsContact CD1-CB 3.45Å; L67-N194 HydrophobicContact CG-CB 3.75Å; L67-N194 PolarHBondContact N-O 3.26Å; L67-L195 HydrophobicContact CB-CD2 3.79Å; L67-L195 HydrophobicContact CB-CG 4.31Å; L67-V245 HydrophobicContact CD1-CG1 4.25Å
68F97.9Very high95.5Very high0 Ų036.4 Ų36.40%019%0.185CC..Hα-helixtrans-73.8-37.4174-158.4-87.5000111.7H37 W40 Y64 P65 P66 W70 L71 E72 Y162 L166 L195H37-F68 AromaticContact CE1-CE1 3.71Å; H37-F68 AromaticContact CE1-CZ 3.81Å; W40-F68 HydrophobicContact CE3-CD1 4.1Å; W40-F68 AromaticContact CE3-CE1 3.83Å; W40-F68 HydrophobicContact CE3-CE1 3.83Å; W40-F68 AromaticContact CZ3-CD1 3.9Å; W40-F68 HydrophobicContact CZ3-CD1 3.9Å; W40-F68 AromaticContact CZ3-CE1 3.6Å; W40-F68 HydrophobicContact CZ3-CE1 3.6Å; Y64-F68 HydrophobicContact CD2-CB 4.09Å; Y64-F68 AromaticContact CD2-CD1 3.54Å; Y64-F68 HydrophobicContact CD2-CD1 3.54Å; Y64-F68 AromaticContact CD2-CD2 3.72Å; Y64-F68 HydrophobicContact CD2-CD2 3.72Å; Y64-F68 AromaticContact CD2-CE1 3.82Å; Y64-F68 HydrophobicContact CD2-CE1 3.82Å; Y64-F68 AromaticContact CD2-CE2 3.98Å; Y64-F68 HydrophobicContact CD2-CE2 3.98Å; Y64-F68 AromaticContact CD2-CG 3.5Å; Y64-F68 HydrophobicContact CD2-CG 3.5Å; Y64-F68 VanDerWaalsContact CD2-CG 3.5Å; Y64-F68 HydrophobicContact CD2-CZ 4.04Å; Y64-F68 HydrophobicContact CE2-CD1 4.32Å; Y64-F68 HydrophobicContact CE2-CD2 4.27Å; Y64-F68 HydrophobicContact CE2-CE1 4.15Å; Y64-F68 HydrophobicContact CE2-CE2 4.09Å; Y64-F68 HydrophobicContact CE2-CG 4.39Å; Y64-F68 HydrophobicContact CE2-CZ 4.03Å; Y64-F68 HydrophobicContact CG-CB 4.5Å; Y64-F68 HydrophobicContact CG-CD1 4.19Å; Y64-F68 HydrophobicContact CG-CG 4.27Å; P65-F68 WeakPolarHBondContact O-CB 3.42Å; P65-F68 PolarHBondContact O-N 2.97Å; P66-F68 PolarHBondContact O-N 3.41Å; F68-W70 PolarHBondContact O-N 3.24Å; F68-L71 HydrophobicContact CD2-CD2 4.19Å; F68-L71 HydrophobicContact CE2-CD2 3.97Å; F68-L71 HydrophobicContact CZ-CD2 4.32Å; F68-L71 WeakPolarHBondContact O-CB 3.38Å; F68-L71 PolarHBondContact O-N 3.42Å; F68-L71 VanDerWaalsContact O-N 3.09Å; F68-E72 HydrophobicContact CD1-CG 3.97Å; F68-E72 HydrophobicContact CE1-CG 3.93Å; F68-E72 VanDerWaalsContact CE1-OE1 3.28Å; F68-E72 WeakPolarHBondContact CE1-OE1 3.4Å; F68-E72 WeakPolarHBondContact O-CG 3.48Å; F68-E72 PolarHBondContact O-N 2.91Å; F68-Y162 HydrophobicContact CZ-CD2 4.18Å; F68-Y162 HydrophobicContact CZ-CG 4.33Å; F68-L166 HydrophobicContact CD2-CD2 4.27Å; F68-L166 HydrophobicContact CE2-CD2 4.25Å; F68-L195 HydrophobicContact CB-CD2 4.43Å; F68-L195 VanDerWaalsContact CB-O 3.31Å; F68-L195 WeakPolarHBondContact CB-O 3.48Å; F68-L195 HydrophobicContact CD2-CB 4.46Å; F68-L195 HydrophobicContact CD2-CD2 4.37Å; F68-L195 WeakPolarHBondContact CD2-O 3.45Å
69A97.3Very high95.9Very high1 Ų135.7 Ų35.71%0.00818%0.18CC..Hα-helixtrans-59.9-37.4171.300000111.6T44 W52 L62 P66 E72 R73T44-A69 HydrophobicContact CG2-CB 4.28Å; T44-A69 WeakPolarHBondContact CG2-O 3.39Å; W52-A69 HydrophobicContact CE3-CB 3.67Å; W52-A69 HydrophobicContact CZ3-CB 3.64Å; L62-A69 HydrophobicContact CD1-CB 3.62Å; L62-A69 HydrophobicContact CD2-CB 3.91Å; L62-A69 HydrophobicContact CG-CB 4.4Å; P66-A69 WeakPolarHBondContact O-CB 3.48Å; P66-A69 PolarHBondContact O-N 3.03Å; P66-A69 VanDerWaalsContact O-N 3.08Å; A69-E72 PolarHBondContact O-N 3.47Å; A69-R73 PolarHBondContact O-N 2.89Å
70W97.4Very high96.4Very high92 Ų9236.2 Ų36.235%0.34818%0.176SC..Hα-helixtrans-67.4-35.9173.2-72.2112.7000113.2L49 W52 P66 L67 F68 R73 G74L49-W70 HydrophobicContact CD1-CH2 4.08Å; L49-W70 HydrophobicContact CD1-CZ2 3.67Å; L49-W70 HydrophobicContact CD2-CH2 4.46Å; L49-W70 HydrophobicContact CD2-CZ2 4.1Å; W52-W70 AromaticContact CH2-CD2 3.96Å; W52-W70 HydrophobicContact CH2-CD2 3.96Å; W52-W70 AromaticContact CH2-CE3 3.81Å; W52-W70 HydrophobicContact CH2-CE3 3.81Å; W52-W70 HydrophobicContact CH2-CH2 4.19Å; W52-W70 HydrophobicContact CH2-CZ2 4.32Å; W52-W70 AromaticContact CH2-CZ3 3.95Å; W52-W70 HydrophobicContact CH2-CZ3 3.95Å; W52-W70 HydrophobicContact CZ3-CD2 4.09Å; W52-W70 HydrophobicContact CZ3-CE3 4.4Å; W52-W70 HydrophobicContact CZ3-CG 4.46Å; W52-W70 HydrophobicContact CZ3-CZ2 4.44Å; P66-W70 PolarHBondContact O-N 3Å; L67-W70 PolarHBondContact O-N 2.94Å; F68-W70 PolarHBondContact O-N 3.24Å; W70-R73 PolarHBondContact O-N 3.23Å; W70-G74 PolarHBondContact O-N 3.47Å
71L97.3Very high96.6Very high37 Ų3741.3 Ų41.319%0.19420%0.201CC..Hα-helixtrans-61-49.9170.8174.369.5000110.7L67 F68 R73 G74 L75 F165L67-L71 PolarHBondContact O-N 3.43Å; F68-L71 HydrophobicContact CD2-CD2 4.19Å; F68-L71 HydrophobicContact CE2-CD2 3.97Å; F68-L71 HydrophobicContact CZ-CD2 4.32Å; F68-L71 WeakPolarHBondContact O-CB 3.38Å; F68-L71 PolarHBondContact O-N 3.42Å; F68-L71 VanDerWaalsContact O-N 3.09Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.27Å; L71-G74 WeakPolarHBondContact O-CA 3.32Å; L71-G74 PolarHBondContact O-N 3.29Å; L71-L75 HydrophobicContact CD1-CG 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.26Å; L71-L75 WeakPolarHBondContact O-CG 3.46Å; L71-L75 PolarHBondContact O-N 2.91Å; L71-F165 HydrophobicContact CD1-CZ 4.34Å; L71-F165 HydrophobicContact CD2-CD1 3.99Å; L71-F165 HydrophobicContact CD2-CE1 3.47Å; L71-F165 VanDerWaalsContact CD2-CE1 3.47Å; L71-F165 HydrophobicContact CD2-CZ 3.86Å
72E97.7Very high96.9Very high0 Ų046.2 Ų46.20%022%0.219CC..Hα-helixtrans-57.6-42.6176.8-69-69-179.300111.1H37 W40 L41 T44 F68 A69 G74 L75 A76H37-E72 IonicContact CE1-OE1 3.33Å; H37-E72 IonicContact CG-OE1 2.89Å; H37-E72 IonicContact ND1-OE1 2.89Å; H37-E72 PolarHBondContact ND1-OE1 3.36Å; W40-E72 HydrophobicContact CB-CB 4.47Å; W40-E72 HydrophobicContact CB-CG 4Å; W40-E72 HydrophobicContact CE3-CG 4.22Å; L41-E72 VanDerWaalsContact CD2-O 3.31Å; L41-E72 WeakPolarHBondContact CD2-O 3.46Å; L41-E72 WeakPolarHBondContact CD2-OE2 3.21Å; L41-E72 WeakPolarHBondContact CG-OE2 3.29Å; T44-E72 HydrophobicContact CG2-CB 4.13Å; F68-E72 HydrophobicContact CD1-CG 3.97Å; F68-E72 HydrophobicContact CE1-CG 3.93Å; F68-E72 VanDerWaalsContact CE1-OE1 3.28Å; F68-E72 WeakPolarHBondContact CE1-OE1 3.4Å; F68-E72 WeakPolarHBondContact O-CG 3.48Å; F68-E72 PolarHBondContact O-N 2.91Å; A69-E72 PolarHBondContact O-N 3.47Å; E72-G74 VanDerWaalsContact C-N 3.31Å; E72-G74 PolarHBondContact O-N 3.07Å; E72-L75 PolarHBondContact O-N 3.15Å; E72-A76 VanDerWaalsContact O-CB 3.31Å; E72-A76 WeakPolarHBondContact O-CB 3.49Å; E72-A76 PolarHBondContact O-N 3.04Å
73R97.4Very high97Very high97 Ų9747.2 Ų47.237%0.36622%0.224SC..Hα-helixtrans-58.1-43.6173.9-170.4-176.5-175.9159.3-3.2112.3T44 W52 A69 W70 L71 A76 Q77T44-R73 WeakPolarHBondContact OG1-CA 3.31Å; T44-R73 PolarHBondContact OG1-N 3.39Å; W52-R73 HydrophobicContact CH2-CB 4.08Å; W52-R73 HydrophobicContact CH2-CG 4.39Å; W52-R73 HydrophobicContact CZ2-CB 4.35Å; W52-R73 HydrophobicContact CZ2-CG 4.29Å; A69-R73 PolarHBondContact O-N 2.89Å; W70-R73 PolarHBondContact O-N 3.23Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.27Å; R73-A76 PolarHBondContact O-N 3.41Å; R73-Q77 WeakPolarHBondContact O-CG 3.48Å; R73-Q77 PolarHBondContact O-N 3.34Å
74G97.4Very high97.2Very high46 Ų4647 Ų4747%0.47423%0.232SC..Hα-helixtrans-63.7-44.517800000112W70 L71 E72 A76 Q77W70-G74 PolarHBondContact O-N 3.47Å; L71-G74 WeakPolarHBondContact O-CA 3.32Å; L71-G74 PolarHBondContact O-N 3.29Å; E72-G74 VanDerWaalsContact C-N 3.31Å; E72-G74 PolarHBondContact O-N 3.07Å; G74-A76 VanDerWaalsContact C-N 3.31Å; G74-A76 PolarHBondContact O-N 3.33Å; G74-Q77 PolarHBondContact O-N 3.08Å
75L98Very high97.2Very high25 Ų2548.1 Ų48.113%0.13124%0.24CC..Hα-helixtrans-62-39.5173.6-67.8177.8000111.4L41 L71 E72 Q77 A78 A79 F102 Y162L41-L75 HydrophobicContact CD2-CB 3.57Å; L71-L75 HydrophobicContact CD1-CG 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.26Å; L71-L75 WeakPolarHBondContact O-CG 3.46Å; L71-L75 PolarHBondContact O-N 2.91Å; E72-L75 PolarHBondContact O-N 3.15Å; L75-Q77 VanDerWaalsContact C-N 3.25Å; L75-Q77 PolarHBondContact O-N 2.9Å; L75-A78 WeakPolarHBondContact O-CB 3.45Å; L75-A78 PolarHBondContact O-N 3.25Å; L75-A79 PolarHBondContact O-N 3.33Å; L75-F102 WeakPolarHBondContact O-CZ 3.5Å; L75-Y162 HydrophobicContact CD1-CE1 3.99Å
76A97.6Very high97.2Very high0 Ų048 Ų480%024%0.239CC..Hα-helixtrans-65.7-27.8-178.800000113.1L41 H45 E72 R73 G74 A78 A79 R80 L87L41-A76 HydrophobicContact CB-CB 4.15Å; L41-A76 HydrophobicContact CD2-CB 3.92Å; H45-A76 HydrophobicContact CB-CB 3.79Å; E72-A76 VanDerWaalsContact O-CB 3.31Å; E72-A76 WeakPolarHBondContact O-CB 3.49Å; E72-A76 PolarHBondContact O-N 3.04Å; R73-A76 PolarHBondContact O-N 3.41Å; G74-A76 VanDerWaalsContact C-N 3.31Å; G74-A76 PolarHBondContact O-N 3.33Å; A76-A78 VanDerWaalsContact C-N 3.35Å; A76-A79 PolarHBondContact O-N 3.15Å; A76-R80 PolarHBondContact O-N 3.49Å; A76-R80 VanDerWaalsContact O-N 3.13Å; A76-L87 HydrophobicContact CB-CD2 4.03Å
77Q97.1Very high97.1Very high89 Ų8948.3 Ų48.342%0.41624%0.241SC..Hα-helixtrans-63.5-41.3170.9-60.9-51.5-51.100111.7R73 G74 L75 H81R73-Q77 WeakPolarHBondContact O-CG 3.48Å; R73-Q77 PolarHBondContact O-N 3.34Å; G74-Q77 PolarHBondContact O-N 3.08Å; L75-Q77 VanDerWaalsContact C-N 3.25Å; L75-Q77 PolarHBondContact O-N 2.9Å; Q77-H81 PolarHBondContact O-CD2 2.89Å; Q77-H81 VanDerWaalsContact O-CD2 3.26Å
78A97.1Very high97Very high44 Ų4454 Ų5436%0.36426%0.26SS..Hα-helixtrans-70.5-42.6174.600000111.2L75 A76 R80 H81 W82 F102L75-A78 WeakPolarHBondContact O-CB 3.45Å; L75-A78 PolarHBondContact O-N 3.25Å; A76-A78 VanDerWaalsContact C-N 3.35Å; A78-R80 PolarHBondContact O-N 3.35Å; A78-H81 WeakPolarHBondContact O-CB 3.06Å; A78-H81 PolarHBondContact O-N 2.82Å; A78-W82 VanDerWaalsContact O-CD1 3.31Å; A78-F102 HydrophobicContact CB-CE2 3.89Å; A78-F102 HydrophobicContact CB-CZ 4.25Å
79A97.1Very high96.8Very high0 Ų055.8 Ų55.80%027%0.27CS..Hα-helixtrans-54.5-38.3-179.400000112.9L75 A76 H81 W82 D83 M86 L87 F102L75-A79 PolarHBondContact O-N 3.33Å; A76-A79 PolarHBondContact O-N 3.15Å; A79-H81 PolarHBondContact O-N 3.12Å; A79-H81 VanDerWaalsContact O-N 3.12Å; A79-W82 PolarHBondContact O-N 3.26Å; A79-D83 PolarHBondContact O-N 3.04Å; A79-M86 HydrophobicContact CB-CE 4.39Å; A79-M86 HydrophobicContact CB-CG 4.45Å; A79-M86 HydrophobicContact CB-SD 3.75Å; A79-L87 HydrophobicContact CB-CD1 4.46Å; A79-L87 HydrophobicContact CB-CD2 4.01Å; A79-F102 HydrophobicContact CB-CD1 3.98Å; A79-F102 HydrophobicContact CB-CE1 3.43Å; A79-F102 VanDerWaalsContact CB-CE1 3.43Å; A79-F102 HydrophobicContact CB-CE2 4.17Å; A79-F102 HydrophobicContact CB-CZ 3.55Å
80R96.6Very high96.6Very high157 Ų15762.8 Ų62.859%0.59231%0.307SS*.THydrogen-bonded Turntrans-55.8-30.5178.6-177.3179.4173.4175.4-1.4113.1A76 A78 L87A76-R80 PolarHBondContact O-N 3.49Å; A76-R80 VanDerWaalsContact O-N 3.13Å; A78-R80 PolarHBondContact O-N 3.35Å; R80-L87 HydrophobicContact CB-CD1 3.68Å; R80-L87 HydrophobicContact CG-CD1 4.36Å
81H96.6Very high96.3Very high162 Ų16260.6 Ų60.675%0.7530%0.302SS*.THydrogen-bonded Turntrans-83.3-15.1179-62.7-69.2000113.6Q77 A78 A79Q77-H81 PolarHBondContact O-CD2 2.89Å; Q77-H81 VanDerWaalsContact O-CD2 3.26Å; A78-H81 WeakPolarHBondContact O-CB 3.06Å; A78-H81 PolarHBondContact O-N 2.82Å; A79-H81 PolarHBondContact O-N 3.12Å; A79-H81 VanDerWaalsContact O-N 3.12Å
82W96.8Very high96Very high115 Ų11562.6 Ų62.644%0.43631%0.312SS..THydrogen-bonded Turntrans-93.2-51.7179.1-73.862.4000110.9A78 A79 M86 L101 F102 L105A78-W82 VanDerWaalsContact O-CD1 3.31Å; A79-W82 PolarHBondContact O-N 3.26Å; W82-M86 HydrophobicContact CB-CE 4.36Å; W82-L101 HydrophobicContact CH2-CG 4.5Å; W82-L101 HydrophobicContact CZ3-CB 4.31Å; W82-L101 HydrophobicContact CZ3-CD2 3.76Å; W82-L101 HydrophobicContact CZ3-CG 3.74Å; W82-F102 HydrophobicContact CB-CB 4.15Å; W82-F102 HydrophobicContact CB-CD2 4.18Å; W82-F102 HydrophobicContact CB-CG 4.34Å; W82-F102 AromaticContact CD1-CD2 3.68Å; W82-F102 HydrophobicContact CD2-CB 3.9Å; W82-F102 AromaticContact CD2-CD2 3.72Å; W82-F102 HydrophobicContact CD2-CD2 3.72Å; W82-F102 HydrophobicContact CD2-CG 4.27Å; W82-F102 AromaticContact CE2-CD2 3.92Å; W82-F102 HydrophobicContact CE3-CB 3.75Å; W82-F102 HydrophobicContact CE3-CD2 4.38Å; W82-F102 HydrophobicContact CG-CB 4.08Å; W82-F102 AromaticContact CG-CD2 3.59Å; W82-F102 HydrophobicContact CG-CD2 3.59Å; W82-F102 HydrophobicContact CG-CE2 4.48Å; W82-F102 HydrophobicContact CG-CG 4.15Å; W82-F102 HydrophobicContact CZ3-CB 4.5Å; W82-F102 AromaticContact NE1-CD2 3.86Å; W82-L105 HydrophobicContact CH2-CD1 3.43Å; W82-L105 VanDerWaalsContact CH2-CD1 3.43Å; W82-L105 HydrophobicContact CZ2-CD1 4.32Å; W82-L105 HydrophobicContact CZ3-CD1 3.98Å
83D97Very high95.8Very high21 Ų2168.3 Ų68.311%0.11234%0.343CS..  trans-160.3110.6179.2178.5-6.1000109.7A79 D85 M86 Y94 S96 A98 T99A79-D83 PolarHBondContact O-N 3.04Å; D83-D85 VanDerWaalsContact C-N 3.27Å; D83-D85 PolarHBondContact O-N 3.08Å; D83-D85 WeakPolarHBondContact OD1-CB 3.49Å; D83-D85 PolarHBondContact OD1-N 3.24Å; D83-M86 HydrophobicContact CB-CE 3.59Å; D83-M86 WeakPolarHBondContact O-CE 3.45Å; D83-M86 WeakPolarHBondContact O-CG 3.28Å; D83-Y94 VanDerWaalsContact OD2-CE1 3.26Å; D83-Y94 WeakPolarHBondContact OD2-CE1 3.3Å; D83-Y94 PolarHBondContact OD2-OH 3.31Å; D83-Y94 VanDerWaalsContact OD2-OH 3.07Å; D83-S96 WeakPolarHBondContact OD2-CB 3.37Å; D83-S96 PolarHBondContact OD2-OG 3.35Å; D83-A98 HydrophobicContact CB-CB 4.06Å; D83-T99 PolarHBondContact OD2-OG1 2.86Å
84G96.2Very high95.6Very high37 Ų3766.2 Ų66.238%0.38134%0.335SS..G310 helixtrans-70.6-21.3-178.400000113.9M86 L87G84-M86 VanDerWaalsContact C-N 3.27Å; G84-M86 PolarHBondContact O-N 3.18Å; G84-L87 PolarHBondContact O-N 3.21Å
85D96.7Very high95.4Very high56 Ų5666.3 Ų66.330%0.29933%0.332SS..G310 helixtrans-74.7-22.6-177-69.9-13.4000111.7D83 L87 R88 N91 Y94D83-D85 VanDerWaalsContact C-N 3.27Å; D83-D85 PolarHBondContact O-N 3.08Å; D83-D85 WeakPolarHBondContact OD1-CB 3.49Å; D83-D85 PolarHBondContact OD1-N 3.24Å; D85-L87 PolarHBondContact O-N 3.3Å; D85-R88 PolarHBondContact O-N 3.34Å; D85-R88 IonicContact OD1-CZ 3.75Å; D85-R88 IonicContact OD1-NE 3.9Å; D85-R88 PolarHBondContact OD1-NE 3.44Å; D85-R88 VanDerWaalsContact OD1-NE 3.11Å; D85-R88 IonicContact OD1-NH1 2.82Å; D85-R88 IonicContact OD1-NH2 3.98Å; D85-R88 PolarHBondContact OD1-NH2 2.98Å; D85-N91 PolarHBondContact O-ND2 3.46Å; D85-Y94 HydrophobicContact CB-CE1 3.93Å; D85-Y94 HydrophobicContact CB-CE2 4.21Å
86M96.4Very high95.3Very high0 Ų066 Ų660%033%0.332CS..G310 helixtrans-65.8-20173.192.3173.57400112.9R38 L41 A79 W82 D83 G84 Y94 T99 F102R38-M86 HydrophobicContact CG-CB 4.3Å; R38-M86 PolarHBondContact NH1-O 3.15Å; L41-M86 HydrophobicContact CD1-SD 4.34Å; A79-M86 HydrophobicContact CB-CE 4.39Å; A79-M86 HydrophobicContact CB-CG 4.45Å; A79-M86 HydrophobicContact CB-SD 3.75Å; W82-M86 HydrophobicContact CB-CE 4.36Å; D83-M86 HydrophobicContact CB-CE 3.59Å; D83-M86 WeakPolarHBondContact O-CE 3.45Å; D83-M86 WeakPolarHBondContact O-CG 3.28Å; G84-M86 VanDerWaalsContact C-N 3.27Å; G84-M86 PolarHBondContact O-N 3.18Å; M86-Y94 HydrophobicContact CB-CD1 4.1Å; M86-Y94 HydrophobicContact CB-CE1 4.25Å; M86-T99 HydrophobicContact CB-CG2 3.87Å; M86-T99 WeakPolarHBondContact CB-OG1 3.05Å; M86-T99 HydrophobicContact CE-CG2 4.2Å; M86-T99 HydrophobicContact SD-CG2 4.07Å; M86-F102 HydrophobicContact CE-CB 4.13Å; M86-F102 HydrophobicContact CE-CD1 4.09Å; M86-F102 HydrophobicContact CE-CG 4.24Å; M86-F102 HydrophobicContact SD-CD1 3.82Å; M86-F102 HydrophobicContact SD-CE1 4.37Å
87L96.9Very high95.3Very high5 Ų571.5 Ų71.53%0.02637%0.368CS..G310 helixtrans-94.41.1-177.5-56.8-179.4000113.5L41 A42 H45 S46 A76 A79 R80 G84 D85L41-L87 HydrophobicContact CB-CD2 3.84Å; A42-L87 WeakPolarHBondContact CB-O 3.2Å; H45-L87 HydrophobicContact CB-CD1 4.42Å; H45-L87 HydrophobicContact CB-CD2 4.38Å; S46-L87 PolarHBondContact OG-O 2.86Å; A76-L87 HydrophobicContact CB-CD2 4.03Å; A79-L87 HydrophobicContact CB-CD1 4.46Å; A79-L87 HydrophobicContact CB-CD2 4.01Å; R80-L87 HydrophobicContact CB-CD1 3.68Å; R80-L87 HydrophobicContact CG-CD1 4.36Å; G84-L87 PolarHBondContact O-N 3.21Å; D85-L87 PolarHBondContact O-N 3.3Å
88R95.6Very high95.3Very high149 Ų14969 Ų6956%0.56236%0.363SS*.  trans-78.6132.4174.1-63.8-177.2-172.5-178.97.6109.7R38 D85 N91R38-R88 PolarHBondContact NH1-O 3.15Å; D85-R88 PolarHBondContact O-N 3.34Å; D85-R88 IonicContact OD1-CZ 3.75Å; D85-R88 IonicContact OD1-NE 3.9Å; D85-R88 PolarHBondContact OD1-NE 3.44Å; D85-R88 VanDerWaalsContact OD1-NE 3.11Å; D85-R88 IonicContact OD1-NH1 2.82Å; D85-R88 IonicContact OD1-NH2 3.98Å; D85-R88 PolarHBondContact OD1-NH2 2.98Å; R88-N91 HydrophobicContact CB-CB 3.86Å
89L92.8Very high95.3Very high39 Ų3967 Ų6720%0.20435%0.345CS..THydrogen-bonded Turntrans-66.8-41.1-178-69.1167.3000111.9A42 I43 L47 N91A42-L89 HydrophobicContact CB-CD2 3.97Å; I43-L89 HydrophobicContact CB-CD2 4.45Å; I43-L89 HydrophobicContact CG1-CD2 3.81Å; L47-L89 HydrophobicContact CD1-CD1 4.07Å; L47-L89 HydrophobicContact CD1-CD2 4.49Å; L47-L89 HydrophobicContact CD2-CD1 3.74Å; L47-L89 HydrophobicContact CG-CD1 3.85Å; L89-N91 PolarHBondContact O-N 3.2Å
90D92.4Very high95.3Very high147 Ų14767.8 Ų67.879%0.78635%0.35SS*.THydrogen-bonded Turntrans-77.9-7.5-175.1-48.3-44.2000113.3L92D90-L92 VanDerWaalsContact C-N 3.26Å; D90-L92 PolarHBondContact O-N 3.42Å
91N92.1Very high95.3Very high46 Ų4663.4 Ų63.425%0.24634%0.338CS..  trans-88.463.2-175.2-160.914.6000111D85 R88 L89 Y94D85-N91 PolarHBondContact O-ND2 3.46Å; R88-N91 HydrophobicContact CB-CB 3.86Å; L89-N91 PolarHBondContact O-N 3.2Å; N91-Y94 VanDerWaalsContact CG-CB 3.49Å; N91-Y94 WeakPolarHBondContact ND2-CB 3.45Å; N91-Y94 WeakPolarHBondContact ND2-CD2 3.48Å; N91-Y94 VanDerWaalsContact O-CB 3.26Å; N91-Y94 WeakPolarHBondContact O-CB 3.35Å; N91-Y94 WeakPolarHBondContact OD1-CD2 3.32Å
92L91.7Very high95.4Very high79 Ų7956.2 Ų56.241%0.41431%0.305SS..THydrogen-bonded Turntrans-68.8140.3-176.8-60.6178.7000111.6D90 Y94D90-L92 VanDerWaalsContact C-N 3.26Å; D90-L92 PolarHBondContact O-N 3.42Å; L92-Y94 PolarHBondContact O-N 3.17Å
93N91.5Very high95.4Very high120 Ų12050.7 Ų50.764%0.64228%0.284SS*.THydrogen-bonded Turntrans60.328.7-177.7-51.9-63.2000113.4E35 A95E35-N93 PolarHBondContact OE1-N 2.86Å; E35-N93 VanDerWaalsContact OE2-CA 3.28Å; E35-N93 WeakPolarHBondContact OE2-CA 3.4Å; E35-N93 PolarHBondContact OE2-N 2.78Å; E35-N93 VanDerWaalsContact OE2-N 3.14Å; N93-A95 PolarHBondContact O-N 3.2Å
94Y93.4Very high95.5Very high53 Ų5350 Ų5021%0.20828%0.28CS..  trans-78.5121179.6-177.3-99.6000111.7D83 D85 M86 N91 L92 S96 T99D83-Y94 VanDerWaalsContact OD2-CE1 3.26Å; D83-Y94 WeakPolarHBondContact OD2-CE1 3.3Å; D83-Y94 PolarHBondContact OD2-OH 3.31Å; D83-Y94 VanDerWaalsContact OD2-OH 3.07Å; D85-Y94 HydrophobicContact CB-CE1 3.93Å; D85-Y94 HydrophobicContact CB-CE2 4.21Å; M86-Y94 HydrophobicContact CB-CD1 4.1Å; M86-Y94 HydrophobicContact CB-CE1 4.25Å; N91-Y94 VanDerWaalsContact CG-CB 3.49Å; N91-Y94 WeakPolarHBondContact ND2-CB 3.45Å; N91-Y94 WeakPolarHBondContact ND2-CD2 3.48Å; N91-Y94 VanDerWaalsContact O-CB 3.26Å; N91-Y94 WeakPolarHBondContact O-CB 3.35Å; N91-Y94 WeakPolarHBondContact OD1-CD2 3.32Å; L92-Y94 PolarHBondContact O-N 3.17Å; Y94-S96 WeakPolarHBondContact OH-CB 3.44Å; Y94-T99 WeakPolarHBondContact CE1-OG1 3.47Å
95A93.8Very high95.5Very high49 Ų4950.6 Ų50.641%0.40527%0.274SS..  trans-141.369.9-177.400000111.5F34 N93 V100F34-A95 HydrophobicContact CE1-CB 4.07Å; N93-A95 PolarHBondContact O-N 3.2Å; A95-V100 HydrophobicContact CB-CG2 4.24Å
96S96.5Very high95.5Very high18 Ų1848.3 Ų48.313%0.12626%0.262CS..  trans-66.4158.416980.50000111D83 Y94 A98 T99 V100D83-S96 WeakPolarHBondContact OD2-CB 3.37Å; D83-S96 PolarHBondContact OD2-OG 3.35Å; Y94-S96 WeakPolarHBondContact OH-CB 3.44Å; S96-A98 PolarHBondContact O-N 3.29Å; S96-A98 PolarHBondContact OG-N 3.42Å; S96-T99 WeakPolarHBondContact O-CB 3.41Å; S96-T99 PolarHBondContact O-N 3.21Å; S96-T99 WeakPolarHBondContact OG-CB 3.45Å; S96-T99 PolarHBondContact OG-N 2.91Å; S96-T99 PolarHBondContact OG-OG1 2.93Å; S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 3.33Å
97P96.8Very high95.6Very high116 Ų11648.3 Ų48.375%0.75326%0.262SS*.Hα-helixtrans-55.3-35.7174.2-26.735.4000113.4L101P97-L101 VanDerWaalsContact O-CB 3.29Å; P97-L101 WeakPolarHBondContact O-CB 3.37Å; P97-L101 PolarHBondContact O-N 2.8Å
98A97.3Very high95.6Very high37 Ų3749.1 Ų49.131%0.30627%0.267SS..Hα-helixtrans-69-39.5176.200000112D83 S96 L101 F102D83-A98 HydrophobicContact CB-CB 4.06Å; S96-A98 PolarHBondContact O-N 3.29Å; S96-A98 PolarHBondContact OG-N 3.42Å; A98-L101 PolarHBondContact O-N 3.01Å; A98-F102 VanDerWaalsContact O-CB 3.31Å; A98-F102 WeakPolarHBondContact O-CB 3.1Å; A98-F102 PolarHBondContact O-N 3.39Å
99T97.1Very high95.6Very high0 Ų045.7 Ų45.70%027%0.266CS..Hα-helixtrans-63.2-48.1174.8-62.40000111.4F34 D83 M86 Y94 S96 L101 F102 Q103F34-T99 HydrophobicContact CE1-CG2 4.28Å; F34-T99 HydrophobicContact CZ-CG2 4.11Å; D83-T99 PolarHBondContact OD2-OG1 2.86Å; M86-T99 HydrophobicContact CB-CG2 3.87Å; M86-T99 WeakPolarHBondContact CB-OG1 3.05Å; M86-T99 HydrophobicContact CE-CG2 4.2Å; M86-T99 HydrophobicContact SD-CG2 4.07Å; Y94-T99 WeakPolarHBondContact CE1-OG1 3.47Å; S96-T99 WeakPolarHBondContact O-CB 3.41Å; S96-T99 PolarHBondContact O-N 3.21Å; S96-T99 WeakPolarHBondContact OG-CB 3.45Å; S96-T99 PolarHBondContact OG-N 2.91Å; S96-T99 PolarHBondContact OG-OG1 2.93Å; T99-L101 VanDerWaalsContact C-N 3.35Å; T99-L101 PolarHBondContact O-N 3.26Å; T99-F102 PolarHBondContact O-N 3.47Å; T99-Q103 WeakPolarHBondContact O-CB 3.25Å; T99-Q103 WeakPolarHBondContact O-CG 3.45Å; T99-Q103 PolarHBondContact O-N 3.34Å
100V97.4Very high95.8Very high18 Ų1844.8 Ų44.811%0.10926%0.262CS..Hα-helixtrans-59-48.3176.8175.20000110.4F34 A95 S96 Q103 R104F34-V100 HydrophobicContact CE2-CG2 4.37Å; F34-V100 HydrophobicContact CZ-CB 4.36Å; F34-V100 HydrophobicContact CZ-CG2 3.84Å; A95-V100 HydrophobicContact CB-CG2 4.24Å; S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 3.33Å; V100-Q103 PolarHBondContact O-N 2.94Å; V100-R104 HydrophobicContact CG1-CG 4.31Å; V100-R104 WeakPolarHBondContact O-CB 3.49Å; V100-R104 WeakPolarHBondContact O-CG 3.03Å; V100-R104 PolarHBondContact O-N 3.48Å
101L97.4Very high95.9Very high64 Ų6437.9 Ų37.934%0.33523%0.225SC..Hα-helixtrans-62.4-46.7179.6-176.261.9000112I26 W82 P97 A98 T99 R104 L105I26-L101 HydrophobicContact CD1-CD1 3.91Å; I26-L101 HydrophobicContact CG2-CD1 3.94Å; W82-L101 HydrophobicContact CH2-CG 4.5Å; W82-L101 HydrophobicContact CZ3-CB 4.31Å; W82-L101 HydrophobicContact CZ3-CD2 3.76Å; W82-L101 HydrophobicContact CZ3-CG 3.74Å; P97-L101 VanDerWaalsContact O-CB 3.29Å; P97-L101 WeakPolarHBondContact O-CB 3.37Å; P97-L101 PolarHBondContact O-N 2.8Å; A98-L101 PolarHBondContact O-N 3.01Å; T99-L101 VanDerWaalsContact C-N 3.35Å; T99-L101 PolarHBondContact O-N 3.26Å; L101-R104 PolarHBondContact O-N 3.06Å; L101-L105 HydrophobicContact CD1-CD1 3.87Å; L101-L105 HydrophobicContact CD1-CG 4.12Å; L101-L105 HydrophobicContact CG-CD1 3.89Å; L101-L105 HydrophobicContact CG-CG 4.48Å; L101-L105 WeakPolarHBondContact O-CB 3.4Å; L101-L105 VanDerWaalsContact O-CG 3.27Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 3Å
102F97.9Very high96.1Very high11 Ų1141.1 Ų41.15%0.04824%0.241CC..Hα-helixtrans-57.6-52.3178.5172.1-99.7000111.5L41 L75 A78 A79 W82 M86 A98 T99 R104 L105 S106L41-F102 HydrophobicContact CD1-CE1 4.06Å; L75-F102 WeakPolarHBondContact O-CZ 3.5Å; A78-F102 HydrophobicContact CB-CE2 3.89Å; A78-F102 HydrophobicContact CB-CZ 4.25Å; A79-F102 HydrophobicContact CB-CD1 3.98Å; A79-F102 HydrophobicContact CB-CE1 3.43Å; A79-F102 VanDerWaalsContact CB-CE1 3.43Å; A79-F102 HydrophobicContact CB-CE2 4.17Å; A79-F102 HydrophobicContact CB-CZ 3.55Å; W82-F102 HydrophobicContact CB-CB 4.15Å; W82-F102 HydrophobicContact CB-CD2 4.18Å; W82-F102 HydrophobicContact CB-CG 4.34Å; W82-F102 AromaticContact CD1-CD2 3.68Å; W82-F102 HydrophobicContact CD2-CB 3.9Å; W82-F102 AromaticContact CD2-CD2 3.72Å; W82-F102 HydrophobicContact CD2-CD2 3.72Å; W82-F102 HydrophobicContact CD2-CG 4.27Å; W82-F102 AromaticContact CE2-CD2 3.92Å; W82-F102 HydrophobicContact CE3-CB 3.75Å; W82-F102 HydrophobicContact CE3-CD2 4.38Å; W82-F102 HydrophobicContact CG-CB 4.08Å; W82-F102 AromaticContact CG-CD2 3.59Å; W82-F102 HydrophobicContact CG-CD2 3.59Å; W82-F102 HydrophobicContact CG-CE2 4.48Å; W82-F102 HydrophobicContact CG-CG 4.15Å; W82-F102 HydrophobicContact CZ3-CB 4.5Å; W82-F102 AromaticContact NE1-CD2 3.86Å; M86-F102 HydrophobicContact CE-CB 4.13Å; M86-F102 HydrophobicContact CE-CD1 4.09Å; M86-F102 HydrophobicContact CE-CG 4.24Å; M86-F102 HydrophobicContact SD-CD1 3.82Å; M86-F102 HydrophobicContact SD-CE1 4.37Å; A98-F102 VanDerWaalsContact O-CB 3.31Å; A98-F102 WeakPolarHBondContact O-CB 3.1Å; A98-F102 PolarHBondContact O-N 3.39Å; T99-F102 PolarHBondContact O-N 3.47Å; F102-R104 PolarHBondContact O-N 2.97Å; F102-L105 PolarHBondContact O-N 3.33Å; F102-S106 PolarHBondContact O-N 3.14Å; F102-S106 PolarHBondContact O-OG 3.1Å
103Q97.6Very high96.4Very high0 Ų039.2 Ų39.20%023%0.231CC..Hα-helixtrans-64.2-38.7-178.2-77.2-158.810.400112.4F34 R38 T99 V100 S106 V107 F160F34-Q103 HydrophobicContact CE2-CB 3.78Å; F34-Q103 HydrophobicContact CE2-CG 4.24Å; F34-Q103 HydrophobicContact CZ-CB 4.25Å; F34-Q103 HydrophobicContact CZ-CG 4.31Å; F34-Q103 PolarHBondContact O-OE1 3.36Å; R38-Q103 VanDerWaalsContact CA-NE2 3.27Å; T99-Q103 WeakPolarHBondContact O-CB 3.25Å; T99-Q103 WeakPolarHBondContact O-CG 3.45Å; T99-Q103 PolarHBondContact O-N 3.34Å; V100-Q103 PolarHBondContact O-N 2.94Å; Q103-S106 WeakPolarHBondContact CA-OG 3.5Å; Q103-S106 PolarHBondContact O-N 3.25Å; Q103-S106 PolarHBondContact O-OG 3.35Å; Q103-V107 WeakPolarHBondContact O-CG2 3.3Å; Q103-V107 PolarHBondContact O-N 2.85Å; Q103-F160 HydrophobicContact CB-CE2 3.61Å; Q103-F160 HydrophobicContact CB-CZ 3.59Å; Q103-F160 HydrophobicContact CG-CZ 4.17Å; Q103-F160 WeakPolarHBondContact O-CE2 3.2Å; Q103-F160 VanDerWaalsContact OE1-CZ 3.26Å
104R97.2Very high96.8Very high7 Ų733.7 Ų33.73%0.02620%0.201CC..Hα-helixtrans-65.8-42175.7-69.6-70.3-165.5-159.54.7111.5I26 A28 Y29 V100 L101 F102 V107 V108 H157 I158I26-R104 HydrophobicContact CG1-CB 4.09Å; I26-R104 HydrophobicContact CG2-CB 4.48Å; I26-R104 HydrophobicContact CG2-CG 4.4Å; I26-R104 PolarHBondContact O-NE 3.42Å; A28-R104 PolarHBondContact O-NH2 2.95Å; Y29-R104 PolarHBondContact O-NH2 3.28Å; V100-R104 HydrophobicContact CG1-CG 4.31Å; V100-R104 WeakPolarHBondContact O-CB 3.49Å; V100-R104 WeakPolarHBondContact O-CG 3.03Å; V100-R104 PolarHBondContact O-N 3.48Å; L101-R104 PolarHBondContact O-N 3.06Å; F102-R104 PolarHBondContact O-N 2.97Å; R104-V107 PolarHBondContact O-N 3.05Å; R104-V108 WeakPolarHBondContact O-CG2 3.47Å; R104-V108 PolarHBondContact O-N 3.49Å; R104-V108 VanDerWaalsContact O-N 3.16Å; R104-H157 VanDerWaalsContact CZ-O 3.31Å; R104-H157 VanDerWaalsContact NH1-C 3.33Å; R104-H157 PolarHBondContact NH1-O 2.91Å; R104-I158 PolarHBondContact NH1-O 3.4Å; R104-I158 PolarHBondContact NH2-O 3.25Å
105L97.1Very high97Very high48 Ų4832 Ų3225%0.25120%0.196SC..Hα-helixtrans-69.3-34.9177.7-70175.1000112.2W82 L101 F102 V107 V108 C109W82-L105 HydrophobicContact CH2-CD1 3.43Å; W82-L105 VanDerWaalsContact CH2-CD1 3.43Å; W82-L105 HydrophobicContact CZ2-CD1 4.32Å; W82-L105 HydrophobicContact CZ3-CD1 3.98Å; L101-L105 HydrophobicContact CD1-CD1 3.87Å; L101-L105 HydrophobicContact CD1-CG 4.12Å; L101-L105 HydrophobicContact CG-CD1 3.89Å; L101-L105 HydrophobicContact CG-CG 4.48Å; L101-L105 WeakPolarHBondContact O-CB 3.4Å; L101-L105 VanDerWaalsContact O-CG 3.27Å; L101-L105 WeakPolarHBondContact O-CG 3.34Å; L101-L105 PolarHBondContact O-N 3Å; F102-L105 PolarHBondContact O-N 3.33Å; L105-V107 VanDerWaalsContact C-N 3.32Å; L105-V107 PolarHBondContact O-N 3.47Å; L105-V108 PolarHBondContact O-N 3.39Å; L105-C109 VanDerWaalsContact O-CB 3.3Å; L105-C109 WeakPolarHBondContact O-CB 3.45Å; L105-C109 PolarHBondContact O-N 3.45Å; L105-C109 PolarHBondContact O-SG 2.93Å
106S97.6Very high97.2Very high8 Ų834.4 Ų34.46%0.05620%0.195CC..Hα-helixtrans-62.8-39.1175.9640000111.8F102 Q103 C109 T110 Y162F102-S106 PolarHBondContact O-N 3.14Å; F102-S106 PolarHBondContact O-OG 3.1Å; Q103-S106 WeakPolarHBondContact CA-OG 3.5Å; Q103-S106 PolarHBondContact O-N 3.25Å; Q103-S106 PolarHBondContact O-OG 3.35Å; S106-C109 PolarHBondContact O-N 3.22Å; S106-T110 WeakPolarHBondContact O-CB 3.41Å; S106-T110 VanDerWaalsContact O-CG2 3.29Å; S106-T110 WeakPolarHBondContact O-CG2 3.12Å; S106-T110 PolarHBondContact O-N 2.81Å; S106-T110 PolarHBondContact O-OG1 3.29Å; S106-Y162 PolarHBondContact OG-OH 3Å
107V97.4Very high97.3Very high0 Ų033.6 Ų33.60%019%0.189CC..Hα-helixtrans-63.4-48.3172.8178.40000110.6Q103 R104 L105 C109 T110 D111 D156 F160 Q161 Y162Q103-V107 WeakPolarHBondContact O-CG2 3.3Å; Q103-V107 PolarHBondContact O-N 2.85Å; R104-V107 PolarHBondContact O-N 3.05Å; L105-V107 VanDerWaalsContact C-N 3.32Å; L105-V107 PolarHBondContact O-N 3.47Å; V107-C109 VanDerWaalsContact C-N 3.33Å; V107-C109 PolarHBondContact O-N 2.95Å; V107-T110 PolarHBondContact O-N 2.77Å; V107-T110 PolarHBondContact O-OG1 2.99Å; V107-T110 VanDerWaalsContact O-OG1 3.06Å; V107-D111 PolarHBondContact O-N 3.22Å; V107-D111 VanDerWaalsContact O-N 3.1Å; V107-D156 HydrophobicContact CG1-CB 4.02Å; V107-F160 HydrophobicContact CG2-CD2 4.4Å; V107-F160 HydrophobicContact CG2-CE2 3.75Å; V107-F160 HydrophobicContact CG2-CZ 3.91Å; V107-Q161 WeakPolarHBondContact CG1-O 3.46Å; V107-Y162 HydrophobicContact CB-CE1 4.47Å; V107-Y162 HydrophobicContact CG2-CD1 4.01Å; V107-Y162 HydrophobicContact CG2-CD2 4.49Å; V107-Y162 HydrophobicContact CG2-CE1 3.75Å; V107-Y162 HydrophobicContact CG2-CE2 4.28Å; V107-Y162 HydrophobicContact CG2-CG 4.38Å
108V96.4Very high97.3Very high22 Ų2228 Ų2813%0.13315%0.154CC..Hα-helixtrans-62.9-37177.8175.30000112.5K22 R104 L105 D111K22-V108 HydrophobicContact CB-CG2 4.15Å; R104-V108 WeakPolarHBondContact O-CG2 3.47Å; R104-V108 PolarHBondContact O-N 3.49Å; R104-V108 VanDerWaalsContact O-N 3.16Å; L105-V108 PolarHBondContact O-N 3.39Å; V108-D111 WeakPolarHBondContact O-CB 3.49Å
109C96.6Very high97.3Very high78 Ų7830.8 Ų30.853%0.52716%0.156SC..Hα-helixtrans-70.1-43.4177.6-73.70000112L105 S106 V107 D111 L112L105-C109 VanDerWaalsContact O-CB 3.3Å; L105-C109 WeakPolarHBondContact O-CB 3.45Å; L105-C109 PolarHBondContact O-N 3.45Å; L105-C109 PolarHBondContact O-SG 2.93Å; S106-C109 PolarHBondContact O-N 3.22Å; V107-C109 VanDerWaalsContact C-N 3.33Å; V107-C109 PolarHBondContact O-N 2.95Å; C109-D111 PolarHBondContact O-N 2.98Å; C109-L112 WeakPolarHBondContact O-CB 3.45Å; C109-L112 WeakPolarHBondContact O-CD1 3.35Å; C109-L112 WeakPolarHBondContact O-CG 3.43Å; C109-L112 PolarHBondContact O-N 3.4Å
110T96.5Very high97.2Very high20 Ų2031 Ų3112%0.12316%0.157CC..Hα-helixtrans-69-23.4179.453.50000112.5S106 V107 L112 L113 Y162S106-T110 WeakPolarHBondContact O-CB 3.41Å; S106-T110 VanDerWaalsContact O-CG2 3.29Å; S106-T110 WeakPolarHBondContact O-CG2 3.12Å; S106-T110 PolarHBondContact O-N 2.81Å; S106-T110 PolarHBondContact O-OG1 3.29Å; V107-T110 PolarHBondContact O-N 2.77Å; V107-T110 PolarHBondContact O-OG1 2.99Å; V107-T110 VanDerWaalsContact O-OG1 3.06Å; T110-L112 PolarHBondContact O-N 2.97Å; T110-L113 PolarHBondContact O-N 2.92Å; T110-Y162 HydrophobicContact CG2-CD1 4.44Å; T110-Y162 HydrophobicContact CG2-CE1 4.42Å; T110-Y162 WeakPolarHBondContact OG1-CD1 3.2Å
111D95Very high97.2Very high2 Ų230.1 Ų30.11%0.01115%0.152CC..THydrogen-bonded Turntrans-63.5-13.5171.3-83.2-10000115K22 V107 V108 C109 L113 F114 I115 H157 G164K22-D111 IonicContact NZ-OD2 3.47Å; K22-D111 PolarHBondContact NZ-OD2 3.07Å; V107-D111 PolarHBondContact O-N 3.22Å; V107-D111 VanDerWaalsContact O-N 3.1Å; V108-D111 WeakPolarHBondContact O-CB 3.49Å; C109-D111 PolarHBondContact O-N 2.98Å; D111-L113 PolarHBondContact O-N 3.37Å; D111-L113 VanDerWaalsContact O-N 3.17Å; D111-F114 WeakPolarHBondContact O-CA 3.36Å; D111-F114 VanDerWaalsContact O-CB 3.3Å; D111-F114 WeakPolarHBondContact O-CB 3.31Å; D111-F114 PolarHBondContact O-N 3.49Å; D111-I115 PolarHBondContact O-N 3.34Å; D111-H157 IonicContact OD2-CE1 3.03Å; D111-H157 PolarHBondContact OD2-CE1 3.45Å; D111-H157 IonicContact OD2-NE2 3.07Å; D111-H157 PolarHBondContact OD2-NE2 3.46Å; D111-G164 WeakPolarHBondContact OD1-CA 3.33Å
112L96.9Very high97Very high114 Ų11427.2 Ų27.260%0.59714%0.136SC*.Hα-helixtrans-55.3-33.1171.6-68.4174.9000111.7C109 T110 I115 Y116C109-L112 WeakPolarHBondContact O-CB 3.45Å; C109-L112 WeakPolarHBondContact O-CD1 3.35Å; C109-L112 WeakPolarHBondContact O-CG 3.43Å; C109-L112 PolarHBondContact O-N 3.4Å; T110-L112 PolarHBondContact O-N 2.97Å; L112-I115 HydrophobicContact CD2-CD1 4.37Å; L112-I115 PolarHBondContact O-N 2.9Å; L112-Y116 WeakPolarHBondContact O-CB 3.46Å; L112-Y116 PolarHBondContact O-N 2.97Å
113L97.8Very high96.7Very high38 Ų3833.8 Ų33.820%0.19916%0.161CC..Hα-helixtrans-65.8-40.7173.5-178.561.4000111.9T110 D111 Y116 A117 F165 F169 L172T110-L113 PolarHBondContact O-N 2.92Å; D111-L113 PolarHBondContact O-N 3.37Å; D111-L113 VanDerWaalsContact O-N 3.17Å; L113-Y116 PolarHBondContact O-N 3.15Å; L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.43Å; L113-F165 HydrophobicContact CB-CD2 4.43Å; L113-F165 HydrophobicContact CD2-CD2 3.88Å; L113-F165 HydrophobicContact CD2-CE2 3.89Å; L113-F169 HydrophobicContact CD2-CD1 4.48Å; L113-F169 HydrophobicContact CD2-CD2 3.28Å; L113-F169 HydrophobicContact CD2-CE1 4.44Å; L113-F169 HydrophobicContact CD2-CE2 3.22Å; L113-F169 HydrophobicContact CD2-CG 3.94Å; L113-F169 HydrophobicContact CD2-CZ 3.85Å; L113-L172 HydrophobicContact CD1-CD2 4.18Å
114F98.2Very high96.4Very high4 Ų435 Ų352%0.01817%0.169CC..Hα-helixtrans-63.9-43.8175.2-174.3-102.9000111.7D111 Y116 A117 A118 L146 L147 L152 G164 F167 L171D111-F114 WeakPolarHBondContact O-CA 3.36Å; D111-F114 VanDerWaalsContact O-CB 3.3Å; D111-F114 WeakPolarHBondContact O-CB 3.31Å; D111-F114 PolarHBondContact O-N 3.49Å; F114-Y116 VanDerWaalsContact C-N 3.32Å; F114-Y116 PolarHBondContact O-N 3.46Å; F114-A117 WeakPolarHBondContact O-CB 3.39Å; F114-A117 PolarHBondContact O-N 2.96Å; F114-A118 WeakPolarHBondContact O-CB 3.42Å; F114-A118 PolarHBondContact O-N 3.41Å; F114-L146 HydrophobicContact CE1-CB 4.44Å; F114-L146 WeakPolarHBondContact CE1-O 3.29Å; F114-L146 HydrophobicContact CZ-CB 4.22Å; F114-L147 HydrophobicContact CD1-CD2 4.1Å; F114-L147 HydrophobicContact CE1-CD2 4.09Å; F114-L152 HydrophobicContact CD2-CD1 4.49Å; F114-L152 HydrophobicContact CE1-CD1 3.86Å; F114-L152 HydrophobicContact CE2-CD1 3.69Å; F114-L152 HydrophobicContact CZ-CD1 3.33Å; F114-G164 WeakPolarHBondContact CB-O 3.41Å; F114-G164 WeakPolarHBondContact CD2-O 3.37Å; F114-F167 HydrophobicContact CD2-CB 4.19Å; F114-F167 HydrophobicContact CE2-CB 4.1Å; F114-L171 HydrophobicContact CD2-CD1 4.3Å; F114-L171 HydrophobicContact CE2-CD1 3.55Å; F114-L171 HydrophobicContact CZ-CD1 4.15Å
115I98Very high95.9Very high19 Ų1935.5 Ų35.510%0.09717%0.172CC..Hα-helixtrans-59.6-45.2176.2-67.1167.5000110.3F11 A15 D111 L112 A118 R119 L147F11-I115 HydrophobicContact CE1-CG2 3.9Å; F11-I115 HydrophobicContact CZ-CG2 4.3Å; F11-I115 WeakPolarHBondContact CZ-O 3.43Å; A15-I115 HydrophobicContact CB-CD1 4.42Å; A15-I115 HydrophobicContact CB-CG2 3.67Å; D111-I115 PolarHBondContact O-N 3.34Å; L112-I115 HydrophobicContact CD2-CD1 4.37Å; L112-I115 PolarHBondContact O-N 2.9Å; I115-A118 PolarHBondContact O-N 3Å; I115-R119 PolarHBondContact O-N 3.25Å; I115-L147 HydrophobicContact CB-CD2 4.41Å; I115-L147 HydrophobicContact CG1-CD2 3.9Å
116Y98Very high94.6Very high99 Ų9943.2 Ų43.239%0.38820%0.198SC..Hα-helixtrans-62.4-44.3175.6178.5-110.4000112.3L112 L113 F114 R119 E120 L172 R176L112-Y116 WeakPolarHBondContact O-CB 3.46Å; L112-Y116 PolarHBondContact O-N 2.97Å; L113-Y116 PolarHBondContact O-N 3.15Å; F114-Y116 VanDerWaalsContact C-N 3.32Å; F114-Y116 PolarHBondContact O-N 3.46Å; Y116-R119 WeakPolarHBondContact O-CB 3.41Å; Y116-R119 PolarHBondContact O-N 3.17Å; Y116-E120 HydrophobicContact CE1-CG 4.13Å; Y116-E120 HydrophobicContact CE2-CG 4.1Å; Y116-E120 PolarHBondContact O-N 3.36Å; Y116-L172 HydrophobicContact CD1-CD1 3.89Å; Y116-L172 HydrophobicContact CD1-CD2 4.02Å; Y116-L172 HydrophobicContact CE1-CD1 3.56Å; Y116-L172 HydrophobicContact CE1-CD2 3.91Å; Y116-L172 HydrophobicContact CE1-CG 4.41Å; Y116-R176 PolarHBondContact OH-NH2 2.89Å
117A98.2Very high93.1Very high0 Ų045.6 Ų45.60%021%0.212CC..Hα-helixtrans-61.5-44.717700000112.2L113 F114 R119 E120 C121 G168 L171 L172L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.43Å; F114-A117 WeakPolarHBondContact O-CB 3.39Å; F114-A117 PolarHBondContact O-N 2.96Å; A117-R119 VanDerWaalsContact C-N 3.3Å; A117-R119 PolarHBondContact O-N 2.89Å; A117-E120 PolarHBondContact O-N 2.91Å; A117-C121 PolarHBondContact O-N 2.96Å; A117-C121 PolarHBondContact O-SG 3.43Å; A117-C121 VanDerWaalsContact O-SG 3.38Å; A117-G168 WeakPolarHBondContact CB-O 3.19Å; A117-L171 HydrophobicContact CB-CB 3.92Å; A117-L172 HydrophobicContact CB-CB 3.86Å
118A97.9Very high91Very high0 Ų054.9 Ų54.90%026%0.256CS..Hα-helixtrans-59.4-41.717600000111.3F11 F114 I115 C121 C122 L146 L147F11-A118 HydrophobicContact CZ-CB 4.43Å; F114-A118 WeakPolarHBondContact O-CB 3.42Å; F114-A118 PolarHBondContact O-N 3.41Å; I115-A118 PolarHBondContact O-N 3Å; A118-C121 PolarHBondContact O-N 3.44Å; A118-C122 PolarHBondContact O-N 2.81Å; A118-C122 PolarHBondContact O-SG 3.22Å; A118-L146 HydrophobicContact CB-CB 4.23Å; A118-L146 HydrophobicContact CB-CD1 3.95Å; A118-L147 HydrophobicContact CB-CD2 3.9Å; A118-L147 HydrophobicContact CB-CG 4.38Å
119R96.4Very high89Confident94 Ų9463 Ų6336%0.35529%0.289SS..Hα-helixtrans-59.6-47.8174.2-167.9178.9175.9-179.9-1.2111.7F11 I115 Y116 A117 C121 C122 R123F11-R119 HydrophobicContact CD1-CB 4.32Å; F11-R119 HydrophobicContact CD1-CG 4.15Å; F11-R119 HydrophobicContact CE1-CB 3.64Å; F11-R119 HydrophobicContact CE1-CG 3.96Å; F11-R119 HydrophobicContact CE2-CB 4.04Å; F11-R119 HydrophobicContact CE2-CG 4.42Å; F11-R119 HydrophobicContact CG-CG 4.49Å; F11-R119 HydrophobicContact CZ-CB 3.48Å; F11-R119 VanDerWaalsContact CZ-CB 3.48Å; F11-R119 HydrophobicContact CZ-CG 4.12Å; I115-R119 PolarHBondContact O-N 3.25Å; Y116-R119 WeakPolarHBondContact O-CB 3.41Å; Y116-R119 PolarHBondContact O-N 3.17Å; A117-R119 VanDerWaalsContact C-N 3.3Å; A117-R119 PolarHBondContact O-N 2.89Å; R119-C121 VanDerWaalsContact C-N 3.35Å; R119-C121 PolarHBondContact O-N 2.83Å; R119-C122 WeakPolarHBondContact O-CB 3.3Å; R119-C122 PolarHBondContact O-N 2.8Å; R119-R123 WeakPolarHBondContact O-CG 3.49Å; R119-R123 PolarHBondContact O-N 2.78Å; R119-R123 VanDerWaalsContact O-N 3.08Å
120E96.3Very high87.3Confident5 Ų561.8 Ų61.82%0.02329%0.285CS..Hα-helixtrans-66-36.1179.8-71.4-67115.200112.2Y116 A117 R123 C124 L172 A175 R176 Q179Y116-E120 HydrophobicContact CE1-CG 4.13Å; Y116-E120 HydrophobicContact CE2-CG 4.1Å; Y116-E120 PolarHBondContact O-N 3.36Å; A117-E120 PolarHBondContact O-N 2.91Å; E120-R123 PolarHBondContact O-N 3.17Å; E120-R123 WeakPolarHBondContact OE1-CD 3.32Å; E120-R123 IonicContact OE1-CZ 3.52Å; E120-R123 IonicContact OE1-NE 3.77Å; E120-R123 IonicContact OE1-NH1 3.59Å; E120-R123 PolarHBondContact OE1-NH1 3.44Å; E120-C124 PolarHBondContact O-N 3.23Å; E120-C124 PolarHBondContact O-SG 3.38Å; E120-L172 HydrophobicContact CB-CD1 4.06Å; E120-L172 HydrophobicContact CG-CD1 3.94Å; E120-A175 HydrophobicContact CB-CB 3.97Å; E120-R176 IonicContact OE2-CZ 3.46Å; E120-R176 IonicContact OE2-NH1 3.68Å; E120-R176 PolarHBondContact OE2-NH1 3.24Å; E120-R176 IonicContact OE2-NH2 3.24Å; E120-Q179 PolarHBondContact OE2-NE2 3.49Å
121C96.1Very high85.6Confident0 Ų063.1 Ų63.10%029%0.294CS..Hα-helixtrans-61.3-44.5170.3-720000111.8A117 A118 R119 R123 C124 L142 L146 I391A117-C121 PolarHBondContact O-N 2.96Å; A117-C121 PolarHBondContact O-SG 3.43Å; A117-C121 VanDerWaalsContact O-SG 3.38Å; A118-C121 PolarHBondContact O-N 3.44Å; R119-C121 VanDerWaalsContact C-N 3.35Å; R119-C121 PolarHBondContact O-N 2.83Å; C121-R123 VanDerWaalsContact C-N 3.27Å; C121-R123 PolarHBondContact O-N 2.89Å; C121-C124 WeakPolarHBondContact O-CB 3.33Å; C121-C124 PolarHBondContact O-N 3.39Å; C121-L142 HydrophobicContact CB-CD2 4.04Å; C121-L146 HydrophobicContact CB-CD1 4.43Å; C121-I391 HydrophobicContact CB-CD1 4.26Å
122C94.6Very high84.1Confident2 Ų272.6 Ų72.61%0.01434%0.338CS..Hα-helixtrans-60-38.2177.5-66.60000112.1W8 A118 R119 C124 I125 S139W8-C122 HydrophobicContact CH2-CB 3.91Å; W8-C122 HydrophobicContact CZ3-CB 3.92Å; A118-C122 PolarHBondContact O-N 2.81Å; A118-C122 PolarHBondContact O-SG 3.22Å; R119-C122 WeakPolarHBondContact O-CB 3.3Å; R119-C122 PolarHBondContact O-N 2.8Å; C122-C124 PolarHBondContact O-N 2.91Å; C122-I125 PolarHBondContact O-N 3.4Å; C122-S139 PolarHBondContact SG-O 3.21Å
123R91.5Very high83.3Confident149 Ų14971.2 Ų71.256%0.56233%0.334SS*.Hα-helixtrans-67.5-18.4175.2-66.317575.9-179.89.4113.7W8 R119 E120 C121W8-R123 HydrophobicContact CH2-CG 3.89Å; W8-R123 HydrophobicContact CZ2-CG 3.85Å; R119-R123 WeakPolarHBondContact O-CG 3.49Å; R119-R123 PolarHBondContact O-N 2.78Å; R119-R123 VanDerWaalsContact O-N 3.08Å; E120-R123 PolarHBondContact O-N 3.17Å; E120-R123 WeakPolarHBondContact OE1-CD 3.32Å; E120-R123 IonicContact OE1-CZ 3.52Å; E120-R123 IonicContact OE1-NE 3.77Å; E120-R123 IonicContact OE1-NH1 3.59Å; E120-R123 PolarHBondContact OE1-NH1 3.44Å; C121-R123 VanDerWaalsContact C-N 3.27Å; C121-R123 PolarHBondContact O-N 2.89Å
124C90.1Very high82.4Confident26 Ų2672.1 Ų72.118%0.17634%0.341CS..Hα-helixtrans-82.6-16177.2-62.50000112.9E120 C121 C122 R126 L178E120-C124 PolarHBondContact O-N 3.23Å; E120-C124 PolarHBondContact O-SG 3.38Å; C121-C124 WeakPolarHBondContact O-CB 3.33Å; C121-C124 PolarHBondContact O-N 3.39Å; C122-C124 PolarHBondContact O-N 2.91Å; C124-R126 PolarHBondContact O-N 3.05Å; C124-L178 HydrophobicContact CB-CB 4.04Å; C124-L178 HydrophobicContact CB-CD1 3.78Å
125I87.4Confident81.6Confident18 Ų1877.3 Ų77.39%0.09237%0.368CS..SBendtrans-72.8127.2179.7-57.6162.1000109.5C122 V127 P138 L142 V394 E395C122-I125 PolarHBondContact O-N 3.4Å; I125-V127 PolarHBondContact O-N 3.12Å; I125-P138 HydrophobicContact CG2-CB 3.8Å; I125-L142 HydrophobicContact CD1-CB 3.69Å; I125-L142 HydrophobicContact CD1-CD2 3.48Å; I125-L142 VanDerWaalsContact CD1-CD2 3.48Å; I125-L142 HydrophobicContact CD1-CG 4.18Å; I125-L142 HydrophobicContact CG1-CD2 4.06Å; I125-V394 HydrophobicContact CD1-CG2 3.71Å; I125-V394 HydrophobicContact CG1-CG2 4.1Å; I125-E395 HydrophobicContact CG2-CG 4.5Å
126R70Confident80.8Confident210 Ų21078.9 Ų78.979%0.79238%0.381SS*.  trans-83.6113.7176.6-65.9-178.4178.7-172.8-1.8110.1C124C124-R126 PolarHBondContact O-N 3.05Å
127V65.2Low80.4Confident58 Ų5875 Ų7535%0.35237%0.367SS..  trans-98.9112.1172.9-1760000108.6I125 A130 P138I125-V127 PolarHBondContact O-N 3.12Å; V127-A130 VanDerWaalsContact CG1-CA 3.44Å; V127-A130 HydrophobicContact CG1-CB 3.85Å; V127-P138 HydrophobicContact CG2-CG 4.26Å
128Q53.1Low80.1Confident195 Ų19576 Ų7691%0.91137%0.373SS*.SBendtrans-78.2-35.6177.7-72.9-177.53.400112.4
129K56.3Low79.8Confident192 Ų19276.2 Ų76.284%0.83537%0.374SS*.SBendtrans-142.9117169.4-74.2-174.6177.6-179.50107.5P131K129-P131 WeakPolarHBondContact O-CD 3.18Å
130A59.6Low79.7Confident53 Ų5372.9 Ų72.944%0.43836%0.363SS..  trans-72.2125.2178.300000108.9V127V127-A130 VanDerWaalsContact CG1-CA 3.44Å; V127-A130 HydrophobicContact CG1-CB 3.85Å
131P61.9Low79.7Confident47 Ų4772.8 Ų72.831%0.30536%0.362SS..  trans-59.7143.8169.721.8-28000109.3K129 V133 S136 Q137K129-P131 WeakPolarHBondContact O-CD 3.18Å; P131-V133 PolarHBondContact O-N 2.94Å; P131-S136 WeakPolarHBondContact CG-O 3.45Å; P131-Q137 HydrophobicContact CG-CB 4.47Å; P131-Q137 HydrophobicContact CG-CG 3.89Å
132Q63.6Low79.7Confident202 Ų20272.8 Ų72.894%0.94436%0.362SS*.SBendtrans-62.1-25.9-179.4-69.9-174.9-16.200112.3
133V79.4Confident79.9Confident84 Ų8472.7 Ų72.751%0.50936%0.361SS..SBendtrans-93.3118.7177.8-176.70000110P131 L135 S136P131-V133 PolarHBondContact O-N 2.94Å; V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 HydrophobicContact CG1-CB 4.06Å; V133-L135 PolarHBondContact O-N 3.46Å; V133-S136 PolarHBondContact O-N 3.32Å
134V78.8Confident80.1Confident57 Ų5766.2 Ų66.235%0.34534%0.338SS..G310 helixtrans-54.9-40.9-179.8178.10000112.2W10 S136 Q137 F140W10-V134 HydrophobicContact CB-CG1 4.34Å; W10-V134 HydrophobicContact CD2-CG1 4.29Å; W10-V134 HydrophobicContact CG-CG1 3.94Å; V134-S136 PolarHBondContact O-N 3.01Å; V134-S136 VanDerWaalsContact O-N 3.08Å; V134-Q137 VanDerWaalsContact O-CB 3.29Å; V134-Q137 WeakPolarHBondContact O-CB 3.29Å; V134-Q137 WeakPolarHBondContact O-CG 3.33Å; V134-Q137 PolarHBondContact O-N 2.99Å; V134-F140 HydrophobicContact CG1-CB 4.44Å; V134-F140 HydrophobicContact CG1-CD2 3.88Å; V134-F140 HydrophobicContact CG1-CG 4.35Å; V134-F140 WeakPolarHBondContact O-CB 3.41Å
135L80.5Confident80.5Confident113 Ų11365 Ų6559%0.59233%0.33SS*.G310 helixtrans-58.6-24.4180-63.9169.9000113.7V133 F140V133-L135 VanDerWaalsContact C-N 3.27Å; V133-L135 HydrophobicContact CG1-CB 4.06Å; V133-L135 PolarHBondContact O-N 3.46Å; L135-F140 HydrophobicContact CD2-CD1 4.3Å; L135-F140 HydrophobicContact CD2-CE1 3.5Å; L135-F140 VanDerWaalsContact CD2-CE1 3.5Å; L135-F140 HydrophobicContact CD2-CE2 4.29Å; L135-F140 HydrophobicContact CD2-CZ 3.51Å
136S82Confident81Confident53 Ų5364.1 Ų64.137%0.37133%0.326SS..G310 helixtrans-96.4-0.6-179.9-57.80000112.8P131 V133 V134P131-S136 WeakPolarHBondContact CG-O 3.45Å; V133-S136 PolarHBondContact O-N 3.32Å; V134-S136 PolarHBondContact O-N 3.01Å; V134-S136 VanDerWaalsContact O-N 3.08Å
137Q88.8Confident82.3Confident18 Ų1854.4 Ų54.48%0.08429%0.289CS..SBendtrans-72.6135.4179.8-67.2-178.8-13.300110.6P131 V134 S139 F140 V141P131-Q137 HydrophobicContact CG-CB 4.47Å; P131-Q137 HydrophobicContact CG-CG 3.89Å; V134-Q137 VanDerWaalsContact O-CB 3.29Å; V134-Q137 WeakPolarHBondContact O-CB 3.29Å; V134-Q137 WeakPolarHBondContact O-CG 3.33Å; V134-Q137 PolarHBondContact O-N 2.99Å; Q137-S139 PolarHBondContact O-N 3.14Å; Q137-S139 VanDerWaalsContact O-N 3.14Å; Q137-F140 HydrophobicContact CB-CB 4.2Å; Q137-F140 PolarHBondContact O-N 3.14Å; Q137-V141 WeakPolarHBondContact O-CG2 3.41Å; Q137-V141 PolarHBondContact O-N 2.93Å
138P91.8Very high83.8Confident19 Ų1954.7 Ų54.712%0.12328%0.284CS..Hα-helixtrans-52.9-36.9177-2123.9000113.7I125 V127 L142 V394 L445I125-P138 HydrophobicContact CG2-CB 3.8Å; V127-P138 HydrophobicContact CG2-CG 4.26Å; P138-L142 WeakPolarHBondContact O-CB 3.1Å; P138-L142 PolarHBondContact O-N 3.42Å; P138-V394 HydrophobicContact CB-CB 4.41Å; P138-L445 HydrophobicContact CB-CD1 4.34Å; P138-L445 HydrophobicContact CB-CD2 4.41Å; P138-L445 HydrophobicContact CG-CD1 3.89Å
139S92.9Very high85.9Confident5 Ų545.5 Ų45.54%0.03524%0.241CC..Hα-helixtrans-67.2-41.9177.548.70000112.7C122 Q137 A143C122-S139 PolarHBondContact SG-O 3.21Å; Q137-S139 PolarHBondContact O-N 3.14Å; Q137-S139 VanDerWaalsContact O-N 3.14Å; S139-A143 WeakPolarHBondContact O-CB 3.36Å; S139-A143 PolarHBondContact O-N 2.88Å
140F93.9Very high87.9Confident25 Ų2536.4 Ų36.411%0.1120%0.202CC..Hα-helixtrans-63.8-47.9173.9-177-88.7000111W10 V134 L135 Q137 L142 A143 V144W10-F140 AromaticContact CD2-CD2 3.96Å; W10-F140 HydrophobicContact CD2-CD2 3.96Å; W10-F140 AromaticContact CE3-CD2 3.4Å; W10-F140 HydrophobicContact CE3-CD2 3.4Å; W10-F140 VanDerWaalsContact CE3-CD2 3.4Å; W10-F140 AromaticContact CE3-CE2 3.93Å; W10-F140 HydrophobicContact CE3-CE2 3.93Å; W10-F140 HydrophobicContact CE3-CG 4.44Å; W10-F140 HydrophobicContact CH2-CB 4.31Å; W10-F140 HydrophobicContact CH2-CD2 4.45Å; W10-F140 HydrophobicContact CZ3-CB 4.3Å; W10-F140 AromaticContact CZ3-CD2 3.69Å; W10-F140 HydrophobicContact CZ3-CD2 3.69Å; W10-F140 HydrophobicContact CZ3-CE2 4.43Å; W10-F140 HydrophobicContact CZ3-CG 4.37Å; V134-F140 HydrophobicContact CG1-CB 4.44Å; V134-F140 HydrophobicContact CG1-CD2 3.88Å; V134-F140 HydrophobicContact CG1-CG 4.35Å; V134-F140 WeakPolarHBondContact O-CB 3.41Å; L135-F140 HydrophobicContact CD2-CD1 4.3Å; L135-F140 HydrophobicContact CD2-CE1 3.5Å; L135-F140 VanDerWaalsContact CD2-CE1 3.5Å; L135-F140 HydrophobicContact CD2-CE2 4.29Å; L135-F140 HydrophobicContact CD2-CZ 3.51Å; Q137-F140 HydrophobicContact CB-CB 4.2Å; Q137-F140 PolarHBondContact O-N 3.14Å; F140-L142 VanDerWaalsContact C-N 3.34Å; F140-L142 PolarHBondContact O-N 3.46Å; F140-A143 WeakPolarHBondContact O-CB 3.17Å; F140-A143 PolarHBondContact O-N 3.39Å; F140-A143 VanDerWaalsContact O-N 3.14Å; F140-V144 HydrophobicContact CD1-CG2 4.17Å; F140-V144 HydrophobicContact CE1-CG2 3.66Å; F140-V144 HydrophobicContact CZ-CG2 3.9Å; F140-V144 PolarHBondContact O-N 3.05Å
141V96Very high89.7Confident2 Ų233.9 Ų33.91%0.01218%0.181CC..Hα-helixtrans-58.2-46.9177.91770000110.6Q137 A143 V144 L145 V394 A441 L442Q137-V141 WeakPolarHBondContact O-CG2 3.41Å; Q137-V141 PolarHBondContact O-N 2.93Å; V141-A143 VanDerWaalsContact C-N 3.34Å; V141-A143 PolarHBondContact O-N 2.98Å; V141-V144 PolarHBondContact O-N 2.94Å; V141-L145 HydrophobicContact CG1-CD1 3.99Å; V141-L145 HydrophobicContact CG1-CG 4.24Å; V141-L145 VanDerWaalsContact O-CG 3.28Å; V141-L145 WeakPolarHBondContact O-CG 3.4Å; V141-L145 PolarHBondContact O-N 2.96Å; V141-V394 HydrophobicContact CB-CG1 4.29Å; V141-V394 HydrophobicContact CG1-CG1 3.96Å; V141-A441 HydrophobicContact CG1-CB 3.85Å; V141-A441 HydrophobicContact CG2-CB 4.06Å; V141-L442 HydrophobicContact CG1-CD2 4.16Å
142L97.3Very high91.3Very high0 Ų032.1 Ų32.10%017%0.169CC..Hα-helixtrans-60.5-43.3176.5-178.562.9000112C121 I125 P138 F140 V144 L145 L146 S390 I391 V394C121-L142 HydrophobicContact CB-CD2 4.04Å; I125-L142 HydrophobicContact CD1-CB 3.69Å; I125-L142 HydrophobicContact CD1-CD2 3.48Å; I125-L142 VanDerWaalsContact CD1-CD2 3.48Å; I125-L142 HydrophobicContact CD1-CG 4.18Å; I125-L142 HydrophobicContact CG1-CD2 4.06Å; P138-L142 WeakPolarHBondContact O-CB 3.1Å; P138-L142 PolarHBondContact O-N 3.42Å; F140-L142 VanDerWaalsContact C-N 3.34Å; F140-L142 PolarHBondContact O-N 3.46Å; L142-V144 VanDerWaalsContact C-N 3.31Å; L142-V144 PolarHBondContact O-N 3.33Å; L142-L145 PolarHBondContact O-N 2.91Å; L142-L146 HydrophobicContact CD1-CD1 3.88Å; L142-L146 HydrophobicContact CD1-CG 3.97Å; L142-L146 HydrophobicContact CD2-CD1 4.28Å; L142-L146 HydrophobicContact CG-CD1 3.85Å; L142-L146 HydrophobicContact CG-CG 4.32Å; L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 WeakPolarHBondContact O-CG 3.33Å; L142-L146 PolarHBondContact O-N 2.91Å; L142-S390 VanDerWaalsContact CD1-C 3.5Å; L142-S390 WeakPolarHBondContact CD1-O 3.38Å; L142-S390 VanDerWaalsContact CD1-OG 3.27Å; L142-S390 WeakPolarHBondContact CD1-OG 3Å; L142-I391 HydrophobicContact CD1-CG1 4.26Å; L142-I391 HydrophobicContact CD2-CG1 4.25Å; L142-V394 HydrophobicContact CB-CG1 4.07Å; L142-V394 HydrophobicContact CB-CG2 4.23Å
143A97.1Very high92.9Very high0 Ų022.7 Ų22.70%013%0.125CC..Hα-helixtrans-59.3-42.6179.600000111.5W10 F11 L14 S139 F140 V141 L147W10-A143 HydrophobicContact CH2-CB 3.96Å; W10-A143 HydrophobicContact CZ3-CB 3.68Å; F11-A143 HydrophobicContact CD2-CB 3.97Å; F11-A143 HydrophobicContact CE2-CB 3.89Å; L14-A143 HydrophobicContact CD2-CB 3.79Å; S139-A143 WeakPolarHBondContact O-CB 3.36Å; S139-A143 PolarHBondContact O-N 2.88Å; F140-A143 WeakPolarHBondContact O-CB 3.17Å; F140-A143 PolarHBondContact O-N 3.39Å; F140-A143 VanDerWaalsContact O-N 3.14Å; V141-A143 VanDerWaalsContact C-N 3.34Å; V141-A143 PolarHBondContact O-N 2.98Å; A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.48Å; A143-L147 VanDerWaalsContact O-CG 3.26Å; A143-L147 WeakPolarHBondContact O-CG 3.4Å; A143-L147 PolarHBondContact O-N 3.27Å
144V97.2Very high93.7Very high13 Ų1318.8 Ų18.88%0.07910%0.101CC..Hα-helixtrans-69.2-44.5175.8-177.90000111.2L14 F140 V141 L142 L146 W148 Y437L14-V144 HydrophobicContact CD1-CG2 4.19Å; L14-V144 HydrophobicContact CD2-CG2 3.8Å; F140-V144 HydrophobicContact CD1-CG2 4.17Å; F140-V144 HydrophobicContact CE1-CG2 3.66Å; F140-V144 HydrophobicContact CZ-CG2 3.9Å; F140-V144 PolarHBondContact O-N 3.05Å; V141-V144 PolarHBondContact O-N 2.94Å; L142-V144 VanDerWaalsContact C-N 3.31Å; L142-V144 PolarHBondContact O-N 3.33Å; V144-L146 PolarHBondContact O-N 3.46Å; V144-L146 VanDerWaalsContact O-N 3.16Å; V144-W148 HydrophobicContact CG1-CB 3.97Å; V144-W148 HydrophobicContact CG1-CG 4.42Å; V144-W148 WeakPolarHBondContact O-CA 3.21Å; V144-W148 VanDerWaalsContact O-CB 3.25Å; V144-W148 WeakPolarHBondContact O-CB 3.48Å; V144-W148 PolarHBondContact O-N 3.08Å; V144-Y437 HydrophobicContact CB-CD1 4.32Å; V144-Y437 HydrophobicContact CB-CE1 3.47Å; V144-Y437 VanDerWaalsContact CB-CE1 3.47Å; V144-Y437 WeakPolarHBondContact CB-OH 3.29Å; V144-Y437 HydrophobicContact CG1-CD1 3.62Å; V144-Y437 HydrophobicContact CG1-CD2 4.42Å; V144-Y437 HydrophobicContact CG1-CE1 3.25Å; V144-Y437 HydrophobicContact CG1-CE2 4.1Å; V144-Y437 HydrophobicContact CG1-CG 4.2Å; V144-Y437 HydrophobicContact CG2-CE1 4.29Å; V144-Y437 WeakPolarHBondContact CG2-OH 3.41Å
145L98.1Very high94.5Very high0 Ų016.1 Ų16.10%09%0.085CC..Hα-helixtrans-59-29.7178.6-69.8-179.8000113.6V141 L142 N149 V394 F403 F434 Y437 S438 L442V141-L145 HydrophobicContact CG1-CD1 3.99Å; V141-L145 HydrophobicContact CG1-CG 4.24Å; V141-L145 VanDerWaalsContact O-CG 3.28Å; V141-L145 WeakPolarHBondContact O-CG 3.4Å; V141-L145 PolarHBondContact O-N 2.96Å; L142-L145 PolarHBondContact O-N 2.91Å; L145-N149 WeakPolarHBondContact O-CB 3.3Å; L145-N149 PolarHBondContact O-ND2 3.24Å; L145-V394 HydrophobicContact CD1-CG1 4.23Å; L145-F403 HydrophobicContact CD1-CE1 4.06Å; L145-F403 HydrophobicContact CD1-CZ 4.21Å; L145-F403 HydrophobicContact CD2-CE1 3.91Å; L145-F403 HydrophobicContact CD2-CZ 4.1Å; L145-F434 HydrophobicContact CD2-CE2 4.24Å; L145-F434 HydrophobicContact CD2-CZ 4.15Å; L145-Y437 HydrophobicContact CD2-CD1 4.39Å; L145-Y437 HydrophobicContact CD2-CE1 4.45Å; L145-S438 WeakPolarHBondContact CD2-OG 3.33Å; L145-L442 HydrophobicContact CD1-CD1 4.31Å; L145-L442 HydrophobicContact CD1-CD2 4.21Å; L145-L442 HydrophobicContact CD1-CG 4.39Å
146L98.3Very high95.3Very high1 Ų110.8 Ų10.81%0.0056%0.057CC..Hα-helixtrans-87.7-55.7176.5-69.9176.4000112.6F114 A118 C121 L142 V144 N149 L171 L387 S390F114-L146 HydrophobicContact CE1-CB 4.44Å; F114-L146 WeakPolarHBondContact CE1-O 3.29Å; F114-L146 HydrophobicContact CZ-CB 4.22Å; A118-L146 HydrophobicContact CB-CB 4.23Å; A118-L146 HydrophobicContact CB-CD1 3.95Å; C121-L146 HydrophobicContact CB-CD1 4.43Å; L142-L146 HydrophobicContact CD1-CD1 3.88Å; L142-L146 HydrophobicContact CD1-CG 3.97Å; L142-L146 HydrophobicContact CD2-CD1 4.28Å; L142-L146 HydrophobicContact CG-CD1 3.85Å; L142-L146 HydrophobicContact CG-CG 4.32Å; L142-L146 WeakPolarHBondContact O-CB 3.49Å; L142-L146 WeakPolarHBondContact O-CG 3.33Å; L142-L146 PolarHBondContact O-N 2.91Å; V144-L146 PolarHBondContact O-N 3.46Å; V144-L146 VanDerWaalsContact O-N 3.16Å; L146-N149 VanDerWaalsContact O-CB 3.27Å; L146-N149 WeakPolarHBondContact O-CB 3.37Å; L146-N149 PolarHBondContact O-N 2.97Å; L146-L171 HydrophobicContact CD1-CD1 4.29Å; L146-L171 HydrophobicContact CD2-CD1 3.87Å; L146-L387 HydrophobicContact CD2-CB 4.37Å; L146-L387 HydrophobicContact CD2-CD2 4.25Å; L146-S390 VanDerWaalsContact CD2-OG 3.23Å; L146-S390 WeakPolarHBondContact CD2-OG 3.41Å
147L97.4Very high95.9Very high5 Ų58.5 Ų8.53%0.0264%0.041CC..Hα-helixtrans-72.7-35.5-172.5-62.2-179.2000112.9F11 L14 A15 V18 F114 I115 A118 A143 N149F11-L147 HydrophobicContact CE2-CD1 4.22Å; F11-L147 HydrophobicContact CZ-CD1 4.11Å; L14-L147 HydrophobicContact CD2-CD1 4.1Å; L14-L147 HydrophobicContact CG-CD1 4.17Å; A15-L147 HydrophobicContact CB-CD1 4.29Å; V18-L147 HydrophobicContact CG1-CB 4.48Å; V18-L147 WeakPolarHBondContact CG1-O 3.49Å; V18-L147 HydrophobicContact CG2-CB 4.02Å; F114-L147 HydrophobicContact CD1-CD2 4.1Å; F114-L147 HydrophobicContact CE1-CD2 4.09Å; I115-L147 HydrophobicContact CB-CD2 4.41Å; I115-L147 HydrophobicContact CG1-CD2 3.9Å; A118-L147 HydrophobicContact CB-CD2 3.9Å; A118-L147 HydrophobicContact CB-CG 4.38Å; A143-L147 VanDerWaalsContact O-CB 3.25Å; A143-L147 WeakPolarHBondContact O-CB 3.48Å; A143-L147 VanDerWaalsContact O-CG 3.26Å; A143-L147 WeakPolarHBondContact O-CG 3.4Å; A143-L147 PolarHBondContact O-N 3.27Å; L147-N149 VanDerWaalsContact C-N 3.32Å
148W96.2Very high96.3Very high65 Ų657.7 Ų7.725%0.2464%0.037CC..THydrogen-bonded Turntrans-94.117.3175.6-97.887.7000112.2V18 F21 V144 F150 L153 L430 M433 F434V18-W148 HydrophobicContact CG2-CG 4.2Å; V18-W148 VanDerWaalsContact CG2-NE1 3.25Å; F21-W148 AromaticContact CD1-CH2 3.9Å; F21-W148 HydrophobicContact CD1-CH2 3.9Å; F21-W148 HydrophobicContact CD1-CZ2 4.15Å; F21-W148 HydrophobicContact CD1-CZ3 4.4Å; F21-W148 HydrophobicContact CD2-CH2 4.31Å; F21-W148 AromaticContact CE1-CH2 3.72Å; F21-W148 HydrophobicContact CE1-CH2 3.72Å; F21-W148 HydrophobicContact CE1-CZ2 4.43Å; F21-W148 AromaticContact CE1-CZ3 3.95Å; F21-W148 HydrophobicContact CE1-CZ3 3.95Å; F21-W148 HydrophobicContact CE2-CH2 4.16Å; F21-W148 HydrophobicContact CG-CH2 4.19Å; F21-W148 HydrophobicContact CG-CZ2 4.23Å; F21-W148 AromaticContact CZ-CH2 3.87Å; F21-W148 HydrophobicContact CZ-CH2 3.87Å; F21-W148 HydrophobicContact CZ-CZ3 4.26Å; V144-W148 HydrophobicContact CG1-CB 3.97Å; V144-W148 HydrophobicContact CG1-CG 4.42Å; V144-W148 WeakPolarHBondContact O-CA 3.21Å; V144-W148 VanDerWaalsContact O-CB 3.25Å; V144-W148 WeakPolarHBondContact O-CB 3.48Å; V144-W148 PolarHBondContact O-N 3.08Å; W148-F150 PolarHBondContact O-N 3.05Å; W148-L153 HydrophobicContact CE3-CD1 4.34Å; W148-L430 HydrophobicContact CZ3-CD2 4.39Å; W148-M433 HydrophobicContact CZ3-CE 4.18Å; W148-F434 VanDerWaalsContact O-CD2 3.23Å; W148-F434 WeakPolarHBondContact O-CD2 3.42Å
149N97.8Very high96.4Very high1 Ų17.4 Ų7.41%0.0053%0.034CC..  trans-58.9116.6-177.5-167.1-89.1000110.9L145 L146 L147 G151 L152 L153 L387 H411L145-N149 WeakPolarHBondContact O-CB 3.3Å; L145-N149 PolarHBondContact O-ND2 3.24Å; L146-N149 VanDerWaalsContact O-CB 3.27Å; L146-N149 WeakPolarHBondContact O-CB 3.37Å; L146-N149 PolarHBondContact O-N 2.97Å; L147-N149 VanDerWaalsContact C-N 3.32Å; N149-G151 VanDerWaalsContact C-N 3.31Å; N149-G151 PolarHBondContact O-N 3.29Å; N149-G151 PolarHBondContact OD1-N 3.42Å; N149-L152 HydrophobicContact CB-CB 4.3Å; N149-L152 HydrophobicContact CB-CD1 4.29Å; N149-L152 HydrophobicContact CB-CG 4.44Å; N149-L152 PolarHBondContact O-N 3.19Å; N149-L152 PolarHBondContact OD1-N 3.5Å; N149-L153 WeakPolarHBondContact O-CG 3.48Å; N149-L153 PolarHBondContact O-N 2.99Å; N149-L387 HydrophobicContact CB-CD2 4.01Å; N149-H411 PolarHBondContact OD1-NE2 2.71Å
150F97.4Very high96.6Very high1 Ų17.2 Ų7.20%0.0043%0.032CC..Hα-helixtrans-50.5-51-178.6165.5-94.9000112.2W148 L152 L153 I154 H411 F415 K427 L430 M431 F434W148-F150 PolarHBondContact O-N 3.05Å; F150-L152 PolarHBondContact O-N 2.9Å; F150-L153 WeakPolarHBondContact O-CB 3.43Å; F150-L153 PolarHBondContact O-N 2.82Å; F150-L153 VanDerWaalsContact O-N 3.13Å; F150-I154 HydrophobicContact CD1-CD1 4.31Å; F150-I154 HydrophobicContact CD1-CG1 4.49Å; F150-I154 HydrophobicContact CD2-CG2 4.06Å; F150-I154 HydrophobicContact CE1-CD1 3.5Å; F150-I154 HydrophobicContact CE1-CG1 4.1Å; F150-I154 HydrophobicContact CE1-CG2 4.47Å; F150-I154 HydrophobicContact CE2-CD1 4.44Å; F150-I154 HydrophobicContact CE2-CG2 3.55Å; F150-I154 HydrophobicContact CZ-CD1 3.59Å; F150-I154 HydrophobicContact CZ-CG1 4.18Å; F150-I154 HydrophobicContact CZ-CG2 3.81Å; F150-I154 WeakPolarHBondContact O-CG1 3.43Å; F150-I154 PolarHBondContact O-N 3.06Å; F150-H411 HydrophobicContact CD1-CB 3.43Å; F150-H411 VanDerWaalsContact CD1-CB 3.43Å; F150-H411 AromaticContact CD1-CD2 3.89Å; F150-H411 AromaticContact CD1-CG 3.56Å; F150-H411 HydrophobicContact CE1-CB 3.84Å; F150-H411 WeakPolarHBondContact CE1-O 3.39Å; F150-H411 HydrophobicContact CG-CB 4.45Å; F150-F415 HydrophobicContact CE1-CD1 4.38Å; F150-F415 HydrophobicContact CE1-CE1 4.01Å; F150-F415 HydrophobicContact CE2-CE1 4.44Å; F150-F415 HydrophobicContact CZ-CD1 4.07Å; F150-F415 AromaticContact CZ-CE1 3.54Å; F150-F415 HydrophobicContact CZ-CE1 3.54Å; F150-F415 HydrophobicContact CZ-CZ 4.47Å; F150-K427 HydrophobicContact CE2-CB 4.49Å; F150-K427 WeakPolarHBondContact CE2-O 3.44Å; F150-L430 HydrophobicContact CD2-CB 3.62Å; F150-L430 HydrophobicContact CE2-CB 3.89Å; F150-M431 HydrophobicContact CD1-SD 3.88Å; F150-M431 HydrophobicContact CD2-CB 3.93Å; F150-M431 VanDerWaalsContact CD2-N 3.32Å; F150-M431 HydrophobicContact CE1-SD 4.03Å; F150-M431 HydrophobicContact CE2-CB 3.7Å; F150-M431 HydrophobicContact CG-CB 4.43Å; F150-M431 HydrophobicContact CG-SD 4.1Å; F150-M431 HydrophobicContact CZ-CB 3.99Å; F150-M431 HydrophobicContact CZ-SD 4.43Å; F150-F434 HydrophobicContact CB-CB 3.89Å; F150-F434 HydrophobicContact CB-CD1 4.16Å; F150-F434 HydrophobicContact CB-CD2 4.49Å; F150-F434 HydrophobicContact CB-CG 3.91Å
151G96.6Very high96.6Very high0 Ų06.6 Ų6.60%03%0.03CC..Hα-helixtrans-62.4-40.4-175.100000113.4N149 I154 V155 H411N149-G151 VanDerWaalsContact C-N 3.31Å; N149-G151 PolarHBondContact O-N 3.29Å; N149-G151 PolarHBondContact OD1-N 3.42Å; G151-I154 WeakPolarHBondContact O-CG1 3.49Å; G151-V155 VanDerWaalsContact O-CB 3.29Å; G151-V155 WeakPolarHBondContact O-CB 3.39Å; G151-V155 WeakPolarHBondContact O-CG2 3.2Å; G151-V155 PolarHBondContact O-N 3.11Å; G151-V155 VanDerWaalsContact O-N 3.08Å; G151-H411 PolarHBondContact N-NE2 3.44Å
152L96.2Very high96.7Very high10 Ų106.8 Ų6.85%0.0523%0.03CC..Hα-helixtrans-65.8-43.1173.3-76.7176.6000111.8F114 N149 F150 I154 V155 D156 N163 F167 L383 L387F114-L152 HydrophobicContact CD2-CD1 4.49Å; F114-L152 HydrophobicContact CE1-CD1 3.86Å; F114-L152 HydrophobicContact CE2-CD1 3.69Å; F114-L152 HydrophobicContact CZ-CD1 3.33Å; N149-L152 HydrophobicContact CB-CB 4.3Å; N149-L152 HydrophobicContact CB-CD1 4.29Å; N149-L152 HydrophobicContact CB-CG 4.44Å; N149-L152 PolarHBondContact O-N 3.19Å; N149-L152 PolarHBondContact OD1-N 3.5Å; F150-L152 PolarHBondContact O-N 2.9Å; L152-I154 PolarHBondContact O-N 2.82Å; L152-V155 PolarHBondContact O-N 3.15Å; L152-D156 WeakPolarHBondContact O-CB 3.47Å; L152-D156 PolarHBondContact O-N 2.92Å; L152-N163 HydrophobicContact CD2-CB 4.21Å; L152-F167 HydrophobicContact CD2-CD2 3.7Å; L152-F167 HydrophobicContact CD2-CE2 4.1Å; L152-L383 HydrophobicContact CD2-CD1 4.08Å; L152-L383 HydrophobicContact CG-CD1 4.47Å; L152-L387 HydrophobicContact CD1-CD1 3.73Å; L152-L387 HydrophobicContact CD1-CD2 3.6Å; L152-L387 HydrophobicContact CD1-CG 4.32Å; L152-L387 HydrophobicContact CD2-CD1 4.05Å; L152-L387 HydrophobicContact CG-CD1 4Å; L152-L387 HydrophobicContact CG-CD2 4.09Å
153L96.5Very high96.7Very high4 Ų47.3 Ų7.32%0.0213%0.033CC..Hα-helixtrans-57.9-48.3-179.5-73.7171.9000111.8K22 W148 N149 F150 H157K22-L153 HydrophobicContact CD-CD2 4.41Å; K22-L153 HydrophobicContact CG-CD2 3.78Å; W148-L153 HydrophobicContact CE3-CD1 4.34Å; N149-L153 WeakPolarHBondContact O-CG 3.48Å; N149-L153 PolarHBondContact O-N 2.99Å; F150-L153 WeakPolarHBondContact O-CB 3.43Å; F150-L153 PolarHBondContact O-N 2.82Å; F150-L153 VanDerWaalsContact O-N 3.13Å; L153-H157 WeakPolarHBondContact O-CB 3.46Å; L153-H157 PolarHBondContact O-N 2.93Å; L153-H157 VanDerWaalsContact O-N 3.11Å
154I96.3Very high96.7Very high2 Ų27.3 Ų7.31%0.013%0.033CC..Hα-helixtrans-72.9-36.2-178.863.3157.9000112.9F150 G151 L152 I158 H159 L414 L418 L430F150-I154 HydrophobicContact CD1-CD1 4.31Å; F150-I154 HydrophobicContact CD1-CG1 4.49Å; F150-I154 HydrophobicContact CD2-CG2 4.06Å; F150-I154 HydrophobicContact CE1-CD1 3.5Å; F150-I154 HydrophobicContact CE1-CG1 4.1Å; F150-I154 HydrophobicContact CE1-CG2 4.47Å; F150-I154 HydrophobicContact CE2-CD1 4.44Å; F150-I154 HydrophobicContact CE2-CG2 3.55Å; F150-I154 HydrophobicContact CZ-CD1 3.59Å; F150-I154 HydrophobicContact CZ-CG1 4.18Å; F150-I154 HydrophobicContact CZ-CG2 3.81Å; F150-I154 WeakPolarHBondContact O-CG1 3.43Å; F150-I154 PolarHBondContact O-N 3.06Å; G151-I154 WeakPolarHBondContact O-CG1 3.49Å; L152-I154 PolarHBondContact O-N 2.82Å; I154-I158 HydrophobicContact CG2-CD1 4.28Å; I154-I158 WeakPolarHBondContact O-CB 3.49Å; I154-I158 PolarHBondContact O-N 3.3Å; I154-H159 WeakPolarHBondContact O-CB 3.29Å; I154-H159 PolarHBondContact O-N 3.36Å; I154-L414 HydrophobicContact CD1-CB 3.61Å; I154-L414 HydrophobicContact CD1-CD1 4.19Å; I154-L418 HydrophobicContact CB-CD1 3.88Å; I154-L418 HydrophobicContact CG2-CD1 4.08Å; I154-L430 HydrophobicContact CG2-CD1 4.25Å
155V96.3Very high96.7Very high1 Ų17.9 Ų7.91%0.0064%0.035CC..Hα-helixtrans-76.8-39-175.5175.80000111.1G151 L152 H159 F160 Q161 N163 K380 L383 L414 L417G151-V155 VanDerWaalsContact O-CB 3.29Å; G151-V155 WeakPolarHBondContact O-CB 3.39Å; G151-V155 WeakPolarHBondContact O-CG2 3.2Å; G151-V155 PolarHBondContact O-N 3.11Å; G151-V155 VanDerWaalsContact O-N 3.08Å; L152-V155 PolarHBondContact O-N 3.15Å; V155-H159 WeakPolarHBondContact O-CB 3.49Å; V155-F160 PolarHBondContact O-N 3.31Å; V155-F160 VanDerWaalsContact O-N 3.1Å; V155-Q161 HydrophobicContact CG1-CB 4.22Å; V155-Q161 HydrophobicContact CG1-CG 4.21Å; V155-Q161 PolarHBondContact O-N 2.9Å; V155-N163 WeakPolarHBondContact CG1-ND2 3.44Å; V155-K380 HydrophobicContact CG1-CD 3.86Å; V155-K380 HydrophobicContact CG1-CG 4.25Å; V155-K380 HydrophobicContact CG2-CG 4.21Å; V155-L383 HydrophobicContact CG2-CD1 4.37Å; V155-L414 HydrophobicContact CG2-CD1 4.14Å; V155-L417 HydrophobicContact CG2-CD1 4.25Å
156D96.8Very high96.7Very high1 Ų17.9 Ų7.91%0.0054%0.035CC..Hα-helixtrans-91.3-44.8-174.8-67.9-9.5000112.5V107 L152 F160 Q161 N163 G164V107-D156 HydrophobicContact CG1-CB 4.02Å; L152-D156 WeakPolarHBondContact O-CB 3.47Å; L152-D156 PolarHBondContact O-N 2.92Å; D156-F160 VanDerWaalsContact O-CA 3.32Å; D156-F160 WeakPolarHBondContact O-CA 3.31Å; D156-Q161 WeakPolarHBondContact CA-O 3.33Å; D156-Q161 VanDerWaalsContact CB-O 3.26Å; D156-Q161 WeakPolarHBondContact CB-O 3.47Å; D156-Q161 PolarHBondContact O-N 3.39Å; D156-Q161 VanDerWaalsContact OD1-O 3.13Å; D156-N163 VanDerWaalsContact OD1-CB 3.23Å; D156-N163 WeakPolarHBondContact OD1-CB 3.29Å; D156-N163 PolarHBondContact OD1-N 3.05Å; D156-N163 VanDerWaalsContact OD1-N 3.08Å; D156-N163 PolarHBondContact OD1-ND2 3.22Å; D156-N163 PolarHBondContact OD2-N 3.14Å; D156-G164 WeakPolarHBondContact OD2-CA 3.43Å; D156-G164 PolarHBondContact OD2-N 2.97Å
157H95.8Very high96.7Very high6 Ų68.3 Ų8.33%0.0284%0.037CC..Hα-helixtrans-98.7-11.2-170.9-55.3-69.4000114.8K22 F25 R104 D111 L153K22-H157 WeakPolarHBondContact CD-NE2 3.47Å; K22-H157 WeakPolarHBondContact CE-NE2 3.26Å; K22-H157 PolarHBondContact NZ-NE2 3.13Å; K22-H157 VanDerWaalsContact NZ-NE2 3.16Å; F25-H157 HydrophobicContact CB-CB 4.42Å; F25-H157 WeakPolarHBondContact CB-O 3.29Å; F25-H157 HydrophobicContact CD2-CB 4.23Å; R104-H157 VanDerWaalsContact CZ-O 3.31Å; R104-H157 VanDerWaalsContact NH1-C 3.33Å; R104-H157 PolarHBondContact NH1-O 2.91Å; D111-H157 IonicContact OD2-CE1 3.03Å; D111-H157 PolarHBondContact OD2-CE1 3.45Å; D111-H157 IonicContact OD2-NE2 3.07Å; D111-H157 PolarHBondContact OD2-NE2 3.46Å; L153-H157 WeakPolarHBondContact O-CB 3.46Å; L153-H157 PolarHBondContact O-N 2.93Å; L153-H157 VanDerWaalsContact O-N 3.11Å
158I95.6Very high96.8Very high0 Ų08.1 Ų8.10%04%0.036CC..THydrogen-bonded Turntrans-109.6-72.1169.5-52.2179.1000107.6F25 A28 Y29 R104 I154 F160 L418 E423 I426F25-I158 HydrophobicContact CB-CG1 4.24Å; F25-I158 HydrophobicContact CD1-CD1 4.23Å; F25-I158 HydrophobicContact CD1-CG1 4.25Å; F25-I158 HydrophobicContact CE1-CD1 4.46Å; F25-I158 HydrophobicContact CG-CG1 4.13Å; A28-I158 HydrophobicContact CB-CG2 4.19Å; Y29-I158 HydrophobicContact CD1-CG2 4.27Å; Y29-I158 CarbonylContact O-C 3.24Å; Y29-I158 VanDerWaalsContact O-C 3.24Å; Y29-I158 WeakPolarHBondContact O-CG2 3.21Å; R104-I158 PolarHBondContact NH1-O 3.4Å; R104-I158 PolarHBondContact NH2-O 3.25Å; I154-I158 HydrophobicContact CG2-CD1 4.28Å; I154-I158 WeakPolarHBondContact O-CB 3.49Å; I154-I158 PolarHBondContact O-N 3.3Å; I158-F160 PolarHBondContact O-N 3.25Å; I158-L418 HydrophobicContact CB-CD1 4.25Å; I158-L418 HydrophobicContact CB-CD2 4.22Å; I158-L418 HydrophobicContact CD1-CD1 4.09Å; I158-L418 HydrophobicContact CG2-CD1 3.95Å; I158-L418 HydrophobicContact CG2-CD2 3.58Å; I158-L418 HydrophobicContact CG2-CG 4.44Å; I158-E423 HydrophobicContact CG2-CG 4.03Å; I158-I426 HydrophobicContact CD1-CG2 4.1Å
159H94.8Very high96.9Very high14 Ų146.5 Ų6.57%0.0653%0.03CC..THydrogen-bonded Turntrans-58.2-24.1-176.9-17385.8000115S31 D33 I154 V155 K380 L418S31-H159 WeakPolarHBondContact CB-CE1 3.22Å; S31-H159 WeakPolarHBondContact CB-ND1 3.47Å; S31-H159 VanDerWaalsContact CB-O 3.25Å; S31-H159 WeakPolarHBondContact CB-O 3.48Å; S31-H159 PolarHBondContact N-O 3.45Å; S31-H159 PolarHBondContact OG-CD2 3.31Å; S31-H159 PolarHBondContact OG-CE1 2.91Å; S31-H159 PolarHBondContact OG-NE2 3.31Å; S31-H159 PolarHBondContact OG-O 3.48Å; D33-H159 IonicContact OD2-CD2 3.55Å; D33-H159 IonicContact OD2-NE2 3.45Å; D33-H159 PolarHBondContact OD2-NE2 2.98Å; I154-H159 WeakPolarHBondContact O-CB 3.29Å; I154-H159 PolarHBondContact O-N 3.36Å; V155-H159 WeakPolarHBondContact O-CB 3.49Å; H159-K380 PolarHBondContact NE2-NZ 3.31Å; H159-L418 HydrophobicContact CB-CD2 4.24Å
160F96.3Very high96.9Very high0 Ų06.4 Ų6.40%03%0.03CC..THydrogen-bonded Turntrans80.293.2177.3-164.7-88000114.8H30 D33 F34 H37 Q103 V107 V155 D156 I158 Y162H30-F160 HydrophobicContact CB-CB 4.28Å; D33-F160 VanDerWaalsContact CB-O 3.28Å; D33-F160 WeakPolarHBondContact CB-O 3.49Å; F34-F160 VanDerWaalsContact CA-CD1 3.47Å; F34-F160 HydrophobicContact CB-CB 4.28Å; F34-F160 HydrophobicContact CB-CD1 4.06Å; F34-F160 HydrophobicContact CB-CG 4.13Å; F34-F160 HydrophobicContact CD2-CB 4.47Å; F34-F160 HydrophobicContact CD2-CD1 4.19Å; F34-F160 AromaticContact CD2-CD2 3.74Å; F34-F160 HydrophobicContact CD2-CD2 3.74Å; F34-F160 HydrophobicContact CD2-CE1 4.45Å; F34-F160 HydrophobicContact CD2-CE2 4.04Å; F34-F160 AromaticContact CD2-CG 3.84Å; F34-F160 HydrophobicContact CD2-CG 3.84Å; F34-F160 HydrophobicContact CD2-CZ 4.39Å; F34-F160 HydrophobicContact CE2-CD2 4.38Å; F34-F160 HydrophobicContact CE2-CE2 4.35Å; F34-F160 HydrophobicContact CG-CG 4.46Å; H37-F160 HydrophobicContact CB-CE1 3.72Å; H37-F160 AromaticContact CD2-CE1 3.77Å; H37-F160 AromaticContact CG-CE1 3.95Å; Q103-F160 HydrophobicContact CB-CE2 3.61Å; Q103-F160 HydrophobicContact CB-CZ 3.59Å; Q103-F160 HydrophobicContact CG-CZ 4.17Å; Q103-F160 WeakPolarHBondContact O-CE2 3.2Å; Q103-F160 VanDerWaalsContact OE1-CZ 3.26Å; V107-F160 HydrophobicContact CG2-CD2 4.4Å; V107-F160 HydrophobicContact CG2-CE2 3.75Å; V107-F160 HydrophobicContact CG2-CZ 3.91Å; V155-F160 PolarHBondContact O-N 3.31Å; V155-F160 VanDerWaalsContact O-N 3.1Å; D156-F160 VanDerWaalsContact O-CA 3.32Å; D156-F160 WeakPolarHBondContact O-CA 3.31Å; I158-F160 PolarHBondContact O-N 3.25Å; F160-Y162 HydrophobicContact CE1-CE2 4.21Å; F160-Y162 HydrophobicContact CZ-CE2 4.25Å
161Q95.6Very high97Very high13 Ų136.4 Ų6.46%0.0613%0.03CC..  trans-153.9160.9173.4-67.7-162.2-36.800111.3D33 V107 V155 D156 N163D33-Q161 HydrophobicContact CB-CG 4.36Å; D33-Q161 PolarHBondContact OD2-NE2 3.23Å; V107-Q161 WeakPolarHBondContact CG1-O 3.46Å; V155-Q161 HydrophobicContact CG1-CB 4.22Å; V155-Q161 HydrophobicContact CG1-CG 4.21Å; V155-Q161 PolarHBondContact O-N 2.9Å; D156-Q161 WeakPolarHBondContact CA-O 3.33Å; D156-Q161 VanDerWaalsContact CB-O 3.26Å; D156-Q161 WeakPolarHBondContact CB-O 3.47Å; D156-Q161 PolarHBondContact O-N 3.39Å; D156-Q161 VanDerWaalsContact OD1-O 3.13Å; Q161-N163 WeakPolarHBondContact CB-ND2 3.5Å; Q161-N163 PolarHBondContact OE1-ND2 3.08Å
162Y97.3Very high97.1Very high5 Ų56.9 Ų6.92%0.023%0.032CC..  trans-96.740.1175.2-67.1-92.8000112.7H37 F68 L75 S106 V107 T110 F160 L166H37-Y162 HydrophobicContact CB-CE2 4.38Å; H37-Y162 AromaticContact CE1-CD2 3.54Å; H37-Y162 AromaticContact CE1-CE2 3.93Å; H37-Y162 AromaticContact CG-CE2 3.84Å; H37-Y162 AromaticContact ND1-CD2 3.75Å; H37-Y162 AromaticContact ND1-CE2 3.64Å; H37-Y162 AromaticContact NE2-CD2 3.78Å; F68-Y162 HydrophobicContact CZ-CD2 4.18Å; F68-Y162 HydrophobicContact CZ-CG 4.33Å; L75-Y162 HydrophobicContact CD1-CE1 3.99Å; S106-Y162 PolarHBondContact OG-OH 3Å; V107-Y162 HydrophobicContact CB-CE1 4.47Å; V107-Y162 HydrophobicContact CG2-CD1 4.01Å; V107-Y162 HydrophobicContact CG2-CD2 4.49Å; V107-Y162 HydrophobicContact CG2-CE1 3.75Å; V107-Y162 HydrophobicContact CG2-CE2 4.28Å; V107-Y162 HydrophobicContact CG2-CG 4.38Å; T110-Y162 HydrophobicContact CG2-CD1 4.44Å; T110-Y162 HydrophobicContact CG2-CE1 4.42Å; T110-Y162 WeakPolarHBondContact OG1-CD1 3.2Å; F160-Y162 HydrophobicContact CE1-CE2 4.21Å; F160-Y162 HydrophobicContact CZ-CE2 4.25Å; Y162-L166 WeakPolarHBondContact O-CG 3.47Å; Y162-L166 PolarHBondContact O-N 3Å
163N96.9Very high97.2Very high11 Ų116.4 Ų6.46%0.0593%0.03CC..Hα-helixtrans-73.9-34.2-176.2-58.4-68.3000113.1L152 V155 D156 Q161 F165 L166 F167 K196L152-N163 HydrophobicContact CD2-CB 4.21Å; V155-N163 WeakPolarHBondContact CG1-ND2 3.44Å; D156-N163 VanDerWaalsContact OD1-CB 3.23Å; D156-N163 WeakPolarHBondContact OD1-CB 3.29Å; D156-N163 PolarHBondContact OD1-N 3.05Å; D156-N163 VanDerWaalsContact OD1-N 3.08Å; D156-N163 PolarHBondContact OD1-ND2 3.22Å; D156-N163 PolarHBondContact OD2-N 3.14Å; Q161-N163 WeakPolarHBondContact CB-ND2 3.5Å; Q161-N163 PolarHBondContact OE1-ND2 3.08Å; N163-F165 VanDerWaalsContact C-N 3.33Å; N163-F165 PolarHBondContact O-N 2.99Å; N163-L166 CarbonylContact O-C 3.59Å; N163-L166 PolarHBondContact O-N 2.92Å; N163-L166 VanDerWaalsContact O-N 3.08Å; N163-F167 HydrophobicContact CB-CD2 3.77Å; N163-F167 HydrophobicContact CB-CE2 3.75Å; N163-F167 WeakPolarHBondContact O-CB 3.36Å; N163-F167 WeakPolarHBondContact O-CD2 3.3Å; N163-F167 PolarHBondContact O-N 2.88Å; N163-K196 PolarHBondContact OD1-NZ 3.18Å
164G97.1Very high97.2Very high1 Ų16.2 Ų6.21%0.013%0.029CC..Hα-helixtrans-56.3-48.8177.800000110.6D111 F114 D156 L166 F167 G168D111-G164 WeakPolarHBondContact OD1-CA 3.33Å; F114-G164 WeakPolarHBondContact CB-O 3.41Å; F114-G164 WeakPolarHBondContact CD2-O 3.37Å; D156-G164 WeakPolarHBondContact OD2-CA 3.43Å; D156-G164 PolarHBondContact OD2-N 2.97Å; G164-L166 PolarHBondContact O-N 3.38Å; G164-F167 PolarHBondContact O-N 3.13Å; G164-G168 PolarHBondContact O-N 2.83Å
165F98Very high97.3Very high24 Ų246.1 Ų6.111%0.1053%0.028CC..Hα-helixtrans-50.8-51.1170.2172.9-108.5000113.2L71 L113 N163 G168 F169 L195L71-F165 HydrophobicContact CD1-CZ 4.34Å; L71-F165 HydrophobicContact CD2-CD1 3.99Å; L71-F165 HydrophobicContact CD2-CE1 3.47Å; L71-F165 VanDerWaalsContact CD2-CE1 3.47Å; L71-F165 HydrophobicContact CD2-CZ 3.86Å; L113-F165 HydrophobicContact CB-CD2 4.43Å; L113-F165 HydrophobicContact CD2-CD2 3.88Å; L113-F165 HydrophobicContact CD2-CE2 3.89Å; N163-F165 VanDerWaalsContact C-N 3.33Å; N163-F165 PolarHBondContact O-N 2.99Å; F165-G168 WeakPolarHBondContact O-CA 3.42Å; F165-G168 PolarHBondContact O-N 3.26Å; F165-F169 HydrophobicContact CD2-CE2 4.39Å; F165-F169 HydrophobicContact CE1-CD2 4.44Å; F165-F169 HydrophobicContact CE1-CE2 4.1Å; F165-F169 HydrophobicContact CE2-CD2 4.33Å; F165-F169 AromaticContact CE2-CE2 3.64Å; F165-F169 HydrophobicContact CE2-CE2 3.64Å; F165-F169 HydrophobicContact CZ-CD2 4.21Å; F165-F169 AromaticContact CZ-CE2 3.49Å; F165-F169 HydrophobicContact CZ-CE2 3.49Å; F165-F169 VanDerWaalsContact CZ-CE2 3.49Å; F165-F169 HydrophobicContact CZ-CZ 4.47Å; F165-F169 PolarHBondContact O-N 3.44Å; F165-L195 HydrophobicContact CE1-CD1 3.87Å; F165-L195 HydrophobicContact CE1-CD2 4.16Å; F165-L195 HydrophobicContact CZ-CD1 4.16Å
166L98.3Very high97.3Very high1 Ų17 Ų71%0.0053%0.032CC..Hα-helixtrans-67.6-43.8-178.3-64170.2000112.8F68 Y162 N163 G164 G168 F169 L170 L192 L195 K196 F199F68-L166 HydrophobicContact CD2-CD2 4.27Å; F68-L166 HydrophobicContact CE2-CD2 4.25Å; Y162-L166 WeakPolarHBondContact O-CG 3.47Å; Y162-L166 PolarHBondContact O-N 3Å; N163-L166 CarbonylContact O-C 3.59Å; N163-L166 PolarHBondContact O-N 2.92Å; N163-L166 VanDerWaalsContact O-N 3.08Å; G164-L166 PolarHBondContact O-N 3.38Å; L166-G168 PolarHBondContact O-N 3.13Å; L166-F169 WeakPolarHBondContact O-CB 3.3Å; L166-F169 PolarHBondContact O-N 3.31Å; L166-L170 PolarHBondContact O-N 2.64Å; L166-L170 VanDerWaalsContact O-N 3.13Å; L166-L192 HydrophobicContact CB-CD1 4.18Å; L166-L192 HydrophobicContact CD2-CD1 4.15Å; L166-L192 VanDerWaalsContact O-CD1 3.29Å; L166-L192 WeakPolarHBondContact O-CD1 3.45Å; L166-L195 HydrophobicContact CD2-CB 3.58Å; L166-L195 HydrophobicContact CD2-CD1 4.31Å; L166-K196 HydrophobicContact CD1-CB 4.02Å; L166-K196 HydrophobicContact CD1-CD 3.37Å; L166-K196 HydrophobicContact CD1-CG 4.34Å; L166-K196 HydrophobicContact CD2-CB 4.19Å; L166-F199 HydrophobicContact CB-CE2 3.87Å; L166-F199 HydrophobicContact CB-CZ 3.9Å; L166-F199 HydrophobicContact CD1-CE2 4.46Å
167F98.4Very high97.2Very high10 Ų107 Ų74%0.0443%0.032CC..Hα-helixtrans-68-24.5173.7-72.7-58.2000111.8F114 L152 N163 G164 L170 L171 F199 L383 L384 L387F114-F167 HydrophobicContact CD2-CB 4.19Å; F114-F167 HydrophobicContact CE2-CB 4.1Å; L152-F167 HydrophobicContact CD2-CD2 3.7Å; L152-F167 HydrophobicContact CD2-CE2 4.1Å; N163-F167 HydrophobicContact CB-CD2 3.77Å; N163-F167 HydrophobicContact CB-CE2 3.75Å; N163-F167 WeakPolarHBondContact O-CB 3.36Å; N163-F167 WeakPolarHBondContact O-CD2 3.3Å; N163-F167 PolarHBondContact O-N 2.88Å; G164-F167 PolarHBondContact O-N 3.13Å; F167-L170 HydrophobicContact CD1-CD2 3.97Å; F167-L170 HydrophobicContact CE1-CD2 4.37Å; F167-L170 PolarHBondContact O-N 3.28Å; F167-L171 VanDerWaalsContact O-CB 3.31Å; F167-L171 WeakPolarHBondContact O-CB 3.23Å; F167-L171 WeakPolarHBondContact O-CG 3.49Å; F167-L171 PolarHBondContact O-N 3.29Å; F167-F199 AromaticContact CD1-CE1 3.95Å; F167-F199 HydrophobicContact CD1-CE1 3.95Å; F167-F199 HydrophobicContact CD1-CZ 4.14Å; F167-F199 AromaticContact CE1-CE1 3.83Å; F167-F199 HydrophobicContact CE1-CE1 3.83Å; F167-F199 HydrophobicContact CE1-CZ 4.09Å; F167-L383 HydrophobicContact CE2-CB 3.75Å; F167-L383 HydrophobicContact CE2-CD1 4.37Å; F167-L383 HydrophobicContact CZ-CB 3.67Å; F167-L384 HydrophobicContact CE1-CB 4.25Å; F167-L384 HydrophobicContact CE1-CD1 4.01Å; F167-L387 HydrophobicContact CB-CD1 3.85Å; F167-L387 HydrophobicContact CD1-CD1 3.82Å; F167-L387 HydrophobicContact CD2-CD1 3.51Å; F167-L387 HydrophobicContact CE1-CD1 4.23Å; F167-L387 HydrophobicContact CE2-CD1 3.91Å; F167-L387 HydrophobicContact CG-CD1 3.44Å; F167-L387 VanDerWaalsContact CG-CD1 3.44Å; F167-L387 HydrophobicContact CZ-CD1 4.26Å
168G98.3Very high97Very high0 Ų08 Ų80%04%0.037CC..Hα-helixtrans-60-47.8169.700000111.1A117 G164 F165 L166 L170 L172A117-G168 WeakPolarHBondContact CB-O 3.19Å; G164-G168 PolarHBondContact O-N 2.83Å; F165-G168 WeakPolarHBondContact O-CA 3.42Å; F165-G168 PolarHBondContact O-N 3.26Å; L166-G168 PolarHBondContact O-N 3.13Å; G168-L170 PolarHBondContact O-N 3.47Å; G168-L172 WeakPolarHBondContact O-CB 3.44Å; G168-L172 PolarHBondContact O-N 3.25Å
169F98.6Very high96.9Very high31 Ų3110.5 Ų10.514%0.1365%0.049CC..Hα-helixtrans-59.9-44.5171.2-86.3-79.7000112.5L113 F165 L166 S173 L188 V191 L192 L195L113-F169 HydrophobicContact CD2-CD1 4.48Å; L113-F169 HydrophobicContact CD2-CD2 3.28Å; L113-F169 HydrophobicContact CD2-CE1 4.44Å; L113-F169 HydrophobicContact CD2-CE2 3.22Å; L113-F169 HydrophobicContact CD2-CG 3.94Å; L113-F169 HydrophobicContact CD2-CZ 3.85Å; F165-F169 HydrophobicContact CD2-CE2 4.39Å; F165-F169 HydrophobicContact CE1-CD2 4.44Å; F165-F169 HydrophobicContact CE1-CE2 4.1Å; F165-F169 HydrophobicContact CE2-CD2 4.33Å; F165-F169 AromaticContact CE2-CE2 3.64Å; F165-F169 HydrophobicContact CE2-CE2 3.64Å; F165-F169 HydrophobicContact CZ-CD2 4.21Å; F165-F169 AromaticContact CZ-CE2 3.49Å; F165-F169 HydrophobicContact CZ-CE2 3.49Å; F165-F169 VanDerWaalsContact CZ-CE2 3.49Å; F165-F169 HydrophobicContact CZ-CZ 4.47Å; F165-F169 PolarHBondContact O-N 3.44Å; L166-F169 WeakPolarHBondContact O-CB 3.3Å; L166-F169 PolarHBondContact O-N 3.31Å; F169-S173 WeakPolarHBondContact O-CB 3.41Å; F169-S173 PolarHBondContact O-N 3.03Å; F169-L188 HydrophobicContact CD1-CB 4.49Å; F169-L188 HydrophobicContact CD1-CD2 3.84Å; F169-L188 HydrophobicContact CE1-CD2 3.92Å; F169-V191 HydrophobicContact CD1-CG1 4.16Å; F169-V191 HydrophobicContact CE1-CB 4.26Å; F169-V191 HydrophobicContact CE1-CG1 3.61Å; F169-V191 HydrophobicContact CZ-CG1 3.91Å; F169-L192 HydrophobicContact CB-CB 4.08Å; F169-L192 HydrophobicContact CB-CD1 3.91Å; F169-L192 HydrophobicContact CB-CD2 4.36Å; F169-L192 HydrophobicContact CB-CG 4.34Å; F169-L195 HydrophobicContact CD2-CD1 3.51Å; F169-L195 HydrophobicContact CE2-CD1 3.44Å; F169-L195 VanDerWaalsContact CE2-CD1 3.44Å; F169-L195 HydrophobicContact CG-CD1 4.15Å; F169-L195 HydrophobicContact CZ-CD1 4.02Å
170L98.6Very high96.8Very high0 Ų013.6 Ų13.60%07%0.072CC..Hα-helixtrans-60.9-52.7179.9-179.166.9000111.5L166 F167 G168 S173 V174 F189 L192 F199 V202 Y206 L384 P388L166-L170 PolarHBondContact O-N 2.64Å; L166-L170 VanDerWaalsContact O-N 3.13Å; F167-L170 HydrophobicContact CD1-CD2 3.97Å; F167-L170 HydrophobicContact CE1-CD2 4.37Å; F167-L170 PolarHBondContact O-N 3.28Å; G168-L170 PolarHBondContact O-N 3.47Å; L170-S173 WeakPolarHBondContact O-CB 3.49Å; L170-S173 PolarHBondContact O-N 3.37Å; L170-V174 WeakPolarHBondContact O-CB 3.45Å; L170-V174 WeakPolarHBondContact O-CG2 3.39Å; L170-V174 PolarHBondContact O-N 3.34Å; L170-F189 HydrophobicContact CD1-CD2 4.49Å; L170-F189 HydrophobicContact CD1-CE2 4.45Å; L170-L192 HydrophobicContact CB-CD2 3.65Å; L170-L192 HydrophobicContact CD1-CD2 3.99Å; L170-L192 HydrophobicContact CG-CD2 4.42Å; L170-F199 HydrophobicContact CB-CE1 4.2Å; L170-F199 HydrophobicContact CD1-CD1 4.31Å; L170-F199 HydrophobicContact CD2-CD1 4.29Å; L170-F199 HydrophobicContact CD2-CE1 3.97Å; L170-F199 HydrophobicContact CG-CE1 4.49Å; L170-V202 HydrophobicContact CD1-CG2 4.32Å; L170-Y206 HydrophobicContact CD1-CE2 4.42Å; L170-L384 HydrophobicContact CD2-CD1 3.66Å; L170-P388 HydrophobicContact CD2-CG 4.1Å
171L98.4Very high96.7Very high0 Ų019.9 Ų19.90%010%0.096CC..Hα-helixtrans-67.2-37.9-177.1-72.1-175.6000111.3F114 A117 L146 F167 V174 A175 P388 I391F114-L171 HydrophobicContact CD2-CD1 4.3Å; F114-L171 HydrophobicContact CE2-CD1 3.55Å; F114-L171 HydrophobicContact CZ-CD1 4.15Å; A117-L171 HydrophobicContact CB-CB 3.92Å; L146-L171 HydrophobicContact CD1-CD1 4.29Å; L146-L171 HydrophobicContact CD2-CD1 3.87Å; F167-L171 VanDerWaalsContact O-CB 3.31Å; F167-L171 WeakPolarHBondContact O-CB 3.23Å; F167-L171 WeakPolarHBondContact O-CG 3.49Å; F167-L171 PolarHBondContact O-N 3.29Å; L171-V174 WeakPolarHBondContact O-CB 3.27Å; L171-V174 PolarHBondContact O-N 3.34Å; L171-A175 WeakPolarHBondContact O-CB 3.48Å; L171-A175 PolarHBondContact O-N 3.34Å; L171-P388 HydrophobicContact CD2-CG 4.33Å; L171-I391 HydrophobicContact CD2-CD1 4.18Å
172L98.5Very high96.6Very high10 Ų1020.4 Ų20.45%0.05210%0.098CC..Hα-helixtrans-66.3-42.5175.5-173.162.7000111L113 Y116 A117 E120 G168 V174 A175 R176 L188L113-L172 HydrophobicContact CD1-CD2 4.18Å; Y116-L172 HydrophobicContact CD1-CD1 3.89Å; Y116-L172 HydrophobicContact CD1-CD2 4.02Å; Y116-L172 HydrophobicContact CE1-CD1 3.56Å; Y116-L172 HydrophobicContact CE1-CD2 3.91Å; Y116-L172 HydrophobicContact CE1-CG 4.41Å; A117-L172 HydrophobicContact CB-CB 3.86Å; E120-L172 HydrophobicContact CB-CD1 4.06Å; E120-L172 HydrophobicContact CG-CD1 3.94Å; G168-L172 WeakPolarHBondContact O-CB 3.44Å; G168-L172 PolarHBondContact O-N 3.25Å; L172-V174 VanDerWaalsContact C-N 3.35Å; L172-V174 PolarHBondContact O-N 3.25Å; L172-A175 PolarHBondContact O-N 3.33Å; L172-R176 WeakPolarHBondContact O-CG 3.46Å; L172-R176 PolarHBondContact O-N 2.79Å; L172-L188 HydrophobicContact CB-CD1 4.19Å; L172-L188 HydrophobicContact CD2-CD1 3.81Å; L172-L188 HydrophobicContact CD2-CD2 4.08Å; L172-L188 HydrophobicContact CG-CD1 3.63Å
173S98.3Very high96.6Very high0 Ų023.3 Ų23.30%011%0.114CC..Hα-helixtrans-56.7-49.2173.2168.80000111.5F169 L170 A175 R176 H177 G185 Y206F169-S173 WeakPolarHBondContact O-CB 3.41Å; F169-S173 PolarHBondContact O-N 3.03Å; L170-S173 WeakPolarHBondContact O-CB 3.49Å; L170-S173 PolarHBondContact O-N 3.37Å; S173-A175 PolarHBondContact O-N 3.38Å; S173-R176 PolarHBondContact O-N 3.17Å; S173-H177 PolarHBondContact O-CD2 2.99Å; S173-H177 VanDerWaalsContact O-CD2 3.29Å; S173-H177 PolarHBondContact O-N 3.24Å; S173-G185 PolarHBondContact OG-O 2.87Å; S173-Y206 VanDerWaalsContact OG-CE1 3.25Å; S173-Y206 WeakPolarHBondContact OG-CE1 3.47Å; S173-Y206 PolarHBondContact OG-OH 3.16Å
174V97.7Very high96.7Very high0 Ų027.1 Ų27.10%013%0.131CC..Hα-helixtrans-55.5-52173.8163.20000110.6L170 L171 L172 R176 H177 L178 F359 L360 L363 I391L170-V174 WeakPolarHBondContact O-CB 3.45Å; L170-V174 WeakPolarHBondContact O-CG2 3.39Å; L170-V174 PolarHBondContact O-N 3.34Å; L171-V174 WeakPolarHBondContact O-CB 3.27Å; L171-V174 PolarHBondContact O-N 3.34Å; L172-V174 VanDerWaalsContact C-N 3.35Å; L172-V174 PolarHBondContact O-N 3.25Å; V174-R176 VanDerWaalsContact C-N 3.31Å; V174-R176 PolarHBondContact O-N 3.28Å; V174-H177 WeakPolarHBondContact O-CA 3.5Å; V174-H177 WeakPolarHBondContact O-CB 3.39Å; V174-H177 PolarHBondContact O-N 3.34Å; V174-L178 HydrophobicContact CG1-CD1 4.17Å; V174-L178 HydrophobicContact CG1-CG 4.29Å; V174-L178 WeakPolarHBondContact O-CG 3.44Å; V174-L178 PolarHBondContact O-N 3.37Å; V174-F359 HydrophobicContact CG2-CE1 4.26Å; V174-L360 HydrophobicContact CG1-CD2 3.39Å; V174-L360 HydrophobicContact CG1-CG 4.32Å; V174-L360 HydrophobicContact CG2-CD2 4.28Å; V174-L363 HydrophobicContact CG2-CD1 3.85Å; V174-I391 HydrophobicContact CG1-CD1 4.03Å
175A97Very high96.7Very high0 Ų027 Ų270%013%0.13CC..Hα-helixtrans-57.8-41.8179.800000112E120 L171 L172 S173 H177 L178 Q179E120-A175 HydrophobicContact CB-CB 3.97Å; L171-A175 WeakPolarHBondContact O-CB 3.48Å; L171-A175 PolarHBondContact O-N 3.34Å; L172-A175 PolarHBondContact O-N 3.33Å; S173-A175 PolarHBondContact O-N 3.38Å; A175-H177 VanDerWaalsContact C-N 3.32Å; A175-H177 PolarHBondContact O-N 3.04Å; A175-L178 WeakPolarHBondContact O-CB 3.25Å; A175-L178 PolarHBondContact O-N 3.42Å; A175-L178 VanDerWaalsContact O-N 3.15Å; A175-Q179 WeakPolarHBondContact O-CB 3.28Å; A175-Q179 VanDerWaalsContact O-CG 3.23Å; A175-Q179 WeakPolarHBondContact O-CG 3.37Å; A175-Q179 PolarHBondContact O-N 3.25Å
176R96.8Very high96.7Very high21 Ų2126.3 Ų26.38%0.07913%0.129CC..Hα-helixtrans-62.1-38.3175.1-67.1-53.7178.9-145.6-7112.4Y116 E120 L172 S173 V174 Q179 S180 R181 Q184 L188Y116-R176 PolarHBondContact OH-NH2 2.89Å; E120-R176 IonicContact OE2-CZ 3.46Å; E120-R176 IonicContact OE2-NH1 3.68Å; E120-R176 PolarHBondContact OE2-NH1 3.24Å; E120-R176 IonicContact OE2-NH2 3.24Å; L172-R176 WeakPolarHBondContact O-CG 3.46Å; L172-R176 PolarHBondContact O-N 2.79Å; S173-R176 PolarHBondContact O-N 3.17Å; V174-R176 VanDerWaalsContact C-N 3.31Å; V174-R176 PolarHBondContact O-N 3.28Å; R176-Q179 CarbonylContact O-C 3.57Å; R176-Q179 PolarHBondContact O-N 3.47Å; R176-S180 PolarHBondContact O-N 3.39Å; R176-R181 HydrophobicContact CB-CB 4.33Å; R176-R181 CarbonylContact O-C 3.55Å; R176-R181 WeakPolarHBondContact O-CA 3.41Å; R176-R181 PolarHBondContact O-N 2.94Å; R176-Q184 HydrophobicContact CB-CB 4.32Å; R176-Q184 HydrophobicContact CG-CB 4.09Å; R176-L188 HydrophobicContact CG-CD1 3.9Å
177H94.8Very high96.7Very high0 Ų030.1 Ų30.10%015%0.149CC..Hα-helixtrans-66.3-40.7172-69.7-44.1000112.8S173 V174 A175 Q179 S180 H182 Y206 F209 F359S173-H177 PolarHBondContact O-CD2 2.99Å; S173-H177 VanDerWaalsContact O-CD2 3.29Å; S173-H177 PolarHBondContact O-N 3.24Å; V174-H177 WeakPolarHBondContact O-CA 3.5Å; V174-H177 WeakPolarHBondContact O-CB 3.39Å; V174-H177 PolarHBondContact O-N 3.34Å; A175-H177 VanDerWaalsContact C-N 3.32Å; A175-H177 PolarHBondContact O-N 3.04Å; H177-Q179 PolarHBondContact O-N 3.03Å; H177-S180 PolarHBondContact O-N 3.23Å; H177-H182 PolarHBondContact CE1-O 3.14Å; H177-H182 VanDerWaalsContact CE1-O 3.24Å; H177-H182 AromaticContact ND1-ND1 3.42Å; H177-H182 PolarHBondContact ND1-ND1 2.9Å; H177-Y206 AromaticContact CD2-CE1 3.47Å; H177-Y206 VanDerWaalsContact CD2-CE1 3.47Å; H177-Y206 WeakPolarHBondContact CD2-CE1 3.33Å; H177-Y206 AromaticContact NE2-CD1 3.53Å; H177-Y206 AromaticContact NE2-CE1 3.28Å; H177-Y206 VanDerWaalsContact NE2-CE1 3.28Å; H177-Y206 WeakPolarHBondContact NE2-CE1 3.26Å; H177-F209 HydrophobicContact CB-CE1 3.99Å; H177-F209 AromaticContact CG-CE1 3.95Å; H177-F359 HydrophobicContact CB-CD1 4.38Å; H177-F359 HydrophobicContact CB-CE1 4.04Å; H177-F359 AromaticContact CD2-CE1 3.99Å; H177-F359 AromaticContact CD2-CZ 3.88Å
178L92.6Very high96.7Very high27 Ų2731.1 Ų31.114%0.14115%0.154CC..Hα-helixtrans-61.7-32.9174.6-59-178.9000112C124 V174 A175 S180 N356 L360 I391C124-L178 HydrophobicContact CB-CB 4.04Å; C124-L178 HydrophobicContact CB-CD1 3.78Å; V174-L178 HydrophobicContact CG1-CD1 4.17Å; V174-L178 HydrophobicContact CG1-CG 4.29Å; V174-L178 WeakPolarHBondContact O-CG 3.44Å; V174-L178 PolarHBondContact O-N 3.37Å; A175-L178 WeakPolarHBondContact O-CB 3.25Å; A175-L178 PolarHBondContact O-N 3.42Å; A175-L178 VanDerWaalsContact O-N 3.15Å; L178-S180 VanDerWaalsContact C-N 3.26Å; L178-S180 PolarHBondContact O-N 3.43Å; L178-N356 HydrophobicContact CD2-CB 3.61Å; L178-N356 PolarHBondContact O-ND2 3.13Å; L178-L360 HydrophobicContact CD1-CD1 4.23Å; L178-L360 HydrophobicContact CD2-CD1 3.93Å; L178-L360 HydrophobicContact CD2-CG 4.19Å; L178-I391 HydrophobicContact CD1-CG2 4.35Å
179Q92.9Very high96.7Very high53 Ų5331.7 Ų31.725%0.24816%0.157CC..THydrogen-bonded Turntrans-82.97.3175.5-65.3168.6-2.900113.7E120 A175 R176 H177 R181E120-Q179 PolarHBondContact OE2-NE2 3.49Å; A175-Q179 WeakPolarHBondContact O-CB 3.28Å; A175-Q179 VanDerWaalsContact O-CG 3.23Å; A175-Q179 WeakPolarHBondContact O-CG 3.37Å; A175-Q179 PolarHBondContact O-N 3.25Å; R176-Q179 CarbonylContact O-C 3.57Å; R176-Q179 PolarHBondContact O-N 3.47Å; H177-Q179 PolarHBondContact O-N 3.03Å; Q179-R181 HydrophobicContact CB-CG 4.38Å; Q179-R181 PolarHBondContact O-N 3.46Å
180S92.1Very high96.7Very high79 Ų7930.4 Ų30.455%0.55215%0.152SC*.THydrogen-bonded Turntrans6215.2-175.8-47.60000115.3R176 H177 L178 H182R176-S180 PolarHBondContact O-N 3.39Å; H177-S180 PolarHBondContact O-N 3.23Å; L178-S180 VanDerWaalsContact C-N 3.26Å; L178-S180 PolarHBondContact O-N 3.43Å; S180-H182 VanDerWaalsContact C-N 3.3Å; S180-H182 PolarHBondContact O-CD2 3.22Å; S180-H182 PolarHBondContact O-N 3.42Å
181R94.5Very high96.7Very high131 Ų13132 Ų3249%0.49416%0.161SC..  trans-89.862.9174.9-62.1-176.6-177.1-175.6-0.4110.4R176 Q179 L183 Q184 G185R176-R181 HydrophobicContact CB-CB 4.33Å; R176-R181 CarbonylContact O-C 3.55Å; R176-R181 WeakPolarHBondContact O-CA 3.41Å; R176-R181 PolarHBondContact O-N 2.94Å; Q179-R181 HydrophobicContact CB-CG 4.38Å; Q179-R181 PolarHBondContact O-N 3.46Å; R181-L183 PolarHBondContact O-N 3.26Å; R181-Q184 HydrophobicContact CB-CB 4.41Å; R181-Q184 PolarHBondContact O-N 3.06Å; R181-G185 PolarHBondContact O-N 2.93Å; R181-G185 VanDerWaalsContact O-N 3.15Å
182H94.4Very high96.7Very high25 Ų2532 Ų3212%0.11616%0.161CC..Hα-helixtrans-62.1-36.8-167.6-60.8-70.1000114.9H177 S180 G185 A186 F209 L210 Y214H177-H182 PolarHBondContact CE1-O 3.14Å; H177-H182 VanDerWaalsContact CE1-O 3.24Å; H177-H182 AromaticContact ND1-ND1 3.42Å; H177-H182 PolarHBondContact ND1-ND1 2.9Å; S180-H182 VanDerWaalsContact C-N 3.3Å; S180-H182 PolarHBondContact O-CD2 3.22Å; S180-H182 PolarHBondContact O-N 3.42Å; H182-G185 PolarHBondContact O-N 3.13Å; H182-A186 WeakPolarHBondContact O-CB 3.44Å; H182-A186 PolarHBondContact O-N 3.08Å; H182-F209 AromaticContact CE1-CZ 3.77Å; H182-F209 AromaticContact ND1-CE1 3.83Å; H182-L210 HydrophobicContact CB-CD2 3.9Å; H182-Y214 HydrophobicContact CB-CD2 3.77Å; H182-Y214 HydrophobicContact CB-CE2 4.32Å; H182-Y214 HydrophobicContact CB-CG 4.19Å; H182-Y214 AromaticContact CD2-CD2 3.9Å
183L96.9Very high96.6Very high66 Ų6633 Ų3335%0.34617%0.167SC..Hα-helixtrans-65.1-40.9178.2-64.5-179.4000112.2R181 A186 L187 Y214 A237 L238 I241R181-L183 PolarHBondContact O-N 3.26Å; L183-A186 PolarHBondContact O-N 3.02Å; L183-L187 WeakPolarHBondContact O-CB 3.4Å; L183-L187 PolarHBondContact O-N 2.86Å; L183-Y214 HydrophobicContact CD2-CE1 3.73Å; L183-Y214 WeakPolarHBondContact CD2-OH 3.17Å; L183-Y214 HydrophobicContact CG-CE1 4.49Å; L183-Y214 HydrophobicContact CG-CE2 4.47Å; L183-Y214 WeakPolarHBondContact CG-OH 3.48Å; L183-A237 HydrophobicContact CD2-CB 4.28Å; L183-L238 HydrophobicContact CD2-CD2 3.89Å; L183-L238 HydrophobicContact CD2-CG 4.47Å; L183-I241 HydrophobicContact CB-CD1 4.09Å; L183-I241 HydrophobicContact CD2-CD1 3.88Å
184Q97.6Very high96.6Very high90 Ų9033 Ų3342%0.42117%0.167SC..Hα-helixtrans-65.5-42.2176.1-67.2179.6-300111.1R176 R181 L187 L188R176-Q184 HydrophobicContact CB-CB 4.32Å; R176-Q184 HydrophobicContact CG-CB 4.09Å; R181-Q184 HydrophobicContact CB-CB 4.41Å; R181-Q184 PolarHBondContact O-N 3.06Å; Q184-L187 PolarHBondContact O-N 3.43Å; Q184-L188 VanDerWaalsContact O-CG 3.29Å; Q184-L188 WeakPolarHBondContact O-CG 3.49Å; Q184-L188 PolarHBondContact O-N 3.43Å
185G97.4Very high96.6Very high0 Ų033.4 Ų33.40%017%0.169CC..Hα-helixtrans-61-45.3174.300000112.2S173 R181 H182 L187 L188 F189S173-G185 PolarHBondContact OG-O 2.87Å; R181-G185 PolarHBondContact O-N 2.93Å; R181-G185 VanDerWaalsContact O-N 3.15Å; H182-G185 PolarHBondContact O-N 3.13Å; G185-L187 PolarHBondContact O-N 2.75Å; G185-L188 PolarHBondContact O-N 3.31Å; G185-F189 WeakPolarHBondContact O-CB 3.17Å; G185-F189 PolarHBondContact O-N 3.43Å
186A97.9Very high96.6Very high9 Ų934.4 Ų34.47%0.07417%0.173CC..Hα-helixtrans-61.9-41.2177.600000112.5H182 L183 F189 A190 L210 L238H182-A186 WeakPolarHBondContact O-CB 3.44Å; H182-A186 PolarHBondContact O-N 3.08Å; L183-A186 PolarHBondContact O-N 3.02Å; A186-F189 PolarHBondContact O-N 3.38Å; A186-A190 WeakPolarHBondContact O-CB 3.31Å; A186-A190 PolarHBondContact O-N 3.2Å; A186-L210 HydrophobicContact CB-CD1 4.02Å; A186-L238 HydrophobicContact CB-CD2 3.66Å
187L98.6Very high96.4Very high81 Ų8136 Ų3642%0.42418%0.182SC..Hα-helixtrans-61.3-49.5175.2177.165.1000111.6L183 Q184 G185 F189 A190 V191 I241 V245L183-L187 WeakPolarHBondContact O-CB 3.4Å; L183-L187 PolarHBondContact O-N 2.86Å; Q184-L187 PolarHBondContact O-N 3.43Å; G185-L187 PolarHBondContact O-N 2.75Å; L187-F189 VanDerWaalsContact C-N 3.33Å; L187-F189 PolarHBondContact O-N 3.39Å; L187-A190 PolarHBondContact O-N 2.74Å; L187-V191 WeakPolarHBondContact O-CG2 3.48Å; L187-V191 PolarHBondContact O-N 3.19Å; L187-I241 HydrophobicContact CB-CG2 3.92Å; L187-I241 HydrophobicContact CD1-CG2 3.93Å; L187-V245 HydrophobicContact CD1-CG2 3.65Å
188L98.6Very high96.3Very high30 Ų3037.7 Ų37.716%0.15719%0.19CC..Hα-helixtrans-61.5-40.8179.2-70.9167.3000112F169 L172 R176 Q184 G185 V191 L192F169-L188 HydrophobicContact CD1-CB 4.49Å; F169-L188 HydrophobicContact CD1-CD2 3.84Å; F169-L188 HydrophobicContact CE1-CD2 3.92Å; L172-L188 HydrophobicContact CB-CD1 4.19Å; L172-L188 HydrophobicContact CD2-CD1 3.81Å; L172-L188 HydrophobicContact CD2-CD2 4.08Å; L172-L188 HydrophobicContact CG-CD1 3.63Å; R176-L188 HydrophobicContact CG-CD1 3.9Å; Q184-L188 VanDerWaalsContact O-CG 3.29Å; Q184-L188 WeakPolarHBondContact O-CG 3.49Å; Q184-L188 PolarHBondContact O-N 3.43Å; G185-L188 PolarHBondContact O-N 3.31Å; L188-V191 PolarHBondContact O-N 3.47Å; L188-L192 WeakPolarHBondContact O-CB 3.36Å; L188-L192 PolarHBondContact O-N 2.95Å
189F98.4Very high96.5Very high13 Ų1336.6 Ų36.66%0.05718%0.184CC..Hα-helixtrans-69-38.5176.5-172.6-112.5000112.7L170 G185 A186 L187 V191 L192 L193 F199 V202 A203 Y206L170-F189 HydrophobicContact CD1-CD2 4.49Å; L170-F189 HydrophobicContact CD1-CE2 4.45Å; G185-F189 WeakPolarHBondContact O-CB 3.17Å; G185-F189 PolarHBondContact O-N 3.43Å; A186-F189 PolarHBondContact O-N 3.38Å; L187-F189 VanDerWaalsContact C-N 3.33Å; L187-F189 PolarHBondContact O-N 3.39Å; F189-V191 VanDerWaalsContact C-N 3.33Å; F189-V191 PolarHBondContact O-N 3.45Å; F189-L192 HydrophobicContact CD2-CD2 4.2Å; F189-L192 HydrophobicContact CE2-CD2 4.46Å; F189-L192 WeakPolarHBondContact O-CB 3.32Å; F189-L192 PolarHBondContact O-N 3.36Å; F189-L193 HydrophobicContact CD1-CD1 4.16Å; F189-L193 HydrophobicContact CD1-CG 4.44Å; F189-L193 HydrophobicContact CE1-CD1 3.72Å; F189-L193 HydrophobicContact CE1-CD2 4.31Å; F189-L193 HydrophobicContact CE1-CG 4.03Å; F189-L193 HydrophobicContact CZ-CD1 4.23Å; F189-L193 HydrophobicContact CZ-CD2 3.97Å; F189-L193 HydrophobicContact CZ-CG 4.08Å; F189-L193 WeakPolarHBondContact O-CG 3.45Å; F189-L193 PolarHBondContact O-N 3.26Å; F189-F199 HydrophobicContact CE2-CB 4.32Å; F189-V202 HydrophobicContact CE2-CG2 3.71Å; F189-V202 HydrophobicContact CZ-CG2 3.91Å; F189-A203 HydrophobicContact CE1-CB 3.89Å; F189-A203 HydrophobicContact CZ-CB 3.96Å; F189-Y206 HydrophobicContact CB-CD1 4.09Å; F189-Y206 HydrophobicContact CB-CE1 3.75Å; F189-Y206 AromaticContact CD1-CD1 3.8Å; F189-Y206 HydrophobicContact CD1-CD1 3.8Å; F189-Y206 AromaticContact CD1-CD2 4Å; F189-Y206 HydrophobicContact CD1-CD2 4Å; F189-Y206 HydrophobicContact CD1-CE1 4.16Å; F189-Y206 HydrophobicContact CD1-CE2 4.35Å; F189-Y206 AromaticContact CD1-CG 3.7Å; F189-Y206 HydrophobicContact CD1-CG 3.7Å; F189-Y206 HydrophobicContact CD2-CD1 4.36Å; F189-Y206 AromaticContact CD2-CD2 4Å; F189-Y206 HydrophobicContact CD2-CD2 4Å; F189-Y206 AromaticContact CD2-CE1 3.96Å; F189-Y206 HydrophobicContact CD2-CE1 3.96Å; F189-Y206 AromaticContact CD2-CE2 3.56Å; F189-Y206 HydrophobicContact CD2-CE2 3.56Å; F189-Y206 HydrophobicContact CD2-CG 4.37Å; F189-Y206 AromaticContact CD2-CZ 3.53Å; F189-Y206 HydrophobicContact CE1-CD1 4.36Å; F189-Y206 AromaticContact CE1-CD2 3.76Å; F189-Y206 HydrophobicContact CE1-CD2 3.76Å; F189-Y206 HydrophobicContact CE1-CE2 4.32Å; F189-Y206 AromaticContact CE1-CG 3.78Å; F189-Y206 HydrophobicContact CE1-CG 3.78Å; F189-Y206 AromaticContact CE2-CD2 3.79Å; F189-Y206 HydrophobicContact CE2-CD2 3.79Å; F189-Y206 AromaticContact CE2-CE2 3.53Å; F189-Y206 HydrophobicContact CE2-CE2 3.53Å; F189-Y206 HydrophobicContact CE2-CG 4.46Å; F189-Y206 AromaticContact CG-CD1 3.81Å; F189-Y206 HydrophobicContact CG-CD1 3.81Å; F189-Y206 HydrophobicContact CG-CD2 4.11Å; F189-Y206 AromaticContact CG-CE1 3.67Å; F189-Y206 HydrophobicContact CG-CE1 3.67Å; F189-Y206 AromaticContact CG-CE2 4Å; F189-Y206 HydrophobicContact CG-CE2 4Å; F189-Y206 HydrophobicContact CG-CG 4.02Å; F189-Y206 AromaticContact CG-CZ 3.77Å; F189-Y206 AromaticContact CZ-CD2 3.67Å; F189-Y206 HydrophobicContact CZ-CD2 3.67Å; F189-Y206 AromaticContact CZ-CE2 3.94Å; F189-Y206 HydrophobicContact CZ-CE2 3.94Å; F189-Y206 HydrophobicContact CZ-CG 4.18Å
190A98.4Very high96.6Very high4 Ų438.5 Ų38.53%0.03320%0.196CC..Hα-helixtrans-62.8-40.8174.400000111.6A186 L187 L193 N194 I241 V245A186-A190 WeakPolarHBondContact O-CB 3.31Å; A186-A190 PolarHBondContact O-N 3.2Å; L187-A190 PolarHBondContact O-N 2.74Å; A190-L193 PolarHBondContact O-N 3.42Å; A190-N194 PolarHBondContact O-N 2.74Å; A190-N194 PolarHBondContact O-ND2 3.38Å; A190-I241 HydrophobicContact CB-CG2 4.48Å; A190-V245 HydrophobicContact CB-CB 4.16Å; A190-V245 HydrophobicContact CB-CG1 4.25Å; A190-V245 HydrophobicContact CB-CG2 4.13Å
191V98.6Very high96.8Very high32 Ų3237.8 Ų37.819%0.19418%0.181CC..Hα-helixtrans-61.5-46.1172.4170.40000110.4L67 F169 L187 L188 F189 L193 N194 L195 V245L67-V191 HydrophobicContact CD1-CG1 4.1Å; F169-V191 HydrophobicContact CD1-CG1 4.16Å; F169-V191 HydrophobicContact CE1-CB 4.26Å; F169-V191 HydrophobicContact CE1-CG1 3.61Å; F169-V191 HydrophobicContact CZ-CG1 3.91Å; L187-V191 WeakPolarHBondContact O-CG2 3.48Å; L187-V191 PolarHBondContact O-N 3.19Å; L188-V191 PolarHBondContact O-N 3.47Å; F189-V191 VanDerWaalsContact C-N 3.33Å; F189-V191 PolarHBondContact O-N 3.45Å; V191-L193 PolarHBondContact O-N 3.03Å; V191-N194 CarbonylContact O-C 3.4Å; V191-N194 WeakPolarHBondContact O-CA 3.3Å; V191-N194 WeakPolarHBondContact O-CB 3.29Å; V191-N194 PolarHBondContact O-N 3.36Å; V191-L195 HydrophobicContact CG1-CD1 3.9Å; V191-L195 HydrophobicContact CG1-CG 4.27Å; V191-L195 WeakPolarHBondContact O-CG 3.45Å; V191-L195 PolarHBondContact O-N 2.77Å; V191-V245 HydrophobicContact CG2-CG1 4.07Å; V191-V245 HydrophobicContact CG2-CG2 4.27Å
192L98.5Very high96.9Very high0 Ų031.6 Ų31.60%016%0.158CC..Hα-helixtrans-57.6-43.5178.2-178.657.4000113.5L166 F169 L170 L188 F189 N194 L195 K196 F199L166-L192 HydrophobicContact CB-CD1 4.18Å; L166-L192 HydrophobicContact CD2-CD1 4.15Å; L166-L192 VanDerWaalsContact O-CD1 3.29Å; L166-L192 WeakPolarHBondContact O-CD1 3.45Å; F169-L192 HydrophobicContact CB-CB 4.08Å; F169-L192 HydrophobicContact CB-CD1 3.91Å; F169-L192 HydrophobicContact CB-CD2 4.36Å; F169-L192 HydrophobicContact CB-CG 4.34Å; L170-L192 HydrophobicContact CB-CD2 3.65Å; L170-L192 HydrophobicContact CD1-CD2 3.99Å; L170-L192 HydrophobicContact CG-CD2 4.42Å; L188-L192 WeakPolarHBondContact O-CB 3.36Å; L188-L192 PolarHBondContact O-N 2.95Å; F189-L192 HydrophobicContact CD2-CD2 4.2Å; F189-L192 HydrophobicContact CE2-CD2 4.46Å; F189-L192 WeakPolarHBondContact O-CB 3.32Å; F189-L192 PolarHBondContact O-N 3.36Å; L192-N194 PolarHBondContact O-N 3.46Å; L192-L195 WeakPolarHBondContact O-CB 3.44Å; L192-L195 PolarHBondContact O-N 3.17Å; L192-K196 PolarHBondContact O-N 3.2Å; L192-F199 HydrophobicContact CD1-CD2 3.44Å; L192-F199 VanDerWaalsContact CD1-CD2 3.44Å; L192-F199 HydrophobicContact CD1-CE1 4.42Å; L192-F199 HydrophobicContact CD1-CE2 3.37Å; L192-F199 HydrophobicContact CD1-CG 4.05Å; L192-F199 HydrophobicContact CD1-CZ 3.89Å; L192-F199 HydrophobicContact CD2-CB 4.1Å; L192-F199 HydrophobicContact CD2-CD1 3.61Å; L192-F199 HydrophobicContact CD2-CD2 3.92Å; L192-F199 HydrophobicContact CD2-CE1 3.95Å; L192-F199 HydrophobicContact CD2-CE2 4.26Å; L192-F199 HydrophobicContact CD2-CG 3.59Å; L192-F199 HydrophobicContact CD2-CZ 4.27Å; L192-F199 HydrophobicContact CG-CB 4.05Å; L192-F199 HydrophobicContact CG-CD1 4.14Å; L192-F199 HydrophobicContact CG-CD2 3.48Å; L192-F199 VanDerWaalsContact CG-CD2 3.48Å; L192-F199 HydrophobicContact CG-CE1 4.5Å; L192-F199 HydrophobicContact CG-CE2 3.93Å; L192-F199 HydrophobicContact CG-CG 3.62Å; L192-F199 HydrophobicContact CG-CZ 4.41Å
193L97.3Very high97Very high32 Ų3231.4 Ų31.417%0.16816%0.161CC..Hα-helixtrans-60-31.3175.8-72.4175.6000112.4F189 A190 V191 F199 L200F189-L193 HydrophobicContact CD1-CD1 4.16Å; F189-L193 HydrophobicContact CD1-CG 4.44Å; F189-L193 HydrophobicContact CE1-CD1 3.72Å; F189-L193 HydrophobicContact CE1-CD2 4.31Å; F189-L193 HydrophobicContact CE1-CG 4.03Å; F189-L193 HydrophobicContact CZ-CD1 4.23Å; F189-L193 HydrophobicContact CZ-CD2 3.97Å; F189-L193 HydrophobicContact CZ-CG 4.08Å; F189-L193 WeakPolarHBondContact O-CG 3.45Å; F189-L193 PolarHBondContact O-N 3.26Å; A190-L193 PolarHBondContact O-N 3.42Å; V191-L193 PolarHBondContact O-N 3.03Å; L193-F199 HydrophobicContact CD2-CB 4.08Å; L193-L200 HydrophobicContact CD2-CB 4.38Å
194N97.8Very high97Very high0 Ų030.8 Ų30.80%016%0.161CC..THydrogen-bonded Turntrans-87.9-4176.4-75.2-90.8000113.3P65 L67 A190 V191 L192 V245 F246 S249 F250P65-N194 CarbonylContact C-O 3.57Å; P65-N194 WeakPolarHBondContact CB-O 3.35Å; L67-N194 HydrophobicContact CB-CB 4.29Å; L67-N194 VanDerWaalsContact CB-O 3.3Å; L67-N194 WeakPolarHBondContact CB-O 3.36Å; L67-N194 HydrophobicContact CD1-CB 3.45Å; L67-N194 VanDerWaalsContact CD1-CB 3.45Å; L67-N194 HydrophobicContact CG-CB 3.75Å; L67-N194 PolarHBondContact N-O 3.26Å; A190-N194 PolarHBondContact O-N 2.74Å; A190-N194 PolarHBondContact O-ND2 3.38Å; V191-N194 CarbonylContact O-C 3.4Å; V191-N194 WeakPolarHBondContact O-CA 3.3Å; V191-N194 WeakPolarHBondContact O-CB 3.29Å; V191-N194 PolarHBondContact O-N 3.36Å; L192-N194 PolarHBondContact O-N 3.46Å; N194-V245 HydrophobicContact CB-CG1 4.5Å; N194-F246 WeakPolarHBondContact ND2-CD2 3.18Å; N194-F246 WeakPolarHBondContact ND2-CE2 3.33Å; N194-S249 WeakPolarHBondContact OD1-CB 3.36Å; N194-S249 PolarHBondContact OD1-OG 2.98Å; N194-F250 WeakPolarHBondContact OD1-CD2 3.34Å; N194-F250 WeakPolarHBondContact OD1-CE2 3.4Å
195L97.9Very high96.9Very high8 Ų826.5 Ų26.54%0.04214%0.141CC..THydrogen-bonded Turntrans-96.5-38.4169.7-70.2169.7000111.5P65 L67 F68 F165 L166 F169 V191 L192P65-L195 WeakPolarHBondContact CD-O 3.3Å; L67-L195 HydrophobicContact CB-CD2 3.79Å; L67-L195 HydrophobicContact CB-CG 4.31Å; F68-L195 HydrophobicContact CB-CD2 4.43Å; F68-L195 VanDerWaalsContact CB-O 3.31Å; F68-L195 WeakPolarHBondContact CB-O 3.48Å; F68-L195 HydrophobicContact CD2-CB 4.46Å; F68-L195 HydrophobicContact CD2-CD2 4.37Å; F68-L195 WeakPolarHBondContact CD2-O 3.45Å; F165-L195 HydrophobicContact CE1-CD1 3.87Å; F165-L195 HydrophobicContact CE1-CD2 4.16Å; F165-L195 HydrophobicContact CZ-CD1 4.16Å; L166-L195 HydrophobicContact CD2-CB 3.58Å; L166-L195 HydrophobicContact CD2-CD1 4.31Å; F169-L195 HydrophobicContact CD2-CD1 3.51Å; F169-L195 HydrophobicContact CE2-CD1 3.44Å; F169-L195 VanDerWaalsContact CE2-CD1 3.44Å; F169-L195 HydrophobicContact CG-CD1 4.15Å; F169-L195 HydrophobicContact CZ-CD1 4.02Å; V191-L195 HydrophobicContact CG1-CD1 3.9Å; V191-L195 HydrophobicContact CG1-CG 4.27Å; V191-L195 WeakPolarHBondContact O-CG 3.45Å; V191-L195 PolarHBondContact O-N 2.77Å; L192-L195 WeakPolarHBondContact O-CB 3.44Å; L192-L195 PolarHBondContact O-N 3.17Å
196K96Very high96.9Very high22 Ų2226.7 Ų26.710%0.09614%0.142CC..  trans-153.2124.5174.4-162.5170.3179.1163.50110.5Y64 N163 L166 L192 I198 F199Y64-K196 HydrophobicContact CD2-CG 4.29Å; Y64-K196 HydrophobicContact CE2-CD 3.75Å; Y64-K196 HydrophobicContact CE2-CG 4Å; Y64-K196 WeakPolarHBondContact OH-CE 3.34Å; Y64-K196 PolarHBondContact OH-NZ 3.1Å; N163-K196 PolarHBondContact OD1-NZ 3.18Å; L166-K196 HydrophobicContact CD1-CB 4.02Å; L166-K196 HydrophobicContact CD1-CD 3.37Å; L166-K196 HydrophobicContact CD1-CG 4.34Å; L166-K196 HydrophobicContact CD2-CB 4.19Å; L192-K196 PolarHBondContact O-N 3.2Å; K196-I198 HydrophobicContact CB-CG2 4.36Å; K196-I198 HydrophobicContact CD-CG2 3.83Å; K196-I198 HydrophobicContact CG-CB 4.38Å; K196-I198 HydrophobicContact CG-CG2 3.74Å; K196-I198 PolarHBondContact O-N 3.33Å; K196-F199 HydrophobicContact CB-CD2 4.05Å; K196-F199 HydrophobicContact CB-CE2 4Å; K196-F199 WeakPolarHBondContact O-CD2 3.35Å; K196-F199 PolarHBondContact O-N 3.29Å
197H92.8Very high96.8Very high54 Ų5428.3 Ų28.325%0.2516%0.159CC..G310 helixtrans-70.2-15.7-174.658.2-95.9000113.6P65 F199 L200 L266 F267P65-H197 HydrophobicContact CG-CB 4.23Å; H197-F199 PolarHBondContact O-N 2.61Å; H197-F199 VanDerWaalsContact O-N 3.12Å; H197-L200 WeakPolarHBondContact O-CB 3.12Å; H197-L200 PolarHBondContact O-N 3.27Å; H197-L266 PolarHBondContact CE1-O 3.25Å; H197-L266 VanDerWaalsContact CE1-O 3.25Å; H197-L266 PolarHBondContact NE2-O 2.83Å; H197-F267 HydrophobicContact CB-CZ 4.25Å
198I93.5Very high96.6Very high36 Ų3626.7 Ų26.719%0.18515%0.15CC..G310 helixtrans-57.5-27.2177.1-160.7172.6000113.2K196 L200 Y201 A381K196-I198 HydrophobicContact CB-CG2 4.36Å; K196-I198 HydrophobicContact CD-CG2 3.83Å; K196-I198 HydrophobicContact CG-CB 4.38Å; K196-I198 HydrophobicContact CG-CG2 3.74Å; K196-I198 PolarHBondContact O-N 3.33Å; I198-L200 PolarHBondContact O-N 3.48Å; I198-L200 VanDerWaalsContact O-N 3.15Å; I198-Y201 HydrophobicContact CD1-CE2 4.17Å; I198-Y201 HydrophobicContact CG1-CD2 3.93Å; I198-Y201 HydrophobicContact CG1-CE2 3.49Å; I198-Y201 VanDerWaalsContact CG1-CE2 3.49Å; I198-Y201 WeakPolarHBondContact O-CB 3.5Å; I198-Y201 WeakPolarHBondContact O-CD2 3.29Å; I198-Y201 PolarHBondContact O-N 3.29Å; I198-A381 HydrophobicContact CD1-CB 3.91Å
199F96.6Very high96.4Very high4 Ų425.4 Ų25.42%0.01814%0.143CC..G310 helixtrans-71-5.6177.6-64.7-78.9000113.2L166 F167 L170 F189 L192 L193 K196 H197 Y201 V202 L384L166-F199 HydrophobicContact CB-CE2 3.87Å; L166-F199 HydrophobicContact CB-CZ 3.9Å; L166-F199 HydrophobicContact CD1-CE2 4.46Å; F167-F199 AromaticContact CD1-CE1 3.95Å; F167-F199 HydrophobicContact CD1-CE1 3.95Å; F167-F199 HydrophobicContact CD1-CZ 4.14Å; F167-F199 AromaticContact CE1-CE1 3.83Å; F167-F199 HydrophobicContact CE1-CE1 3.83Å; F167-F199 HydrophobicContact CE1-CZ 4.09Å; L170-F199 HydrophobicContact CB-CE1 4.2Å; L170-F199 HydrophobicContact CD1-CD1 4.31Å; L170-F199 HydrophobicContact CD2-CD1 4.29Å; L170-F199 HydrophobicContact CD2-CE1 3.97Å; L170-F199 HydrophobicContact CG-CE1 4.49Å; F189-F199 HydrophobicContact CE2-CB 4.32Å; L192-F199 HydrophobicContact CD1-CD2 3.44Å; L192-F199 VanDerWaalsContact CD1-CD2 3.44Å; L192-F199 HydrophobicContact CD1-CE1 4.42Å; L192-F199 HydrophobicContact CD1-CE2 3.37Å; L192-F199 HydrophobicContact CD1-CG 4.05Å; L192-F199 HydrophobicContact CD1-CZ 3.89Å; L192-F199 HydrophobicContact CD2-CB 4.1Å; L192-F199 HydrophobicContact CD2-CD1 3.61Å; L192-F199 HydrophobicContact CD2-CD2 3.92Å; L192-F199 HydrophobicContact CD2-CE1 3.95Å; L192-F199 HydrophobicContact CD2-CE2 4.26Å; L192-F199 HydrophobicContact CD2-CG 3.59Å; L192-F199 HydrophobicContact CD2-CZ 4.27Å; L192-F199 HydrophobicContact CG-CB 4.05Å; L192-F199 HydrophobicContact CG-CD1 4.14Å; L192-F199 HydrophobicContact CG-CD2 3.48Å; L192-F199 VanDerWaalsContact CG-CD2 3.48Å; L192-F199 HydrophobicContact CG-CE1 4.5Å; L192-F199 HydrophobicContact CG-CE2 3.93Å; L192-F199 HydrophobicContact CG-CG 3.62Å; L192-F199 HydrophobicContact CG-CZ 4.41Å; L193-F199 HydrophobicContact CD2-CB 4.08Å; K196-F199 HydrophobicContact CB-CD2 4.05Å; K196-F199 HydrophobicContact CB-CE2 4Å; K196-F199 WeakPolarHBondContact O-CD2 3.35Å; K196-F199 PolarHBondContact O-N 3.29Å; H197-F199 PolarHBondContact O-N 2.61Å; H197-F199 VanDerWaalsContact O-N 3.12Å; F199-Y201 PolarHBondContact O-N 2.86Å; F199-V202 WeakPolarHBondContact O-CG2 3.09Å; F199-V202 PolarHBondContact O-N 2.87Å; F199-V202 VanDerWaalsContact O-N 3.13Å; F199-L384 HydrophobicContact CD1-CD1 3.56Å; F199-L384 HydrophobicContact CE1-CD1 3.58Å
200L95.6Very high96.2Very high93 Ų9325.5 Ų25.549%0.48715%0.145SC..G310 helixtrans-56-28.4168.4-173.764.3000111.7L193 H197 I198 V202 A203 P204L193-L200 HydrophobicContact CD2-CB 4.38Å; H197-L200 WeakPolarHBondContact O-CB 3.12Å; H197-L200 PolarHBondContact O-N 3.27Å; I198-L200 PolarHBondContact O-N 3.48Å; I198-L200 VanDerWaalsContact O-N 3.15Å; L200-V202 PolarHBondContact O-N 3.01Å; L200-V202 VanDerWaalsContact O-N 3.15Å; L200-A203 HydrophobicContact CD1-CB 4.02Å; L200-A203 WeakPolarHBondContact O-CB 2.99Å; L200-A203 PolarHBondContact O-N 3.3Å; L200-P204 WeakPolarHBondContact O-CD 3.29Å
201Y94.9Very high96Very high64 Ų6427.7 Ų27.725%0.25116%0.156SC..G310 helixtrans-55-32.5176.6-64-9.4000113.5I198 F199 C366 L384I198-Y201 HydrophobicContact CD1-CE2 4.17Å; I198-Y201 HydrophobicContact CG1-CD2 3.93Å; I198-Y201 HydrophobicContact CG1-CE2 3.49Å; I198-Y201 VanDerWaalsContact CG1-CE2 3.49Å; I198-Y201 WeakPolarHBondContact O-CB 3.5Å; I198-Y201 WeakPolarHBondContact O-CD2 3.29Å; I198-Y201 PolarHBondContact O-N 3.29Å; F199-Y201 PolarHBondContact O-N 2.86Å; Y201-C366 WeakPolarHBondContact O-CB 3.47Å; Y201-L384 HydrophobicContact CD2-CD2 4.03Å
202V97.2Very high95.6Very high0 Ų026.3 Ų26.30%015%0.147CC..G310 helixtrans-101.5-5.7180-63.90000113.3L170 F189 F199 L200 P204 A205 Y206 L363 A367 L384L170-V202 HydrophobicContact CD1-CG2 4.32Å; F189-V202 HydrophobicContact CE2-CG2 3.71Å; F189-V202 HydrophobicContact CZ-CG2 3.91Å; F199-V202 WeakPolarHBondContact O-CG2 3.09Å; F199-V202 PolarHBondContact O-N 2.87Å; F199-V202 VanDerWaalsContact O-N 3.13Å; L200-V202 PolarHBondContact O-N 3.01Å; L200-V202 VanDerWaalsContact O-N 3.15Å; V202-P204 VanDerWaalsContact C-CD 3.45Å; V202-A205 WeakPolarHBondContact O-CB 3.45Å; V202-A205 PolarHBondContact O-N 2.99Å; V202-A205 VanDerWaalsContact O-N 3.11Å; V202-Y206 HydrophobicContact CG2-CD2 4.47Å; V202-Y206 HydrophobicContact CG2-CE2 4.21Å; V202-Y206 WeakPolarHBondContact O-CD2 3.43Å; V202-Y206 PolarHBondContact O-N 2.73Å; V202-L363 HydrophobicContact CB-CG 4.06Å; V202-L363 HydrophobicContact CG1-CD2 4.18Å; V202-L363 HydrophobicContact CG1-CG 4Å; V202-A367 HydrophobicContact CG1-CB 3.83Å; V202-L384 HydrophobicContact CG1-CD1 4.39Å; V202-L384 HydrophobicContact CG1-CD2 4.15Å; V202-L384 HydrophobicContact CG1-CG 4.27Å
203A97.1Very high95Very high21 Ų2126.8 Ų26.817%0.17415%0.15CC..Hα-helixtrans-57.4-37.7-179.200000114.2F189 L200 A205 Y206 G207F189-A203 HydrophobicContact CE1-CB 3.89Å; F189-A203 HydrophobicContact CZ-CB 3.96Å; L200-A203 HydrophobicContact CD1-CB 4.02Å; L200-A203 WeakPolarHBondContact O-CB 2.99Å; L200-A203 PolarHBondContact O-N 3.3Å; A203-A205 VanDerWaalsContact C-N 3.28Å; A203-A205 PolarHBondContact O-N 3.34Å; A203-Y206 WeakPolarHBondContact O-CB 3.11Å; A203-Y206 PolarHBondContact O-N 3.32Å; A203-Y206 VanDerWaalsContact O-N 3.15Å; A203-G207 PolarHBondContact O-N 2.99Å
204P96.9Very high94.7Very high54 Ų5427 Ų2735%0.35115%0.149SC..Hα-helixtrans-57.9-38.7175.5-26.936.1000113.3L200 V202 G207 I208 V342 L346L200-P204 WeakPolarHBondContact O-CD 3.29Å; V202-P204 VanDerWaalsContact C-CD 3.45Å; P204-G207 PolarHBondContact O-N 3.26Å; P204-I208 WeakPolarHBondContact O-CG1 3.49Å; P204-I208 PolarHBondContact O-N 2.93Å; P204-V342 HydrophobicContact CB-CG1 4.48Å; P204-L346 HydrophobicContact CB-CD1 3.92Å; P204-L346 HydrophobicContact CB-CD2 3.92Å; P204-L346 WeakPolarHBondContact O-CD2 3.14Å
205A95.9Very high94.3Very high0 Ų027 Ų270%015%0.149CC..Hα-helixtrans-63.8-43.8176.600000111.5V202 A203 F209 C362 L363V202-A205 WeakPolarHBondContact O-CB 3.45Å; V202-A205 PolarHBondContact O-N 2.99Å; V202-A205 VanDerWaalsContact O-N 3.11Å; A203-A205 VanDerWaalsContact C-N 3.28Å; A203-A205 PolarHBondContact O-N 3.34Å; A205-F209 WeakPolarHBondContact O-CB 3.31Å; A205-F209 PolarHBondContact O-N 3.4Å; A205-C362 HydrophobicContact CB-CB 4.37Å; A205-L363 HydrophobicContact CB-CB 4.26Å
206Y96.4Very high93.9Very high4 Ų427 Ų272%0.01615%0.148CC..Hα-helixtrans-61.5-48.3175.3-84.2-96.6000112L170 S173 H177 F189 V202 A203 F209 L210 F359 L363L170-Y206 HydrophobicContact CD1-CE2 4.42Å; S173-Y206 VanDerWaalsContact OG-CE1 3.25Å; S173-Y206 WeakPolarHBondContact OG-CE1 3.47Å; S173-Y206 PolarHBondContact OG-OH 3.16Å; H177-Y206 AromaticContact CD2-CE1 3.47Å; H177-Y206 VanDerWaalsContact CD2-CE1 3.47Å; H177-Y206 WeakPolarHBondContact CD2-CE1 3.33Å; H177-Y206 AromaticContact NE2-CD1 3.53Å; H177-Y206 AromaticContact NE2-CE1 3.28Å; H177-Y206 VanDerWaalsContact NE2-CE1 3.28Å; H177-Y206 WeakPolarHBondContact NE2-CE1 3.26Å; F189-Y206 HydrophobicContact CB-CD1 4.09Å; F189-Y206 HydrophobicContact CB-CE1 3.75Å; F189-Y206 AromaticContact CD1-CD1 3.8Å; F189-Y206 HydrophobicContact CD1-CD1 3.8Å; F189-Y206 AromaticContact CD1-CD2 4Å; F189-Y206 HydrophobicContact CD1-CD2 4Å; F189-Y206 HydrophobicContact CD1-CE1 4.16Å; F189-Y206 HydrophobicContact CD1-CE2 4.35Å; F189-Y206 AromaticContact CD1-CG 3.7Å; F189-Y206 HydrophobicContact CD1-CG 3.7Å; F189-Y206 HydrophobicContact CD2-CD1 4.36Å; F189-Y206 AromaticContact CD2-CD2 4Å; F189-Y206 HydrophobicContact CD2-CD2 4Å; F189-Y206 AromaticContact CD2-CE1 3.96Å; F189-Y206 HydrophobicContact CD2-CE1 3.96Å; F189-Y206 AromaticContact CD2-CE2 3.56Å; F189-Y206 HydrophobicContact CD2-CE2 3.56Å; F189-Y206 HydrophobicContact CD2-CG 4.37Å; F189-Y206 AromaticContact CD2-CZ 3.53Å; F189-Y206 HydrophobicContact CE1-CD1 4.36Å; F189-Y206 AromaticContact CE1-CD2 3.76Å; F189-Y206 HydrophobicContact CE1-CD2 3.76Å; F189-Y206 HydrophobicContact CE1-CE2 4.32Å; F189-Y206 AromaticContact CE1-CG 3.78Å; F189-Y206 HydrophobicContact CE1-CG 3.78Å; F189-Y206 AromaticContact CE2-CD2 3.79Å; F189-Y206 HydrophobicContact CE2-CD2 3.79Å; F189-Y206 AromaticContact CE2-CE2 3.53Å; F189-Y206 HydrophobicContact CE2-CE2 3.53Å; F189-Y206 HydrophobicContact CE2-CG 4.46Å; F189-Y206 AromaticContact CG-CD1 3.81Å; F189-Y206 HydrophobicContact CG-CD1 3.81Å; F189-Y206 HydrophobicContact CG-CD2 4.11Å; F189-Y206 AromaticContact CG-CE1 3.67Å; F189-Y206 HydrophobicContact CG-CE1 3.67Å; F189-Y206 AromaticContact CG-CE2 4Å; F189-Y206 HydrophobicContact CG-CE2 4Å; F189-Y206 HydrophobicContact CG-CG 4.02Å; F189-Y206 AromaticContact CG-CZ 3.77Å; F189-Y206 AromaticContact CZ-CD2 3.67Å; F189-Y206 HydrophobicContact CZ-CD2 3.67Å; F189-Y206 AromaticContact CZ-CE2 3.94Å; F189-Y206 HydrophobicContact CZ-CE2 3.94Å; F189-Y206 HydrophobicContact CZ-CG 4.18Å; V202-Y206 HydrophobicContact CG2-CD2 4.47Å; V202-Y206 HydrophobicContact CG2-CE2 4.21Å; V202-Y206 WeakPolarHBondContact O-CD2 3.43Å; V202-Y206 PolarHBondContact O-N 2.73Å; A203-Y206 WeakPolarHBondContact O-CB 3.11Å; A203-Y206 PolarHBondContact O-N 3.32Å; A203-Y206 VanDerWaalsContact O-N 3.15Å; Y206-F209 PolarHBondContact O-N 2.86Å; Y206-L210 VanDerWaalsContact O-CB 3.3Å; Y206-L210 WeakPolarHBondContact O-CB 3.48Å; Y206-L210 VanDerWaalsContact O-CG 3.31Å; Y206-L210 WeakPolarHBondContact O-CG 3.48Å; Y206-L210 PolarHBondContact O-N 3.3Å; Y206-F359 HydrophobicContact CD1-CE2 4.3Å; Y206-F359 HydrophobicContact CD1-CZ 4.1Å; Y206-F359 HydrophobicContact CD2-CE2 4.24Å; Y206-F359 HydrophobicContact CD2-CZ 4.28Å; Y206-F359 HydrophobicContact CE1-CE2 4.44Å; Y206-F359 AromaticContact CE1-CZ 3.8Å; Y206-F359 HydrophobicContact CE1-CZ 3.8Å; Y206-F359 HydrophobicContact CE2-CE2 4.4Å; Y206-F359 AromaticContact CE2-CZ 4Å; Y206-F359 HydrophobicContact CE2-CZ 4Å; Y206-F359 HydrophobicContact CG-CE2 4.2Å; Y206-F359 HydrophobicContact CG-CZ 4.33Å; Y206-F359 AromaticContact CZ-CZ 3.76Å; Y206-L363 HydrophobicContact CD2-CD1 4.35Å; Y206-L363 HydrophobicContact CE2-CD1 3.53Å
207G95.5Very high93.3Very high43 Ų4328.1 Ų28.144%0.44316%0.158SC..Hα-helixtrans-59-52.7-178.300000112.1A203 P204 L211A203-G207 PolarHBondContact O-N 2.99Å; P204-G207 PolarHBondContact O-N 3.26Å; G207-L211 WeakPolarHBondContact O-CB 3.38Å; G207-L211 PolarHBondContact O-N 3.41Å
208I94.9Very high92.8Very high47 Ų4729.9 Ų29.924%0.24117%0.168CC..Hα-helixtrans-67.7-39.5-180-62.7-59.3000111.4P204 R212 L346 I349 W350P204-I208 WeakPolarHBondContact O-CG1 3.49Å; P204-I208 PolarHBondContact O-N 2.93Å; I208-R212 WeakPolarHBondContact O-CB 3.48Å; I208-R212 PolarHBondContact O-N 2.91Å; I208-L346 HydrophobicContact CB-CD2 4.29Å; I208-L346 HydrophobicContact CG1-CB 4.27Å; I208-L346 HydrophobicContact CG1-CD1 4.42Å; I208-L346 HydrophobicContact CG1-CD2 4Å; I208-L346 HydrophobicContact CG1-CG 4.46Å; I208-I349 HydrophobicContact CG2-CB 4.45Å; I208-I349 HydrophobicContact CG2-CG2 4.06Å; I208-W350 HydrophobicContact CG2-CB 4.2Å; I208-W350 HydrophobicContact CG2-CE3 4.12Å
209F94.1Very high92.1Very high2 Ų230.2 Ų30.21%0.00917%0.17CC..Hα-helixtrans-63.6-47.4177.6169.1-111.6000112.7H177 H182 A205 Y206 R212 S213 F359H177-F209 HydrophobicContact CB-CE1 3.99Å; H177-F209 AromaticContact CG-CE1 3.95Å; H182-F209 AromaticContact CE1-CZ 3.77Å; H182-F209 AromaticContact ND1-CE1 3.83Å; A205-F209 WeakPolarHBondContact O-CB 3.31Å; A205-F209 PolarHBondContact O-N 3.4Å; Y206-F209 PolarHBondContact O-N 2.86Å; F209-R212 PolarHBondContact O-N 3.46Å; F209-S213 VanDerWaalsContact CD2-OG 3.24Å; F209-S213 WeakPolarHBondContact CD2-OG 3.35Å; F209-S213 VanDerWaalsContact CE2-OG 3.22Å; F209-S213 WeakPolarHBondContact CE2-OG 3.4Å; F209-S213 WeakPolarHBondContact O-CA 3.38Å; F209-S213 WeakPolarHBondContact O-CB 3.31Å; F209-S213 PolarHBondContact O-N 2.94Å; F209-S213 PolarHBondContact O-OG 3.41Å; F209-F359 HydrophobicContact CB-CD2 3.56Å; F209-F359 HydrophobicContact CB-CE2 4.14Å; F209-F359 HydrophobicContact CB-CG 4.42Å; F209-F359 HydrophobicContact CD1-CB 4.34Å; F209-F359 HydrophobicContact CD1-CD1 4.44Å; F209-F359 AromaticContact CD1-CD2 3.44Å; F209-F359 HydrophobicContact CD1-CD2 3.44Å; F209-F359 VanDerWaalsContact CD1-CD2 3.44Å; F209-F359 AromaticContact CD1-CE2 3.77Å; F209-F359 HydrophobicContact CD1-CE2 3.77Å; F209-F359 AromaticContact CD1-CG 3.81Å; F209-F359 HydrophobicContact CD1-CG 3.81Å; F209-F359 HydrophobicContact CD1-CZ 4.39Å; F209-F359 HydrophobicContact CD2-CB 3.6Å; F209-F359 AromaticContact CD2-CD2 3.97Å; F209-F359 HydrophobicContact CD2-CD2 3.97Å; F209-F359 AromaticContact CD2-CG 3.98Å; F209-F359 HydrophobicContact CD2-CG 3.98Å; F209-F359 HydrophobicContact CE1-CB 4.4Å; F209-F359 HydrophobicContact CE1-CD1 4.28Å; F209-F359 HydrophobicContact CE1-CD2 4.08Å; F209-F359 HydrophobicContact CE1-CE2 4.44Å; F209-F359 AromaticContact CE1-CG 3.98Å; F209-F359 HydrophobicContact CE1-CG 3.98Å; F209-F359 HydrophobicContact CE2-CB 3.67Å; F209-F359 HydrophobicContact CE2-CG 4.14Å; F209-F359 HydrophobicContact CG-CB 3.94Å; F209-F359 AromaticContact CG-CD2 3.36Å; F209-F359 HydrophobicContact CG-CD2 3.36Å; F209-F359 HydrophobicContact CG-CE2 4.07Å; F209-F359 AromaticContact CG-CG 3.8Å; F209-F359 HydrophobicContact CG-CG 3.8Å; F209-F359 HydrophobicContact CZ-CB 4.07Å; F209-F359 HydrophobicContact CZ-CD1 4.5Å; F209-F359 HydrophobicContact CZ-CG 4.13Å
210L94.4Very high91.1Very high16 Ų1635.4 Ų35.48%0.08419%0.19CC..Hα-helixtrans-68.8-41.9-179.4-72.5168.2000111.1H182 A186 Y206 R212 Y214 C215 L238H182-L210 HydrophobicContact CB-CD2 3.9Å; A186-L210 HydrophobicContact CB-CD1 4.02Å; Y206-L210 VanDerWaalsContact O-CB 3.3Å; Y206-L210 WeakPolarHBondContact O-CB 3.48Å; Y206-L210 VanDerWaalsContact O-CG 3.31Å; Y206-L210 WeakPolarHBondContact O-CG 3.48Å; Y206-L210 PolarHBondContact O-N 3.3Å; L210-R212 VanDerWaalsContact C-N 3.35Å; L210-R212 PolarHBondContact O-N 2.81Å; L210-Y214 WeakPolarHBondContact O-CA 3.08Å; L210-Y214 WeakPolarHBondContact O-CB 3.46Å; L210-Y214 PolarHBondContact O-N 3.04Å; L210-C215 PolarHBondContact O-N 3.39Å; L210-L238 HydrophobicContact CB-CD1 3.88Å; L210-L238 HydrophobicContact CD1-CD2 4.38Å; L210-L238 HydrophobicContact CD2-CD2 4.5Å
211L93.3Very high90Very high50 Ų5036.3 Ų36.326%0.26220%0.201SC..Iπ-helixtrans-57-51.1172.9-174.561000110.4G207 C215 F216 F230 L235 W350G207-L211 WeakPolarHBondContact O-CB 3.38Å; G207-L211 PolarHBondContact O-N 3.41Å; L211-C215 HydrophobicContact CD1-CB 4.1Å; L211-C215 WeakPolarHBondContact O-CB 3.31Å; L211-C215 PolarHBondContact O-N 2.95Å; L211-F216 HydrophobicContact CD1-CE2 4.36Å; L211-F216 HydrophobicContact CG-CE2 4.29Å; L211-F216 VanDerWaalsContact O-CD2 3.26Å; L211-F216 WeakPolarHBondContact O-CD2 3.31Å; L211-F216 PolarHBondContact O-N 3.43Å; L211-F230 HydrophobicContact CD1-CE2 4.26Å; L211-L235 HydrophobicContact CD1-CD1 4.43Å; L211-W350 HydrophobicContact CB-CZ3 4.29Å; L211-W350 HydrophobicContact CD2-CH2 3.86Å; L211-W350 HydrophobicContact CD2-CZ3 3.57Å; L211-W350 HydrophobicContact CG-CH2 4.13Å; L211-W350 HydrophobicContact CG-CZ3 3.74Å
212R90.2Very high88.9Confident2 Ų237.7 Ų37.71%0.00821%0.213CC..Iπ-helixtrans-67.6-39.5-178176.559.2-175.988.1-1.9114.5I208 F209 L210 D219 G223 W350 R352I208-R212 WeakPolarHBondContact O-CB 3.48Å; I208-R212 PolarHBondContact O-N 2.91Å; F209-R212 PolarHBondContact O-N 3.46Å; L210-R212 VanDerWaalsContact C-N 3.35Å; L210-R212 PolarHBondContact O-N 2.81Å; R212-D219 IonicContact CZ-OD1 3.01Å; R212-D219 IonicContact CZ-OD2 2.75Å; R212-D219 IonicContact NH1-OD1 3.8Å; R212-D219 PolarHBondContact NH1-OD1 2.86Å; R212-D219 IonicContact NH1-OD2 2.76Å; R212-D219 IonicContact NH2-OD1 3.05Å; R212-D219 PolarHBondContact NH2-OD1 3.07Å; R212-D219 IonicContact NH2-OD2 3.76Å; R212-D219 PolarHBondContact NH2-OD2 3.01Å; R212-G223 PolarHBondContact NH2-O 3.5Å; R212-W350 HydrophobicContact CB-CE3 4.15Å; R212-W350 HydrophobicContact CB-CZ3 4.44Å; R212-W350 VanDerWaalsContact CD-O 3.27Å; R212-W350 WeakPolarHBondContact CD-O 3.17Å; R212-W350 PolarHBondContact NE-O 2.72Å; R212-W350 VanDerWaalsContact NE-O 3.09Å; R212-R352 VanDerWaalsContact CZ-O 3.26Å; R212-R352 PolarHBondContact NE-O 3.11Å; R212-R352 VanDerWaalsContact NE-O 3.15Å; R212-R352 PolarHBondContact NH2-O 3.4Å
213S87.3Confident87.7Confident10 Ų1037.7 Ų37.77%0.0721%0.213CC..Iπ-helixtrans-102.9-28.1-166.6-50.40000113.5F209 R354F209-S213 VanDerWaalsContact CD2-OG 3.24Å; F209-S213 WeakPolarHBondContact CD2-OG 3.35Å; F209-S213 VanDerWaalsContact CE2-OG 3.22Å; F209-S213 WeakPolarHBondContact CE2-OG 3.4Å; F209-S213 WeakPolarHBondContact O-CA 3.38Å; F209-S213 WeakPolarHBondContact O-CB 3.31Å; F209-S213 PolarHBondContact O-N 2.94Å; F209-S213 PolarHBondContact O-OG 3.41Å; S213-R354 WeakPolarHBondContact O-CD 3.39Å; S213-R354 PolarHBondContact O-NE 3.34Å
214Y89.6Confident86.9Confident37 Ų3738.2 Ų38.215%0.14522%0.215CC..Iπ-helixtrans-102.6-47.5-179.3-174.4-107.9000112.1H182 L183 L210 R234 L238H182-Y214 HydrophobicContact CB-CD2 3.77Å; H182-Y214 HydrophobicContact CB-CE2 4.32Å; H182-Y214 HydrophobicContact CB-CG 4.19Å; H182-Y214 AromaticContact CD2-CD2 3.9Å; L183-Y214 HydrophobicContact CD2-CE1 3.73Å; L183-Y214 WeakPolarHBondContact CD2-OH 3.17Å; L183-Y214 HydrophobicContact CG-CE1 4.49Å; L183-Y214 HydrophobicContact CG-CE2 4.47Å; L183-Y214 WeakPolarHBondContact CG-OH 3.48Å; L210-Y214 WeakPolarHBondContact O-CA 3.08Å; L210-Y214 WeakPolarHBondContact O-CB 3.46Å; L210-Y214 PolarHBondContact O-N 3.04Å; Y214-R234 HydrophobicContact CD1-CB 3.87Å; Y214-R234 HydrophobicContact CD1-CG 4.46Å; Y214-R234 HydrophobicContact CE1-CB 3.53Å; Y214-R234 HydrophobicContact CE1-CG 3.91Å; Y214-R234 WeakPolarHBondContact O-CD 3.32Å; Y214-R234 PolarHBondContact O-NH1 3.04Å; Y214-L238 HydrophobicContact CD1-CD1 3.69Å; Y214-L238 HydrophobicContact CD1-CD2 4.24Å; Y214-L238 HydrophobicContact CD1-CG 3.88Å; Y214-L238 HydrophobicContact CE1-CD1 4.36Å; Y214-L238 HydrophobicContact CE1-CD2 4.39Å; Y214-L238 HydrophobicContact CE1-CG 4.06Å
215C91.3Very high86.2Confident0 Ų036.1 Ų36.10%020%0.201CC..Iπ-helixtrans-77.2-36.9-176.1-56.10000113.3L210 L211 F230 A231L210-C215 PolarHBondContact O-N 3.39Å; L211-C215 HydrophobicContact CD1-CB 4.1Å; L211-C215 WeakPolarHBondContact O-CB 3.31Å; L211-C215 PolarHBondContact O-N 2.95Å; C215-F230 HydrophobicContact CB-CD2 4.28Å; C215-F230 HydrophobicContact CB-CE2 3.99Å; C215-A231 PolarHBondContact O-N 3.32Å
216F89.6Confident85.6Confident7 Ų740.9 Ų40.93%0.03122%0.219CC..BIsolated β-bridgetrans-87.5123.5169.6-69.3-82.1000109.9L211 I225 W227 F230 W350 R354L211-F216 HydrophobicContact CD1-CE2 4.36Å; L211-F216 HydrophobicContact CG-CE2 4.29Å; L211-F216 VanDerWaalsContact O-CD2 3.26Å; L211-F216 WeakPolarHBondContact O-CD2 3.31Å; L211-F216 PolarHBondContact O-N 3.43Å; F216-I225 HydrophobicContact CB-CG2 4.19Å; F216-I225 HydrophobicContact CD1-CG2 3.26Å; F216-I225 HydrophobicContact CD2-CG2 4.09Å; F216-I225 HydrophobicContact CE1-CG2 3.52Å; F216-I225 HydrophobicContact CE2-CG2 4.34Å; F216-I225 HydrophobicContact CG-CG2 3.57Å; F216-I225 HydrophobicContact CZ-CG2 4.08Å; F216-W227 HydrophobicContact CE1-CE3 4.13Å; F216-W227 HydrophobicContact CZ-CE3 4.04Å; F216-W227 HydrophobicContact CZ-CZ3 4.13Å; F216-F230 HydrophobicContact CD1-CB 4.02Å; F216-F230 HydrophobicContact CD1-CD2 4.38Å; F216-F230 HydrophobicContact CE1-CB 3.65Å; F216-F230 AromaticContact CE1-CD2 3.94Å; F216-F230 HydrophobicContact CE1-CD2 3.94Å; F216-F230 HydrophobicContact CE1-CG 4.2Å; F216-F230 HydrophobicContact CE2-CD2 4.06Å; F216-F230 HydrophobicContact CZ-CB 4.28Å; F216-F230 AromaticContact CZ-CD2 3.76Å; F216-F230 HydrophobicContact CZ-CD2 3.76Å; F216-F230 HydrophobicContact CZ-CG 4.36Å; F216-W350 HydrophobicContact CD2-CH2 4.5Å; F216-W350 AromaticContact CE2-CH2 3.73Å; F216-W350 HydrophobicContact CE2-CH2 3.73Å; F216-W350 HydrophobicContact CE2-CZ3 4.33Å; F216-W350 HydrophobicContact CZ-CH2 4.38Å; F216-R354 PolarHBondContact O-NE 3.01Å; F216-R354 PolarHBondContact O-NH1 3.29Å; F216-R354 PolarHBondContact O-NH2 3.45Å
217T83Confident85.1Confident47 Ų4748.6 Ų48.629%0.28825%0.248SC..  trans-96.8-25.1-17057.90000114.1S229 A231 R354T217-S229 PolarHBondContact N-O 3.15Å; T217-S229 VanDerWaalsContact N-O 3.1Å; T217-S229 PolarHBondContact N-OG 3.46Å; T217-S229 PolarHBondContact OG1-O 2.88Å; T217-A231 HydrophobicContact CG2-CB 4.07Å; T217-R354 VanDerWaalsContact O-CZ 3.31Å; T217-R354 PolarHBondContact O-NH1 3.5Å; T217-R354 PolarHBondContact O-NH2 3.31Å
218L80.7Confident84.6Confident90 Ų9051.6 Ų51.647%0.47126%0.263SS..  trans-124.7140.1179.7-61.9168.9000111.5S229 R354L218-S229 PolarHBondContact N-OG 3.07Å; L218-S229 PolarHBondContact O-OG 3.35Å; L218-R354 VanDerWaalsContact N-NH2 3.18Å
219D79Confident84.3Confident43 Ų4349.8 Ų49.823%0.2325%0.254CS..BIsolated β-bridgetrans-103.5145.1172.2-68.56.9000108.4R212 R354R212-D219 IonicContact CZ-OD1 3.01Å; R212-D219 IonicContact CZ-OD2 2.75Å; R212-D219 IonicContact NH1-OD1 3.8Å; R212-D219 PolarHBondContact NH1-OD1 2.86Å; R212-D219 IonicContact NH1-OD2 2.76Å; R212-D219 IonicContact NH2-OD1 3.05Å; R212-D219 PolarHBondContact NH2-OD1 3.07Å; R212-D219 IonicContact NH2-OD2 3.76Å; R212-D219 PolarHBondContact NH2-OD2 3.01Å; D219-R354 IonicContact OD1-CZ 3.69Å; D219-R354 IonicContact OD1-NE 2.61Å; D219-R354 IonicContact OD1-NH2 2.89Å; D219-R354 PolarHBondContact OD1-NH2 3.38Å
220R77.4Confident84.2Confident114 Ų11453.4 Ų53.443%0.4327%0.27SS..  trans-70.8162.6169.6-76.2-172.9-175150.8-4.3110.3D222 G223 S224 R226R220-D222 WeakPolarHBondContact CB-OD1 3.09Å; R220-D222 PolarHBondContact O-N 3.49Å; R220-G223 VanDerWaalsContact O-CA 3.22Å; R220-G223 WeakPolarHBondContact O-CA 3.45Å; R220-G223 PolarHBondContact O-N 3.09Å; R220-S224 WeakPolarHBondContact CD-OG 3.28Å; R220-S224 PolarHBondContact N-O 3.34Å; R220-R226 HydrophobicContact CG-CB 4.13Å
221P72.2Confident84.1Confident112 Ų11253.8 Ų53.873%0.72728%0.275SS*.THydrogen-bonded Turntrans-59.9-31.6179.2-22.933.3000113.4G223 R353P221-G223 PolarHBondContact O-N 2.7Å; P221-R353 PolarHBondContact O-NH2 3.07Å
222D71.4Confident84.1Confident92 Ų9255 Ų5549%0.49229%0.286SS..THydrogen-bonded Turntrans-68.9-9.6170.664.9-8.2000113R220 S224 R518R220-D222 WeakPolarHBondContact CB-OD1 3.09Å; R220-D222 PolarHBondContact O-N 3.49Å; D222-S224 WeakPolarHBondContact OD1-CB 3.42Å; D222-S224 PolarHBondContact OD1-N 3.32Å; D222-S224 PolarHBondContact OD1-OG 2.74Å; D222-S224 WeakPolarHBondContact OD2-CB 3.37Å; D222-S224 PolarHBondContact OD2-OG 3.45Å; D222-R518 PolarHBondContact O-NE 3.22Å; D222-R518 PolarHBondContact O-NH2 3.07Å
223G72.3Confident84.3Confident0 Ų061.4 Ų61.40%032%0.32CS..SBendtrans78.210.3-174.500000115R212 R220 P221 R518R212-G223 PolarHBondContact NH2-O 3.5Å; R220-G223 VanDerWaalsContact O-CA 3.22Å; R220-G223 WeakPolarHBondContact O-CA 3.45Å; R220-G223 PolarHBondContact O-N 3.09Å; P221-G223 PolarHBondContact O-N 2.7Å; G223-R518 PolarHBondContact O-NH2 3.17Å
224S78.6Confident84.7Confident32 Ų3265.4 Ų65.422%0.22433%0.333CS..  trans-76.9164.5171.971.60000110.9R220 D222 R226R220-S224 WeakPolarHBondContact CD-OG 3.28Å; R220-S224 PolarHBondContact N-O 3.34Å; D222-S224 WeakPolarHBondContact OD1-CB 3.42Å; D222-S224 PolarHBondContact OD1-N 3.32Å; D222-S224 PolarHBondContact OD1-OG 2.74Å; D222-S224 WeakPolarHBondContact OD2-CB 3.37Å; D222-S224 PolarHBondContact OD2-OG 3.45Å; S224-R226 PolarHBondContact O-N 3.11Å
225I82.3Confident85Confident11 Ų1167.3 Ų67.36%0.05635%0.346CS..BIsolated β-bridgetrans-74.4128.8-177.1-58.4172.1000109.2F216 W227 W350F216-I225 HydrophobicContact CB-CG2 4.19Å; F216-I225 HydrophobicContact CD1-CG2 3.26Å; F216-I225 HydrophobicContact CD2-CG2 4.09Å; F216-I225 HydrophobicContact CE1-CG2 3.52Å; F216-I225 HydrophobicContact CE2-CG2 4.34Å; F216-I225 HydrophobicContact CG-CG2 3.57Å; F216-I225 HydrophobicContact CZ-CG2 4.08Å; I225-W227 PolarHBondContact O-N 3.03Å; I225-W350 HydrophobicContact CD1-CD2 3.68Å; I225-W350 HydrophobicContact CD1-CE3 4.12Å; I225-W350 HydrophobicContact CD1-CG 4.27Å; I225-W350 HydrophobicContact CD1-CH2 3.9Å; I225-W350 HydrophobicContact CD1-CZ2 3.39Å; I225-W350 HydrophobicContact CD1-CZ3 4.22Å
226R84Confident85.2Confident99 Ų9972.9 Ų72.937%0.37438%0.375SS..  trans-83.3103164.4-175.1178.7-65.7-171.5-1.4108.2R220 S224 S228 S229R220-R226 HydrophobicContact CG-CB 4.13Å; S224-R226 PolarHBondContact O-N 3.11Å; R226-S228 VanDerWaalsContact CG-OG 3.3Å; R226-S228 WeakPolarHBondContact CG-OG 3.34Å; R226-S228 PolarHBondContact O-N 3.35Å; R226-S229 VanDerWaalsContact O-CB 3.29Å; R226-S229 WeakPolarHBondContact O-CB 3.18Å; R226-S229 PolarHBondContact O-N 2.95Å; R226-S229 PolarHBondContact O-OG 3.42Å
227W85.9Confident85.6Confident166 Ų16674 Ų7463%0.62939%0.385SS*.G310 helixtrans-55.8-34.8-177.7-69.798.1000113.7F216 I225 S229 F230 W350F216-W227 HydrophobicContact CE1-CE3 4.13Å; F216-W227 HydrophobicContact CZ-CE3 4.04Å; F216-W227 HydrophobicContact CZ-CZ3 4.13Å; I225-W227 PolarHBondContact O-N 3.03Å; W227-S229 PolarHBondContact O-N 3.26Å; W227-S229 VanDerWaalsContact O-N 3.16Å; W227-F230 WeakPolarHBondContact O-CB 3.24Å; W227-F230 PolarHBondContact O-N 3.46Å; W227-W350 HydrophobicContact CH2-CZ2 4.01Å
228S86Confident86.2Confident107 Ų10772.5 Ų72.575%0.74838%0.375SS*.G310 helixtrans-67.2-10.7175.159.50000114.7R226 F230R226-S228 VanDerWaalsContact CG-OG 3.3Å; R226-S228 WeakPolarHBondContact CG-OG 3.34Å; R226-S228 PolarHBondContact O-N 3.35Å; S228-F230 VanDerWaalsContact C-N 3.29Å
229S87.7Confident87Confident8 Ų869.8 Ų69.86%0.05637%0.37CS..G310 helixtrans-89.15.7178.378.20000114T217 L218 R226 W227 A231T217-S229 PolarHBondContact N-O 3.15Å; T217-S229 VanDerWaalsContact N-O 3.1Å; T217-S229 PolarHBondContact N-OG 3.46Å; T217-S229 PolarHBondContact OG1-O 2.88Å; L218-S229 PolarHBondContact N-OG 3.07Å; L218-S229 PolarHBondContact O-OG 3.35Å; R226-S229 VanDerWaalsContact O-CB 3.29Å; R226-S229 WeakPolarHBondContact O-CB 3.18Å; R226-S229 PolarHBondContact O-N 2.95Å; R226-S229 PolarHBondContact O-OG 3.42Å; W227-S229 PolarHBondContact O-N 3.26Å; W227-S229 VanDerWaalsContact O-N 3.16Å; S229-A231 PolarHBondContact O-N 3.48Å
230F92.3Very high87.9Confident79 Ų7970.8 Ų70.835%0.34638%0.38SS..BIsolated β-bridgetrans-65.4121.5177.3-178.6-112000110.6L211 C215 F216 W227 S228 P232 L235L211-F230 HydrophobicContact CD1-CE2 4.26Å; C215-F230 HydrophobicContact CB-CD2 4.28Å; C215-F230 HydrophobicContact CB-CE2 3.99Å; F216-F230 HydrophobicContact CD1-CB 4.02Å; F216-F230 HydrophobicContact CD1-CD2 4.38Å; F216-F230 HydrophobicContact CE1-CB 3.65Å; F216-F230 AromaticContact CE1-CD2 3.94Å; F216-F230 HydrophobicContact CE1-CD2 3.94Å; F216-F230 HydrophobicContact CE1-CG 4.2Å; F216-F230 HydrophobicContact CE2-CD2 4.06Å; F216-F230 HydrophobicContact CZ-CB 4.28Å; F216-F230 AromaticContact CZ-CD2 3.76Å; F216-F230 HydrophobicContact CZ-CD2 3.76Å; F216-F230 HydrophobicContact CZ-CG 4.36Å; W227-F230 WeakPolarHBondContact O-CB 3.24Å; W227-F230 PolarHBondContact O-N 3.46Å; S228-F230 VanDerWaalsContact C-N 3.29Å; F230-P232 HydrophobicContact CE1-CB 4.01Å; F230-P232 VanDerWaalsContact O-CD 3.27Å; F230-P232 WeakPolarHBondContact O-CD 3.43Å; F230-L235 HydrophobicContact CE2-CD2 4.39Å; F230-L235 HydrophobicContact CZ-CB 4.17Å; F230-L235 HydrophobicContact CZ-CD2 3.75Å
231A93.2Very high88.9Confident23 Ų2366.8 Ų66.819%0.1937%0.366CS..  trans-102.597.9177.600000109.9C215 T217 S229 L233 R234 L235C215-A231 PolarHBondContact O-N 3.32Å; T217-A231 HydrophobicContact CG2-CB 4.07Å; S229-A231 PolarHBondContact O-N 3.48Å; A231-L233 VanDerWaalsContact C-N 3.26Å; A231-L233 PolarHBondContact O-N 2.72Å; A231-R234 HydrophobicContact CB-CB 4.15Å; A231-R234 HydrophobicContact CB-CG 3.92Å; A231-R234 WeakPolarHBondContact O-CB 3.39Å; A231-R234 PolarHBondContact O-N 3.24Å; A231-L235 PolarHBondContact O-N 2.95Å
232P92.9Very high90.1Very high75 Ų7564.6 Ų64.649%0.48735%0.351SS..Hα-helixtrans-61.2-34.5-177.423.2-33.4000112.5F230 R234 L235 L236F230-P232 HydrophobicContact CE1-CB 4.01Å; F230-P232 VanDerWaalsContact O-CD 3.27Å; F230-P232 WeakPolarHBondContact O-CD 3.43Å; P232-R234 PolarHBondContact O-N 3.17Å; P232-L235 WeakPolarHBondContact O-CB 3.47Å; P232-L235 PolarHBondContact O-N 3.03Å; P232-L235 VanDerWaalsContact O-N 3.07Å; P232-L236 WeakPolarHBondContact O-CG 3.48Å; P232-L236 PolarHBondContact O-N 3.11Å
233L94.5Very high91.3Very high137 Ų13765 Ų6572%0.71736%0.357SS*.Hα-helixtrans-59-33.8175.9-66174.7000112.9A231 L236 A237A231-L233 VanDerWaalsContact C-N 3.26Å; A231-L233 PolarHBondContact O-N 2.72Å; L233-L236 HydrophobicContact CD2-CD1 4.43Å; L233-L236 PolarHBondContact O-N 3.12Å; L233-A237 WeakPolarHBondContact O-CB 3.4Å; L233-A237 PolarHBondContact O-N 2.96Å
234R94.5Very high92.6Very high94 Ų9468.6 Ų68.636%0.35538%0.381SS..Hα-helixtrans-72.5-36.3176.2-70.7-170.6-178.6-167.4-1111.9Y214 A231 P232 A237 L238Y214-R234 HydrophobicContact CD1-CB 3.87Å; Y214-R234 HydrophobicContact CD1-CG 4.46Å; Y214-R234 HydrophobicContact CE1-CB 3.53Å; Y214-R234 HydrophobicContact CE1-CG 3.91Å; Y214-R234 WeakPolarHBondContact O-CD 3.32Å; Y214-R234 PolarHBondContact O-NH1 3.04Å; A231-R234 HydrophobicContact CB-CB 4.15Å; A231-R234 HydrophobicContact CB-CG 3.92Å; A231-R234 WeakPolarHBondContact O-CB 3.39Å; A231-R234 PolarHBondContact O-N 3.24Å; P232-R234 PolarHBondContact O-N 3.17Å; R234-A237 PolarHBondContact O-N 3.03Å; R234-L238 WeakPolarHBondContact O-CG 3.4Å; R234-L238 PolarHBondContact O-N 3.15Å; R234-L238 VanDerWaalsContact O-N 3.15Å
235L95.7Very high93.5Very high78 Ų7867.6 Ų67.641%0.40837%0.374SS..Hα-helixtrans-66.2-43.5172.5-178.464.9000110.8L211 F230 A231 P232 A237 L238 G239L211-L235 HydrophobicContact CD1-CD1 4.43Å; F230-L235 HydrophobicContact CE2-CD2 4.39Å; F230-L235 HydrophobicContact CZ-CB 4.17Å; F230-L235 HydrophobicContact CZ-CD2 3.75Å; A231-L235 PolarHBondContact O-N 2.95Å; P232-L235 WeakPolarHBondContact O-CB 3.47Å; P232-L235 PolarHBondContact O-N 3.03Å; P232-L235 VanDerWaalsContact O-N 3.07Å; L235-A237 VanDerWaalsContact C-N 3.32Å; L235-A237 PolarHBondContact O-N 2.81Å; L235-L238 PolarHBondContact O-N 2.97Å; L235-G239 PolarHBondContact O-N 2.75Å
236L96.6Very high94.2Very high116 Ų11670.8 Ų70.861%0.60739%0.388SS*.Hα-helixtrans-60-41.1175.3-71.5173.6000111.7P232 L233 L238 G239 S240P232-L236 WeakPolarHBondContact O-CG 3.48Å; P232-L236 PolarHBondContact O-N 3.11Å; L233-L236 HydrophobicContact CD2-CD1 4.43Å; L233-L236 PolarHBondContact O-N 3.12Å; L236-L238 PolarHBondContact O-N 2.9Å; L236-G239 PolarHBondContact O-N 3.43Å; L236-S240 WeakPolarHBondContact O-CB 3.41Å; L236-S240 PolarHBondContact O-N 3Å; L236-S240 PolarHBondContact O-OG 2.91Å
237A97.1Very high94.9Very high30 Ų3068.8 Ų68.825%0.24839%0.392CS..Hα-helixtrans-63.1-38.2175.400000113.1L183 L233 R234 L235 S240 I241L183-A237 HydrophobicContact CD2-CB 4.28Å; L233-A237 WeakPolarHBondContact O-CB 3.4Å; L233-A237 PolarHBondContact O-N 2.96Å; R234-A237 PolarHBondContact O-N 3.03Å; L235-A237 VanDerWaalsContact C-N 3.32Å; L235-A237 PolarHBondContact O-N 2.81Å; A237-S240 PolarHBondContact O-OG 3.09Å; A237-I241 WeakPolarHBondContact O-CG1 3.38Å; A237-I241 PolarHBondContact O-N 3.46Å
238L96.8Very high95.4Very high16 Ų1667 Ų678%0.08440%0.395CS..Hα-helixtrans-69.2-43.6173.2-70.3175.8000111.5L183 A186 L210 Y214 R234 L235 L236 S240 I241 V242L183-L238 HydrophobicContact CD2-CD2 3.89Å; L183-L238 HydrophobicContact CD2-CG 4.47Å; A186-L238 HydrophobicContact CB-CD2 3.66Å; L210-L238 HydrophobicContact CB-CD1 3.88Å; L210-L238 HydrophobicContact CD1-CD2 4.38Å; L210-L238 HydrophobicContact CD2-CD2 4.5Å; Y214-L238 HydrophobicContact CD1-CD1 3.69Å; Y214-L238 HydrophobicContact CD1-CD2 4.24Å; Y214-L238 HydrophobicContact CD1-CG 3.88Å; Y214-L238 HydrophobicContact CE1-CD1 4.36Å; Y214-L238 HydrophobicContact CE1-CD2 4.39Å; Y214-L238 HydrophobicContact CE1-CG 4.06Å; R234-L238 WeakPolarHBondContact O-CG 3.4Å; R234-L238 PolarHBondContact O-N 3.15Å; R234-L238 VanDerWaalsContact O-N 3.15Å; L235-L238 PolarHBondContact O-N 2.97Å; L236-L238 PolarHBondContact O-N 2.9Å; L238-S240 VanDerWaalsContact C-N 3.35Å; L238-S240 PolarHBondContact O-N 3.47Å; L238-I241 PolarHBondContact O-N 3.2Å; L238-V242 PolarHBondContact O-N 3.15Å; L238-V242 VanDerWaalsContact O-N 3.15Å
239G96.6Very high95.9Very high34 Ų3461.9 Ų61.935%0.35136%0.359SS..Hα-helixtrans-59.9-44.2176.900000111.8L235 L236 I241 V242 V243L235-G239 PolarHBondContact O-N 2.75Å; L236-G239 PolarHBondContact O-N 3.43Å; G239-I241 VanDerWaalsContact C-N 3.31Å; G239-I241 PolarHBondContact O-N 3.31Å; G239-V242 PolarHBondContact O-N 3.27Å; G239-V243 WeakPolarHBondContact O-CB 3.16Å; G239-V243 VanDerWaalsContact O-CG2 3.29Å; G239-V243 WeakPolarHBondContact O-CG2 3.23Å; G239-V243 PolarHBondContact O-N 2.79Å
240S97.9Very high96.4Very high63 Ų6362.8 Ų62.844%0.44136%0.362SS..Hα-helixtrans-63.3-37178.466.60000112L236 A237 L238 S244L236-S240 WeakPolarHBondContact O-CB 3.41Å; L236-S240 PolarHBondContact O-N 3Å; L236-S240 PolarHBondContact O-OG 2.91Å; A237-S240 PolarHBondContact O-OG 3.09Å; L238-S240 VanDerWaalsContact C-N 3.35Å; L238-S240 PolarHBondContact O-N 3.47Å; S240-S244 WeakPolarHBondContact O-CB 3.45Å; S240-S244 PolarHBondContact O-N 3.21Å; S240-S244 PolarHBondContact O-OG 3Å
241I98.1Very high96.6Very high30 Ų3060.3 Ų60.315%0.15436%0.358CS..Hα-helixtrans-61.1-52.1174.1-72.4167.8000110.4L183 L187 A190 A237 L238 G239 S244 V245L183-I241 HydrophobicContact CB-CD1 4.09Å; L183-I241 HydrophobicContact CD2-CD1 3.88Å; L187-I241 HydrophobicContact CB-CG2 3.92Å; L187-I241 HydrophobicContact CD1-CG2 3.93Å; A190-I241 HydrophobicContact CB-CG2 4.48Å; A237-I241 WeakPolarHBondContact O-CG1 3.38Å; A237-I241 PolarHBondContact O-N 3.46Å; L238-I241 PolarHBondContact O-N 3.2Å; G239-I241 VanDerWaalsContact C-N 3.31Å; G239-I241 PolarHBondContact O-N 3.31Å; I241-S244 PolarHBondContact O-N 2.97Å; I241-V245 WeakPolarHBondContact O-CG2 3.43Å; I241-V245 PolarHBondContact O-N 3.22Å
242V97.2Very high96.7Very high66 Ų6661.2 Ų61.240%0.436%0.363SS..Hα-helixtrans-61.4-50.3-178.8176.60000110.3L238 G239 S244 V245 F246L238-V242 PolarHBondContact O-N 3.15Å; L238-V242 VanDerWaalsContact O-N 3.15Å; G239-V242 PolarHBondContact O-N 3.27Å; V242-S244 VanDerWaalsContact C-N 3.33Å; V242-S244 PolarHBondContact O-N 2.74Å; V242-V245 PolarHBondContact O-N 2.9Å; V242-F246 HydrophobicContact CG1-CD2 3.82Å; V242-F246 HydrophobicContact CG1-CE2 3.98Å; V242-F246 WeakPolarHBondContact O-CB 3.47Å; V242-F246 VanDerWaalsContact O-CD2 3.3Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å; V242-F246 PolarHBondContact O-N 3.36Å
243V98Very high96.9Very high101 Ų10157.7 Ų57.761%0.61234%0.339SS*.Hα-helixtrans-59.1-44.3179.31720000111.1G239 V245 F246 A247G239-V243 WeakPolarHBondContact O-CB 3.16Å; G239-V243 VanDerWaalsContact O-CG2 3.29Å; G239-V243 WeakPolarHBondContact O-CG2 3.23Å; G239-V243 PolarHBondContact O-N 2.79Å; V243-V245 PolarHBondContact O-N 3.02Å; V243-F246 PolarHBondContact O-N 3.28Å; V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 2.87Å
244S98.1Very high97Very high75 Ų7554.9 Ų54.952%0.52433%0.328SS..Hα-helixtrans-64.3-43.5-179.2-58.20000112.2S240 I241 V242 A247 L248S240-S244 WeakPolarHBondContact O-CB 3.45Å; S240-S244 PolarHBondContact O-N 3.21Å; S240-S244 PolarHBondContact O-OG 3Å; I241-S244 PolarHBondContact O-N 2.97Å; V242-S244 VanDerWaalsContact C-N 3.33Å; V242-S244 PolarHBondContact O-N 2.74Å; S244-A247 PolarHBondContact O-N 3.36Å; S244-L248 WeakPolarHBondContact O-CB 3.45Å; S244-L248 PolarHBondContact O-N 3.3Å
245V98.1Very high97.1Very high12 Ų1254.8 Ų54.87%0.07335%0.347CS..Hα-helixtrans-67.7-43.9179.2175.80000111.2L67 L187 A190 V191 N194 I241 V242 V243 L248 S249L67-V245 HydrophobicContact CD1-CG1 4.25Å; L187-V245 HydrophobicContact CD1-CG2 3.65Å; A190-V245 HydrophobicContact CB-CB 4.16Å; A190-V245 HydrophobicContact CB-CG1 4.25Å; A190-V245 HydrophobicContact CB-CG2 4.13Å; V191-V245 HydrophobicContact CG2-CG1 4.07Å; V191-V245 HydrophobicContact CG2-CG2 4.27Å; N194-V245 HydrophobicContact CB-CG1 4.5Å; I241-V245 WeakPolarHBondContact O-CG2 3.43Å; I241-V245 PolarHBondContact O-N 3.22Å; V242-V245 PolarHBondContact O-N 2.9Å; V243-V245 PolarHBondContact O-N 3.02Å; V245-L248 PolarHBondContact O-N 3.49Å; V245-S249 VanDerWaalsContact O-CB 3.28Å; V245-S249 WeakPolarHBondContact O-CB 3.45Å; V245-S249 PolarHBondContact O-N 3.27Å
246F97.5Very high97.2Very high77 Ų7754.6 Ų54.634%0.33835%0.345SS..Hα-helixtrans-67.4-36.7177.2-86.7-100.3000111.9N194 V242 V243 S249 F250N194-F246 WeakPolarHBondContact ND2-CD2 3.18Å; N194-F246 WeakPolarHBondContact ND2-CE2 3.33Å; V242-F246 HydrophobicContact CG1-CD2 3.82Å; V242-F246 HydrophobicContact CG1-CE2 3.98Å; V242-F246 WeakPolarHBondContact O-CB 3.47Å; V242-F246 VanDerWaalsContact O-CD2 3.3Å; V242-F246 WeakPolarHBondContact O-CD2 3.41Å; V242-F246 PolarHBondContact O-N 3.36Å; V243-F246 PolarHBondContact O-N 3.28Å; F246-S249 PolarHBondContact O-N 2.86Å; F246-F250 AromaticContact CD1-CD2 3.77Å; F246-F250 HydrophobicContact CD1-CD2 3.77Å; F246-F250 AromaticContact CD1-CE2 3.82Å; F246-F250 HydrophobicContact CD1-CE2 3.82Å; F246-F250 HydrophobicContact CE1-CD2 4.35Å; F246-F250 AromaticContact CE1-CE2 3.93Å; F246-F250 HydrophobicContact CE1-CE2 3.93Å; F246-F250 WeakPolarHBondContact O-CB 3.07Å; F246-F250 PolarHBondContact O-N 2.89Å
247A97.5Very high97.1Very high57 Ų5751.9 Ų51.947%0.47135%0.346SS..Hα-helixtrans-64.2-41.7173.300000111.5V243 S244 G251V243-A247 WeakPolarHBondContact O-CB 3.31Å; V243-A247 PolarHBondContact O-N 2.87Å; S244-A247 PolarHBondContact O-N 3.36Å; A247-G251 WeakPolarHBondContact O-CA 3.5Å; A247-G251 PolarHBondContact O-N 3.44Å
248L97.1Very high97.1Very high129 Ų12951.5 Ų51.568%0.67534%0.339SS*.Hα-helixtrans-65.2-40.5175.7-176.965.6000112.2S244 V245S244-L248 WeakPolarHBondContact O-CB 3.45Å; S244-L248 PolarHBondContact O-N 3.3Å; V245-L248 PolarHBondContact O-N 3.49Å
249S97.1Very high97Very high0 Ų054.4 Ų54.40%035%0.354CS..Hα-helixtrans-74.2-59.6-177.7179.50000112.2P66 N194 V245 F246P66-S249 WeakPolarHBondContact CB-O 3.44Å; N194-S249 WeakPolarHBondContact OD1-CB 3.36Å; N194-S249 PolarHBondContact OD1-OG 2.98Å; V245-S249 VanDerWaalsContact O-CB 3.28Å; V245-S249 WeakPolarHBondContact O-CB 3.45Å; V245-S249 PolarHBondContact O-N 3.27Å; F246-S249 PolarHBondContact O-N 2.86Å
250F97.1Very high96.9Very high26 Ų2657.3 Ų57.311%0.11437%0.368CS..Hα-helixtrans-92.9-18.9-173.4-71.3-89.6000113.7P65 P66 N194 F246 F253 V254 L259 V262 L266P65-F250 HydrophobicContact CB-CZ 4.18Å; P66-F250 HydrophobicContact CG-CD1 3.97Å; P66-F250 HydrophobicContact CG-CE1 4.04Å; P66-F250 HydrophobicContact CG-CG 4.29Å; P66-F250 HydrophobicContact CG-CZ 4.42Å; N194-F250 WeakPolarHBondContact OD1-CD2 3.34Å; N194-F250 WeakPolarHBondContact OD1-CE2 3.4Å; F246-F250 AromaticContact CD1-CD2 3.77Å; F246-F250 HydrophobicContact CD1-CD2 3.77Å; F246-F250 AromaticContact CD1-CE2 3.82Å; F246-F250 HydrophobicContact CD1-CE2 3.82Å; F246-F250 HydrophobicContact CE1-CD2 4.35Å; F246-F250 AromaticContact CE1-CE2 3.93Å; F246-F250 HydrophobicContact CE1-CE2 3.93Å; F246-F250 WeakPolarHBondContact O-CB 3.07Å; F246-F250 PolarHBondContact O-N 2.89Å; F250-F253 PolarHBondContact O-N 2.99Å; F250-V254 HydrophobicContact CB-CG2 4.46Å; F250-V254 WeakPolarHBondContact O-CG2 3.27Å; F250-V254 PolarHBondContact O-N 3.21Å; F250-L259 HydrophobicContact CD1-CD1 4.04Å; F250-V262 HydrophobicContact CD1-CG1 4.2Å; F250-V262 HydrophobicContact CE1-CG1 3.72Å; F250-L266 HydrophobicContact CE1-CD2 4.32Å; F250-L266 HydrophobicContact CZ-CD2 4.12Å
251G96.8Very high96.7Very high27 Ų2756.6 Ų56.628%0.27836%0.358SS..Hα-helixtrans-52.4-45.3-175.800000114.8A247 F253 V254 A255A247-G251 WeakPolarHBondContact O-CA 3.5Å; A247-G251 PolarHBondContact O-N 3.44Å; G251-F253 VanDerWaalsContact C-N 3.29Å; G251-F253 PolarHBondContact O-N 2.95Å; G251-V254 PolarHBondContact O-N 3.1Å; G251-A255 WeakPolarHBondContact O-CB 3.39Å; G251-A255 PolarHBondContact O-N 2.85Å
252P96.6Very high96.6Very high43 Ų4355.1 Ų55.128%0.27935%0.351SS..Hα-helixtrans-58.4-40.1175.4-25.935.2000113.1L49 A255 M256L49-P252 HydrophobicContact CD2-CB 3.7Å; P252-A255 PolarHBondContact O-N 3.01Å; P252-M256 WeakPolarHBondContact O-CE 3.05Å; P252-M256 WeakPolarHBondContact O-CG 3.42Å; P252-M256 PolarHBondContact O-N 2.92Å
253F96.5Very high96.4Very high0 Ų055.1 Ų55.10%035%0.351CS..Hα-helixtrans-75.4-33.1-180-59.9-83.6000112.3L49 W52 Y53 P66 F250 G251 M256 G257 Q258 V262L49-F253 HydrophobicContact CD1-CE1 3.99Å; L49-F253 HydrophobicContact CD1-CE2 4.19Å; L49-F253 HydrophobicContact CD1-CZ 3.45Å; L49-F253 VanDerWaalsContact CD1-CZ 3.45Å; L49-F253 HydrophobicContact CG-CE1 4.17Å; L49-F253 HydrophobicContact CG-CZ 4.04Å; W52-F253 HydrophobicContact CE3-CZ 4.07Å; Y53-F253 AromaticContact CD2-CD1 3.92Å; Y53-F253 HydrophobicContact CD2-CD1 3.92Å; Y53-F253 AromaticContact CD2-CE1 3.46Å; Y53-F253 HydrophobicContact CD2-CE1 3.46Å; Y53-F253 VanDerWaalsContact CD2-CE1 3.46Å; Y53-F253 HydrophobicContact CD2-CZ 4Å; Y53-F253 HydrophobicContact CE2-CD1 4.18Å; Y53-F253 AromaticContact CE2-CE1 3.59Å; Y53-F253 HydrophobicContact CE2-CE1 3.59Å; Y53-F253 HydrophobicContact CE2-CE2 4.27Å; Y53-F253 AromaticContact CE2-CZ 3.62Å; Y53-F253 HydrophobicContact CE2-CZ 3.62Å; P66-F253 HydrophobicContact CB-CD2 4.12Å; P66-F253 HydrophobicContact CB-CE2 3.63Å; P66-F253 HydrophobicContact CB-CZ 4.48Å; P66-F253 HydrophobicContact CG-CD2 3.86Å; P66-F253 HydrophobicContact CG-CE2 3.82Å; F250-F253 PolarHBondContact O-N 2.99Å; G251-F253 VanDerWaalsContact C-N 3.29Å; G251-F253 PolarHBondContact O-N 2.95Å; F253-M256 HydrophobicContact CD1-CE 3.85Å; F253-M256 HydrophobicContact CE1-CE 4.21Å; F253-M256 HydrophobicContact CG-CE 4.38Å; F253-M256 PolarHBondContact O-N 3.12Å; F253-G257 PolarHBondContact O-N 2.66Å; F253-Q258 HydrophobicContact CB-CB 4.42Å; F253-Q258 PolarHBondContact O-N 3.13Å; F253-V262 HydrophobicContact CB-CG2 4.05Å; F253-V262 HydrophobicContact CD1-CG2 3.98Å; F253-V262 HydrophobicContact CG-CG2 4.04Å
254V96.7Very high96.1Very high79 Ų7953.1 Ų53.148%0.47934%0.341SS..Hα-helixtrans-64.5-45.8171.7174.20000110.4F250 G251 M256 G257 L259F250-V254 HydrophobicContact CB-CG2 4.46Å; F250-V254 WeakPolarHBondContact O-CG2 3.27Å; F250-V254 PolarHBondContact O-N 3.21Å; G251-V254 PolarHBondContact O-N 3.1Å; V254-M256 PolarHBondContact O-N 3.41Å; V254-G257 PolarHBondContact O-N 3.08Å; V254-L259 HydrophobicContact CG2-CB 4.24Å; V254-L259 HydrophobicContact CG2-CD1 4.13Å; V254-L259 HydrophobicContact CG2-CD2 4.21Å; V254-L259 HydrophobicContact CG2-CG 4.42Å
255A96.9Very high95.7Very high91 Ų9151.9 Ų51.975%0.75233%0.325SS*.Hα-helixtrans-61.9-30.6178.200000112.8G251 P252 G257G251-A255 WeakPolarHBondContact O-CB 3.39Å; G251-A255 PolarHBondContact O-N 2.85Å; P252-A255 PolarHBondContact O-N 3.01Å; A255-G257 VanDerWaalsContact C-N 3.34Å
256M96.4Very high95.4Very high74 Ų7451.7 Ų51.737%0.36532%0.323SS..THydrogen-bonded Turntrans-85.50.4174.5-65.3-175.9-62.400114L49 P252 F253 V254 Q258L49-M256 HydrophobicContact CB-CE 4.47Å; L49-M256 HydrophobicContact CD2-CE 4Å; L49-M256 HydrophobicContact CG-CE 3.85Å; P252-M256 WeakPolarHBondContact O-CE 3.05Å; P252-M256 WeakPolarHBondContact O-CG 3.42Å; P252-M256 PolarHBondContact O-N 2.92Å; F253-M256 HydrophobicContact CD1-CE 3.85Å; F253-M256 HydrophobicContact CE1-CE 4.21Å; F253-M256 HydrophobicContact CG-CE 4.38Å; F253-M256 PolarHBondContact O-N 3.12Å; V254-M256 PolarHBondContact O-N 3.41Å; M256-Q258 VanDerWaalsContact C-N 3.32Å; M256-Q258 HydrophobicContact CB-CG 4.02Å; M256-Q258 PolarHBondContact O-N 2.72Å
257G95.9Very high94.9Very high60 Ų6052 Ų5262%0.61933%0.325SS*.THydrogen-bonded Turntrans71.820-177.700000114.9F253 V254 A255F253-G257 PolarHBondContact O-N 2.66Å; V254-G257 PolarHBondContact O-N 3.08Å; A255-G257 VanDerWaalsContact C-N 3.34Å
258Q95.5Very high93.9Very high22 Ų2251.7 Ų51.710%0.10332%0.318CS..  trans-100.66.7-172.4-62.9-173.6-20.200114.5S50 H54 F253 M256 S260 Q261 V262S50-Q258 PolarHBondContact O-NE2 3.41Å; H54-Q258 PolarHBondContact CD2-NE2 3.44Å; H54-Q258 VanDerWaalsContact CD2-NE2 3.34Å; H54-Q258 PolarHBondContact NE2-NE2 3.06Å; F253-Q258 HydrophobicContact CB-CB 4.42Å; F253-Q258 PolarHBondContact O-N 3.13Å; M256-Q258 VanDerWaalsContact C-N 3.32Å; M256-Q258 HydrophobicContact CB-CG 4.02Å; M256-Q258 PolarHBondContact O-N 2.72Å; Q258-S260 VanDerWaalsContact C-N 3.29Å; Q258-S260 PolarHBondContact O-N 3.39Å; Q258-Q261 WeakPolarHBondContact O-CB 3.21Å; Q258-Q261 PolarHBondContact O-N 3.22Å; Q258-Q261 VanDerWaalsContact O-N 3.11Å; Q258-V262 WeakPolarHBondContact O-CG2 3.28Å; Q258-V262 PolarHBondContact O-N 3.11Å
259L94.6Very high92.3Very high77 Ų7754.5 Ų54.540%0.40333%0.325SS..Hα-helixtrans-56.7-42.4-175.3-178.663.6000112.6F250 V254 Q261 V262 V263F250-L259 HydrophobicContact CD1-CD1 4.04Å; V254-L259 HydrophobicContact CG2-CB 4.24Å; V254-L259 HydrophobicContact CG2-CD1 4.13Å; V254-L259 HydrophobicContact CG2-CD2 4.21Å; V254-L259 HydrophobicContact CG2-CG 4.42Å; L259-Q261 VanDerWaalsContact C-N 3.33Å; L259-Q261 PolarHBondContact O-N 2.67Å; L259-V262 PolarHBondContact O-N 2.77Å; L259-V263 HydrophobicContact CD1-CG2 4.19Å; L259-V263 HydrophobicContact CG-CG2 4.4Å; L259-V263 VanDerWaalsContact O-CG2 3.3Å; L259-V263 WeakPolarHBondContact O-CG2 3.45Å; L259-V263 PolarHBondContact O-N 3.48Å
260S94.4Very high90.5Very high94 Ų9465.6 Ų65.666%0.65737%0.367SS*.Hα-helixtrans-60.4-43.3178.253.60000112Q258 V263 S264Q258-S260 VanDerWaalsContact C-N 3.29Å; Q258-S260 PolarHBondContact O-N 3.39Å; S260-V263 PolarHBondContact O-N 3.46Å; S260-S264 PolarHBondContact O-N 2.84Å
261Q94.8Very high88.9Confident48 Ų4868.2 Ų68.222%0.22438%0.376CS..Hα-helixtrans-62.2-49.2177.1-179.763.316.700110.9Y53 Q258 L259 V263 S264 R265Y53-Q261 PolarHBondContact O-NE2 3.22Å; Q258-Q261 WeakPolarHBondContact O-CB 3.21Å; Q258-Q261 PolarHBondContact O-N 3.22Å; Q258-Q261 VanDerWaalsContact O-N 3.11Å; L259-Q261 VanDerWaalsContact C-N 3.33Å; L259-Q261 PolarHBondContact O-N 2.67Å; Q261-V263 PolarHBondContact O-N 3.43Å; Q261-S264 PolarHBondContact O-N 3.44Å; Q261-S264 PolarHBondContact O-OG 3.16Å; Q261-R265 PolarHBondContact O-N 3.45Å; Q261-R265 VanDerWaalsContact O-N 3.14Å
262V95.1Very high87.5Confident0 Ų067 Ų670%036%0.364CS..Hα-helixtrans-57.8-49.3177.7179.30000110.2Y53 P66 F250 F253 Q258 L259 S264 R265 L266Y53-V262 HydrophobicContact CD1-CG1 4.39Å; Y53-V262 HydrophobicContact CD1-CG2 4.31Å; Y53-V262 HydrophobicContact CD2-CG2 3.69Å; Y53-V262 HydrophobicContact CE1-CG1 4.11Å; Y53-V262 HydrophobicContact CE2-CG1 4.4Å; Y53-V262 HydrophobicContact CE2-CG2 4.07Å; Y53-V262 HydrophobicContact CG-CG2 3.82Å; P66-V262 HydrophobicContact CG-CG1 4.46Å; F250-V262 HydrophobicContact CD1-CG1 4.2Å; F250-V262 HydrophobicContact CE1-CG1 3.72Å; F253-V262 HydrophobicContact CB-CG2 4.05Å; F253-V262 HydrophobicContact CD1-CG2 3.98Å; F253-V262 HydrophobicContact CG-CG2 4.04Å; Q258-V262 WeakPolarHBondContact O-CG2 3.28Å; Q258-V262 PolarHBondContact O-N 3.11Å; L259-V262 PolarHBondContact O-N 2.77Å; V262-S264 VanDerWaalsContact C-N 3.32Å; V262-S264 PolarHBondContact O-N 3.26Å; V262-R265 WeakPolarHBondContact O-CB 3.36Å; V262-R265 PolarHBondContact O-N 3.01Å; V262-R265 VanDerWaalsContact O-N 3.1Å; V262-L266 HydrophobicContact CG1-CD1 3.77Å; V262-L266 HydrophobicContact CG1-CD2 4.43Å; V262-L266 WeakPolarHBondContact O-CD1 3.27Å; V262-L266 PolarHBondContact O-N 3.24Å
263V92.9Very high86.3Confident65 Ų6565.1 Ų65.139%0.39435%0.351SS..Hα-helixtrans-60.3-40.1179.8172.30000112.1L259 S260 Q261 R265 L266 F267L259-V263 HydrophobicContact CD1-CG2 4.19Å; L259-V263 HydrophobicContact CG-CG2 4.4Å; L259-V263 VanDerWaalsContact O-CG2 3.3Å; L259-V263 WeakPolarHBondContact O-CG2 3.45Å; L259-V263 PolarHBondContact O-N 3.48Å; S260-V263 PolarHBondContact O-N 3.46Å; Q261-V263 PolarHBondContact O-N 3.43Å; V263-R265 VanDerWaalsContact C-N 3.29Å; V263-R265 PolarHBondContact O-N 3.05Å; V263-L266 PolarHBondContact O-N 3.29Å; V263-F267 HydrophobicContact CG1-CD2 4.25Å; V263-F267 PolarHBondContact O-N 3.4Å
264S91.9Very high84.7Confident60 Ų6065.8 Ų65.842%0.4236%0.356SS..Hα-helixtrans-65-30.1176.972.10000113.9S260 Q261 V262S260-S264 PolarHBondContact O-N 2.84Å; Q261-S264 PolarHBondContact O-N 3.44Å; Q261-S264 PolarHBondContact O-OG 3.16Å; V262-S264 VanDerWaalsContact C-N 3.32Å; V262-S264 PolarHBondContact O-N 3.26Å
265R91.3Very high83.1Confident49 Ų4963.6 Ų63.619%0.18534%0.34CS..Hα-helixtrans-74-43.4174.6-69.9-70.6-171.4-169.30.3111.5Y53 E55 T61 Q261 V262 V263 F267Y53-R265 HydrophobicContact CD1-CB 4.2Å; Y53-R265 HydrophobicContact CD1-CG 4.22Å; Y53-R265 PolarHBondContact O-NE 3.4Å; E55-R265 PolarHBondContact O-NH2 3.19Å; T61-R265 VanDerWaalsContact CG2-NH1 3.32Å; T61-R265 PolarHBondContact OG1-NH1 2.61Å; Q261-R265 PolarHBondContact O-N 3.45Å; Q261-R265 VanDerWaalsContact O-N 3.14Å; V262-R265 WeakPolarHBondContact O-CB 3.36Å; V262-R265 PolarHBondContact O-N 3.01Å; V262-R265 VanDerWaalsContact O-N 3.1Å; V263-R265 VanDerWaalsContact C-N 3.29Å; V263-R265 PolarHBondContact O-N 3.05Å; R265-F267 PolarHBondContact O-N 3.18Å
266L90.3Very high81.1Confident7 Ų760.8 Ų60.84%0.03732%0.317CS..Hα-helixtrans-67.8-35.1-179.1-88.161.1000112.4Y53 P65 H197 F250 V262 V263 P268Y53-L266 HydrophobicContact CE1-CD1 4.04Å; P65-L266 HydrophobicContact CB-CD2 3.85Å; P65-L266 HydrophobicContact CG-CD2 3.93Å; P65-L266 HydrophobicContact CG-CG 4.43Å; H197-L266 PolarHBondContact CE1-O 3.25Å; H197-L266 VanDerWaalsContact CE1-O 3.25Å; H197-L266 PolarHBondContact NE2-O 2.83Å; F250-L266 HydrophobicContact CE1-CD2 4.32Å; F250-L266 HydrophobicContact CZ-CD2 4.12Å; V262-L266 HydrophobicContact CG1-CD1 3.77Å; V262-L266 HydrophobicContact CG1-CD2 4.43Å; V262-L266 WeakPolarHBondContact O-CD1 3.27Å; V262-L266 PolarHBondContact O-N 3.24Å; V263-L266 PolarHBondContact O-N 3.29Å; L266-P268 VanDerWaalsContact C-CD 3.47Å; L266-P268 WeakPolarHBondContact O-CD 3.43Å
267F87.1Confident79.2Confident83 Ų8360.9 Ų60.936%0.36431%0.314SS..SBendtrans-123.275.1-177.9-59.6-76.9000111.3H197 V263 R265 F269H197-F267 HydrophobicContact CB-CZ 4.25Å; V263-F267 HydrophobicContact CG1-CD2 4.25Å; V263-F267 PolarHBondContact O-N 3.4Å; R265-F267 PolarHBondContact O-N 3.18Å; F267-F269 HydrophobicContact CB-CE2 4.48Å; F267-F269 VanDerWaalsContact O-CD2 3.22Å; F267-F269 WeakPolarHBondContact O-CD2 3.23Å; F267-F269 WeakPolarHBondContact O-CE2 3.43Å; F267-F269 PolarHBondContact O-N 3.11Å
268P76.5Confident78.1Confident52 Ų5259.2 Ų59.234%0.33829%0.289SS..  trans-73110.7178.928.9-33.3000110.5L266 R270 R271L266-P268 VanDerWaalsContact C-CD 3.47Å; L266-P268 WeakPolarHBondContact O-CD 3.43Å; P268-R270 VanDerWaalsContact C-N 3.25Å; P268-R270 PolarHBondContact O-N 3.32Å; P268-R271 HydrophobicContact CG-CG 4.49Å; P268-R271 VanDerWaalsContact CG-NE 3.31Å
269F63.3Low77.6Confident187 Ų18758.3 Ų58.382%0.8229%0.285SS*.SBendtrans-73.8-5.6-174.7-69.5-80.9000115.3F267 R271F267-F269 HydrophobicContact CB-CE2 4.48Å; F267-F269 VanDerWaalsContact O-CD2 3.22Å; F267-F269 WeakPolarHBondContact O-CD2 3.23Å; F267-F269 WeakPolarHBondContact O-CE2 3.43Å; F267-F269 PolarHBondContact O-N 3.11Å; F269-R271 PolarHBondContact O-N 2.95Å
270R60.4Low77.6Confident233 Ų23354.7 Ų54.788%0.87927%0.266SS*.  trans-93.126.7-173.3-62.7-171.9-179.2179.10.6114.7P268P268-R270 VanDerWaalsContact C-N 3.25Å; P268-R270 PolarHBondContact O-N 3.32Å
271R63.4Low77.5Confident82 Ų8250.4 Ų50.431%0.30924%0.236SC..  trans-107.2133.9-176-55.1-163.9-175.6176.50.2111.5P268 F269 V318 W375 H376P268-R271 HydrophobicContact CG-CG 4.49Å; P268-R271 VanDerWaalsContact CG-NE 3.31Å; F269-R271 PolarHBondContact O-N 2.95Å; R271-V318 HydrophobicContact CB-CG1 3.98Å; R271-V318 HydrophobicContact CG-CG1 4.45Å; R271-W375 VanDerWaalsContact O-CE2 3.26Å; R271-W375 WeakPolarHBondContact O-CZ2 3.48Å; R271-W375 PolarHBondContact O-NE1 3.44Å; R271-H376 HydrophobicContact CB-CB 4.4Å; R271-H376 WeakPolarHBondContact CB-ND1 3.43Å; R271-H376 WeakPolarHBondContact CD-CD2 3.25Å; R271-H376 WeakPolarHBondContact CD-NE2 3.22Å; R271-H376 PolarHBondContact NH1-NE2 3.46Å
272G67.6Low77.5Confident1 Ų149 Ų491%0.0123%0.233CC..  trans-71.1163.7178.800000114C274 H376G272-C274 PolarHBondContact O-N 2.95Å; G272-H376 PolarHBondContact O-ND1 3.13Å
273L71Confident77.3Confident3 Ų350 Ų502%0.01624%0.236CC..SBendtrans-57.2-49.5-175.3-179.569.9000113.4W283 V321 V329 T334 W375L273-W283 HydrophobicContact CD1-CD2 4.07Å; L273-W283 HydrophobicContact CD1-CG 3.94Å; L273-W283 HydrophobicContact CD2-CB 4.19Å; L273-W283 HydrophobicContact CD2-CD2 4.35Å; L273-W283 HydrophobicContact CD2-CE3 4.46Å; L273-W283 HydrophobicContact CD2-CG 4.23Å; L273-W283 HydrophobicContact CG-CB 4.24Å; L273-W283 HydrophobicContact CG-CG 4.11Å; L273-V321 HydrophobicContact CB-CB 4.39Å; L273-V321 HydrophobicContact CB-CG2 4.04Å; L273-V329 HydrophobicContact CD2-CB 3.97Å; L273-V329 HydrophobicContact CD2-CG2 4.35Å; L273-T334 HydrophobicContact CD1-CG2 3.72Å; L273-W375 HydrophobicContact CB-CE3 4.26Å; L273-W375 HydrophobicContact CB-CH2 3.88Å; L273-W375 HydrophobicContact CB-CZ2 4.48Å; L273-W375 HydrophobicContact CB-CZ3 3.75Å; L273-W375 HydrophobicContact CD1-CD2 4.32Å; L273-W375 HydrophobicContact CD1-CE3 3.42Å; L273-W375 VanDerWaalsContact CD1-CE3 3.42Å; L273-W375 HydrophobicContact CD1-CH2 4.47Å; L273-W375 HydrophobicContact CD1-CZ3 3.51Å; L273-W375 HydrophobicContact CG-CE3 4.45Å; L273-W375 HydrophobicContact CG-CZ3 4.19Å
274C63.6Low77.2Confident14 Ų1446.9 Ų46.910%0.09522%0.217CC..SBendtrans-104.6130.5178-66.30000109.9G272 M313 V321G272-C274 PolarHBondContact O-N 2.95Å; C274-M313 HydrophobicContact CB-CE 4.11Å; C274-V321 HydrophobicContact CB-CG2 4.1Å
275H62Low77.3Confident34 Ų3446.4 Ų46.416%0.15721%0.21CC..  trans-74.7162.6170.2-169.6-107000111.1Y277 W278 H376 H378 E379H275-Y277 AromaticContact CE1-CD2 3.99Å; H275-Y277 PolarHBondContact O-N 3.16Å; H275-Y277 VanDerWaalsContact O-N 3.1Å; H275-W278 VanDerWaalsContact O-CD1 3.27Å; H275-W278 PolarHBondContact O-N 3.33Å; H275-H376 AromaticContact CD2-CE1 3.88Å; H275-H378 AromaticContact CD2-CE1 3.61Å; H275-H378 AromaticContact CD2-ND1 4Å; H275-H378 AromaticContact CE1-ND1 3.97Å; H275-H378 AromaticContact CG-CE1 3.96Å; H275-H378 AromaticContact CG-ND1 3.89Å; H275-H378 AromaticContact ND1-ND1 3.86Å; H275-H378 AromaticContact NE2-CE1 3.67Å; H275-E379 IonicContact ND1-OE2 3.48Å
276A54.3Low77.3Confident31 Ų3146.8 Ų46.826%0.25621%0.212SC..THydrogen-bonded Turntrans-54.8-32.2-176.900000114.1
277Y57.5Low77.2Confident76 Ų7646.6 Ų46.630%0.29821%0.211SC..THydrogen-bonded Turntrans-92.85.8178.9-66.7-73.3000114.8H275 P416 L489H275-Y277 AromaticContact CE1-CD2 3.99Å; H275-Y277 PolarHBondContact O-N 3.16Å; H275-Y277 VanDerWaalsContact O-N 3.1Å; Y277-P416 HydrophobicContact CD1-CB 3.88Å; Y277-P416 HydrophobicContact CE1-CB 4.45Å; Y277-L489 HydrophobicContact CD1-CD2 4.19Å
278W72.2Confident77.3Confident26 Ų2643.4 Ų43.410%0.09820%0.202CC..  trans44.487178.8-7243.8000112.5H275 A284 S287 M313 L490 S493H275-W278 VanDerWaalsContact O-CD1 3.27Å; H275-W278 PolarHBondContact O-N 3.33Å; W278-A284 HydrophobicContact CE3-CB 4.14Å; W278-S287 VanDerWaalsContact CH2-CB 3.44Å; W278-S287 VanDerWaalsContact CZ3-CB 3.47Å; W278-M313 HydrophobicContact CH2-CE 4.23Å; W278-M313 HydrophobicContact CZ2-CE 3.57Å; W278-L490 HydrophobicContact CD2-CD1 4.48Å; W278-L490 HydrophobicContact CE3-CD1 3.65Å; W278-L490 HydrophobicContact CH2-CD1 3.32Å; W278-L490 HydrophobicContact CZ2-CD1 4.18Å; W278-L490 HydrophobicContact CZ3-CD1 3.01Å; W278-L490 HydrophobicContact CZ3-CG 4.47Å; W278-S493 VanDerWaalsContact CB-OG 3.31Å; W278-S493 WeakPolarHBondContact CB-OG 3.4Å; W278-S493 WeakPolarHBondContact O-CB 3.4Å; W278-S493 PolarHBondContact O-OG 3.04Å
279A86.4Confident78Confident3 Ų343 Ų433%0.02520%0.203CC..  trans-52138.8171.600000110.4N281 A284 F371 V377 E379A279-N281 PolarHBondContact O-N 2.93Å; A279-N281 PolarHBondContact O-OD1 2.61Å; A279-A284 WeakPolarHBondContact O-CB 3.28Å; A279-F371 HydrophobicContact CB-CZ 4.37Å; A279-V377 WeakPolarHBondContact CB-O 3.16Å; A279-E379 HydrophobicContact CB-CB 4.41Å
280P92.9Very high79.2Confident0 Ų034.3 Ų34.30%017%0.165CC..SBendtrans-73.667.1-177.234.2-42.8000111.7F371 S413 C496 A497 V500P280-F371 HydrophobicContact CG-CE1 4.09Å; P280-F371 HydrophobicContact CG-CZ 3.79Å; P280-F371 WeakPolarHBondContact O-CE1 3.16Å; P280-S413 WeakPolarHBondContact CG-OG 3.43Å; P280-C496 HydrophobicContact CB-CB 3.51Å; P280-C496 HydrophobicContact CG-CB 4.3Å; P280-A497 VanDerWaalsContact C-CB 3.45Å; P280-A497 HydrophobicContact CB-CB 4.19Å; P280-A497 WeakPolarHBondContact O-CA 3.29Å; P280-V500 HydrophobicContact CB-CG2 4.47Å; P280-V500 HydrophobicContact CG-CG2 4.34Å
281N93.4Very high80.4Confident4 Ų426 Ų262%0.02114%0.135CC..SBendtrans-116.2-177.3-174.36716.7000111.9A279 W283 A284 L285 F371 A497A279-N281 PolarHBondContact O-N 2.93Å; A279-N281 PolarHBondContact O-OD1 2.61Å; N281-W283 PolarHBondContact O-N 3.34Å; N281-W283 WeakPolarHBondContact OD1-CA 3.46Å; N281-W283 WeakPolarHBondContact OD1-CB 3.35Å; N281-W283 PolarHBondContact OD1-N 2.81Å; N281-A284 PolarHBondContact O-N 3.34Å; N281-A284 PolarHBondContact OD1-N 3.37Å; N281-L285 PolarHBondContact O-N 2.74Å; N281-F371 HydrophobicContact CB-CE1 4.37Å; N281-F371 VanDerWaalsContact CB-O 3.24Å; N281-F371 WeakPolarHBondContact CB-O 3.37Å; N281-A497 WeakPolarHBondContact O-CB 3.29Å
282A94.5Very high81.5Confident20 Ų2025 Ų2517%0.16514%0.144CC..Hα-helixtrans-63-29.3-179.300000112L285 Y286 L372 F373A282-L285 WeakPolarHBondContact O-CB 3.35Å; A282-L285 PolarHBondContact O-N 3.37Å; A282-Y286 PolarHBondContact O-N 3.16Å; A282-L372 VanDerWaalsContact CB-O 3.26Å; A282-L372 WeakPolarHBondContact CB-O 3.26Å; A282-L372 PolarHBondContact N-O 2.93Å; A282-F373 HydrophobicContact CB-CD1 3.83Å; A282-F373 HydrophobicContact CB-CE1 3.68Å
283W91.6Very high82.5Confident19 Ų1928.7 Ų28.77%0.07216%0.163CC..Hα-helixtrans-72.7-31.3178.6-46.5124.4000112.7L273 N281 L285 Y286 S287 V329 T334 F373 G374L273-W283 HydrophobicContact CD1-CD2 4.07Å; L273-W283 HydrophobicContact CD1-CG 3.94Å; L273-W283 HydrophobicContact CD2-CB 4.19Å; L273-W283 HydrophobicContact CD2-CD2 4.35Å; L273-W283 HydrophobicContact CD2-CE3 4.46Å; L273-W283 HydrophobicContact CD2-CG 4.23Å; L273-W283 HydrophobicContact CG-CB 4.24Å; L273-W283 HydrophobicContact CG-CG 4.11Å; N281-W283 PolarHBondContact O-N 3.34Å; N281-W283 WeakPolarHBondContact OD1-CA 3.46Å; N281-W283 WeakPolarHBondContact OD1-CB 3.35Å; N281-W283 PolarHBondContact OD1-N 2.81Å; W283-L285 VanDerWaalsContact C-N 3.34Å; W283-Y286 PolarHBondContact O-N 3.33Å; W283-S287 WeakPolarHBondContact O-CB 3.42Å; W283-S287 PolarHBondContact O-N 3.45Å; W283-S287 PolarHBondContact O-OG 2.87Å; W283-V329 HydrophobicContact CE3-CG1 4.31Å; W283-V329 HydrophobicContact CE3-CG2 4.18Å; W283-V329 HydrophobicContact CH2-CG1 3.75Å; W283-V329 HydrophobicContact CZ2-CG1 4.39Å; W283-V329 HydrophobicContact CZ3-CB 4.33Å; W283-V329 HydrophobicContact CZ3-CG1 3.7Å; W283-V329 HydrophobicContact CZ3-CG2 3.9Å; W283-T334 HydrophobicContact CH2-CG2 4.04Å; W283-T334 HydrophobicContact CZ2-CG2 3.47Å; W283-T334 VanDerWaalsContact CZ2-CG2 3.47Å; W283-F373 HydrophobicContact CZ2-CB 4.38Å; W283-F373 WeakPolarHBondContact CZ2-O 3.38Å; W283-F373 PolarHBondContact NE1-O 2.98Å; W283-G374 PolarHBondContact NE1-O 3.02Å
284A91.1Very high83.2Confident0 Ų029 Ų290%017%0.166CC..Hα-helixtrans-62.2-42.1169.900000111.5W278 A279 N281 G288 V494 A497W278-A284 HydrophobicContact CE3-CB 4.14Å; A279-A284 WeakPolarHBondContact O-CB 3.28Å; N281-A284 PolarHBondContact O-N 3.34Å; N281-A284 PolarHBondContact OD1-N 3.37Å; A284-G288 PolarHBondContact O-N 3.5Å; A284-V494 WeakPolarHBondContact O-CG2 3.05Å; A284-A497 HydrophobicContact CB-CB 4.32Å
285L93.6Very high84.3Confident50 Ų5032.2 Ų32.226%0.26219%0.185SC..Hα-helixtrans-63.4-43.8173.6-61.5177000111.4N281 A282 W283 G288 A289 V494 A497 V498N281-L285 PolarHBondContact O-N 2.74Å; A282-L285 WeakPolarHBondContact O-CB 3.35Å; A282-L285 PolarHBondContact O-N 3.37Å; W283-L285 VanDerWaalsContact C-N 3.34Å; L285-G288 PolarHBondContact O-N 2.91Å; L285-A289 WeakPolarHBondContact O-CB 3.32Å; L285-A289 PolarHBondContact O-N 3.24Å; L285-V494 HydrophobicContact CD2-CG1 4.07Å; L285-V494 WeakPolarHBondContact CD2-O 3.12Å; L285-A497 HydrophobicContact CD1-CB 4.26Å; L285-A497 HydrophobicContact CD2-CB 3.71Å; L285-A497 HydrophobicContact CG-CB 3.67Å; L285-V498 HydrophobicContact CD2-CG2 3.74Å
286Y91.6Very high85.4Confident58 Ų5835 Ų3523%0.22720%0.201CC..Hα-helixtrans-62.3-49.2179.1-169.8-95.7000112.1A282 W283 G288 A289 D290 H323 L326 P327 V329A282-Y286 PolarHBondContact O-N 3.16Å; W283-Y286 PolarHBondContact O-N 3.33Å; Y286-G288 VanDerWaalsContact C-N 3.34Å; Y286-G288 PolarHBondContact O-N 3.16Å; Y286-A289 PolarHBondContact O-N 2.82Å; Y286-D290 PolarHBondContact O-N 3.06Å; Y286-H323 AromaticContact CD1-CD2 3.77Å; Y286-H323 AromaticContact CD1-CE1 3.93Å; Y286-H323 AromaticContact CD1-NE2 3.42Å; Y286-H323 WeakPolarHBondContact CD1-NE2 3.46Å; Y286-H323 AromaticContact CE1-CD2 3.79Å; Y286-H323 AromaticContact CE1-CE1 3.88Å; Y286-H323 AromaticContact CE1-NE2 3.71Å; Y286-L326 HydrophobicContact CD1-CD1 4.13Å; Y286-L326 HydrophobicContact CD2-CD1 3.97Å; Y286-L326 HydrophobicContact CE1-CB 3.72Å; Y286-L326 HydrophobicContact CE1-CD1 3.92Å; Y286-L326 HydrophobicContact CE1-CG 4.47Å; Y286-L326 HydrophobicContact CE2-CB 4.39Å; Y286-L326 HydrophobicContact CE2-CD1 3.76Å; Y286-L326 HydrophobicContact CG-CD1 4.17Å; Y286-L326 WeakPolarHBondContact O-CD1 3.43Å; Y286-L326 WeakPolarHBondContact OH-CB 3.41Å; Y286-P327 WeakPolarHBondContact OH-CD 3.27Å; Y286-P327 WeakPolarHBondContact OH-CG 3.29Å; Y286-P327 PolarHBondContact OH-O 2.89Å; Y286-V329 HydrophobicContact CD1-CG2 4.28Å; Y286-V329 HydrophobicContact CE1-CG2 3.83Å
287S88.1Confident86.9Confident3 Ų334 Ų342%0.02119%0.193CC..Hα-helixtrans-67.1-33.3175.7-70.70000112.5W278 W283 K291 H323W278-S287 VanDerWaalsContact CH2-CB 3.44Å; W278-S287 VanDerWaalsContact CZ3-CB 3.47Å; W283-S287 WeakPolarHBondContact O-CB 3.42Å; W283-S287 PolarHBondContact O-N 3.45Å; W283-S287 PolarHBondContact O-OG 2.87Å; S287-K291 WeakPolarHBondContact O-CG 3.48Å; S287-K291 PolarHBondContact O-N 2.93Å; S287-K291 VanDerWaalsContact O-N 3.13Å; S287-H323 PolarHBondContact OG-NE2 2.82Å
288G88.6Confident88.2Confident16 Ų1632 Ų3217%0.16519%0.189CC..Hα-helixtrans-64.2-42.9171.700000112.4A284 L285 Y286 K291 A292A284-G288 PolarHBondContact O-N 3.5Å; L285-G288 PolarHBondContact O-N 2.91Å; Y286-G288 VanDerWaalsContact C-N 3.34Å; Y286-G288 PolarHBondContact O-N 3.16Å; G288-K291 PolarHBondContact O-N 3.41Å; G288-A292 PolarHBondContact O-N 3.08Å
289A91.1Very high88.9Confident43 Ų4340.6 Ų40.636%0.35522%0.221SC..Hα-helixtrans-64.8-43.5175.100000111.9L285 Y286 K291 A292 L293 L326L285-A289 WeakPolarHBondContact O-CB 3.32Å; L285-A289 PolarHBondContact O-N 3.24Å; Y286-A289 PolarHBondContact O-N 2.82Å; A289-K291 VanDerWaalsContact C-N 3.32Å; A289-K291 PolarHBondContact O-N 3.38Å; A289-A292 PolarHBondContact O-N 3Å; A289-L293 WeakPolarHBondContact O-CB 3.19Å; A289-L293 VanDerWaalsContact O-CG 3.29Å; A289-L293 WeakPolarHBondContact O-CG 3.28Å; A289-L293 PolarHBondContact O-N 3.4Å; A289-L326 HydrophobicContact CB-CD1 4.38Å
290D88.4Confident89Confident4 Ų445.5 Ų45.52%0.02125%0.247CC..Hα-helixtrans-53.9-47.5174.2-177.568.6000111.8Y286 L293 A294 A324 V325 L326Y286-D290 PolarHBondContact O-N 3.06Å; D290-L293 PolarHBondContact O-N 2.92Å; D290-A294 WeakPolarHBondContact O-CB 3.5Å; D290-A294 PolarHBondContact O-N 3.1Å; D290-A324 PolarHBondContact OD1-N 2.95Å; D290-A324 VanDerWaalsContact OD1-N 3.16Å; D290-A324 PolarHBondContact OD2-N 2.95Å; D290-V325 WeakPolarHBondContact OD1-CA 3.46Å; D290-V325 PolarHBondContact OD1-N 3.47Å; D290-L326 HydrophobicContact CB-CB 4.33Å; D290-L326 HydrophobicContact CB-CD1 3.96Å; D290-L326 HydrophobicContact CB-CG 4.14Å; D290-L326 PolarHBondContact OD1-N 3.15Å
291K85.5Confident88.5Confident60 Ų6054.6 Ų54.626%0.26129%0.286SS..Hα-helixtrans-65.9-40.8177.2-67.6-57.6-177.8-165.20112.8S287 G288 A289 L293 A294 V295S287-K291 WeakPolarHBondContact O-CG 3.48Å; S287-K291 PolarHBondContact O-N 2.93Å; S287-K291 VanDerWaalsContact O-N 3.13Å; G288-K291 PolarHBondContact O-N 3.41Å; A289-K291 VanDerWaalsContact C-N 3.32Å; A289-K291 PolarHBondContact O-N 3.38Å; K291-L293 VanDerWaalsContact C-N 3.35Å; K291-A294 PolarHBondContact O-N 3.14Å; K291-V295 WeakPolarHBondContact O-CG2 3.27Å; K291-V295 PolarHBondContact O-N 3.1Å
292A87.6Confident87.7Confident61 Ų6160.9 Ų60.950%0.50432%0.319SS..Hα-helixtrans-63.1-42.6176.700000111.6G288 A289 V295 L296G288-A292 PolarHBondContact O-N 3.08Å; A289-A292 PolarHBondContact O-N 3Å; A292-V295 PolarHBondContact O-N 2.84Å; A292-L296 WeakPolarHBondContact O-CB 3.41Å; A292-L296 PolarHBondContact O-N 3.22Å
293L88.2Confident86.9Confident77 Ų7762.7 Ų62.740%0.40333%0.325SS..Hα-helixtrans-65.3-41.6176.3-70.6173.1000111.9A289 D290 K291 L296 G297 V325 L326A289-L293 WeakPolarHBondContact O-CB 3.19Å; A289-L293 VanDerWaalsContact O-CG 3.29Å; A289-L293 WeakPolarHBondContact O-CG 3.28Å; A289-L293 PolarHBondContact O-N 3.4Å; D290-L293 PolarHBondContact O-N 2.92Å; K291-L293 VanDerWaalsContact C-N 3.35Å; L293-L296 PolarHBondContact O-N 3.24Å; L293-G297 PolarHBondContact O-N 3.5Å; L293-V325 HydrophobicContact CB-CB 4.39Å; L293-V325 HydrophobicContact CB-CG1 4.21Å; L293-V325 HydrophobicContact CB-CG2 4.42Å; L293-V325 HydrophobicContact CD1-CG1 4.42Å; L293-L326 HydrophobicContact CD1-CD2 3.99Å; L293-L326 HydrophobicContact CD1-CG 4.26Å
294A85.5Confident86Confident10 Ų1068 Ų688%0.08335%0.351CS..Hα-helixtrans-60.4-47.5175.600000111.6D290 K291 L296 G297 V298 L308 V325D290-A294 WeakPolarHBondContact O-CB 3.5Å; D290-A294 PolarHBondContact O-N 3.1Å; K291-A294 PolarHBondContact O-N 3.14Å; A294-L296 PolarHBondContact O-N 3.39Å; A294-G297 PolarHBondContact O-N 2.71Å; A294-V298 WeakPolarHBondContact O-CG2 3.36Å; A294-V298 PolarHBondContact O-N 3.33Å; A294-L308 HydrophobicContact CB-CD2 4.21Å; A294-V325 HydrophobicContact CB-CG2 3.99Å
295V85.3Confident84.7Confident82 Ų8275.1 Ų75.150%0.49738%0.384SS..Hα-helixtrans-63.4-41.9177.8172.50000111.4K291 A292 R299K291-V295 WeakPolarHBondContact O-CG2 3.27Å; K291-V295 PolarHBondContact O-N 3.1Å; A292-V295 PolarHBondContact O-N 2.84Å; V295-R299 WeakPolarHBondContact O-CB 3.38Å; V295-R299 WeakPolarHBondContact O-CG 3.45Å; V295-R299 PolarHBondContact O-N 3.3Å
296L86.9Confident83.1Confident93 Ų9377.3 Ų77.349%0.48741%0.409SS..Hα-helixtrans-66.4-42.5178.1-174.164.1000111.6A292 L293 A294 V298 R299 L300A292-L296 WeakPolarHBondContact O-CB 3.41Å; A292-L296 PolarHBondContact O-N 3.22Å; L293-L296 PolarHBondContact O-N 3.24Å; A294-L296 PolarHBondContact O-N 3.39Å; L296-V298 PolarHBondContact O-N 3.34Å; L296-R299 PolarHBondContact O-N 3.03Å; L296-L300 HydrophobicContact CD1-CD1 3.94Å; L296-L300 HydrophobicContact CD1-CG 4.15Å; L296-L300 HydrophobicContact CD2-CD1 4.41Å; L296-L300 HydrophobicContact CG-CD1 3.8Å; L296-L300 HydrophobicContact CG-CG 4.33Å; L296-L300 WeakPolarHBondContact O-CB 3.38Å; L296-L300 VanDerWaalsContact O-CG 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.3Å; L296-L300 PolarHBondContact O-N 3Å
297G85.1Confident81.6Confident8 Ų881.2 Ų81.28%0.08243%0.43CS..Hα-helixtrans-63.1-40.2178.400000112.8L293 A294 L300 K301 L302 L303L293-G297 PolarHBondContact O-N 3.5Å; A294-G297 PolarHBondContact O-N 2.71Å; G297-L300 PolarHBondContact O-N 2.89Å; G297-K301 PolarHBondContact O-N 3.47Å; G297-K301 VanDerWaalsContact O-N 3.17Å; G297-L302 PolarHBondContact O-N 3.29Å; G297-L303 PolarHBondContact O-N 2.95Å
298V85.5Confident80.4Confident36 Ų3683 Ų8322%0.21844%0.439CS..Hα-helixtrans-64.5-46.5172.5171.30000111A294 L296 L300 K301 L303 E305 L308A294-V298 WeakPolarHBondContact O-CG2 3.36Å; A294-V298 PolarHBondContact O-N 3.33Å; L296-V298 PolarHBondContact O-N 3.34Å; V298-L300 VanDerWaalsContact C-N 3.29Å; V298-L300 PolarHBondContact O-N 2.91Å; V298-K301 PolarHBondContact O-N 3.49Å; V298-L303 HydrophobicContact CG2-CB 4.5Å; V298-E305 HydrophobicContact CB-CG 4.48Å; V298-E305 HydrophobicContact CG1-CG 3.6Å; V298-E305 HydrophobicContact CG2-CG 3.97Å; V298-L308 HydrophobicContact CG2-CD1 3.61Å
299R86.1Confident79Confident206 Ų20685 Ų8578%0.77745%0.449SS*.Hα-helixtrans-62.9-34.8178.9-76.9-174.1178.4-160.60.6113.2V295 L296 K301V295-R299 WeakPolarHBondContact O-CB 3.38Å; V295-R299 WeakPolarHBondContact O-CG 3.45Å; V295-R299 PolarHBondContact O-N 3.3Å; L296-R299 PolarHBondContact O-N 3.03Å; R299-K301 VanDerWaalsContact C-N 3.28Å
300L87.6Confident77.1Confident106 Ų10694.5 Ų94.556%0.55548%0.476SS*.THydrogen-bonded Turntrans-85.63.7177.4-65.2177.5000113.2L296 G297 V298 L302L296-L300 HydrophobicContact CD1-CD1 3.94Å; L296-L300 HydrophobicContact CD1-CG 4.15Å; L296-L300 HydrophobicContact CD2-CD1 4.41Å; L296-L300 HydrophobicContact CG-CD1 3.8Å; L296-L300 HydrophobicContact CG-CG 4.33Å; L296-L300 WeakPolarHBondContact O-CB 3.38Å; L296-L300 VanDerWaalsContact O-CG 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.3Å; L296-L300 PolarHBondContact O-N 3Å; G297-L300 PolarHBondContact O-N 2.89Å; V298-L300 VanDerWaalsContact C-N 3.29Å; V298-L300 PolarHBondContact O-N 2.91Å; L300-L302 HydrophobicContact CB-CD1 4.02Å; L300-L302 HydrophobicContact CB-CG 4.01Å; L300-L302 HydrophobicContact CD1-CD1 4.26Å; L300-L302 PolarHBondContact O-N 3.39Å
301K82.6Confident75.3Confident191 Ų19196.7 Ų96.783%0.8349%0.494SS*.THydrogen-bonded Turntrans5723.3-176.5-54-178.9179.3-179.70114.2G297 V298 R299G297-K301 PolarHBondContact O-N 3.47Å; G297-K301 VanDerWaalsContact O-N 3.17Å; V298-K301 PolarHBondContact O-N 3.49Å; R299-K301 VanDerWaalsContact C-N 3.28Å
302L78.4Confident73.4Confident135 Ų13595.8 Ų95.871%0.70750%0.498SS*.SBendtrans-85.4-20.3175.8-64.2174.5000112G297 L300G297-L302 PolarHBondContact O-N 3.29Å; L300-L302 HydrophobicContact CB-CD1 4.02Å; L300-L302 HydrophobicContact CB-CG 4.01Å; L300-L302 HydrophobicContact CD1-CD1 4.26Å; L300-L302 PolarHBondContact O-N 3.39Å
303L76.8Confident71.3Confident58 Ų5894.4 Ų94.430%0.30448%0.481SS..SBendtrans-129.6139.5176.7-64.2172.7000109G297 V298 V325G297-L303 PolarHBondContact O-N 2.95Å; V298-L303 HydrophobicContact CG2-CB 4.5Å; L303-V325 HydrophobicContact CD1-CG2 3.91Å
304Q72.3Confident69.1Low130 Ų13093.8 Ų93.861%0.60748%0.481SS*.  trans-89.3136.8171.6-64.4-175.713.100109.7A306 E307Q304-A306 PolarHBondContact O-N 3.22Å; Q304-A306 VanDerWaalsContact O-N 3.08Å; Q304-E307 HydrophobicContact CB-CG 4.3Å; Q304-E307 PolarHBondContact O-N 3.37Å
305E64.3Low66.9Low151 Ų15195.6 Ų95.671%0.70650%0.5SS*.G310 helixtrans-57.4-26.1178.2-70.9-172.7168.300113V298 E307V298-E305 HydrophobicContact CB-CG 4.48Å; V298-E305 HydrophobicContact CG1-CG 3.6Å; V298-E305 HydrophobicContact CG2-CG 3.97Å; E305-E307 VanDerWaalsContact C-N 3.31Å; E305-E307 PolarHBondContact O-N 3.25Å
306A60Low64.7Low95 Ų9593.9 Ų93.979%0.78550%0.499SS*.G310 helixtrans-70.6-22.8178.500000114Q304Q304-A306 PolarHBondContact O-N 3.22Å; Q304-A306 VanDerWaalsContact O-N 3.08Å
307E60.3Low62.4Low140 Ų14095.4 Ų95.465%0.65451%0.507SS*.G310 helixtrans-91.3-12.4-178.1-64.4179.3157.200112.6Q304 E305Q304-E307 HydrophobicContact CB-CG 4.3Å; Q304-E307 PolarHBondContact O-N 3.37Å; E305-E307 VanDerWaalsContact C-N 3.31Å; E305-E307 PolarHBondContact O-N 3.25Å
308L61.8Low60.4Low41 Ų4198.1 Ų98.122%0.21552%0.522CS..SBendtrans-79.4132.3179.5-70.1166.2000110.2A294 V298 R310 A324A294-L308 HydrophobicContact CB-CD2 4.21Å; V298-L308 HydrophobicContact CG2-CD1 3.61Å; L308-R310 PolarHBondContact O-N 3.08Å; L308-R310 VanDerWaalsContact O-N 3.13Å; L308-A324 HydrophobicContact CD2-CB 3.79Å
309P59.3Low58.7Low57 Ų57101.5 Ų101.537%0.3754%0.535SS..PPolyproline II helixtrans-55.5123172.6-18.127.3000109.5A311P309-A311 PolarHBondContact O-N 3.49Å
310R52.8Low57.2Low244 Ų24498.7 Ų98.792%0.92153%0.531SS*.PPolyproline II helixtrans-52.5127.7172-84.6-177177.2172.30.1108L308 A312L308-R310 PolarHBondContact O-N 3.08Å; L308-R310 VanDerWaalsContact O-N 3.13Å; R310-A312 PolarHBondContact O-N 3.26Å
311A50.3Low55.7Low49 Ų4994.3 Ų94.341%0.40551%0.509SS..  trans-50.395.8-164.700000113.3P309 M313 T314P309-A311 PolarHBondContact O-N 3.49Å; A311-M313 PolarHBondContact O-N 2.82Å; A311-T314 HydrophobicContact CB-CG2 4.09Å; A311-T314 PolarHBondContact O-OG1 2.96Å
312A44.9Very low54.8Low42 Ų4291.4 Ų91.435%0.34750%0.498SS..G310 helixtrans-73.3-7.9171.900000112.3R310 T314R310-A312 PolarHBondContact O-N 3.26Å; A312-T314 VanDerWaalsContact C-N 3.27Å; A312-T314 PolarHBondContact O-N 2.92Å
313M43.9Very low54.8Low32 Ų3285.8 Ų85.816%0.15847%0.468CS..G310 helixtrans-79.8-2.4-179-69.1-62.9-86.300114.5C274 W278 A311 V321C274-M313 HydrophobicContact CB-CE 4.11Å; W278-M313 HydrophobicContact CH2-CE 4.23Å; W278-M313 HydrophobicContact CZ2-CE 3.57Å; A311-M313 PolarHBondContact O-N 2.82Å; M313-V321 HydrophobicContact CE-CB 4.2Å; M313-V321 HydrophobicContact CE-CG1 3.59Å; M313-V321 HydrophobicContact CE-CG2 3.65Å; M313-V321 HydrophobicContact CG-CG1 4.43Å; M313-V321 HydrophobicContact SD-CB 3.74Å; M313-V321 HydrophobicContact SD-CG1 3.4Å; M313-V321 WeakPolarHBondContact SD-CG1 3.18Å; M313-V321 HydrophobicContact SD-CG2 3.41Å; M313-V321 WeakPolarHBondContact SD-CG2 3.28Å
314T42.6Very low54.7Low64 Ų6484.4 Ų84.439%0.39347%0.465SS..G310 helixtrans-116.815.6-167.355.60000113.3A311 A312 F486A311-T314 HydrophobicContact CB-CG2 4.09Å; A311-T314 PolarHBondContact O-OG1 2.96Å; A312-T314 VanDerWaalsContact C-N 3.27Å; A312-T314 PolarHBondContact O-N 2.92Å; T314-F486 VanDerWaalsContact CB-CE2 3.48Å; T314-F486 HydrophobicContact CG2-CD2 3.63Å; T314-F486 HydrophobicContact CG2-CE2 4.15Å; T314-F486 HydrophobicContact CG2-CG 4.26Å; T314-F486 WeakPolarHBondContact O-CE2 3.29Å; T314-F486 WeakPolarHBondContact O-CZ 3.45Å
315G39.3Very low55.1Low47 Ų4781.2 Ų81.249%0.48545%0.454SS..SBendtrans-89.9-10.5-175.500000115.8L317G315-L317 PolarHBondContact O-N 3.25Å
316G38.4Very low56.2Low46 Ų4676 Ų7647%0.47443%0.431SS..SBendtrans64.3-16-169.100000114.6
317L37.4Very low57.4Low125 Ų12576 Ų7665%0.65442%0.423SS*.SBendtrans-80.6137.4170.9-67.5164.2000109.7G315 Q319G315-L317 PolarHBondContact O-N 3.25Å; L317-Q319 HydrophobicContact CB-CG 4.34Å; L317-Q319 PolarHBondContact O-N 2.87Å
318V44.8Very low58.6Low65 Ų6573.2 Ų73.239%0.39442%0.419SS..  trans-6974.9179.4-175.90000109.6R271R271-V318 HydrophobicContact CB-CG1 3.98Å; R271-V318 HydrophobicContact CG-CG1 4.45Å
319Q49Very low59.8Low108 Ų10872.2 Ų72.251%0.50542%0.415SS..  trans-98.3153175.5-67.2-174.7-12.300110.6L317 V321L317-Q319 HydrophobicContact CB-CG 4.34Å; L317-Q319 PolarHBondContact O-N 2.87Å; Q319-V321 PolarHBondContact O-N 2.83Å
320E54.1Low61.2Low146 Ų14672.8 Ų72.868%0.68242%0.418SS*.  trans-61.7126.7177.4-68.2-176.9170.200110.3Q322E320-Q322 PolarHBondContact O-N 3.2Å; E320-Q322 VanDerWaalsContact O-N 3.14Å
321V56.8Low62.9Low15 Ų1564.5 Ų64.59%0.09140%0.396CS..  trans-69.6109.8-179.51770000109L273 C274 M313 Q319 H323L273-V321 HydrophobicContact CB-CB 4.39Å; L273-V321 HydrophobicContact CB-CG2 4.04Å; C274-V321 HydrophobicContact CB-CG2 4.1Å; M313-V321 HydrophobicContact CE-CB 4.2Å; M313-V321 HydrophobicContact CE-CG1 3.59Å; M313-V321 HydrophobicContact CE-CG2 3.65Å; M313-V321 HydrophobicContact CG-CG1 4.43Å; M313-V321 HydrophobicContact SD-CB 3.74Å; M313-V321 HydrophobicContact SD-CG1 3.4Å; M313-V321 WeakPolarHBondContact SD-CG1 3.18Å; M313-V321 HydrophobicContact SD-CG2 3.41Å; M313-V321 WeakPolarHBondContact SD-CG2 3.28Å; Q319-V321 PolarHBondContact O-N 2.83Å; V321-H323 VanDerWaalsContact CG1-CE1 3.4Å; V321-H323 WeakPolarHBondContact CG1-CE1 3.48Å
322Q64.3Low64.8Low129 Ų12965.7 Ų65.760%0.60341%0.406SS*.  trans-93.7110.1162.6-67.3-171.8-6.400108.7E320E320-Q322 PolarHBondContact O-N 3.2Å; E320-Q322 VanDerWaalsContact O-N 3.14Å
323H77.5Confident67Low18 Ų1865.3 Ų65.38%0.08340%0.403CS..  trans-71.1142.6172.1-65.293.7000109.8Y286 S287 V321 L326Y286-H323 AromaticContact CD1-CD2 3.77Å; Y286-H323 AromaticContact CD1-CE1 3.93Å; Y286-H323 AromaticContact CD1-NE2 3.42Å; Y286-H323 WeakPolarHBondContact CD1-NE2 3.46Å; Y286-H323 AromaticContact CE1-CD2 3.79Å; Y286-H323 AromaticContact CE1-CE1 3.88Å; Y286-H323 AromaticContact CE1-NE2 3.71Å; S287-H323 PolarHBondContact OG-NE2 2.82Å; V321-H323 VanDerWaalsContact CG1-CE1 3.4Å; V321-H323 WeakPolarHBondContact CG1-CE1 3.48Å; H323-L326 HydrophobicContact CB-CB 4.35Å; H323-L326 WeakPolarHBondContact CB-O 3.29Å
324A74.4Confident69.4Low28 Ų2863.9 Ų63.923%0.23140%0.396CS..SBendtrans-87.3-31.7-170.200000113.2D290 L308D290-A324 PolarHBondContact OD1-N 2.95Å; D290-A324 VanDerWaalsContact OD1-N 3.16Å; D290-A324 PolarHBondContact OD2-N 2.95Å; L308-A324 HydrophobicContact CD2-CB 3.79Å
325V81.6Confident71.7Confident64 Ų6465.8 Ų65.839%0.38840%0.403SS..SBendtrans-122.3-43.4-178.5-179.80000110.6D290 L293 A294 L303D290-V325 WeakPolarHBondContact OD1-CA 3.46Å; D290-V325 PolarHBondContact OD1-N 3.47Å; L293-V325 HydrophobicContact CB-CB 4.39Å; L293-V325 HydrophobicContact CB-CG1 4.21Å; L293-V325 HydrophobicContact CB-CG2 4.42Å; L293-V325 HydrophobicContact CD1-CG1 4.42Å; A294-V325 HydrophobicContact CB-CG2 3.99Å; L303-V325 HydrophobicContact CD1-CG2 3.91Å
326L86.1Confident74.4Confident42 Ų4268.3 Ų68.322%0.2241%0.405CS..SBendtrans-80.8153.7178.9-66.1-177.4000111.3Y286 A289 D290 L293 H323Y286-L326 HydrophobicContact CD1-CD1 4.13Å; Y286-L326 HydrophobicContact CD2-CD1 3.97Å; Y286-L326 HydrophobicContact CE1-CB 3.72Å; Y286-L326 HydrophobicContact CE1-CD1 3.92Å; Y286-L326 HydrophobicContact CE1-CG 4.47Å; Y286-L326 HydrophobicContact CE2-CB 4.39Å; Y286-L326 HydrophobicContact CE2-CD1 3.76Å; Y286-L326 HydrophobicContact CG-CD1 4.17Å; Y286-L326 WeakPolarHBondContact O-CD1 3.43Å; Y286-L326 WeakPolarHBondContact OH-CB 3.41Å; A289-L326 HydrophobicContact CB-CD1 4.38Å; D290-L326 HydrophobicContact CB-CB 4.33Å; D290-L326 HydrophobicContact CB-CD1 3.96Å; D290-L326 HydrophobicContact CB-CG 4.14Å; D290-L326 PolarHBondContact OD1-N 3.15Å; L293-L326 HydrophobicContact CD1-CD2 3.99Å; L293-L326 HydrophobicContact CD1-CG 4.26Å; H323-L326 HydrophobicContact CB-CB 4.35Å; H323-L326 WeakPolarHBondContact CB-O 3.29Å
327P86.7Confident77.2Confident93 Ų9368.5 Ų68.560%0.60440%0.399SS*.PPolyproline II helixtrans-66.3145.1177.624.9-33000112.1Y286 V329Y286-P327 WeakPolarHBondContact OH-CD 3.27Å; Y286-P327 WeakPolarHBondContact OH-CG 3.29Å; Y286-P327 PolarHBondContact OH-O 2.89Å; P327-V329 PolarHBondContact O-N 3.48Å
328S85Confident80Confident83 Ų8363.4 Ų63.458%0.5837%0.373SS*.PPolyproline II helixtrans-63.3137.2172.6590000110.4P330S328-P330 WeakPolarHBondContact O-CD 3.39Å
329V87.5Confident82.4Confident20 Ų2065.2 Ų65.212%0.12138%0.38CS..  trans-93.1115.3-179.1-176.20000108.4L273 W283 Y286 P327 A333 T334 W375L273-V329 HydrophobicContact CD2-CB 3.97Å; L273-V329 HydrophobicContact CD2-CG2 4.35Å; W283-V329 HydrophobicContact CE3-CG1 4.31Å; W283-V329 HydrophobicContact CE3-CG2 4.18Å; W283-V329 HydrophobicContact CH2-CG1 3.75Å; W283-V329 HydrophobicContact CZ2-CG1 4.39Å; W283-V329 HydrophobicContact CZ3-CB 4.33Å; W283-V329 HydrophobicContact CZ3-CG1 3.7Å; W283-V329 HydrophobicContact CZ3-CG2 3.9Å; Y286-V329 HydrophobicContact CD1-CG2 4.28Å; Y286-V329 HydrophobicContact CE1-CG2 3.83Å; P327-V329 PolarHBondContact O-N 3.48Å; V329-A333 HydrophobicContact CG1-CB 4.13Å; V329-T334 HydrophobicContact CG1-CG2 3.6Å; V329-W375 VanDerWaalsContact O-CZ3 3.3Å; V329-W375 WeakPolarHBondContact O-CZ3 3.13Å
330P88.1Confident84.7Confident68 Ų6865.1 Ų65.144%0.44238%0.382SS..  trans-79157.1177.230.4-34.7000111.8S328 A332 A333 T334S328-P330 WeakPolarHBondContact O-CD 3.39Å; P330-A332 PolarHBondContact O-N 3.47Å; P330-A332 VanDerWaalsContact O-N 3.15Å; P330-A333 HydrophobicContact CG-CB 3.79Å; P330-A333 WeakPolarHBondContact O-CB 3.4Å; P330-A333 PolarHBondContact O-N 3.4Å; P330-T334 PolarHBondContact O-N 2.83Å
331P87.8Confident86.7Confident70 Ų7058.9 Ų58.946%0.45536%0.355SS..Hα-helixtrans-52.6-38.5175.9-26.532.8000113.6A333 T334 L335 W375P331-A333 VanDerWaalsContact C-N 3.32Å; P331-A333 PolarHBondContact O-N 3.31Å; P331-T334 PolarHBondContact O-N 3.32Å; P331-T334 PolarHBondContact O-OG1 3.07Å; P331-L335 PolarHBondContact O-N 3.3Å; P331-W375 HydrophobicContact CB-CD2 4.05Å; P331-W375 HydrophobicContact CB-CE3 4.05Å; P331-W375 HydrophobicContact CB-CG 4.44Å; P331-W375 HydrophobicContact CB-CZ3 4.44Å; P331-W375 HydrophobicContact CG-CD2 3.9Å; P331-W375 HydrophobicContact CG-CE3 3.88Å; P331-W375 HydrophobicContact CG-CH2 3.82Å; P331-W375 HydrophobicContact CG-CZ2 3.84Å; P331-W375 HydrophobicContact CG-CZ3 3.83Å
332A90.1Very high88.6Confident74 Ų7458.7 Ų58.761%0.61235%0.354SS*.Hα-helixtrans-61.2-38177.300000113.1P330 L335 L336P330-A332 PolarHBondContact O-N 3.47Å; P330-A332 VanDerWaalsContact O-N 3.15Å; A332-L335 PolarHBondContact O-N 2.98Å; A332-L336 PolarHBondContact O-N 2.95Å
333A92.3Very high90Very high34 Ų3457 Ų5728%0.28135%0.349SS..Hα-helixtrans-67.1-42176.500000111V329 P330 P331 L335 L336 C337V329-A333 HydrophobicContact CG1-CB 4.13Å; P330-A333 HydrophobicContact CG-CB 3.79Å; P330-A333 WeakPolarHBondContact O-CB 3.4Å; P330-A333 PolarHBondContact O-N 3.4Å; P331-A333 VanDerWaalsContact C-N 3.32Å; P331-A333 PolarHBondContact O-N 3.31Å; A333-L335 VanDerWaalsContact C-N 3.33Å; A333-L335 PolarHBondContact O-N 2.82Å; A333-L336 PolarHBondContact O-N 3.47Å; A333-C337 PolarHBondContact O-N 2.95Å; A333-C337 PolarHBondContact O-SG 3.47Å; A333-C337 VanDerWaalsContact O-SG 3.34Å
334T92.8Very high90.8Very high2 Ų258.6 Ų58.61%0.01236%0.361CS..Hα-helixtrans-62.5-39.9176.869.90000112.3L273 W283 V329 P330 P331 C337 T338 F373 W375L273-T334 HydrophobicContact CD1-CG2 3.72Å; W283-T334 HydrophobicContact CH2-CG2 4.04Å; W283-T334 HydrophobicContact CZ2-CG2 3.47Å; W283-T334 VanDerWaalsContact CZ2-CG2 3.47Å; V329-T334 HydrophobicContact CG1-CG2 3.6Å; P330-T334 PolarHBondContact O-N 2.83Å; P331-T334 PolarHBondContact O-N 3.32Å; P331-T334 PolarHBondContact O-OG1 3.07Å; T334-C337 PolarHBondContact O-N 3.29Å; T334-T338 WeakPolarHBondContact O-CB 3.32Å; T334-T338 PolarHBondContact O-N 3.42Å; T334-T338 PolarHBondContact O-OG1 2.86Å; T334-F373 VanDerWaalsContact CB-O 3.3Å; T334-F373 WeakPolarHBondContact CB-O 3.38Å; T334-W375 HydrophobicContact CG2-CE3 3.76Å; T334-W375 HydrophobicContact CG2-CZ3 4.4Å; T334-W375 WeakPolarHBondContact OG1-CB 3.36Å
335L92.6Very high91.6Very high104 Ų10457.3 Ų57.355%0.54535%0.35SS..Hα-helixtrans-62.1-46.8174.4178.762.9000110.8P331 A332 A333 T338 L339P331-L335 PolarHBondContact O-N 3.3Å; A332-L335 PolarHBondContact O-N 2.98Å; A333-L335 VanDerWaalsContact C-N 3.33Å; A333-L335 PolarHBondContact O-N 2.82Å; L335-T338 PolarHBondContact O-N 3.4Å; L335-L339 HydrophobicContact CD1-CD1 4.13Å; L335-L339 HydrophobicContact CD1-CG 4.18Å; L335-L339 HydrophobicContact CG-CD1 4.01Å; L335-L339 HydrophobicContact CG-CG 4.45Å; L335-L339 WeakPolarHBondContact O-CB 3.48Å; L335-L339 VanDerWaalsContact O-CG 3.28Å; L335-L339 WeakPolarHBondContact O-CG 3.17Å; L335-L339 PolarHBondContact O-N 3.29Å
336L96Very high92.2Very high101 Ų10155.6 Ų55.653%0.52934%0.338SS..Hα-helixtrans-60.8-48.2177.7-179.261.8000111.6A332 A333 T338 L339 L340A332-L336 PolarHBondContact O-N 2.95Å; A333-L336 PolarHBondContact O-N 3.47Å; L336-T338 VanDerWaalsContact C-N 3.31Å; L336-T338 PolarHBondContact O-N 3.21Å; L336-L339 PolarHBondContact O-N 3.16Å; L336-L340 HydrophobicContact CD1-CD1 4.03Å; L336-L340 HydrophobicContact CD1-CG 4.08Å; L336-L340 HydrophobicContact CG-CD1 3.94Å; L336-L340 HydrophobicContact CG-CG 4.39Å; L336-L340 WeakPolarHBondContact O-CB 3.22Å; L336-L340 VanDerWaalsContact O-CG 3.27Å; L336-L340 WeakPolarHBondContact O-CG 3.48Å; L336-L340 PolarHBondContact O-N 3.1Å
337C96.3Very high92.5Very high50 Ų5055.9 Ų55.934%0.33834%0.342SS..Hα-helixtrans-56.3-45.5175.7-71.90000111.7A333 T334 L340 A341 F373A333-C337 PolarHBondContact O-N 2.95Å; A333-C337 PolarHBondContact O-SG 3.47Å; A333-C337 VanDerWaalsContact O-SG 3.34Å; T334-C337 PolarHBondContact O-N 3.29Å; C337-L340 PolarHBondContact O-N 2.94Å; C337-A341 VanDerWaalsContact O-CB 3.3Å; C337-A341 WeakPolarHBondContact O-CB 3.47Å; C337-A341 PolarHBondContact O-N 2.9Å; C337-F373 HydrophobicContact CB-CB 3.97Å; C337-F373 HydrophobicContact CB-CD1 4.27Å; C337-F373 HydrophobicContact CB-CG 4.2Å
338T96.3Very high92.6Very high18 Ų1851.6 Ų51.611%0.1131%0.314CS..Hα-helixtrans-62.3-48.6178.3-58.60000111.3T334 L335 L336 L340 A341 V342 F373 G374T334-T338 WeakPolarHBondContact O-CB 3.32Å; T334-T338 PolarHBondContact O-N 3.42Å; T334-T338 PolarHBondContact O-OG1 2.86Å; L335-T338 PolarHBondContact O-N 3.4Å; L336-T338 VanDerWaalsContact C-N 3.31Å; L336-T338 PolarHBondContact O-N 3.21Å; T338-L340 PolarHBondContact O-N 3.27Å; T338-A341 PolarHBondContact O-N 3.02Å; T338-V342 HydrophobicContact CG2-CG2 4.45Å; T338-V342 WeakPolarHBondContact O-CB 3.24Å; T338-V342 VanDerWaalsContact O-CG2 3.29Å; T338-V342 WeakPolarHBondContact O-CG2 3.26Å; T338-V342 PolarHBondContact O-N 3.41Å; T338-F373 WeakPolarHBondContact OG1-CB 3.44Å; T338-F373 PolarHBondContact OG1-O 3.29Å; T338-F373 VanDerWaalsContact OG1-O 3.08Å; T338-G374 PolarHBondContact OG1-N 3.22Å
339L95.9Very high92.8Very high103 Ų10348 Ų4854%0.53929%0.288SS..Hα-helixtrans-61.8-44.2179.6-71.5174.3000111.9L335 L336 A341 V342 L343L335-L339 HydrophobicContact CD1-CD1 4.13Å; L335-L339 HydrophobicContact CD1-CG 4.18Å; L335-L339 HydrophobicContact CG-CD1 4.01Å; L335-L339 HydrophobicContact CG-CG 4.45Å; L335-L339 WeakPolarHBondContact O-CB 3.48Å; L335-L339 VanDerWaalsContact O-CG 3.28Å; L335-L339 WeakPolarHBondContact O-CG 3.17Å; L335-L339 PolarHBondContact O-N 3.29Å; L336-L339 PolarHBondContact O-N 3.16Å; L339-A341 VanDerWaalsContact C-N 3.33Å; L339-A341 PolarHBondContact O-N 3.14Å; L339-V342 PolarHBondContact O-N 3.03Å; L339-L343 VanDerWaalsContact O-CB 3.29Å; L339-L343 WeakPolarHBondContact O-CB 3.47Å; L339-L343 PolarHBondContact O-N 2.99Å
340L96.6Very high92.8Very high106 Ų10650.2 Ų50.256%0.55529%0.294SS*.Hα-helixtrans-63.3-39.2176.9-70.4175.2000112L336 C337 T338 P344L336-L340 HydrophobicContact CD1-CD1 4.03Å; L336-L340 HydrophobicContact CD1-CG 4.08Å; L336-L340 HydrophobicContact CG-CD1 3.94Å; L336-L340 HydrophobicContact CG-CG 4.39Å; L336-L340 WeakPolarHBondContact O-CB 3.22Å; L336-L340 VanDerWaalsContact O-CG 3.27Å; L336-L340 WeakPolarHBondContact O-CG 3.48Å; L336-L340 PolarHBondContact O-N 3.1Å; C337-L340 PolarHBondContact O-N 2.94Å; T338-L340 PolarHBondContact O-N 3.27Å; L340-P344 WeakPolarHBondContact O-CD 3.47Å
341A96.3Very high92.7Very high15 Ų1554.8 Ų54.812%0.12430%0.303CS..Hα-helixtrans-67.8-37.4177.200000112.4C337 T338 L339 A369 F373 F504 Y508C337-A341 VanDerWaalsContact O-CB 3.3Å; C337-A341 WeakPolarHBondContact O-CB 3.47Å; C337-A341 PolarHBondContact O-N 2.9Å; T338-A341 PolarHBondContact O-N 3.02Å; L339-A341 VanDerWaalsContact C-N 3.33Å; L339-A341 PolarHBondContact O-N 3.14Å; A341-A369 HydrophobicContact CB-CB 3.75Å; A341-F373 HydrophobicContact CB-CD2 3.71Å; A341-F373 HydrophobicContact CB-CE2 3.75Å; A341-F504 HydrophobicContact CB-CZ 4.26Å; A341-Y508 VanDerWaalsContact O-CE2 3.29Å; A341-Y508 WeakPolarHBondContact O-CE2 3.28Å; A341-Y508 PolarHBondContact O-OH 3.45Å
342V96.1Very high92Very high10 Ų1052.6 Ų52.66%0.06129%0.286CS..Hα-helixtrans-75.3-36.2179.7169.90000112.6P204 T338 L339 A345 L346 A369P204-V342 HydrophobicContact CB-CG1 4.48Å; T338-V342 HydrophobicContact CG2-CG2 4.45Å; T338-V342 WeakPolarHBondContact O-CB 3.24Å; T338-V342 VanDerWaalsContact O-CG2 3.29Å; T338-V342 WeakPolarHBondContact O-CG2 3.26Å; T338-V342 PolarHBondContact O-N 3.41Å; L339-V342 PolarHBondContact O-N 3.03Å; V342-A345 WeakPolarHBondContact O-CB 3.17Å; V342-A345 PolarHBondContact O-N 3.32Å; V342-L346 HydrophobicContact CG1-CD1 3.66Å; V342-L346 HydrophobicContact CG1-CD2 4.24Å; V342-L346 HydrophobicContact CG1-CG 3.73Å; V342-L346 PolarHBondContact O-N 2.94Å; V342-A369 HydrophobicContact CG2-CB 3.61Å
343L95.2Very high91Very high94 Ų9456.2 Ų56.249%0.49228%0.283SS..Hα-helixtrans-55.4-48.8-167.8177.167.5000114.4L339 A345 L346 V347L339-L343 VanDerWaalsContact O-CB 3.29Å; L339-L343 WeakPolarHBondContact O-CB 3.47Å; L339-L343 PolarHBondContact O-N 2.99Å; L343-A345 PolarHBondContact O-N 3.44Å; L343-L346 PolarHBondContact O-N 3.47Å; L343-L346 VanDerWaalsContact O-N 3.13Å; L343-V347 HydrophobicContact CD1-CG2 4.04Å; L343-V347 HydrophobicContact CG-CG2 4.3Å; L343-V347 WeakPolarHBondContact O-CG2 3.39Å; L343-V347 PolarHBondContact O-N 2.67Å
344P92.6Very high89.9Confident52 Ų5259 Ų5934%0.33829%0.287SS..Hα-helixtrans-63.1-28.8178.8-20.129000113.8L340 S348 Y508L340-P344 WeakPolarHBondContact O-CD 3.47Å; P344-S348 WeakPolarHBondContact O-CB 3.38Å; P344-S348 PolarHBondContact O-N 2.91Å; P344-Y508 HydrophobicContact CB-CE1 4.03Å; P344-Y508 WeakPolarHBondContact CB-OH 3.33Å; P344-Y508 WeakPolarHBondContact CD-OH 3.48Å; P344-Y508 HydrophobicContact CG-CE1 4.37Å; P344-Y508 WeakPolarHBondContact CG-OH 2.95Å
345A92.6Very high89.1Confident0 Ų060.2 Ų60.20%030%0.299CS..Hα-helixtrans-65.9-44.4173.500000111.6V342 L343 S348 I349 L365 L511V342-A345 WeakPolarHBondContact O-CB 3.17Å; V342-A345 PolarHBondContact O-N 3.32Å; L343-A345 PolarHBondContact O-N 3.44Å; A345-S348 WeakPolarHBondContact O-CB 3.25Å; A345-S348 PolarHBondContact O-N 3.41Å; A345-I349 PolarHBondContact O-N 3.23Å; A345-I349 VanDerWaalsContact O-N 3.1Å; A345-L365 HydrophobicContact CB-CB 3.93Å; A345-L365 HydrophobicContact CB-CD1 3.81Å; A345-L511 HydrophobicContact CB-CD2 4.15Å
346L94.3Very high88.6Confident28 Ų2857.6 Ų57.615%0.14729%0.286CS..Hα-helixtrans-63.7-46.6176.1-60.6-179.3000111.8P204 I208 V342 L343 S348 I349 W350P204-L346 HydrophobicContact CB-CD1 3.92Å; P204-L346 HydrophobicContact CB-CD2 3.92Å; P204-L346 WeakPolarHBondContact O-CD2 3.14Å; I208-L346 HydrophobicContact CB-CD2 4.29Å; I208-L346 HydrophobicContact CG1-CB 4.27Å; I208-L346 HydrophobicContact CG1-CD1 4.42Å; I208-L346 HydrophobicContact CG1-CD2 4Å; I208-L346 HydrophobicContact CG1-CG 4.46Å; V342-L346 HydrophobicContact CG1-CD1 3.66Å; V342-L346 HydrophobicContact CG1-CD2 4.24Å; V342-L346 HydrophobicContact CG1-CG 3.73Å; V342-L346 PolarHBondContact O-N 2.94Å; L343-L346 PolarHBondContact O-N 3.47Å; L343-L346 VanDerWaalsContact O-N 3.13Å; L346-S348 VanDerWaalsContact C-N 3.25Å; L346-S348 PolarHBondContact O-N 2.9Å; L346-I349 PolarHBondContact O-N 3.44Å; L346-W350 WeakPolarHBondContact O-CB 3.47Å; L346-W350 PolarHBondContact O-N 3.41Å
347V91.9Very high88.1Confident49 Ų4958.6 Ų58.630%0.29728%0.283SS..Hα-helixtrans-60.6-38.5176.9173.30000110.8L343 W350 R351L343-V347 HydrophobicContact CD1-CG2 4.04Å; L343-V347 HydrophobicContact CG-CG2 4.3Å; L343-V347 WeakPolarHBondContact O-CG2 3.39Å; L343-V347 PolarHBondContact O-N 2.67Å; V347-W350 PolarHBondContact O-N 3.16Å; V347-R351 HydrophobicContact CG1-CG 4.36Å; V347-R351 WeakPolarHBondContact O-CB 3.39Å; V347-R351 VanDerWaalsContact O-CG 3.32Å; V347-R351 WeakPolarHBondContact O-CG 3.46Å; V347-R351 PolarHBondContact O-N 2.82Å
348S88.3Confident87.7Confident3 Ų357 Ų572%0.02127%0.272CS..Hα-helixtrans-62.6-46.5177.1-169.80000111.9P344 A345 L346 R351 R352 L511 N515P344-S348 WeakPolarHBondContact O-CB 3.38Å; P344-S348 PolarHBondContact O-N 2.91Å; A345-S348 WeakPolarHBondContact O-CB 3.25Å; A345-S348 PolarHBondContact O-N 3.41Å; L346-S348 VanDerWaalsContact C-N 3.25Å; L346-S348 PolarHBondContact O-N 2.9Å; S348-R351 PolarHBondContact O-N 3.43Å; S348-R352 VanDerWaalsContact O-CB 3.3Å; S348-R352 WeakPolarHBondContact O-CB 3.34Å; S348-R352 WeakPolarHBondContact O-CD 3.41Å; S348-R352 WeakPolarHBondContact O-CG 3.26Å; S348-R352 PolarHBondContact O-N 3.12Å; S348-R352 PolarHBondContact OG-NE 3.47Å; S348-R352 PolarHBondContact OG-NH2 3.01Å; S348-L511 WeakPolarHBondContact OG-CD1 3.25Å; S348-N515 PolarHBondContact OG-ND2 3.32Å; S348-N515 PolarHBondContact OG-OD1 3.38Å
349I88.8Confident87.5Confident7 Ų756.1 Ų56.14%0.03627%0.267CS..Hα-helixtrans-61.8-47.3174-75.7-163.5000111.3I208 A345 L346 R351 R352 A358 C362I208-I349 HydrophobicContact CG2-CB 4.45Å; I208-I349 HydrophobicContact CG2-CG2 4.06Å; A345-I349 PolarHBondContact O-N 3.23Å; A345-I349 VanDerWaalsContact O-N 3.1Å; L346-I349 PolarHBondContact O-N 3.44Å; I349-R351 PolarHBondContact O-N 3.4Å; I349-R352 PolarHBondContact O-N 3.25Å; I349-R352 VanDerWaalsContact O-N 3.14Å; I349-A358 WeakPolarHBondContact CD1-O 3.43Å; I349-A358 HydrophobicContact CG1-CB 4.48Å; I349-C362 HydrophobicContact CD1-CB 3.06Å; I349-C362 HydrophobicContact CG1-CB 3.65Å
350W89.1Confident87.4Confident66 Ų6651.3 Ų51.325%0.2524%0.242CC..Hα-helixtrans-56-43.3-178.1-176.3-103.8000111.8I208 L211 R212 F216 I225 W227 L346 V347I208-W350 HydrophobicContact CG2-CB 4.2Å; I208-W350 HydrophobicContact CG2-CE3 4.12Å; L211-W350 HydrophobicContact CB-CZ3 4.29Å; L211-W350 HydrophobicContact CD2-CH2 3.86Å; L211-W350 HydrophobicContact CD2-CZ3 3.57Å; L211-W350 HydrophobicContact CG-CH2 4.13Å; L211-W350 HydrophobicContact CG-CZ3 3.74Å; R212-W350 HydrophobicContact CB-CE3 4.15Å; R212-W350 HydrophobicContact CB-CZ3 4.44Å; R212-W350 VanDerWaalsContact CD-O 3.27Å; R212-W350 WeakPolarHBondContact CD-O 3.17Å; R212-W350 PolarHBondContact NE-O 2.72Å; R212-W350 VanDerWaalsContact NE-O 3.09Å; F216-W350 HydrophobicContact CD2-CH2 4.5Å; F216-W350 AromaticContact CE2-CH2 3.73Å; F216-W350 HydrophobicContact CE2-CH2 3.73Å; F216-W350 HydrophobicContact CE2-CZ3 4.33Å; F216-W350 HydrophobicContact CZ-CH2 4.38Å; I225-W350 HydrophobicContact CD1-CD2 3.68Å; I225-W350 HydrophobicContact CD1-CE3 4.12Å; I225-W350 HydrophobicContact CD1-CG 4.27Å; I225-W350 HydrophobicContact CD1-CH2 3.9Å; I225-W350 HydrophobicContact CD1-CZ2 3.39Å; I225-W350 HydrophobicContact CD1-CZ3 4.22Å; W227-W350 HydrophobicContact CH2-CZ2 4.01Å; L346-W350 WeakPolarHBondContact O-CB 3.47Å; L346-W350 PolarHBondContact O-N 3.41Å; V347-W350 PolarHBondContact O-N 3.16Å
351R84.3Confident87.3Confident165 Ų16547.9 Ų47.962%0.62322%0.222SC*.Hα-helixtrans-77.2-25.9-179.1-68.3179.1-177-173.42.9113.2V347 S348 I349 R518V347-R351 HydrophobicContact CG1-CG 4.36Å; V347-R351 WeakPolarHBondContact O-CB 3.39Å; V347-R351 VanDerWaalsContact O-CG 3.32Å; V347-R351 WeakPolarHBondContact O-CG 3.46Å; V347-R351 PolarHBondContact O-N 2.82Å; S348-R351 PolarHBondContact O-N 3.43Å; I349-R351 PolarHBondContact O-N 3.4Å; R351-R518 PolarHBondContact O-NH1 3.36Å; R351-R518 PolarHBondContact O-NH2 3.35Å
352R75Confident87.3Confident24 Ų2447.2 Ų47.29%0.09122%0.216CC..SBendtrans-76.6155.1-175.5-79.6172.1-171.6-141.82113.3R212 S348 I349 L511 S514 N515R212-R352 VanDerWaalsContact CZ-O 3.26Å; R212-R352 PolarHBondContact NE-O 3.11Å; R212-R352 VanDerWaalsContact NE-O 3.15Å; R212-R352 PolarHBondContact NH2-O 3.4Å; S348-R352 VanDerWaalsContact O-CB 3.3Å; S348-R352 WeakPolarHBondContact O-CB 3.34Å; S348-R352 WeakPolarHBondContact O-CD 3.41Å; S348-R352 WeakPolarHBondContact O-CG 3.26Å; S348-R352 PolarHBondContact O-N 3.12Å; S348-R352 PolarHBondContact OG-NE 3.47Å; S348-R352 PolarHBondContact OG-NH2 3.01Å; I349-R352 PolarHBondContact O-N 3.25Å; I349-R352 VanDerWaalsContact O-N 3.14Å; R352-L511 PolarHBondContact NH2-O 3.04Å; R352-S514 PolarHBondContact NH1-OG 2.82Å; R352-S514 PolarHBondContact NH2-OG 3Å; R352-N515 PolarHBondContact NE-OD1 3.11Å; R352-N515 VanDerWaalsContact NH2-N 3.15Å; R352-N515 PolarHBondContact NH2-OD1 3.47Å
353R67.3Low87.3Confident149 Ų14946.7 Ų46.756%0.56221%0.213SC*.PPolyproline II helixtrans-62.1153.1164-71.1-171.6-176.4168.22.1109.5P221 G355P221-R353 PolarHBondContact O-NH2 3.07Å; R353-G355 PolarHBondContact O-N 2.49Å
354R69.9Low87.4Confident94 Ų9442.3 Ų42.336%0.35519%0.19SC..SBendtrans-52.3124.8179.4-59.5-172.7-168.8135.939.2110.6S213 F216 T217 L218 D219S213-R354 WeakPolarHBondContact O-CD 3.39Å; S213-R354 PolarHBondContact O-NE 3.34Å; F216-R354 PolarHBondContact O-NE 3.01Å; F216-R354 PolarHBondContact O-NH1 3.29Å; F216-R354 PolarHBondContact O-NH2 3.45Å; T217-R354 VanDerWaalsContact O-CZ 3.31Å; T217-R354 PolarHBondContact O-NH1 3.5Å; T217-R354 PolarHBondContact O-NH2 3.31Å; L218-R354 VanDerWaalsContact N-NH2 3.18Å; D219-R354 IonicContact OD1-CZ 3.69Å; D219-R354 IonicContact OD1-NE 2.61Å; D219-R354 IonicContact OD1-NH2 2.89Å; D219-R354 PolarHBondContact OD1-NH2 3.38Å
355G75.9Confident87.6Confident26 Ų2639.8 Ų39.827%0.26817%0.174SC..  trans-159.2119.2-175.200000112.7R353 R357 A358 F359R353-G355 PolarHBondContact O-N 2.49Å; G355-R357 VanDerWaalsContact C-N 3.3Å; G355-R357 PolarHBondContact O-N 2.88Å; G355-A358 WeakPolarHBondContact O-CB 3.32Å; G355-A358 PolarHBondContact O-N 2.92Å; G355-A358 VanDerWaalsContact O-N 3.08Å; G355-F359 PolarHBondContact O-N 3.47Å; G355-F359 VanDerWaalsContact O-N 3.15Å
356N81.8Confident87.9Confident50 Ų5039.8 Ų39.827%0.26717%0.174SC..Hα-helixtrans-60.3-36.7-179.5-70.4-2.3000113.1L178 F359 L360L178-N356 HydrophobicContact CD2-CB 3.61Å; L178-N356 PolarHBondContact O-ND2 3.13Å; N356-F359 WeakPolarHBondContact O-CB 3.42Å; N356-F359 PolarHBondContact O-N 3.39Å; N356-L360 PolarHBondContact O-N 2.98Å; N356-L360 VanDerWaalsContact O-N 3.15Å
357R85.3Confident88.1Confident122 Ų12238.6 Ų38.646%0.4617%0.168SC..Hα-helixtrans-68.1-35.7174.6-68.6-176.3177.4170.62.3112.8G355 F359 L360 R361 L392 E395G355-R357 VanDerWaalsContact C-N 3.3Å; G355-R357 PolarHBondContact O-N 2.88Å; R357-F359 VanDerWaalsContact C-N 3.34Å; R357-L360 PolarHBondContact O-N 3.11Å; R357-R361 WeakPolarHBondContact O-CG 3.4Å; R357-R361 PolarHBondContact O-N 2.99Å; R357-L392 HydrophobicContact CG-CD2 4.37Å; R357-E395 IonicContact CZ-OE1 2.97Å; R357-E395 IonicContact CZ-OE2 3.8Å; R357-E395 IonicContact NE-OE1 3.67Å; R357-E395 IonicContact NE-OE2 3.95Å; R357-E395 PolarHBondContact NE-OE2 3.04Å; R357-E395 VanDerWaalsContact NH2-CD 3.27Å; R357-E395 IonicContact NH2-OE1 2.67Å; R357-E395 PolarHBondContact NH2-OE1 2.88Å; R357-E395 VanDerWaalsContact NH2-OE1 3.15Å; R357-E395 IonicContact NH2-OE2 2.82Å; R357-E395 PolarHBondContact NH2-OE2 3Å
358A88.2Confident88.3Confident15 Ų1536.3 Ų36.312%0.12415%0.154CC..Hα-helixtrans-66.3-41.2177.500000110.4I349 G355 R361 C362I349-A358 WeakPolarHBondContact CD1-O 3.43Å; I349-A358 HydrophobicContact CG1-CB 4.48Å; G355-A358 WeakPolarHBondContact O-CB 3.32Å; G355-A358 PolarHBondContact O-N 2.92Å; G355-A358 VanDerWaalsContact O-N 3.08Å; A358-R361 PolarHBondContact O-N 3.47Å; A358-C362 WeakPolarHBondContact O-CB 3.41Å; A358-C362 PolarHBondContact O-N 2.98Å
359F92.6Very high88.8Confident1 Ų136.1 Ų36.10%0.00415%0.153CC..Hα-helixtrans-54.3-56.1171.4169.5-116.8000112.2V174 H177 Y206 F209 G355 N356 R357 R361 C362 L363V174-F359 HydrophobicContact CG2-CE1 4.26Å; H177-F359 HydrophobicContact CB-CD1 4.38Å; H177-F359 HydrophobicContact CB-CE1 4.04Å; H177-F359 AromaticContact CD2-CE1 3.99Å; H177-F359 AromaticContact CD2-CZ 3.88Å; Y206-F359 HydrophobicContact CD1-CE2 4.3Å; Y206-F359 HydrophobicContact CD1-CZ 4.1Å; Y206-F359 HydrophobicContact CD2-CE2 4.24Å; Y206-F359 HydrophobicContact CD2-CZ 4.28Å; Y206-F359 HydrophobicContact CE1-CE2 4.44Å; Y206-F359 AromaticContact CE1-CZ 3.8Å; Y206-F359 HydrophobicContact CE1-CZ 3.8Å; Y206-F359 HydrophobicContact CE2-CE2 4.4Å; Y206-F359 AromaticContact CE2-CZ 4Å; Y206-F359 HydrophobicContact CE2-CZ 4Å; Y206-F359 HydrophobicContact CG-CE2 4.2Å; Y206-F359 HydrophobicContact CG-CZ 4.33Å; Y206-F359 AromaticContact CZ-CZ 3.76Å; F209-F359 HydrophobicContact CB-CD2 3.56Å; F209-F359 HydrophobicContact CB-CE2 4.14Å; F209-F359 HydrophobicContact CB-CG 4.42Å; F209-F359 HydrophobicContact CD1-CB 4.34Å; F209-F359 HydrophobicContact CD1-CD1 4.44Å; F209-F359 AromaticContact CD1-CD2 3.44Å; F209-F359 HydrophobicContact CD1-CD2 3.44Å; F209-F359 VanDerWaalsContact CD1-CD2 3.44Å; F209-F359 AromaticContact CD1-CE2 3.77Å; F209-F359 HydrophobicContact CD1-CE2 3.77Å; F209-F359 AromaticContact CD1-CG 3.81Å; F209-F359 HydrophobicContact CD1-CG 3.81Å; F209-F359 HydrophobicContact CD1-CZ 4.39Å; F209-F359 HydrophobicContact CD2-CB 3.6Å; F209-F359 AromaticContact CD2-CD2 3.97Å; F209-F359 HydrophobicContact CD2-CD2 3.97Å; F209-F359 AromaticContact CD2-CG 3.98Å; F209-F359 HydrophobicContact CD2-CG 3.98Å; F209-F359 HydrophobicContact CE1-CB 4.4Å; F209-F359 HydrophobicContact CE1-CD1 4.28Å; F209-F359 HydrophobicContact CE1-CD2 4.08Å; F209-F359 HydrophobicContact CE1-CE2 4.44Å; F209-F359 AromaticContact CE1-CG 3.98Å; F209-F359 HydrophobicContact CE1-CG 3.98Å; F209-F359 HydrophobicContact CE2-CB 3.67Å; F209-F359 HydrophobicContact CE2-CG 4.14Å; F209-F359 HydrophobicContact CG-CB 3.94Å; F209-F359 AromaticContact CG-CD2 3.36Å; F209-F359 HydrophobicContact CG-CD2 3.36Å; F209-F359 HydrophobicContact CG-CE2 4.07Å; F209-F359 AromaticContact CG-CG 3.8Å; F209-F359 HydrophobicContact CG-CG 3.8Å; F209-F359 HydrophobicContact CZ-CB 4.07Å; F209-F359 HydrophobicContact CZ-CD1 4.5Å; F209-F359 HydrophobicContact CZ-CG 4.13Å; G355-F359 PolarHBondContact O-N 3.47Å; G355-F359 VanDerWaalsContact O-N 3.15Å; N356-F359 WeakPolarHBondContact O-CB 3.42Å; N356-F359 PolarHBondContact O-N 3.39Å; R357-F359 VanDerWaalsContact C-N 3.34Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 PolarHBondContact O-N 3.49Å; F359-C362 PolarHBondContact O-N 2.83Å; F359-C362 VanDerWaalsContact O-N 3.17Å; F359-L363 HydrophobicContact CE1-CD1 4.37Å; F359-L363 HydrophobicContact CE2-CD1 4.35Å; F359-L363 HydrophobicContact CZ-CD1 3.87Å; F359-L363 WeakPolarHBondContact O-CB 3.29Å; F359-L363 PolarHBondContact O-N 3.25Å
360L94.1Very high89.1Confident2 Ų236.2 Ų36.21%0.0115%0.154CC..Hα-helixtrans-56.9-45179.2-82.9179.4000112.7V174 L178 N356 R357 C362 L363 L364 I391 L392V174-L360 HydrophobicContact CG1-CD2 3.39Å; V174-L360 HydrophobicContact CG1-CG 4.32Å; V174-L360 HydrophobicContact CG2-CD2 4.28Å; L178-L360 HydrophobicContact CD1-CD1 4.23Å; L178-L360 HydrophobicContact CD2-CD1 3.93Å; L178-L360 HydrophobicContact CD2-CG 4.19Å; N356-L360 PolarHBondContact O-N 2.98Å; N356-L360 VanDerWaalsContact O-N 3.15Å; R357-L360 PolarHBondContact O-N 3.11Å; L360-C362 PolarHBondContact O-N 3.1Å; L360-L363 WeakPolarHBondContact O-CB 3.23Å; L360-L363 PolarHBondContact O-N 3.39Å; L360-L364 VanDerWaalsContact O-CG 3.26Å; L360-L364 WeakPolarHBondContact O-CG 3.29Å; L360-L364 PolarHBondContact O-N 3.28Å; L360-I391 HydrophobicContact CD1-CB 4.33Å; L360-I391 HydrophobicContact CD1-CG2 3.92Å; L360-L392 HydrophobicContact CB-CD1 4.18Å; L360-L392 HydrophobicContact CB-CD2 4.07Å; L360-L392 HydrophobicContact CB-CG 4.24Å; L360-L392 HydrophobicContact CD1-CD2 3.87Å; L360-L392 HydrophobicContact CD1-CG 4.28Å
361R93.9Very high89.5Confident34 Ų3433.2 Ų33.213%0.12814%0.143CC..Hα-helixtrans-63.3-40177.7-74.1-175.2177164.3-0.9112.7R357 A358 F359 L364 L365 L392 D399 L507R357-R361 WeakPolarHBondContact O-CG 3.4Å; R357-R361 PolarHBondContact O-N 2.99Å; A358-R361 PolarHBondContact O-N 3.47Å; F359-R361 VanDerWaalsContact C-N 3.34Å; F359-R361 PolarHBondContact O-N 3.49Å; R361-L364 PolarHBondContact O-N 3.04Å; R361-L365 WeakPolarHBondContact O-CB 3.44Å; R361-L365 VanDerWaalsContact O-CG 3.29Å; R361-L365 WeakPolarHBondContact O-CG 3.17Å; R361-L365 PolarHBondContact O-N 2.94Å; R361-L392 HydrophobicContact CG-CD1 3.5Å; R361-D399 IonicContact CZ-OD1 3.86Å; R361-D399 IonicContact CZ-OD2 3.65Å; R361-D399 IonicContact NE-OD1 3.11Å; R361-D399 IonicContact NE-OD2 3.73Å; R361-D399 PolarHBondContact NE-OD2 2.98Å; R361-D399 IonicContact NH2-OD1 2.59Å; R361-D399 PolarHBondContact NH2-OD1 2.86Å; R361-D399 IonicContact NH2-OD2 3.09Å; R361-D399 PolarHBondContact NH2-OD2 2.91Å; R361-L507 HydrophobicContact CG-CD1 4.37Å
362C95.3Very high90.1Very high0 Ų025.5 Ų25.50%011%0.113CC..Hα-helixtrans-69.1-39.4176.1-175.60000112.2A205 I349 A358 F359 L360 L364 L365 C366A205-C362 HydrophobicContact CB-CB 4.37Å; I349-C362 HydrophobicContact CD1-CB 3.06Å; I349-C362 HydrophobicContact CG1-CB 3.65Å; A358-C362 WeakPolarHBondContact O-CB 3.41Å; A358-C362 PolarHBondContact O-N 2.98Å; F359-C362 PolarHBondContact O-N 2.83Å; F359-C362 VanDerWaalsContact O-N 3.17Å; L360-C362 PolarHBondContact O-N 3.1Å; C362-L364 VanDerWaalsContact C-N 3.3Å; C362-L364 PolarHBondContact O-N 3.37Å; C362-L365 PolarHBondContact O-N 3.08Å; C362-C366 WeakPolarHBondContact O-CB 3.28Å; C362-C366 PolarHBondContact O-N 3.41Å; C362-C366 PolarHBondContact O-SG 3.41Å
363L97.1Very high91.1Very high0 Ų026.7 Ų26.70%012%0.12CC..Hα-helixtrans-56.1-47.5172.9-179.1153.7000110.5V174 V202 A205 Y206 F359 L360 C366 A367 P388V174-L363 HydrophobicContact CG2-CD1 3.85Å; V202-L363 HydrophobicContact CB-CG 4.06Å; V202-L363 HydrophobicContact CG1-CD2 4.18Å; V202-L363 HydrophobicContact CG1-CG 4Å; A205-L363 HydrophobicContact CB-CB 4.26Å; Y206-L363 HydrophobicContact CD2-CD1 4.35Å; Y206-L363 HydrophobicContact CE2-CD1 3.53Å; F359-L363 HydrophobicContact CE1-CD1 4.37Å; F359-L363 HydrophobicContact CE2-CD1 4.35Å; F359-L363 HydrophobicContact CZ-CD1 3.87Å; F359-L363 WeakPolarHBondContact O-CB 3.29Å; F359-L363 PolarHBondContact O-N 3.25Å; L360-L363 WeakPolarHBondContact O-CB 3.23Å; L360-L363 PolarHBondContact O-N 3.39Å; L363-C366 PolarHBondContact O-N 2.82Å; L363-A367 WeakPolarHBondContact O-CB 3.45Å; L363-A367 PolarHBondContact O-N 3.28Å; L363-P388 HydrophobicContact CD2-CB 4.11Å; L363-P388 HydrophobicContact CD2-CG 4.07Å
364L97.5Very high92.2Very high1 Ų120 Ų201%0.00510%0.096CC..Hα-helixtrans-63.6-41.5177-71168.3000113L360 R361 C362 C366 A367 L368 A385 P388 L389 L392 L507L360-L364 VanDerWaalsContact O-CG 3.26Å; L360-L364 WeakPolarHBondContact O-CG 3.29Å; L360-L364 PolarHBondContact O-N 3.28Å; R361-L364 PolarHBondContact O-N 3.04Å; C362-L364 VanDerWaalsContact C-N 3.3Å; C362-L364 PolarHBondContact O-N 3.37Å; L364-C366 VanDerWaalsContact C-N 3.34Å; L364-A367 PolarHBondContact O-N 2.89Å; L364-L368 WeakPolarHBondContact O-CB 3.13Å; L364-L368 WeakPolarHBondContact O-CG 3.43Å; L364-L368 PolarHBondContact O-N 3.25Å; L364-A385 HydrophobicContact CD2-CB 4.44Å; L364-A385 WeakPolarHBondContact CD2-O 3.46Å; L364-P388 HydrophobicContact CD2-CB 3.95Å; L364-P388 HydrophobicContact CD2-CG 4.46Å; L364-L389 HydrophobicContact CD1-CB 4.02Å; L364-L389 HydrophobicContact CD1-CD1 3.78Å; L364-L389 HydrophobicContact CD1-CG 4.49Å; L364-L389 HydrophobicContact CD2-CB 3.86Å; L364-L392 HydrophobicContact CD1-CD1 3.55Å; L364-L392 HydrophobicContact CD1-CG 4.45Å; L364-L507 HydrophobicContact CB-CD2 3.68Å; L364-L507 HydrophobicContact CD1-CD2 4.46Å
365L97.4Very high93.1Very high0 Ų018.8 Ų18.80%09%0.092CC..Hα-helixtrans-66.2-36.3175.5-73.7173.8000112.1A345 R361 C362 A369 F504 L507 Y508 L511A345-L365 HydrophobicContact CB-CB 3.93Å; A345-L365 HydrophobicContact CB-CD1 3.81Å; R361-L365 WeakPolarHBondContact O-CB 3.44Å; R361-L365 VanDerWaalsContact O-CG 3.29Å; R361-L365 WeakPolarHBondContact O-CG 3.17Å; R361-L365 PolarHBondContact O-N 2.94Å; C362-L365 PolarHBondContact O-N 3.08Å; L365-A369 WeakPolarHBondContact O-CB 3.46Å; L365-A369 PolarHBondContact O-N 3.27Å; L365-F504 HydrophobicContact CD2-CD2 3.92Å; L365-F504 HydrophobicContact CD2-CE2 3.81Å; L365-L507 HydrophobicContact CD2-CB 4.09Å; L365-L507 HydrophobicContact CD2-CD2 3.86Å; L365-L507 HydrophobicContact CD2-CG 3.87Å; L365-L507 HydrophobicContact CG-CD2 4Å; L365-L507 HydrophobicContact CG-CG 4.13Å; L365-Y508 HydrophobicContact CD1-CD2 4.32Å; L365-Y508 HydrophobicContact CD2-CD2 3.58Å; L365-Y508 HydrophobicContact CD2-CE2 4.24Å; L365-Y508 HydrophobicContact CD2-CG 4.31Å; L365-L511 HydrophobicContact CD1-CB 4.19Å; L365-L511 HydrophobicContact CD1-CD2 3.67Å; L365-L511 HydrophobicContact CD1-CG 4.36Å
366C97.8Very high93.5Very high0 Ų018.4 Ų18.40%08%0.083CC..Hα-helixtrans-66.7-43.2173.5-64.30000111.6Y201 C362 L363 L364 S370Y201-C366 WeakPolarHBondContact O-CB 3.47Å; C362-C366 WeakPolarHBondContact O-CB 3.28Å; C362-C366 PolarHBondContact O-N 3.41Å; C362-C366 PolarHBondContact O-SG 3.41Å; L363-C366 PolarHBondContact O-N 2.82Å; L364-C366 VanDerWaalsContact C-N 3.34Å; C366-S370 WeakPolarHBondContact O-CB 3.49Å; C366-S370 PolarHBondContact O-N 3.33Å; C366-S370 PolarHBondContact O-OG 2.74Å
367A97.8Very high93.7Very high2 Ų216.1 Ų16.12%0.0177%0.071CC..Hα-helixtrans-60.5-51.5175.500000111.6V202 L363 L364 S370 F371 L384 A385V202-A367 HydrophobicContact CG1-CB 3.83Å; L363-A367 WeakPolarHBondContact O-CB 3.45Å; L363-A367 PolarHBondContact O-N 3.28Å; L364-A367 PolarHBondContact O-N 2.89Å; A367-S370 PolarHBondContact O-N 3.39Å; A367-F371 VanDerWaalsContact O-CB 3.29Å; A367-F371 WeakPolarHBondContact O-CB 3.26Å; A367-F371 PolarHBondContact O-N 2.98Å; A367-L384 HydrophobicContact CB-CB 4.44Å; A367-L384 HydrophobicContact CB-CD2 4.01Å; A367-L384 HydrophobicContact CB-CG 3.82Å; A367-A385 HydrophobicContact CB-CB 4.31Å
368L98Very high93.9Very high1 Ų112.8 Ų12.81%0.0056%0.06CC..Hα-helixtrans-68.9-38.3-179.2-73.4173.4000112.9L364 F371 L372 I382 A385 L406 V500 F504 L507L364-L368 WeakPolarHBondContact O-CB 3.13Å; L364-L368 WeakPolarHBondContact O-CG 3.43Å; L364-L368 PolarHBondContact O-N 3.25Å; L368-F371 PolarHBondContact O-N 2.59Å; L368-L372 VanDerWaalsContact O-CB 3.29Å; L368-L372 WeakPolarHBondContact O-CB 3.31Å; L368-L372 VanDerWaalsContact O-CG 3.27Å; L368-L372 WeakPolarHBondContact O-CG 3.23Å; L368-L372 PolarHBondContact O-N 3.37Å; L368-I382 HydrophobicContact CD2-CD1 4.19Å; L368-A385 HydrophobicContact CD1-CB 4.46Å; L368-A385 HydrophobicContact CD2-CB 3.49Å; L368-A385 VanDerWaalsContact CD2-CB 3.49Å; L368-A385 HydrophobicContact CG-CB 3.66Å; L368-L406 HydrophobicContact CD1-CD2 4.38Å; L368-L406 HydrophobicContact CD2-CD1 4.03Å; L368-L406 HydrophobicContact CD2-CD2 4.19Å; L368-V500 HydrophobicContact CD2-CG1 4.19Å; L368-F504 HydrophobicContact CB-CB 4.38Å; L368-F504 HydrophobicContact CB-CD2 3.59Å; L368-F504 HydrophobicContact CB-CE2 4.32Å; L368-F504 HydrophobicContact CB-CG 4.37Å; L368-F504 HydrophobicContact CD1-CB 4.28Å; L368-F504 HydrophobicContact CD1-CD2 4.35Å; L368-L507 HydrophobicContact CD1-CD2 4.11Å
369A97.6Very high94Very high0 Ų012.1 Ų12.10%06%0.055CC..Hα-helixtrans-63.2-45.3175.500000111.4A341 V342 L365 F371 L372 F373 F504A341-A369 HydrophobicContact CB-CB 3.75Å; V342-A369 HydrophobicContact CG2-CB 3.61Å; L365-A369 WeakPolarHBondContact O-CB 3.46Å; L365-A369 PolarHBondContact O-N 3.27Å; A369-F371 VanDerWaalsContact C-N 3.31Å; A369-F371 PolarHBondContact O-N 2.76Å; A369-L372 PolarHBondContact O-N 3.41Å; A369-F373 WeakPolarHBondContact O-CD2 3.27Å; A369-F373 PolarHBondContact O-N 3.26Å; A369-F504 HydrophobicContact CB-CE2 4.03Å; A369-F504 HydrophobicContact CB-CZ 4.24Å
370S96.3Very high94Very high8 Ų813.6 Ų13.66%0.0566%0.061CC..Hα-helixtrans-66.4-34.7176-52.30000111.8C366 A367 G374 V377C366-S370 WeakPolarHBondContact O-CB 3.49Å; C366-S370 PolarHBondContact O-N 3.33Å; C366-S370 PolarHBondContact O-OG 2.74Å; A367-S370 PolarHBondContact O-N 3.39Å; S370-G374 WeakPolarHBondContact O-CA 3.22Å; S370-G374 PolarHBondContact O-N 3.29Å; S370-V377 WeakPolarHBondContact O-CG2 3.46Å
371F96.3Very high94Very high4 Ų414 Ų142%0.0187%0.065CC..Hα-helixtrans-67.6-44.2175.1-179.8-94000112.6A279 P280 N281 A367 L368 A369 V377 A381 I382 V500A279-F371 HydrophobicContact CB-CZ 4.37Å; P280-F371 HydrophobicContact CG-CE1 4.09Å; P280-F371 HydrophobicContact CG-CZ 3.79Å; P280-F371 WeakPolarHBondContact O-CE1 3.16Å; N281-F371 HydrophobicContact CB-CE1 4.37Å; N281-F371 VanDerWaalsContact CB-O 3.24Å; N281-F371 WeakPolarHBondContact CB-O 3.37Å; A367-F371 VanDerWaalsContact O-CB 3.29Å; A367-F371 WeakPolarHBondContact O-CB 3.26Å; A367-F371 PolarHBondContact O-N 2.98Å; L368-F371 PolarHBondContact O-N 2.59Å; A369-F371 VanDerWaalsContact C-N 3.31Å; A369-F371 PolarHBondContact O-N 2.76Å; F371-V377 HydrophobicContact CD2-CG1 3.45Å; F371-V377 VanDerWaalsContact CD2-CG1 3.45Å; F371-V377 HydrophobicContact CE2-CG1 3.82Å; F371-V377 HydrophobicContact CG-CG1 4.17Å; F371-A381 HydrophobicContact CD2-CB 3.93Å; F371-A381 HydrophobicContact CE2-CB 4.23Å; F371-I382 HydrophobicContact CD1-CD1 3.97Å; F371-I382 HydrophobicContact CD2-CB 4.46Å; F371-I382 HydrophobicContact CE1-CD1 3.76Å; F371-I382 HydrophobicContact CE2-CB 3.84Å; F371-I382 HydrophobicContact CE2-CD1 4.36Å; F371-I382 HydrophobicContact CG-CD1 4.35Å; F371-I382 HydrophobicContact CZ-CB 3.89Å; F371-I382 HydrophobicContact CZ-CD1 3.97Å; F371-I382 HydrophobicContact CZ-CG1 4.31Å; F371-V500 HydrophobicContact CD1-CG1 3.97Å; F371-V500 HydrophobicContact CE1-CG1 3.91Å
372L96.4Very high94.1Very high2 Ų212.5 Ų12.51%0.016%0.059CC..Hα-helixtrans-73.1-42-176.7-76.3174000112.7A282 L368 A369 V500 F504A282-L372 VanDerWaalsContact CB-O 3.26Å; A282-L372 WeakPolarHBondContact CB-O 3.26Å; A282-L372 PolarHBondContact N-O 2.93Å; L368-L372 VanDerWaalsContact O-CB 3.29Å; L368-L372 WeakPolarHBondContact O-CB 3.31Å; L368-L372 VanDerWaalsContact O-CG 3.27Å; L368-L372 WeakPolarHBondContact O-CG 3.23Å; L368-L372 PolarHBondContact O-N 3.37Å; A369-L372 PolarHBondContact O-N 3.41Å; L372-V500 HydrophobicContact CD2-CB 4.48Å; L372-V500 HydrophobicContact CD2-CG1 3.85Å; L372-V500 HydrophobicContact CG-CG1 4.4Å; L372-F504 HydrophobicContact CD1-CB 3.51Å; L372-F504 HydrophobicContact CD1-CD1 3.55Å; L372-F504 HydrophobicContact CD1-CD2 4.16Å; L372-F504 HydrophobicContact CD1-CE1 4.29Å; L372-F504 HydrophobicContact CD1-CG 3.47Å; L372-F504 VanDerWaalsContact CD1-CG 3.47Å
373F95.9Very high94.2Very high50 Ų5012.5 Ų12.522%0.2196%0.059CC..Hα-helixtrans-115.4-1.1-169.7-55.6-64.9000113.9A282 W283 T334 C337 T338 A341 A369 F504A282-F373 HydrophobicContact CB-CD1 3.83Å; A282-F373 HydrophobicContact CB-CE1 3.68Å; W283-F373 HydrophobicContact CZ2-CB 4.38Å; W283-F373 WeakPolarHBondContact CZ2-O 3.38Å; W283-F373 PolarHBondContact NE1-O 2.98Å; T334-F373 VanDerWaalsContact CB-O 3.3Å; T334-F373 WeakPolarHBondContact CB-O 3.38Å; C337-F373 HydrophobicContact CB-CB 3.97Å; C337-F373 HydrophobicContact CB-CD1 4.27Å; C337-F373 HydrophobicContact CB-CG 4.2Å; T338-F373 WeakPolarHBondContact OG1-CB 3.44Å; T338-F373 PolarHBondContact OG1-O 3.29Å; T338-F373 VanDerWaalsContact OG1-O 3.08Å; A341-F373 HydrophobicContact CB-CD2 3.71Å; A341-F373 HydrophobicContact CB-CE2 3.75Å; A369-F373 WeakPolarHBondContact O-CD2 3.27Å; A369-F373 PolarHBondContact O-N 3.26Å; F373-F504 HydrophobicContact CE2-CE1 4.14Å; F373-F504 HydrophobicContact CE2-CZ 4.46Å
374G92.1Very high94.2Very high7 Ų712.8 Ų12.87%0.0726%0.061CC..  trans-67.9152.9179.300000112.7W283 T338 S370W283-G374 PolarHBondContact NE1-O 3.02Å; T338-G374 PolarHBondContact OG1-N 3.22Å; S370-G374 WeakPolarHBondContact O-CA 3.22Å; S370-G374 PolarHBondContact O-N 3.29Å
375W87.4Confident94.3Very high70 Ų7012.8 Ų12.827%0.2656%0.061SC..SBendtrans-73.8132.8166.9-174.8-98.1000109.6R271 L273 V329 P331 T334R271-W375 VanDerWaalsContact O-CE2 3.26Å; R271-W375 WeakPolarHBondContact O-CZ2 3.48Å; R271-W375 PolarHBondContact O-NE1 3.44Å; L273-W375 HydrophobicContact CB-CE3 4.26Å; L273-W375 HydrophobicContact CB-CH2 3.88Å; L273-W375 HydrophobicContact CB-CZ2 4.48Å; L273-W375 HydrophobicContact CB-CZ3 3.75Å; L273-W375 HydrophobicContact CD1-CD2 4.32Å; L273-W375 HydrophobicContact CD1-CE3 3.42Å; L273-W375 VanDerWaalsContact CD1-CE3 3.42Å; L273-W375 HydrophobicContact CD1-CH2 4.47Å; L273-W375 HydrophobicContact CD1-CZ3 3.51Å; L273-W375 HydrophobicContact CG-CE3 4.45Å; L273-W375 HydrophobicContact CG-CZ3 4.19Å; V329-W375 VanDerWaalsContact O-CZ3 3.3Å; V329-W375 WeakPolarHBondContact O-CZ3 3.13Å; P331-W375 HydrophobicContact CB-CD2 4.05Å; P331-W375 HydrophobicContact CB-CE3 4.05Å; P331-W375 HydrophobicContact CB-CG 4.44Å; P331-W375 HydrophobicContact CB-CZ3 4.44Å; P331-W375 HydrophobicContact CG-CD2 3.9Å; P331-W375 HydrophobicContact CG-CE3 3.88Å; P331-W375 HydrophobicContact CG-CH2 3.82Å; P331-W375 HydrophobicContact CG-CZ2 3.84Å; P331-W375 HydrophobicContact CG-CZ3 3.83Å; T334-W375 HydrophobicContact CG2-CE3 3.76Å; T334-W375 HydrophobicContact CG2-CZ3 4.4Å; T334-W375 WeakPolarHBondContact OG1-CB 3.36Å
376H84.4Confident94.3Very high18 Ų1812.8 Ų12.88%0.0836%0.061CC..SBendtrans55.157.9171.7-162.575000114R271 G272 H275 H378R271-H376 HydrophobicContact CB-CB 4.4Å; R271-H376 WeakPolarHBondContact CB-ND1 3.43Å; R271-H376 WeakPolarHBondContact CD-CD2 3.25Å; R271-H376 WeakPolarHBondContact CD-NE2 3.22Å; R271-H376 PolarHBondContact NH1-NE2 3.46Å; G272-H376 PolarHBondContact O-ND1 3.13Å; H275-H376 AromaticContact CD2-CE1 3.88Å; H376-H378 AromaticContact CD2-NE2 3.87Å; H376-H378 AromaticContact NE2-CE1 3.9Å; H376-H378 AromaticContact NE2-NE2 3.48Å; H376-H378 PolarHBondContact NE2-NE2 2.62Å
377V87.3Confident94.3Very high2 Ų212.8 Ų12.81%0.0126%0.061CC..  trans-91.3133.9177.4-178.80000109.8A279 S370 F371 A381A279-V377 WeakPolarHBondContact CB-O 3.16Å; S370-V377 WeakPolarHBondContact O-CG2 3.46Å; F371-V377 HydrophobicContact CD2-CG1 3.45Å; F371-V377 VanDerWaalsContact CD2-CG1 3.45Å; F371-V377 HydrophobicContact CE2-CG1 3.82Å; F371-V377 HydrophobicContact CG-CG1 4.17Å; V377-A381 HydrophobicContact CG1-CB 4.1Å
378H88.1Confident94.3Very high51 Ų5112.7 Ų12.724%0.2366%0.06CC..  trans-87.2146.4172.5-68.9-88000111.6H275 H376 K380 A381H275-H378 AromaticContact CD2-CE1 3.61Å; H275-H378 AromaticContact CD2-ND1 4Å; H275-H378 AromaticContact CE1-ND1 3.97Å; H275-H378 AromaticContact CG-CE1 3.96Å; H275-H378 AromaticContact CG-ND1 3.89Å; H275-H378 AromaticContact ND1-ND1 3.86Å; H275-H378 AromaticContact NE2-CE1 3.67Å; H376-H378 AromaticContact CD2-NE2 3.87Å; H376-H378 AromaticContact NE2-CE1 3.9Å; H376-H378 AromaticContact NE2-NE2 3.48Å; H376-H378 PolarHBondContact NE2-NE2 2.62Å; H378-K380 PolarHBondContact O-N 3.04Å; H378-A381 WeakPolarHBondContact O-CB 3.38Å; H378-A381 PolarHBondContact O-N 3.32Å
379E89.8Confident94.3Very high2 Ų212.7 Ų12.71%0.0096%0.06CC..G310 helixtrans-52.1-40176.161.5-61.4134.700112.6H275 A279 A381 I382 L414 L417H275-E379 IonicContact ND1-OE2 3.48Å; A279-E379 HydrophobicContact CB-CB 4.41Å; E379-A381 PolarHBondContact O-N 3.22Å; E379-A381 VanDerWaalsContact O-N 3.1Å; E379-I382 VanDerWaalsContact O-CG2 3.27Å; E379-I382 WeakPolarHBondContact O-CG2 3.26Å; E379-I382 PolarHBondContact O-N 3.07Å; E379-L414 HydrophobicContact CB-CD2 4.22Å; E379-L414 HydrophobicContact CG-CD2 4.09Å; E379-L417 HydrophobicContact CG-CD1 4.12Å; E379-L417 HydrophobicContact CG-CD2 4.01Å; E379-L417 HydrophobicContact CG-CG 4.14Å; E379-L417 WeakPolarHBondContact OE1-CD2 3.3Å
380K92.8Very high94.3Very high32 Ų3212.8 Ų12.814%0.1396%0.061CC..G310 helixtrans-57.3-26177.6-63178.7-80.8-1630113.6D33 V155 H159 H378 I382 L383 L414 L417D33-K380 IonicContact OD2-NZ 3.87Å; D33-K380 PolarHBondContact OD2-NZ 2.74Å; V155-K380 HydrophobicContact CG1-CD 3.86Å; V155-K380 HydrophobicContact CG1-CG 4.25Å; V155-K380 HydrophobicContact CG2-CG 4.21Å; H159-K380 PolarHBondContact NE2-NZ 3.31Å; H378-K380 PolarHBondContact O-N 3.04Å; K380-I382 PolarHBondContact O-N 2.99Å; K380-I382 VanDerWaalsContact O-N 3.16Å; K380-L383 PolarHBondContact O-N 3.49Å; K380-L414 HydrophobicContact CG-CD2 4.37Å; K380-L417 HydrophobicContact CD-CD1 3.95Å; K380-L417 HydrophobicContact CG-CD1 3.58Å
381A94.6Very high94.3Very high11 Ų1112.6 Ų12.69%0.0916%0.059CC..G310 helixtrans-67.4-14.6-177.800000113.6I198 F371 V377 H378 E379 L383 L384I198-A381 HydrophobicContact CD1-CB 3.91Å; F371-A381 HydrophobicContact CD2-CB 3.93Å; F371-A381 HydrophobicContact CE2-CB 4.23Å; V377-A381 HydrophobicContact CG1-CB 4.1Å; H378-A381 WeakPolarHBondContact O-CB 3.38Å; H378-A381 PolarHBondContact O-N 3.32Å; E379-A381 PolarHBondContact O-N 3.22Å; E379-A381 VanDerWaalsContact O-N 3.1Å; A381-L383 PolarHBondContact O-N 3.08Å; A381-L383 VanDerWaalsContact O-N 3.14Å; A381-L384 WeakPolarHBondContact O-CB 3.24Å; A381-L384 PolarHBondContact O-N 3.23Å
382I96.8Very high94.3Very high1 Ų112.4 Ų12.41%0.0056%0.059CC..G310 helixtrans-58.7-26.8176.6-164.953.8000112.7L368 F371 E379 K380 L384 A385 V386 L406 L414 V500L368-I382 HydrophobicContact CD2-CD1 4.19Å; F371-I382 HydrophobicContact CD1-CD1 3.97Å; F371-I382 HydrophobicContact CD2-CB 4.46Å; F371-I382 HydrophobicContact CE1-CD1 3.76Å; F371-I382 HydrophobicContact CE2-CB 3.84Å; F371-I382 HydrophobicContact CE2-CD1 4.36Å; F371-I382 HydrophobicContact CG-CD1 4.35Å; F371-I382 HydrophobicContact CZ-CB 3.89Å; F371-I382 HydrophobicContact CZ-CD1 3.97Å; F371-I382 HydrophobicContact CZ-CG1 4.31Å; E379-I382 VanDerWaalsContact O-CG2 3.27Å; E379-I382 WeakPolarHBondContact O-CG2 3.26Å; E379-I382 PolarHBondContact O-N 3.07Å; K380-I382 PolarHBondContact O-N 2.99Å; K380-I382 VanDerWaalsContact O-N 3.16Å; I382-L384 PolarHBondContact O-N 3.35Å; I382-A385 PolarHBondContact O-N 2.85Å; I382-V386 HydrophobicContact CG1-CG2 4.22Å; I382-V386 PolarHBondContact O-N 3.33Å; I382-L406 HydrophobicContact CD1-CD1 4.02Å; I382-L414 HydrophobicContact CG2-CD2 4.42Å; I382-V500 HydrophobicContact CD1-CG1 3.95Å; I382-V500 HydrophobicContact CD1-CG2 4.16Å
383L97.6Very high94.3Very high1 Ų112.3 Ų12.31%0.0056%0.058CC..Hα-helixtrans-62.4-24.9177.1-61.8179.4000113L152 V155 F167 K380 A381 A385 V386 L387 L414L152-L383 HydrophobicContact CD2-CD1 4.08Å; L152-L383 HydrophobicContact CG-CD1 4.47Å; V155-L383 HydrophobicContact CG2-CD1 4.37Å; F167-L383 HydrophobicContact CE2-CB 3.75Å; F167-L383 HydrophobicContact CE2-CD1 4.37Å; F167-L383 HydrophobicContact CZ-CB 3.67Å; K380-L383 PolarHBondContact O-N 3.49Å; A381-L383 PolarHBondContact O-N 3.08Å; A381-L383 VanDerWaalsContact O-N 3.14Å; L383-A385 PolarHBondContact O-N 3.45Å; L383-V386 PolarHBondContact O-N 3.42Å; L383-L387 HydrophobicContact CB-CD1 4.3Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 2.98Å; L383-L387 VanDerWaalsContact O-N 3.11Å; L383-L414 HydrophobicContact CD2-CD1 4.42Å
384L97.3Very high94.3Very high5 Ų510.2 Ų10.23%0.0265%0.049CC..Hα-helixtrans-60.1-27.6173.2-17363000112.5F167 L170 F199 Y201 V202 A367 A381 I382 P388F167-L384 HydrophobicContact CE1-CB 4.25Å; F167-L384 HydrophobicContact CE1-CD1 4.01Å; L170-L384 HydrophobicContact CD2-CD1 3.66Å; F199-L384 HydrophobicContact CD1-CD1 3.56Å; F199-L384 HydrophobicContact CE1-CD1 3.58Å; Y201-L384 HydrophobicContact CD2-CD2 4.03Å; V202-L384 HydrophobicContact CG1-CD1 4.39Å; V202-L384 HydrophobicContact CG1-CD2 4.15Å; V202-L384 HydrophobicContact CG1-CG 4.27Å; A367-L384 HydrophobicContact CB-CB 4.44Å; A367-L384 HydrophobicContact CB-CD2 4.01Å; A367-L384 HydrophobicContact CB-CG 3.82Å; A381-L384 WeakPolarHBondContact O-CB 3.24Å; A381-L384 PolarHBondContact O-N 3.23Å; I382-L384 PolarHBondContact O-N 3.35Å; L384-P388 VanDerWaalsContact O-CD 3.24Å; L384-P388 WeakPolarHBondContact O-CD 3.35Å; L384-P388 WeakPolarHBondContact O-CG 3.26Å
385A97.7Very high94.2Very high2 Ų212.2 Ų12.22%0.0176%0.057CC..Hα-helixtrans-97-42.6174.400000112.6L364 A367 L368 I382 L383 L387 P388 L389 L406L364-A385 HydrophobicContact CD2-CB 4.44Å; L364-A385 WeakPolarHBondContact CD2-O 3.46Å; A367-A385 HydrophobicContact CB-CB 4.31Å; L368-A385 HydrophobicContact CD1-CB 4.46Å; L368-A385 HydrophobicContact CD2-CB 3.49Å; L368-A385 VanDerWaalsContact CD2-CB 3.49Å; L368-A385 HydrophobicContact CG-CB 3.66Å; I382-A385 PolarHBondContact O-N 2.85Å; L383-A385 PolarHBondContact O-N 3.45Å; A385-L387 PolarHBondContact O-N 2.89Å; A385-P388 WeakPolarHBondContact O-CD 3.19Å; A385-L389 WeakPolarHBondContact O-CB 3.39Å; A385-L389 PolarHBondContact O-N 2.74Å; A385-L406 HydrophobicContact CB-CD2 4.15Å
386V98.3Very high94.4Very high0 Ų010.1 Ų10.10%05%0.053CC..Hα-helixtrans-61.6-45.3-175.4173.60000111.8I382 L383 L389 S390 F403 L406I382-V386 HydrophobicContact CG1-CG2 4.22Å; I382-V386 PolarHBondContact O-N 3.33Å; L383-V386 PolarHBondContact O-N 3.42Å; V386-L389 PolarHBondContact O-N 3.15Å; V386-S390 PolarHBondContact O-N 3.31Å; V386-F403 HydrophobicContact CG1-CE2 4.14Å; V386-L406 HydrophobicContact CG2-CD2 4.37Å; V386-L406 HydrophobicContact CG2-CG 4.16Å
387L98.1Very high94.8Very high0 Ų012.5 Ų12.50%06%0.061CC..Hα-helixtrans-67.5-52-174.2-60.3167.5000112.3L146 N149 L152 F167 L383 A385 L389 S390L146-L387 HydrophobicContact CD2-CB 4.37Å; L146-L387 HydrophobicContact CD2-CD2 4.25Å; N149-L387 HydrophobicContact CB-CD2 4.01Å; L152-L387 HydrophobicContact CD1-CD1 3.73Å; L152-L387 HydrophobicContact CD1-CD2 3.6Å; L152-L387 HydrophobicContact CD1-CG 4.32Å; L152-L387 HydrophobicContact CD2-CD1 4.05Å; L152-L387 HydrophobicContact CG-CD1 4Å; L152-L387 HydrophobicContact CG-CD2 4.09Å; F167-L387 HydrophobicContact CB-CD1 3.85Å; F167-L387 HydrophobicContact CD1-CD1 3.82Å; F167-L387 HydrophobicContact CD2-CD1 3.51Å; F167-L387 HydrophobicContact CE1-CD1 4.23Å; F167-L387 HydrophobicContact CE2-CD1 3.91Å; F167-L387 HydrophobicContact CG-CD1 3.44Å; F167-L387 VanDerWaalsContact CG-CD1 3.44Å; F167-L387 HydrophobicContact CZ-CD1 4.26Å; L383-L387 HydrophobicContact CB-CD1 4.3Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 2.98Å; L383-L387 VanDerWaalsContact O-N 3.11Å; A385-L387 PolarHBondContact O-N 2.89Å; L387-L389 PolarHBondContact O-N 3.35Å; L387-S390 WeakPolarHBondContact O-CB 3.42Å; L387-S390 PolarHBondContact O-N 3.19Å; L387-S390 PolarHBondContact O-OG 3.45Å
388P97.5Very high95.2Very high0 Ų015 Ų150%07%0.073CC..Hα-helixtrans-67.9-25.1178.7-17.833.3000113L170 L171 L363 L364 L384 A385 S390 I391L170-P388 HydrophobicContact CD2-CG 4.1Å; L171-P388 HydrophobicContact CD2-CG 4.33Å; L363-P388 HydrophobicContact CD2-CB 4.11Å; L363-P388 HydrophobicContact CD2-CG 4.07Å; L364-P388 HydrophobicContact CD2-CB 3.95Å; L364-P388 HydrophobicContact CD2-CG 4.46Å; L384-P388 VanDerWaalsContact O-CD 3.24Å; L384-P388 WeakPolarHBondContact O-CD 3.35Å; L384-P388 WeakPolarHBondContact O-CG 3.26Å; A385-P388 WeakPolarHBondContact O-CD 3.19Å; P388-S390 VanDerWaalsContact C-N 3.28Å; P388-S390 PolarHBondContact O-N 3.5Å; P388-I391 WeakPolarHBondContact O-CB 3.32Å; P388-I391 PolarHBondContact O-N 2.96Å
389L97.9Very high95.5Very high1 Ų112.7 Ų12.71%0.0056%0.062CC..Hα-helixtrans-67.3-29.9178-18062.9000111.8L364 A385 V386 L387 I391 L392 A393 D399 I402 F403 L406L364-L389 HydrophobicContact CD1-CB 4.02Å; L364-L389 HydrophobicContact CD1-CD1 3.78Å; L364-L389 HydrophobicContact CD1-CG 4.49Å; L364-L389 HydrophobicContact CD2-CB 3.86Å; A385-L389 WeakPolarHBondContact O-CB 3.39Å; A385-L389 PolarHBondContact O-N 2.74Å; V386-L389 PolarHBondContact O-N 3.15Å; L387-L389 PolarHBondContact O-N 3.35Å; L389-I391 PolarHBondContact O-N 3Å; L389-L392 HydrophobicContact CD1-CB 4.38Å; L389-L392 PolarHBondContact O-N 3.43Å; L389-A393 WeakPolarHBondContact O-CB 3.49Å; L389-A393 PolarHBondContact O-N 3.27Å; L389-D399 HydrophobicContact CD1-CB 4.45Å; L389-I402 HydrophobicContact CD2-CG2 4.1Å; L389-F403 HydrophobicContact CB-CD2 4.26Å; L389-F403 HydrophobicContact CD2-CB 3.94Å; L389-F403 HydrophobicContact CD2-CD2 4.2Å; L389-F403 HydrophobicContact CG-CB 4Å; L389-F403 HydrophobicContact CG-CD2 4.01Å; L389-L406 HydrophobicContact CD2-CB 4.29Å; L389-L406 HydrophobicContact CD2-CD2 3.58Å
390S97.7Very high95.9Very high1 Ų112.6 Ų12.61%0.0076%0.061CC..Hα-helixtrans-55.6-33.5174.770.10000112.8L142 L146 V386 L387 P388 L392 A393 V394L142-S390 VanDerWaalsContact CD1-C 3.5Å; L142-S390 WeakPolarHBondContact CD1-O 3.38Å; L142-S390 VanDerWaalsContact CD1-OG 3.27Å; L142-S390 WeakPolarHBondContact CD1-OG 3Å; L146-S390 VanDerWaalsContact CD2-OG 3.23Å; L146-S390 WeakPolarHBondContact CD2-OG 3.41Å; V386-S390 PolarHBondContact O-N 3.31Å; L387-S390 WeakPolarHBondContact O-CB 3.42Å; L387-S390 PolarHBondContact O-N 3.19Å; L387-S390 PolarHBondContact O-OG 3.45Å; P388-S390 VanDerWaalsContact C-N 3.28Å; P388-S390 PolarHBondContact O-N 3.5Å; S390-L392 PolarHBondContact O-N 2.66Å; S390-A393 WeakPolarHBondContact O-CB 3.34Å; S390-A393 PolarHBondContact O-N 3.02Å; S390-V394 PolarHBondContact O-N 3.23Å
391I96.9Very high96.1Very high4 Ų411 Ų112%0.0216%0.055CC..Hα-helixtrans-63.8-41.7176.9-54.3176.3000110.6C121 L142 L171 V174 L178 L360 P388 L389 V394C121-I391 HydrophobicContact CB-CD1 4.26Å; L142-I391 HydrophobicContact CD1-CG1 4.26Å; L142-I391 HydrophobicContact CD2-CG1 4.25Å; L171-I391 HydrophobicContact CD2-CD1 4.18Å; V174-I391 HydrophobicContact CG1-CD1 4.03Å; L178-I391 HydrophobicContact CD1-CG2 4.35Å; L360-I391 HydrophobicContact CD1-CB 4.33Å; L360-I391 HydrophobicContact CD1-CG2 3.92Å; P388-I391 WeakPolarHBondContact O-CB 3.32Å; P388-I391 PolarHBondContact O-N 2.96Å; L389-I391 PolarHBondContact O-N 3Å; I391-V394 VanDerWaalsContact O-CG2 3.29Å; I391-V394 WeakPolarHBondContact O-CG2 3.38Å
392L95.2Very high96.3Very high1 Ų110.5 Ų10.51%0.0055%0.051CC..Hα-helixtrans-76.1-33176.8-64.8-178.3000112R357 L360 R361 L364 L389 S390 V394 E395 S396 D399R357-L392 HydrophobicContact CG-CD2 4.37Å; L360-L392 HydrophobicContact CB-CD1 4.18Å; L360-L392 HydrophobicContact CB-CD2 4.07Å; L360-L392 HydrophobicContact CB-CG 4.24Å; L360-L392 HydrophobicContact CD1-CD2 3.87Å; L360-L392 HydrophobicContact CD1-CG 4.28Å; R361-L392 HydrophobicContact CG-CD1 3.5Å; L364-L392 HydrophobicContact CD1-CD1 3.55Å; L364-L392 HydrophobicContact CD1-CG 4.45Å; L389-L392 HydrophobicContact CD1-CB 4.38Å; L389-L392 PolarHBondContact O-N 3.43Å; S390-L392 PolarHBondContact O-N 2.66Å; L392-V394 VanDerWaalsContact C-N 3.29Å; L392-V394 PolarHBondContact O-N 3.22Å; L392-E395 PolarHBondContact O-N 3.38Å; L392-S396 PolarHBondContact O-N 3.45Å; L392-D399 HydrophobicContact CB-CB 3.77Å
393A96.6Very high96.4Very high0 Ų010.5 Ų10.50%05%0.05CC..Hα-helixtrans-59.1-38.6-179.400000112.4L389 S390 E395 A400 F403 L442 H446L389-A393 WeakPolarHBondContact O-CB 3.49Å; L389-A393 PolarHBondContact O-N 3.27Å; S390-A393 WeakPolarHBondContact O-CB 3.34Å; S390-A393 PolarHBondContact O-N 3.02Å; A393-E395 VanDerWaalsContact C-N 3.29Å; A393-E395 PolarHBondContact O-N 3.34Å; A393-A400 HydrophobicContact CB-CB 4.49Å; A393-A400 WeakPolarHBondContact O-CB 3.28Å; A393-F403 HydrophobicContact CB-CB 3.61Å; A393-F403 HydrophobicContact CB-CD1 4.18Å; A393-F403 HydrophobicContact CB-CD2 4.25Å; A393-F403 HydrophobicContact CB-CG 3.75Å; A393-L442 HydrophobicContact CB-CD1 4.26Å; A393-L442 HydrophobicContact CB-CD2 4.33Å; A393-H446 PolarHBondContact O-NE2 3.02Å
394V95.3Very high96.4Very high6 Ų610.5 Ų10.54%0.0365%0.05CC..THydrogen-bonded Turntrans-76.6-15.6177-61.50000113.5I125 P138 V141 L142 L145 S390 I391 L392 L442 L445I125-V394 HydrophobicContact CD1-CG2 3.71Å; I125-V394 HydrophobicContact CG1-CG2 4.1Å; P138-V394 HydrophobicContact CB-CB 4.41Å; V141-V394 HydrophobicContact CB-CG1 4.29Å; V141-V394 HydrophobicContact CG1-CG1 3.96Å; L142-V394 HydrophobicContact CB-CG1 4.07Å; L142-V394 HydrophobicContact CB-CG2 4.23Å; L145-V394 HydrophobicContact CD1-CG1 4.23Å; S390-V394 PolarHBondContact O-N 3.23Å; I391-V394 VanDerWaalsContact O-CG2 3.29Å; I391-V394 WeakPolarHBondContact O-CG2 3.38Å; L392-V394 VanDerWaalsContact C-N 3.29Å; L392-V394 PolarHBondContact O-N 3.22Å; V394-L442 HydrophobicContact CG1-CD2 4.1Å; V394-L445 HydrophobicContact CB-CD2 3.91Å; V394-L445 HydrophobicContact CG1-CD2 4.23Å; V394-L445 WeakPolarHBondContact O-CD2 3.24Å
395E90.9Very high96.4Very high48 Ų4810.2 Ų10.222%0.2245%0.049CC..THydrogen-bonded Turntrans-97.7-26.9-179-68.8-159.5124.400114.1I125 R357 L392 A393I125-E395 HydrophobicContact CG2-CG 4.5Å; R357-E395 IonicContact CZ-OE1 2.97Å; R357-E395 IonicContact CZ-OE2 3.8Å; R357-E395 IonicContact NE-OE1 3.67Å; R357-E395 IonicContact NE-OE2 3.95Å; R357-E395 PolarHBondContact NE-OE2 3.04Å; R357-E395 VanDerWaalsContact NH2-CD 3.27Å; R357-E395 IonicContact NH2-OE1 2.67Å; R357-E395 PolarHBondContact NH2-OE1 2.88Å; R357-E395 VanDerWaalsContact NH2-OE1 3.15Å; R357-E395 IonicContact NH2-OE2 2.82Å; R357-E395 PolarHBondContact NH2-OE2 3Å; L392-E395 PolarHBondContact O-N 3.38Å; A393-E395 VanDerWaalsContact C-N 3.29Å; A393-E395 PolarHBondContact O-N 3.34Å
396S91.5Very high96.5Very high27 Ų2710.2 Ų10.219%0.1895%0.048CC..  trans-139.1131.7-173.8-175.40000112.3L392 E398 D399 A400L392-S396 PolarHBondContact O-N 3.45Å; S396-E398 VanDerWaalsContact C-N 3.28Å; S396-E398 PolarHBondContact O-N 3.22Å; S396-D399 WeakPolarHBondContact CB-OD2 3.27Å; S396-D399 PolarHBondContact O-N 2.57Å; S396-A400 WeakPolarHBondContact O-CB 3.39Å; S396-A400 PolarHBondContact O-N 2.83Å
397R94.1Very high96.5Very high67 Ų6710.2 Ų10.225%0.2535%0.049SC..Hα-helixtrans-57.7-37.4174.7178-96.3171.2-151.32.3113.2A400 G401 H446 Q449 S451 L452R397-A400 WeakPolarHBondContact O-CB 3.41Å; R397-A400 PolarHBondContact O-N 3.46Å; R397-G401 PolarHBondContact O-N 2.97Å; R397-G401 VanDerWaalsContact O-N 3.11Å; R397-H446 HydrophobicContact CB-CB 4.01Å; R397-H446 HydrophobicContact CG-CB 4.16Å; R397-Q449 HydrophobicContact CB-CB 4Å; R397-Q449 HydrophobicContact CG-CB 4.02Å; R397-S451 PolarHBondContact NE-O 2.7Å; R397-S451 PolarHBondContact NH2-O 3.13Å; R397-L452 HydrophobicContact CB-CD2 4.47Å; R397-L452 HydrophobicContact CG-CD2 3.67Å; R397-L452 PolarHBondContact NH2-O 2.93Å
398E93.8Very high96.5Very high55 Ų5510.8 Ų10.826%0.2575%0.052SC..Hα-helixtrans-68-46.7179.8-170.9175.7-173.100111S396 A400 G401 I402 T510S396-E398 VanDerWaalsContact C-N 3.28Å; S396-E398 PolarHBondContact O-N 3.22Å; E398-A400 VanDerWaalsContact C-N 3.28Å; E398-A400 PolarHBondContact O-N 3.29Å; E398-G401 PolarHBondContact O-N 3.4Å; E398-I402 WeakPolarHBondContact O-CG1 3.37Å; E398-I402 PolarHBondContact O-N 3.48Å; E398-T510 PolarHBondContact OE1-OG1 3.02Å; E398-T510 WeakPolarHBondContact OE2-CG2 3.47Å
399D95.7Very high96.4Very high2 Ų210.8 Ų10.81%0.0115%0.052CC..Hα-helixtrans-67.4-30.8176.6-62.7-42.1000111.3R361 L389 L392 S396 I402 F403R361-D399 IonicContact CZ-OD1 3.86Å; R361-D399 IonicContact CZ-OD2 3.65Å; R361-D399 IonicContact NE-OD1 3.11Å; R361-D399 IonicContact NE-OD2 3.73Å; R361-D399 PolarHBondContact NE-OD2 2.98Å; R361-D399 IonicContact NH2-OD1 2.59Å; R361-D399 PolarHBondContact NH2-OD1 2.86Å; R361-D399 IonicContact NH2-OD2 3.09Å; R361-D399 PolarHBondContact NH2-OD2 2.91Å; L389-D399 HydrophobicContact CD1-CB 4.45Å; L392-D399 HydrophobicContact CB-CB 3.77Å; S396-D399 WeakPolarHBondContact CB-OD2 3.27Å; S396-D399 PolarHBondContact O-N 2.57Å; D399-I402 PolarHBondContact O-N 3.04Å; D399-F403 WeakPolarHBondContact O-CB 3.45Å; D399-F403 PolarHBondContact O-N 3.11Å
400A97.4Very high96.4Very high0 Ų010.8 Ų10.80%05%0.052CC..Hα-helixtrans-62.5-45.6173.100000112.3A393 S396 R397 E398 F403 L404 L442 L452A393-A400 HydrophobicContact CB-CB 4.49Å; A393-A400 WeakPolarHBondContact O-CB 3.28Å; S396-A400 WeakPolarHBondContact O-CB 3.39Å; S396-A400 PolarHBondContact O-N 2.83Å; R397-A400 WeakPolarHBondContact O-CB 3.41Å; R397-A400 PolarHBondContact O-N 3.46Å; E398-A400 VanDerWaalsContact C-N 3.28Å; E398-A400 PolarHBondContact O-N 3.29Å; A400-F403 WeakPolarHBondContact O-CB 3.19Å; A400-F403 PolarHBondContact O-N 2.82Å; A400-L404 WeakPolarHBondContact O-CG 3.45Å; A400-L404 PolarHBondContact O-N 2.79Å; A400-L442 HydrophobicContact CB-CD1 4.37Å; A400-L442 HydrophobicContact CB-CD2 4.5Å; A400-L452 HydrophobicContact CB-CD2 4.07Å
401G97.7Very high96.4Very high0 Ų010.7 Ų10.70%05%0.052CC..Hα-helixtrans-62.2-42.1175.600000112.3R397 E398 F403 L404 V405R397-G401 PolarHBondContact O-N 2.97Å; R397-G401 VanDerWaalsContact O-N 3.11Å; E398-G401 PolarHBondContact O-N 3.4Å; G401-F403 VanDerWaalsContact C-N 3.33Å; G401-L404 PolarHBondContact O-N 2.79Å; G401-V405 PolarHBondContact O-N 3.07Å
402I98Very high96.4Very high0 Ų010.8 Ų10.80%05%0.052CC..Hα-helixtrans-62.9-42.4174.8-61.6167.5000110.4L389 E398 D399 V405 L406 R506 L507L389-I402 HydrophobicContact CD2-CG2 4.1Å; E398-I402 WeakPolarHBondContact O-CG1 3.37Å; E398-I402 PolarHBondContact O-N 3.48Å; D399-I402 PolarHBondContact O-N 3.04Å; I402-V405 PolarHBondContact O-N 3.19Å; I402-L406 VanDerWaalsContact O-CB 3.25Å; I402-L406 WeakPolarHBondContact O-CB 3.28Å; I402-L406 PolarHBondContact O-N 3.05Å; I402-R506 HydrophobicContact CD1-CB 3.94Å; I402-R506 HydrophobicContact CG1-CB 3.91Å; I402-L507 HydrophobicContact CD1-CB 4.24Å; I402-L507 HydrophobicContact CD1-CD1 4.28Å
403F98.5Very high96.4Very high0 Ų011 Ų110%05%0.053CC..Hα-helixtrans-59.2-48.1176.7176.5-95.1000111.8L145 V386 L389 A393 D399 A400 G401 V405 L406 S407 F434 L442L145-F403 HydrophobicContact CD1-CE1 4.06Å; L145-F403 HydrophobicContact CD1-CZ 4.21Å; L145-F403 HydrophobicContact CD2-CE1 3.91Å; L145-F403 HydrophobicContact CD2-CZ 4.1Å; V386-F403 HydrophobicContact CG1-CE2 4.14Å; L389-F403 HydrophobicContact CB-CD2 4.26Å; L389-F403 HydrophobicContact CD2-CB 3.94Å; L389-F403 HydrophobicContact CD2-CD2 4.2Å; L389-F403 HydrophobicContact CG-CB 4Å; L389-F403 HydrophobicContact CG-CD2 4.01Å; A393-F403 HydrophobicContact CB-CB 3.61Å; A393-F403 HydrophobicContact CB-CD1 4.18Å; A393-F403 HydrophobicContact CB-CD2 4.25Å; A393-F403 HydrophobicContact CB-CG 3.75Å; D399-F403 WeakPolarHBondContact O-CB 3.45Å; D399-F403 PolarHBondContact O-N 3.11Å; A400-F403 WeakPolarHBondContact O-CB 3.19Å; A400-F403 PolarHBondContact O-N 2.82Å; G401-F403 VanDerWaalsContact C-N 3.33Å; F403-V405 VanDerWaalsContact C-N 3.33Å; F403-V405 PolarHBondContact O-N 3.4Å; F403-L406 PolarHBondContact O-N 3.16Å; F403-S407 VanDerWaalsContact O-CB 3.23Å; F403-S407 WeakPolarHBondContact O-CB 3.5Å; F403-S407 PolarHBondContact O-N 3.22Å; F403-S407 PolarHBondContact O-OG 2.89Å; F403-F434 HydrophobicContact CZ-CZ 4.22Å; F403-L442 HydrophobicContact CD1-CD1 3.59Å; F403-L442 HydrophobicContact CE1-CD1 4.05Å
404L98.3Very high96.3Very high1 Ų111 Ų111%0.0055%0.053CC..Hα-helixtrans-59.6-42.3-179.6-69.2-176.8000112.3A400 G401 T408 F439 L442 L452 L453A400-L404 WeakPolarHBondContact O-CG 3.45Å; A400-L404 PolarHBondContact O-N 2.79Å; G401-L404 PolarHBondContact O-N 2.79Å; L404-T408 VanDerWaalsContact O-CB 3.26Å; L404-T408 WeakPolarHBondContact O-CB 3.22Å; L404-T408 PolarHBondContact O-N 3.43Å; L404-T408 PolarHBondContact O-OG1 2.89Å; L404-F439 HydrophobicContact CB-CE2 4.06Å; L404-F439 HydrophobicContact CB-CZ 4Å; L404-F439 HydrophobicContact CD1-CD1 3.97Å; L404-F439 HydrophobicContact CD1-CD2 4.29Å; L404-F439 HydrophobicContact CD1-CE1 4.1Å; L404-F439 HydrophobicContact CD1-CE2 4.41Å; L404-F439 HydrophobicContact CD1-CG 4.08Å; L404-F439 HydrophobicContact CD1-CZ 4.3Å; L404-F439 HydrophobicContact CD2-CD2 3.59Å; L404-F439 HydrophobicContact CD2-CE2 3.79Å; L404-F439 HydrophobicContact CD2-CG 4.09Å; L404-F439 HydrophobicContact CD2-CZ 4.44Å; L404-F439 HydrophobicContact CG-CD2 4.37Å; L404-F439 HydrophobicContact CG-CE2 4.3Å; L404-F439 HydrophobicContact CG-CZ 4.48Å; L404-L442 HydrophobicContact CD2-CD1 3.87Å; L404-L442 HydrophobicContact CG-CD1 4.28Å; L404-L452 HydrophobicContact CD1-CB 4.16Å; L404-L452 HydrophobicContact CD1-CD1 3.58Å; L404-L453 HydrophobicContact CB-CD2 4.33Å; L404-L453 HydrophobicContact CD1-CD1 4.42Å; L404-L453 HydrophobicContact CD1-CG 4.4Å
405V98.3Very high96.2Very high0 Ų011.1 Ų11.10%05%0.054CC..Hα-helixtrans-68.5-48.4176.7179.60000110.8G401 I402 F403 T409 L453 E457 Y460 L461 Y502G401-V405 PolarHBondContact O-N 3.07Å; I402-V405 PolarHBondContact O-N 3.19Å; F403-V405 VanDerWaalsContact C-N 3.33Å; F403-V405 PolarHBondContact O-N 3.4Å; V405-T409 WeakPolarHBondContact O-CB 3.45Å; V405-T409 WeakPolarHBondContact O-CG2 3.44Å; V405-T409 PolarHBondContact O-N 3.33Å; V405-T409 VanDerWaalsContact O-N 3.1Å; V405-T409 PolarHBondContact O-OG1 3.45Å; V405-L453 HydrophobicContact CG2-CD2 3.86Å; V405-E457 HydrophobicContact CG2-CB 4.37Å; V405-E457 HydrophobicContact CG2-CG 4.26Å; V405-Y460 HydrophobicContact CG1-CE1 4.33Å; V405-L461 HydrophobicContact CG2-CD1 4.37Å; V405-Y502 HydrophobicContact CG1-CD1 4.25Å
406L98.4Very high96.2Very high1 Ų19.5 Ų9.51%0.0055%0.047CC..Hα-helixtrans-66.9-43-176.8-174.666.6000112.8L368 I382 A385 V386 L389 I402 F403 T409 G410 V500 S503L368-L406 HydrophobicContact CD1-CD2 4.38Å; L368-L406 HydrophobicContact CD2-CD1 4.03Å; L368-L406 HydrophobicContact CD2-CD2 4.19Å; I382-L406 HydrophobicContact CD1-CD1 4.02Å; A385-L406 HydrophobicContact CB-CD2 4.15Å; V386-L406 HydrophobicContact CG2-CD2 4.37Å; V386-L406 HydrophobicContact CG2-CG 4.16Å; L389-L406 HydrophobicContact CD2-CB 4.29Å; L389-L406 HydrophobicContact CD2-CD2 3.58Å; I402-L406 VanDerWaalsContact O-CB 3.25Å; I402-L406 WeakPolarHBondContact O-CB 3.28Å; I402-L406 PolarHBondContact O-N 3.05Å; F403-L406 PolarHBondContact O-N 3.16Å; L406-T409 PolarHBondContact O-OG1 3.08Å; L406-G410 WeakPolarHBondContact O-CA 3.48Å; L406-G410 PolarHBondContact O-N 2.67Å; L406-V500 HydrophobicContact CD1-CB 4.36Å; L406-V500 HydrophobicContact CD1-CG1 4.07Å; L406-V500 HydrophobicContact CD1-CG2 4.19Å; L406-S503 PolarHBondContact N-OG 3.28Å
407S98Very high96.2Very high1 Ų18.4 Ų8.41%0.0074%0.039CC..Hα-helixtrans-66.6-46.4179.569.70000110.1F403 T409 H411F403-S407 VanDerWaalsContact O-CB 3.23Å; F403-S407 WeakPolarHBondContact O-CB 3.5Å; F403-S407 PolarHBondContact O-N 3.22Å; F403-S407 PolarHBondContact O-OG 2.89Å; S407-T409 PolarHBondContact O-N 2.72Å; S407-H411 WeakPolarHBondContact O-CB 3.05Å; S407-H411 PolarHBondContact O-N 3.14Å; S407-H411 PolarHBondContact O-ND1 2.91Å
408T97.8Very high96Very high12 Ų125.2 Ų5.27%0.0743%0.027CC..Hα-helixtrans-63.8-44.8-177.3-50.40000111.5L404 Y412 M431 T435 L461 L464L404-T408 VanDerWaalsContact O-CB 3.26Å; L404-T408 WeakPolarHBondContact O-CB 3.22Å; L404-T408 PolarHBondContact O-N 3.43Å; L404-T408 PolarHBondContact O-OG1 2.89Å; T408-Y412 WeakPolarHBondContact O-CB 3.46Å; T408-Y412 PolarHBondContact O-N 3.38Å; T408-M431 HydrophobicContact CG2-CE 3.89Å; T408-M431 WeakPolarHBondContact O-CE 3.41Å; T408-T435 HydrophobicContact CG2-CG2 4.26Å; T408-L461 HydrophobicContact CG2-CD2 3.98Å; T408-L464 HydrophobicContact CG2-CD2 3.78Å
409T97.3Very high95.6Very high0 Ų08.9 Ų8.90%04%0.042CC..Hα-helixtrans-73.5-44.317953.30000112.7V405 L406 S407 H411 Y412 S413 Y460 L464 C496V405-T409 WeakPolarHBondContact O-CB 3.45Å; V405-T409 WeakPolarHBondContact O-CG2 3.44Å; V405-T409 PolarHBondContact O-N 3.33Å; V405-T409 VanDerWaalsContact O-N 3.1Å; V405-T409 PolarHBondContact O-OG1 3.45Å; L406-T409 PolarHBondContact O-OG1 3.08Å; S407-T409 PolarHBondContact O-N 2.72Å; T409-H411 VanDerWaalsContact C-N 3.34Å; T409-H411 PolarHBondContact O-N 3.03Å; T409-Y412 PolarHBondContact O-N 3.49Å; T409-S413 WeakPolarHBondContact O-CB 3.44Å; T409-S413 PolarHBondContact O-N 3.48Å; T409-Y460 HydrophobicContact CG2-CE1 3.52Å; T409-Y460 VanDerWaalsContact CG2-OH 3.3Å; T409-Y460 WeakPolarHBondContact CG2-OH 3.38Å; T409-L464 HydrophobicContact CG2-CD2 4.42Å; T409-C496 PolarHBondContact O-SG 2.84Å
410G96.8Very high95.2Very high0 Ų010.1 Ų10.10%05%0.05CC..Hα-helixtrans-62.1-41.217700000112.1L406 S413L406-G410 WeakPolarHBondContact O-CA 3.48Å; L406-G410 PolarHBondContact O-N 2.67Å; G410-S413 PolarHBondContact O-N 2.94Å; G410-S413 PolarHBondContact O-OG 2.92Å
411H97.4Very high94.6Very high0 Ų015.7 Ų15.70%09%0.086CC..Hα-helixtrans-70.3-44.7177.1-73.4162.9000112.8N149 F150 G151 S407 T409 S413 L414 M431 F434N149-H411 PolarHBondContact OD1-NE2 2.71Å; F150-H411 HydrophobicContact CD1-CB 3.43Å; F150-H411 VanDerWaalsContact CD1-CB 3.43Å; F150-H411 AromaticContact CD1-CD2 3.89Å; F150-H411 AromaticContact CD1-CG 3.56Å; F150-H411 HydrophobicContact CE1-CB 3.84Å; F150-H411 WeakPolarHBondContact CE1-O 3.39Å; F150-H411 HydrophobicContact CG-CB 4.45Å; G151-H411 PolarHBondContact N-NE2 3.44Å; S407-H411 WeakPolarHBondContact O-CB 3.05Å; S407-H411 PolarHBondContact O-N 3.14Å; S407-H411 PolarHBondContact O-ND1 2.91Å; T409-H411 VanDerWaalsContact C-N 3.34Å; T409-H411 PolarHBondContact O-N 3.03Å; H411-S413 PolarHBondContact O-N 3.14Å; H411-L414 WeakPolarHBondContact O-CB 3.47Å; H411-L414 PolarHBondContact O-N 3.14Å; H411-M431 HydrophobicContact CB-CE 3.76Å; H411-M431 HydrophobicContact CB-SD 3.54Å; H411-M431 VanDerWaalsContact CB-SD 3.54Å; H411-F434 AromaticContact CE1-CD1 3.74Å; H411-F434 AromaticContact CE1-CE1 3.28Å; H411-F434 WeakPolarHBondContact CE1-CE1 3.22Å; H411-F434 AromaticContact CE1-CZ 3.75Å; H411-F434 AromaticContact ND1-CD1 3.59Å; H411-F434 AromaticContact ND1-CE1 3.45Å; H411-F434 WeakPolarHBondContact ND1-CE1 3.37Å
412Y96.6Very high94.1Very high5 Ų519.2 Ų19.22%0.0212%0.116CC..Hα-helixtrans-61.2-34.6175.4178.3-109.2000111.9T408 T409 L414 F415 L464 V467 A468 T492 C496T408-Y412 WeakPolarHBondContact O-CB 3.46Å; T408-Y412 PolarHBondContact O-N 3.38Å; T409-Y412 PolarHBondContact O-N 3.49Å; Y412-L414 PolarHBondContact O-N 3.03Å; Y412-F415 HydrophobicContact CD2-CB 4.46Å; Y412-F415 AromaticContact CD2-CD1 3.97Å; Y412-F415 HydrophobicContact CD2-CD1 3.97Å; Y412-F415 AromaticContact CD2-CD2 3.85Å; Y412-F415 HydrophobicContact CD2-CD2 3.85Å; Y412-F415 HydrophobicContact CD2-CE1 4.14Å; Y412-F415 HydrophobicContact CD2-CE2 4.03Å; Y412-F415 AromaticContact CD2-CG 3.83Å; Y412-F415 HydrophobicContact CD2-CG 3.83Å; Y412-F415 HydrophobicContact CD2-CZ 4.18Å; Y412-F415 HydrophobicContact CE2-CB 4.43Å; Y412-F415 AromaticContact CE2-CD2 3.77Å; Y412-F415 HydrophobicContact CE2-CD2 3.77Å; Y412-F415 HydrophobicContact CE2-CE2 4.16Å; Y412-F415 HydrophobicContact CE2-CG 4.04Å; Y412-F415 VanDerWaalsContact O-CB 3.26Å; Y412-F415 WeakPolarHBondContact O-CB 3.32Å; Y412-F415 WeakPolarHBondContact O-CD1 3.34Å; Y412-F415 PolarHBondContact O-N 3.47Å; Y412-L464 HydrophobicContact CD1-CD1 3.48Å; Y412-L464 VanDerWaalsContact CD1-CD1 3.48Å; Y412-L464 HydrophobicContact CD1-CD2 4.34Å; Y412-L464 HydrophobicContact CD1-CG 3.9Å; Y412-L464 HydrophobicContact CE1-CD1 4.03Å; Y412-L464 HydrophobicContact CE1-CG 4.5Å; Y412-L464 HydrophobicContact CG-CD1 4.21Å; Y412-L464 HydrophobicContact CG-CD2 4.26Å; Y412-L464 HydrophobicContact CG-CG 4.18Å; Y412-V467 HydrophobicContact CE1-CG1 4.12Å; Y412-A468 HydrophobicContact CD2-CB 4.23Å; Y412-A468 HydrophobicContact CE2-CB 3.44Å; Y412-A468 VanDerWaalsContact CE2-CB 3.44Å; Y412-A468 VanDerWaalsContact OH-CA 3.25Å; Y412-A468 WeakPolarHBondContact OH-CA 3.3Å; Y412-T492 HydrophobicContact CD1-CG2 4.05Å; Y412-T492 HydrophobicContact CE1-CG2 3.56Å; Y412-T492 PolarHBondContact OH-OG1 3.41Å; Y412-C496 VanDerWaalsContact CD1-SG 3.57Å
413S95Very high93.8Very high6 Ų620.1 Ų20.14%0.04212%0.12CC..THydrogen-bonded Turntrans-62-14.6175.780.80000115P280 T409 G410 H411 P416P280-S413 WeakPolarHBondContact CG-OG 3.43Å; T409-S413 WeakPolarHBondContact O-CB 3.44Å; T409-S413 PolarHBondContact O-N 3.48Å; G410-S413 PolarHBondContact O-N 2.94Å; G410-S413 PolarHBondContact O-OG 2.92Å; H411-S413 PolarHBondContact O-N 3.14Å; S413-P416 WeakPolarHBondContact O-CD 3.48Å
414L95.1Very high93.4Very high0 Ų022.3 Ų22.30%013%0.13CC..THydrogen-bonded Turntrans-88.4-8.5175.9-58.4175.7000112.8I154 V155 E379 K380 I382 L383 H411 Y412 P416 L417I154-L414 HydrophobicContact CD1-CB 3.61Å; I154-L414 HydrophobicContact CD1-CD1 4.19Å; V155-L414 HydrophobicContact CG2-CD1 4.14Å; E379-L414 HydrophobicContact CB-CD2 4.22Å; E379-L414 HydrophobicContact CG-CD2 4.09Å; K380-L414 HydrophobicContact CG-CD2 4.37Å; I382-L414 HydrophobicContact CG2-CD2 4.42Å; L383-L414 HydrophobicContact CD2-CD1 4.42Å; H411-L414 WeakPolarHBondContact O-CB 3.47Å; H411-L414 PolarHBondContact O-N 3.14Å; Y412-L414 PolarHBondContact O-N 3.03Å; L414-P416 VanDerWaalsContact C-CD 3.44Å; L414-P416 VanDerWaalsContact C-N 3.32Å; L414-L417 HydrophobicContact CB-CD1 4.16Å; L414-L417 HydrophobicContact CD2-CD1 3.89Å; L414-L417 VanDerWaalsContact O-CB 3.24Å; L414-L417 WeakPolarHBondContact O-CB 3.22Å; L414-L417 WeakPolarHBondContact O-CG 3.22Å; L414-L417 PolarHBondContact O-N 2.93Å
415F93.8Very high93.1Very high9 Ų927.7 Ų27.74%0.03916%0.158CC..G310 helixtrans-54.9-39.9179.9-87.743.1000113.9F150 Y412 L417 L418 K427 V428 M431 E472F150-F415 HydrophobicContact CE1-CD1 4.38Å; F150-F415 HydrophobicContact CE1-CE1 4.01Å; F150-F415 HydrophobicContact CE2-CE1 4.44Å; F150-F415 HydrophobicContact CZ-CD1 4.07Å; F150-F415 AromaticContact CZ-CE1 3.54Å; F150-F415 HydrophobicContact CZ-CE1 3.54Å; F150-F415 HydrophobicContact CZ-CZ 4.47Å; Y412-F415 HydrophobicContact CD2-CB 4.46Å; Y412-F415 AromaticContact CD2-CD1 3.97Å; Y412-F415 HydrophobicContact CD2-CD1 3.97Å; Y412-F415 AromaticContact CD2-CD2 3.85Å; Y412-F415 HydrophobicContact CD2-CD2 3.85Å; Y412-F415 HydrophobicContact CD2-CE1 4.14Å; Y412-F415 HydrophobicContact CD2-CE2 4.03Å; Y412-F415 AromaticContact CD2-CG 3.83Å; Y412-F415 HydrophobicContact CD2-CG 3.83Å; Y412-F415 HydrophobicContact CD2-CZ 4.18Å; Y412-F415 HydrophobicContact CE2-CB 4.43Å; Y412-F415 AromaticContact CE2-CD2 3.77Å; Y412-F415 HydrophobicContact CE2-CD2 3.77Å; Y412-F415 HydrophobicContact CE2-CE2 4.16Å; Y412-F415 HydrophobicContact CE2-CG 4.04Å; Y412-F415 VanDerWaalsContact O-CB 3.26Å; Y412-F415 WeakPolarHBondContact O-CB 3.32Å; Y412-F415 WeakPolarHBondContact O-CD1 3.34Å; Y412-F415 PolarHBondContact O-N 3.47Å; F415-L417 PolarHBondContact O-N 2.92Å; F415-L417 VanDerWaalsContact O-N 3.13Å; F415-L418 PolarHBondContact O-N 3.41Å; F415-L418 VanDerWaalsContact O-N 3.13Å; F415-K427 HydrophobicContact CD2-CD 4.15Å; F415-K427 HydrophobicContact CD2-CG 4.4Å; F415-K427 HydrophobicContact CE2-CG 4.26Å; F415-K427 HydrophobicContact CG-CD 4.3Å; F415-K427 PolarHBondContact O-NZ 2.64Å; F415-V428 HydrophobicContact CE2-CG2 4Å; F415-M431 HydrophobicContact CE1-CB 3.89Å; F415-M431 HydrophobicContact CE1-CG 3.84Å; F415-M431 HydrophobicContact CE1-SD 4.43Å; F415-M431 HydrophobicContact CZ-CB 3.76Å; F415-M431 HydrophobicContact CZ-CG 3.84Å; F415-E472 HydrophobicContact CD2-CG 4.32Å
416P91.2Very high92.8Very high13 Ų1330.4 Ų30.48%0.08417%0.172CC..G310 helixtrans-59.1-20176.2-3139.8000115.7Y277 S413 L414 L418 L489 T492Y277-P416 HydrophobicContact CD1-CB 3.88Å; Y277-P416 HydrophobicContact CE1-CB 4.45Å; S413-P416 WeakPolarHBondContact O-CD 3.48Å; L414-P416 VanDerWaalsContact C-CD 3.44Å; L414-P416 VanDerWaalsContact C-N 3.32Å; P416-L418 PolarHBondContact O-N 3.2Å; P416-L489 HydrophobicContact CB-CD2 3.46Å; P416-L489 VanDerWaalsContact CB-CD2 3.46Å; P416-L489 HydrophobicContact CG-CD2 3.75Å; P416-T492 HydrophobicContact CG-CG2 4.29Å
417L90.1Very high92.6Very high5 Ų530.6 Ų30.63%0.02617%0.173CC..G310 helixtrans-68-24.8177.5-64.7176.5000113.1V155 E379 K380 L414 F415V155-L417 HydrophobicContact CG2-CD1 4.25Å; E379-L417 HydrophobicContact CG-CD1 4.12Å; E379-L417 HydrophobicContact CG-CD2 4.01Å; E379-L417 HydrophobicContact CG-CG 4.14Å; E379-L417 WeakPolarHBondContact OE1-CD2 3.3Å; K380-L417 HydrophobicContact CD-CD1 3.95Å; K380-L417 HydrophobicContact CG-CD1 3.58Å; L414-L417 HydrophobicContact CB-CD1 4.16Å; L414-L417 HydrophobicContact CD2-CD1 3.89Å; L414-L417 VanDerWaalsContact O-CB 3.24Å; L414-L417 WeakPolarHBondContact O-CB 3.22Å; L414-L417 WeakPolarHBondContact O-CG 3.22Å; L414-L417 PolarHBondContact O-N 2.93Å; F415-L417 PolarHBondContact O-N 2.92Å; F415-L417 VanDerWaalsContact O-N 3.13Å
418L90.5Very high92.4Very high0 Ų032.6 Ų32.60%019%0.185CC..  trans-115.880.3179.5-59.2-173.7000108.5Y29 I154 I158 H159 F415 P416 K427Y29-L418 HydrophobicContact CD1-CD2 3.62Å; Y29-L418 HydrophobicContact CE1-CD2 3.83Å; I154-L418 HydrophobicContact CB-CD1 3.88Å; I154-L418 HydrophobicContact CG2-CD1 4.08Å; I158-L418 HydrophobicContact CB-CD1 4.25Å; I158-L418 HydrophobicContact CB-CD2 4.22Å; I158-L418 HydrophobicContact CD1-CD1 4.09Å; I158-L418 HydrophobicContact CG2-CD1 3.95Å; I158-L418 HydrophobicContact CG2-CD2 3.58Å; I158-L418 HydrophobicContact CG2-CG 4.44Å; H159-L418 HydrophobicContact CB-CD2 4.24Å; F415-L418 PolarHBondContact O-N 3.41Å; F415-L418 VanDerWaalsContact O-N 3.13Å; P416-L418 PolarHBondContact O-N 3.2Å; L418-K427 HydrophobicContact CB-CD 3.98Å; L418-K427 HydrophobicContact CD1-CB 4.2Å; L418-K427 PolarHBondContact O-NZ 3.48Å
419F85.6Confident92.3Very high131 Ų13135 Ų3558%0.57520%0.202SC*.  trans-87.7-8.1-17563.9-93.2000113.6Y29Y29-F419 HydrophobicContact CE2-CE1 4.23Å; Y29-F419 HydrophobicContact CE2-CZ 4.26Å; Y29-F419 AromaticContact CZ-CE1 3.99Å; Y29-F419 WeakPolarHBondContact OH-CE1 3.38Å
420T86.9Confident92.3Very high28 Ų2835.4 Ų35.417%0.17220%0.204CC..  trans-73.1137.4-177.9430000111.3Y29 A422 E423 M424Y29-T420 HydrophobicContact CD2-CG2 3.71Å; Y29-T420 HydrophobicContact CE2-CG2 4.17Å; Y29-T420 HydrophobicContact CG-CG2 4.22Å; T420-A422 VanDerWaalsContact C-N 3.3Å; T420-A422 PolarHBondContact O-N 3Å; T420-E423 WeakPolarHBondContact CB-OE2 3.23Å; T420-E423 PolarHBondContact O-N 3.04Å; T420-E423 PolarHBondContact OG1-OE2 3.31Å; T420-M424 PolarHBondContact O-N 2.99Å
421P84.9Confident92.2Very high118 Ų11836 Ų3677%0.76621%0.207SC*.Hα-helixtrans-61.4-33.5-178.7-26.435000114.4E423 M424P421-E423 PolarHBondContact O-N 3.49Å; P421-M424 WeakPolarHBondContact O-CB 3.22Å; P421-M424 PolarHBondContact O-N 3.48Å
422A86.7Confident92.2Very high74 Ų7439.5 Ų39.561%0.61223%0.228SC*.Hα-helixtrans-64.8-39.3-17800000112.1T420 M424T420-A422 VanDerWaalsContact C-N 3.3Å; T420-A422 PolarHBondContact O-N 3Å; A422-M424 VanDerWaalsContact C-N 3.3Å; A422-M424 PolarHBondContact O-N 2.85Å
423E91.9Very high92.2Very high18 Ų1843.5 Ų43.58%0.08425%0.248CC..Hα-helixtrans-80.8-7.7179.9-72.969.6-162.500113.2Y29 I158 T420 P421 I425 I426 K427Y29-E423 VanDerWaalsContact CB-CD 3.42Å; Y29-E423 VanDerWaalsContact CB-OE1 3.26Å; Y29-E423 WeakPolarHBondContact CB-OE1 3.45Å; Y29-E423 PolarHBondContact N-OE1 3.05Å; I158-E423 HydrophobicContact CG2-CG 4.03Å; T420-E423 WeakPolarHBondContact CB-OE2 3.23Å; T420-E423 PolarHBondContact O-N 3.04Å; T420-E423 PolarHBondContact OG1-OE2 3.31Å; P421-E423 PolarHBondContact O-N 3.49Å; E423-I425 PolarHBondContact O-N 3.06Å; E423-I426 PolarHBondContact O-N 3.43Å; E423-K427 WeakPolarHBondContact O-CG 3.31Å; E423-K427 PolarHBondContact O-N 2.69Å
424M90.9Very high92.3Very high46 Ų4643.5 Ų43.523%0.22725%0.247CC..Hα-helixtrans-60.8-48.4-178.2-175-83.4-84.900112T420 P421 A422 I426 K427 V428 F473T420-M424 PolarHBondContact O-N 2.99Å; P421-M424 WeakPolarHBondContact O-CB 3.22Å; P421-M424 PolarHBondContact O-N 3.48Å; A422-M424 VanDerWaalsContact C-N 3.3Å; A422-M424 PolarHBondContact O-N 2.85Å; M424-I426 VanDerWaalsContact C-N 3.3Å; M424-I426 PolarHBondContact O-N 2.99Å; M424-K427 WeakPolarHBondContact O-CG 3.45Å; M424-K427 PolarHBondContact O-N 3.1Å; M424-V428 WeakPolarHBondContact O-CB 3.42Å; M424-V428 VanDerWaalsContact O-CG2 3.27Å; M424-V428 WeakPolarHBondContact O-CG2 3.26Å; M424-V428 PolarHBondContact O-N 3.46Å; M424-V428 HydrophobicContact SD-CG2 4.01Å; M424-F473 HydrophobicContact CE-CD1 4.22Å; M424-F473 HydrophobicContact CE-CE1 3.34Å; M424-F473 HydrophobicContact CE-CZ 3.7Å; M424-F473 HydrophobicContact SD-CE1 3.97Å; M424-F473 HydrophobicContact SD-CZ 3.64Å
425I91.9Very high92.4Very high115 Ų11544.7 Ų44.759%0.5925%0.254SS*.Hα-helixtrans-63.4-42.9178.4-62.2172.4000109.7E423 V428 C429E423-I425 PolarHBondContact O-N 3.06Å; I425-V428 PolarHBondContact O-N 3.46Å; I425-C429 VanDerWaalsContact O-CB 3.31Å; I425-C429 WeakPolarHBondContact O-CB 3.4Å; I425-C429 PolarHBondContact O-N 2.97Å; I425-C429 PolarHBondContact O-SG 2.81Å
426I92.7Very high92.5Very high57 Ų5749.1 Ų49.129%0.29228%0.277SS..Hα-helixtrans-60.2-52.8-179.7-59.1176.9000110.3F25 I158 E423 M424 V428 C429 L430F25-I426 HydrophobicContact CD1-CG2 4.42Å; F25-I426 HydrophobicContact CE1-CG2 3.68Å; F25-I426 HydrophobicContact CZ-CG2 4.41Å; I158-I426 HydrophobicContact CD1-CG2 4.1Å; E423-I426 PolarHBondContact O-N 3.43Å; M424-I426 VanDerWaalsContact C-N 3.3Å; M424-I426 PolarHBondContact O-N 2.99Å; I426-V428 PolarHBondContact O-N 3.21Å; I426-C429 PolarHBondContact O-N 3.3Å; I426-L430 HydrophobicContact CG2-CD1 3.78Å; I426-L430 HydrophobicContact CG2-CG 4.27Å; I426-L430 WeakPolarHBondContact O-CB 3.33Å; I426-L430 VanDerWaalsContact O-CG 3.23Å; I426-L430 WeakPolarHBondContact O-CG 3.44Å; I426-L430 PolarHBondContact O-N 3.45Å
427K93.4Very high92.8Very high4 Ų451.2 Ų51.22%0.01728%0.284CS..Hα-helixtrans-64-39.4-178.574.2-175.2-174.9177.90111.8F150 F415 L418 E423 M424 M431 E472F150-K427 HydrophobicContact CE2-CB 4.49Å; F150-K427 WeakPolarHBondContact CE2-O 3.44Å; F415-K427 HydrophobicContact CD2-CD 4.15Å; F415-K427 HydrophobicContact CD2-CG 4.4Å; F415-K427 HydrophobicContact CE2-CG 4.26Å; F415-K427 HydrophobicContact CG-CD 4.3Å; F415-K427 PolarHBondContact O-NZ 2.64Å; L418-K427 HydrophobicContact CB-CD 3.98Å; L418-K427 HydrophobicContact CD1-CB 4.2Å; L418-K427 PolarHBondContact O-NZ 3.48Å; E423-K427 WeakPolarHBondContact O-CG 3.31Å; E423-K427 PolarHBondContact O-N 2.69Å; M424-K427 WeakPolarHBondContact O-CG 3.45Å; M424-K427 PolarHBondContact O-N 3.1Å; K427-M431 VanDerWaalsContact O-CB 3.22Å; K427-M431 WeakPolarHBondContact O-CB 3.07Å; K427-M431 PolarHBondContact O-N 3.03Å; K427-E472 WeakPolarHBondContact CE-OE2 3.28Å; K427-E472 IonicContact NZ-OE1 2.74Å; K427-E472 PolarHBondContact NZ-OE1 3.04Å; K427-E472 IonicContact NZ-OE2 3.58Å; K427-E472 PolarHBondContact NZ-OE2 2.85Å
428V94.8Very high93.2Very high43 Ų4351 Ų5126%0.26128%0.283SS..Hα-helixtrans-64.7-49176.4171.70000110.9F415 M424 I425 I426 M431 V432F415-V428 HydrophobicContact CE2-CG2 4Å; M424-V428 WeakPolarHBondContact O-CB 3.42Å; M424-V428 VanDerWaalsContact O-CG2 3.27Å; M424-V428 WeakPolarHBondContact O-CG2 3.26Å; M424-V428 PolarHBondContact O-N 3.46Å; M424-V428 HydrophobicContact SD-CG2 4.01Å; I425-V428 PolarHBondContact O-N 3.46Å; I426-V428 PolarHBondContact O-N 3.21Å; V428-M431 PolarHBondContact O-N 3.23Å; V428-V432 HydrophobicContact CG1-CG2 4.34Å; V428-V432 WeakPolarHBondContact O-CB 3.27Å; V428-V432 VanDerWaalsContact O-CG2 3.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.4Å; V428-V432 PolarHBondContact O-N 2.91Å
429C95Very high93.5Very high63 Ų6354 Ų5443%0.42630%0.296SS..Hα-helixtrans-60.6-48.1179.1-72.80000111.8I425 I426 M431 V432 M433I425-C429 VanDerWaalsContact O-CB 3.31Å; I425-C429 WeakPolarHBondContact O-CB 3.4Å; I425-C429 PolarHBondContact O-N 2.97Å; I425-C429 PolarHBondContact O-SG 2.81Å; I426-C429 PolarHBondContact O-N 3.3Å; C429-M431 VanDerWaalsContact C-N 3.32Å; C429-M431 PolarHBondContact O-N 2.74Å; C429-V432 PolarHBondContact O-N 3.43Å; C429-M433 WeakPolarHBondContact O-CB 3.3Å; C429-M433 VanDerWaalsContact O-CG 3.26Å; C429-M433 WeakPolarHBondContact O-CG 3.22Å; C429-M433 PolarHBondContact O-N 3.1Å
430L95.9Very high94Very high8 Ų851.1 Ų51.14%0.04229%0.289CS..Hα-helixtrans-60-43178.1-68175.2000111.7F21 F25 W148 F150 I154 I426 M433 F434F21-L430 HydrophobicContact CE1-CD2 3.59Å; F21-L430 HydrophobicContact CZ-CD2 3.65Å; F25-L430 HydrophobicContact CE1-CD1 4.49Å; F25-L430 HydrophobicContact CZ-CD1 3.99Å; F25-L430 HydrophobicContact CZ-CD2 4.36Å; W148-L430 HydrophobicContact CZ3-CD2 4.39Å; F150-L430 HydrophobicContact CD2-CB 3.62Å; F150-L430 HydrophobicContact CE2-CB 3.89Å; I154-L430 HydrophobicContact CG2-CD1 4.25Å; I426-L430 HydrophobicContact CG2-CD1 3.78Å; I426-L430 HydrophobicContact CG2-CG 4.27Å; I426-L430 WeakPolarHBondContact O-CB 3.33Å; I426-L430 VanDerWaalsContact O-CG 3.23Å; I426-L430 WeakPolarHBondContact O-CG 3.44Å; I426-L430 PolarHBondContact O-N 3.45Å; L430-M433 HydrophobicContact CD2-CE 3.78Å; L430-F434 WeakPolarHBondContact O-CB 3.2Å; L430-F434 PolarHBondContact O-N 3.26Å
431M96Very high94.4Very high14 Ų1450.2 Ų50.27%0.06929%0.285CS..Hα-helixtrans-63.8-47.7178.9179.660.1-179.800111.7F150 T408 H411 F415 K427 V428 C429 F434 T435F150-M431 HydrophobicContact CD1-SD 3.88Å; F150-M431 HydrophobicContact CD2-CB 3.93Å; F150-M431 VanDerWaalsContact CD2-N 3.32Å; F150-M431 HydrophobicContact CE1-SD 4.03Å; F150-M431 HydrophobicContact CE2-CB 3.7Å; F150-M431 HydrophobicContact CG-CB 4.43Å; F150-M431 HydrophobicContact CG-SD 4.1Å; F150-M431 HydrophobicContact CZ-CB 3.99Å; F150-M431 HydrophobicContact CZ-SD 4.43Å; T408-M431 HydrophobicContact CG2-CE 3.89Å; T408-M431 WeakPolarHBondContact O-CE 3.41Å; H411-M431 HydrophobicContact CB-CE 3.76Å; H411-M431 HydrophobicContact CB-SD 3.54Å; H411-M431 VanDerWaalsContact CB-SD 3.54Å; F415-M431 HydrophobicContact CE1-CB 3.89Å; F415-M431 HydrophobicContact CE1-CG 3.84Å; F415-M431 HydrophobicContact CE1-SD 4.43Å; F415-M431 HydrophobicContact CZ-CB 3.76Å; F415-M431 HydrophobicContact CZ-CG 3.84Å; K427-M431 VanDerWaalsContact O-CB 3.22Å; K427-M431 WeakPolarHBondContact O-CB 3.07Å; K427-M431 PolarHBondContact O-N 3.03Å; V428-M431 PolarHBondContact O-N 3.23Å; C429-M431 VanDerWaalsContact C-N 3.32Å; C429-M431 PolarHBondContact O-N 2.74Å; M431-F434 PolarHBondContact O-N 3.18Å; M431-T435 VanDerWaalsContact O-CB 3.28Å; M431-T435 WeakPolarHBondContact O-CB 3.45Å; M431-T435 PolarHBondContact O-N 2.93Å; M431-T435 PolarHBondContact O-OG1 3.38Å
432V96.1Very high94.9Very high73 Ų7344.6 Ų44.644%0.44225%0.248SC..Hα-helixtrans-63.6-45.4179.7169.60000110.5V428 C429 F434 T435 I436V428-V432 HydrophobicContact CG1-CG2 4.34Å; V428-V432 WeakPolarHBondContact O-CB 3.27Å; V428-V432 VanDerWaalsContact O-CG2 3.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.4Å; V428-V432 PolarHBondContact O-N 2.91Å; C429-V432 PolarHBondContact O-N 3.43Å; V432-F434 PolarHBondContact O-N 3.43Å; V432-T435 PolarHBondContact O-N 3.36Å; V432-I436 HydrophobicContact CG1-CD1 3.5Å; V432-I436 HydrophobicContact CG1-CG1 4.19Å; V432-I436 WeakPolarHBondContact O-CB 3.39Å; V432-I436 VanDerWaalsContact O-CG1 3.27Å; V432-I436 WeakPolarHBondContact O-CG1 3.46Å; V432-I436 PolarHBondContact O-N 2.93Å
433M96.6Very high95.3Very high89 Ų8942.2 Ų42.244%0.43823%0.231SC..Hα-helixtrans-59-49.2176.5-73.4-172.6-6200111.8W148 C429 L430 T435 Y437W148-M433 HydrophobicContact CZ3-CE 4.18Å; C429-M433 WeakPolarHBondContact O-CB 3.3Å; C429-M433 VanDerWaalsContact O-CG 3.26Å; C429-M433 WeakPolarHBondContact O-CG 3.22Å; C429-M433 PolarHBondContact O-N 3.1Å; L430-M433 HydrophobicContact CD2-CE 3.78Å; M433-T435 VanDerWaalsContact C-N 3.34Å; M433-T435 PolarHBondContact O-N 2.92Å; M433-Y437 WeakPolarHBondContact O-CB 3.18Å; M433-Y437 PolarHBondContact O-N 3.32Å
434F97.8Very high95.3Very high5 Ų545.2 Ų45.22%0.02225%0.247CC..Hα-helixtrans-62.1-42.1178.7179.9-95000112.1L145 W148 F150 F403 H411 L430 M431 V432 S438L145-F434 HydrophobicContact CD2-CE2 4.24Å; L145-F434 HydrophobicContact CD2-CZ 4.15Å; W148-F434 VanDerWaalsContact O-CD2 3.23Å; W148-F434 WeakPolarHBondContact O-CD2 3.42Å; F150-F434 HydrophobicContact CB-CB 3.89Å; F150-F434 HydrophobicContact CB-CD1 4.16Å; F150-F434 HydrophobicContact CB-CD2 4.49Å; F150-F434 HydrophobicContact CB-CG 3.91Å; F403-F434 HydrophobicContact CZ-CZ 4.22Å; H411-F434 AromaticContact CE1-CD1 3.74Å; H411-F434 AromaticContact CE1-CE1 3.28Å; H411-F434 WeakPolarHBondContact CE1-CE1 3.22Å; H411-F434 AromaticContact CE1-CZ 3.75Å; H411-F434 AromaticContact ND1-CD1 3.59Å; H411-F434 AromaticContact ND1-CE1 3.45Å; H411-F434 WeakPolarHBondContact ND1-CE1 3.37Å; L430-F434 WeakPolarHBondContact O-CB 3.2Å; L430-F434 PolarHBondContact O-N 3.26Å; M431-F434 PolarHBondContact O-N 3.18Å; V432-F434 PolarHBondContact O-N 3.43Å; F434-S438 WeakPolarHBondContact CE1-OG 3.19Å; F434-S438 VanDerWaalsContact O-CB 3.29Å; F434-S438 WeakPolarHBondContact O-CB 3.46Å; F434-S438 PolarHBondContact O-N 2.97Å; F434-S438 PolarHBondContact O-OG 2.89Å
435T96.9Very high95.4Very high26 Ų2645 Ų4516%0.1625%0.247CC..Hα-helixtrans-67.4-50.5-179.4-56.40000110.7T408 M431 V432 M433 Y437 S438 F439T408-T435 HydrophobicContact CG2-CG2 4.26Å; M431-T435 VanDerWaalsContact O-CB 3.28Å; M431-T435 WeakPolarHBondContact O-CB 3.45Å; M431-T435 PolarHBondContact O-N 2.93Å; M431-T435 PolarHBondContact O-OG1 3.38Å; V432-T435 PolarHBondContact O-N 3.36Å; M433-T435 VanDerWaalsContact C-N 3.34Å; M433-T435 PolarHBondContact O-N 2.92Å; T435-Y437 VanDerWaalsContact C-N 3.3Å; T435-Y437 PolarHBondContact O-N 3Å; T435-S438 PolarHBondContact O-N 3.25Å; T435-S438 VanDerWaalsContact O-N 3.16Å; T435-F439 HydrophobicContact CG2-CD2 3.73Å; T435-F439 HydrophobicContact CG2-CE2 3.55Å; T435-F439 HydrophobicContact CG2-CZ 4.49Å; T435-F439 WeakPolarHBondContact O-CD2 3.25Å; T435-F439 PolarHBondContact O-N 2.81Å
436I97.3Very high95.4Very high102 Ų10239.8 Ų39.852%0.52322%0.22SC..Hα-helixtrans-57-46.8177-69.2172000110.3V432 S438 F439 T440V432-I436 HydrophobicContact CG1-CD1 3.5Å; V432-I436 HydrophobicContact CG1-CG1 4.19Å; V432-I436 WeakPolarHBondContact O-CB 3.39Å; V432-I436 VanDerWaalsContact O-CG1 3.27Å; V432-I436 WeakPolarHBondContact O-CG1 3.46Å; V432-I436 PolarHBondContact O-N 2.93Å; I436-S438 PolarHBondContact O-N 3.35Å; I436-F439 PolarHBondContact O-N 3.49Å; I436-T440 HydrophobicContact CG2-CG2 4.31Å; I436-T440 WeakPolarHBondContact O-CB 3.47Å; I436-T440 VanDerWaalsContact O-CG2 3.26Å; I436-T440 WeakPolarHBondContact O-CG2 3.42Å; I436-T440 PolarHBondContact O-N 3.22Å; I436-T440 PolarHBondContact O-OG1 3.42Å
437Y97.4Very high95.3Very high56 Ų5645.3 Ų45.322%0.2224%0.237CC..Hα-helixtrans-60.5-48177.2-179.8-92.5000111.6V144 L145 M433 T435 F439 T440 A441V144-Y437 HydrophobicContact CB-CD1 4.32Å; V144-Y437 HydrophobicContact CB-CE1 3.47Å; V144-Y437 VanDerWaalsContact CB-CE1 3.47Å; V144-Y437 WeakPolarHBondContact CB-OH 3.29Å; V144-Y437 HydrophobicContact CG1-CD1 3.62Å; V144-Y437 HydrophobicContact CG1-CD2 4.42Å; V144-Y437 HydrophobicContact CG1-CE1 3.25Å; V144-Y437 HydrophobicContact CG1-CE2 4.1Å; V144-Y437 HydrophobicContact CG1-CG 4.2Å; V144-Y437 HydrophobicContact CG2-CE1 4.29Å; V144-Y437 WeakPolarHBondContact CG2-OH 3.41Å; L145-Y437 HydrophobicContact CD2-CD1 4.39Å; L145-Y437 HydrophobicContact CD2-CE1 4.45Å; M433-Y437 WeakPolarHBondContact O-CB 3.18Å; M433-Y437 PolarHBondContact O-N 3.32Å; T435-Y437 VanDerWaalsContact C-N 3.3Å; T435-Y437 PolarHBondContact O-N 3Å; Y437-F439 PolarHBondContact O-N 2.88Å; Y437-T440 PolarHBondContact O-N 2.95Å; Y437-T440 PolarHBondContact O-OG1 3.38Å; Y437-T440 VanDerWaalsContact O-OG1 3.06Å; Y437-A441 HydrophobicContact CD1-CB 4.31Å; Y437-A441 HydrophobicContact CE1-CB 3.88Å; Y437-A441 HydrophobicContact CE2-CB 4.28Å; Y437-A441 WeakPolarHBondContact O-CB 3.34Å; Y437-A441 PolarHBondContact O-N 3.29Å
438S97.4Very high95Very high0 Ų050.5 Ų50.50%027%0.274CS..Hα-helixtrans-59.6-45.8-178.6-62.20000112.2L145 F434 T435 I436 L442L145-S438 WeakPolarHBondContact CD2-OG 3.33Å; F434-S438 WeakPolarHBondContact CE1-OG 3.19Å; F434-S438 VanDerWaalsContact O-CB 3.29Å; F434-S438 WeakPolarHBondContact O-CB 3.46Å; F434-S438 PolarHBondContact O-N 2.97Å; F434-S438 PolarHBondContact O-OG 2.89Å; T435-S438 PolarHBondContact O-N 3.25Å; T435-S438 VanDerWaalsContact O-N 3.16Å; I436-S438 PolarHBondContact O-N 3.35Å; S438-L442 VanDerWaalsContact O-CB 3.28Å; S438-L442 WeakPolarHBondContact O-CB 3.44Å; S438-L442 WeakPolarHBondContact O-CG 3.3Å; S438-L442 PolarHBondContact O-N 2.97Å; S438-L442 VanDerWaalsContact O-N 3.08Å
439F96.8Very high94.6Very high65 Ų6553.8 Ų53.829%0.28529%0.287SS..Hα-helixtrans-66.9-44.9179.9-83.1-113.5000111.9L404 T435 I436 Y437 G443 L453 L461L404-F439 HydrophobicContact CB-CE2 4.06Å; L404-F439 HydrophobicContact CB-CZ 4Å; L404-F439 HydrophobicContact CD1-CD1 3.97Å; L404-F439 HydrophobicContact CD1-CD2 4.29Å; L404-F439 HydrophobicContact CD1-CE1 4.1Å; L404-F439 HydrophobicContact CD1-CE2 4.41Å; L404-F439 HydrophobicContact CD1-CG 4.08Å; L404-F439 HydrophobicContact CD1-CZ 4.3Å; L404-F439 HydrophobicContact CD2-CD2 3.59Å; L404-F439 HydrophobicContact CD2-CE2 3.79Å; L404-F439 HydrophobicContact CD2-CG 4.09Å; L404-F439 HydrophobicContact CD2-CZ 4.44Å; L404-F439 HydrophobicContact CG-CD2 4.37Å; L404-F439 HydrophobicContact CG-CE2 4.3Å; L404-F439 HydrophobicContact CG-CZ 4.48Å; T435-F439 HydrophobicContact CG2-CD2 3.73Å; T435-F439 HydrophobicContact CG2-CE2 3.55Å; T435-F439 HydrophobicContact CG2-CZ 4.49Å; T435-F439 WeakPolarHBondContact O-CD2 3.25Å; T435-F439 PolarHBondContact O-N 2.81Å; I436-F439 PolarHBondContact O-N 3.49Å; Y437-F439 PolarHBondContact O-N 2.88Å; F439-G443 WeakPolarHBondContact O-CA 3.46Å; F439-G443 PolarHBondContact O-N 3.03Å; F439-L453 HydrophobicContact CD1-CD1 4.31Å; F439-L453 HydrophobicContact CE1-CD1 3.44Å; F439-L453 VanDerWaalsContact CE1-CD1 3.44Å; F439-L453 HydrophobicContact CZ-CD1 4.09Å; F439-L461 HydrophobicContact CE1-CD1 4.19Å; F439-L461 HydrophobicContact CZ-CD1 3.79Å
440T96Very high94.3Very high69 Ų6952.9 Ų52.942%0.42329%0.287SS..Hα-helixtrans-69.5-47.2-179.353.80000111.8I436 Y437 G443 N444I436-T440 HydrophobicContact CG2-CG2 4.31Å; I436-T440 WeakPolarHBondContact O-CB 3.47Å; I436-T440 VanDerWaalsContact O-CG2 3.26Å; I436-T440 WeakPolarHBondContact O-CG2 3.42Å; I436-T440 PolarHBondContact O-N 3.22Å; I436-T440 PolarHBondContact O-OG1 3.42Å; Y437-T440 PolarHBondContact O-N 2.95Å; Y437-T440 PolarHBondContact O-OG1 3.38Å; Y437-T440 VanDerWaalsContact O-OG1 3.06Å; T440-G443 PolarHBondContact O-N 2.85Å; T440-N444 VanDerWaalsContact O-CB 3.31Å; T440-N444 WeakPolarHBondContact O-CB 3.24Å; T440-N444 PolarHBondContact O-N 2.72Å; T440-N444 PolarHBondContact O-ND2 3.36Å
441A95.6Very high94.2Very high10 Ų1056.4 Ų56.48%0.08331%0.313CS..Hα-helixtrans-65.3-49.6-178.100000111.9V141 Y437 N444 L445V141-A441 HydrophobicContact CG1-CB 3.85Å; V141-A441 HydrophobicContact CG2-CB 4.06Å; Y437-A441 HydrophobicContact CD1-CB 4.31Å; Y437-A441 HydrophobicContact CE1-CB 3.88Å; Y437-A441 HydrophobicContact CE2-CB 4.28Å; Y437-A441 WeakPolarHBondContact O-CB 3.34Å; Y437-A441 PolarHBondContact O-N 3.29Å; A441-N444 PolarHBondContact O-N 3.04Å; A441-L445 WeakPolarHBondContact O-CB 3.45Å; A441-L445 PolarHBondContact O-N 3.25Å
442L96.1Very high94.1Very high0 Ų056.4 Ų56.40%031%0.313CS..Hα-helixtrans-69.7-35.3178-67.2173.5000111.9V141 L145 A393 V394 A400 F403 L404 S438 N444 L445 H446 L452V141-L442 HydrophobicContact CG1-CD2 4.16Å; L145-L442 HydrophobicContact CD1-CD1 4.31Å; L145-L442 HydrophobicContact CD1-CD2 4.21Å; L145-L442 HydrophobicContact CD1-CG 4.39Å; A393-L442 HydrophobicContact CB-CD1 4.26Å; A393-L442 HydrophobicContact CB-CD2 4.33Å; V394-L442 HydrophobicContact CG1-CD2 4.1Å; A400-L442 HydrophobicContact CB-CD1 4.37Å; A400-L442 HydrophobicContact CB-CD2 4.5Å; F403-L442 HydrophobicContact CD1-CD1 3.59Å; F403-L442 HydrophobicContact CE1-CD1 4.05Å; L404-L442 HydrophobicContact CD2-CD1 3.87Å; L404-L442 HydrophobicContact CG-CD1 4.28Å; S438-L442 VanDerWaalsContact O-CB 3.28Å; S438-L442 WeakPolarHBondContact O-CB 3.44Å; S438-L442 WeakPolarHBondContact O-CG 3.3Å; S438-L442 PolarHBondContact O-N 2.97Å; S438-L442 VanDerWaalsContact O-N 3.08Å; L442-N444 VanDerWaalsContact C-N 3.32Å; L442-N444 PolarHBondContact O-N 3.33Å; L442-L445 HydrophobicContact CD2-CD2 4.32Å; L442-L445 PolarHBondContact O-N 3.48Å; L442-H446 PolarHBondContact O-CD2 3.02Å; L442-H446 PolarHBondContact O-N 2.87Å; L442-L452 HydrophobicContact CB-CD1 3.77Å
443G94.6Very high94.1Very high24 Ų2453.7 Ų53.725%0.24730%0.296CS..Hα-helixtrans-63.6-38.9175.900000111.9F439 T440 R447F439-G443 WeakPolarHBondContact O-CA 3.46Å; F439-G443 PolarHBondContact O-N 3.03Å; T440-G443 PolarHBondContact O-N 2.85Å; G443-R447 VanDerWaalsContact O-CA 3.32Å; G443-R447 WeakPolarHBondContact O-CA 3.44Å; G443-R447 WeakPolarHBondContact O-CB 3.4Å; G443-R447 PolarHBondContact O-N 3.27Å; G443-R447 VanDerWaalsContact O-N 3.09Å
444N92.6Very high94Very high80 Ų8051.7 Ų51.743%0.42829%0.29SS..Hα-helixtrans-69.2-41.9173.4-70.2-19.3000111.9T440 A441 L442 H446 R447T440-N444 VanDerWaalsContact O-CB 3.31Å; T440-N444 WeakPolarHBondContact O-CB 3.24Å; T440-N444 PolarHBondContact O-N 2.72Å; T440-N444 PolarHBondContact O-ND2 3.36Å; A441-N444 PolarHBondContact O-N 3.04Å; L442-N444 VanDerWaalsContact C-N 3.32Å; L442-N444 PolarHBondContact O-N 3.33Å; N444-H446 VanDerWaalsContact C-N 3.33Å; N444-H446 PolarHBondContact O-N 3.49Å; N444-R447 WeakPolarHBondContact O-CB 3.26Å; N444-R447 PolarHBondContact O-N 3.45Å; N444-R447 PolarHBondContact OD1-NH2 3.3Å
445L91.6Very high93.9Very high41 Ų4156.1 Ų56.122%0.21532%0.32CS..Hα-helixtrans-62.3-39.8-178.6-167.263000112.6P138 V394 A441 L442P138-L445 HydrophobicContact CB-CD1 4.34Å; P138-L445 HydrophobicContact CB-CD2 4.41Å; P138-L445 HydrophobicContact CG-CD1 3.89Å; V394-L445 HydrophobicContact CB-CD2 3.91Å; V394-L445 HydrophobicContact CG1-CD2 4.23Å; V394-L445 WeakPolarHBondContact O-CD2 3.24Å; A441-L445 WeakPolarHBondContact O-CB 3.45Å; A441-L445 PolarHBondContact O-N 3.25Å; L442-L445 HydrophobicContact CD2-CD2 4.32Å; L442-L445 PolarHBondContact O-N 3.48Å
446H92.9Very high93.8Very high6 Ų661.8 Ų61.83%0.02835%0.346CS..THydrogen-bonded Turntrans-106.716.4-177-62.6-64.3000113.5A393 R397 L442 N444 S448 Q449 L452A393-H446 PolarHBondContact O-NE2 3.02Å; R397-H446 HydrophobicContact CB-CB 4.01Å; R397-H446 HydrophobicContact CG-CB 4.16Å; L442-H446 PolarHBondContact O-CD2 3.02Å; L442-H446 PolarHBondContact O-N 2.87Å; N444-H446 VanDerWaalsContact C-N 3.33Å; N444-H446 PolarHBondContact O-N 3.49Å; H446-S448 PolarHBondContact O-N 3.3Å; H446-Q449 PolarHBondContact O-N 3.49Å; H446-L452 HydrophobicContact CB-CD2 3.77Å
447R89.4Confident93.8Very high174 Ų17457.3 Ų57.366%0.65732%0.323SS*.G310 helixtrans-52.1-36.9-174.2-171.5-176.7-69169.6-5.5113.4G443 N444 Q449 G450G443-R447 VanDerWaalsContact O-CA 3.32Å; G443-R447 WeakPolarHBondContact O-CA 3.44Å; G443-R447 WeakPolarHBondContact O-CB 3.4Å; G443-R447 PolarHBondContact O-N 3.27Å; G443-R447 VanDerWaalsContact O-N 3.09Å; N444-R447 WeakPolarHBondContact O-CB 3.26Å; N444-R447 PolarHBondContact O-N 3.45Å; N444-R447 PolarHBondContact OD1-NH2 3.3Å; R447-Q449 PolarHBondContact O-N 2.97Å; R447-G450 PolarHBondContact O-N 3.44Å
448S87.3Confident93.7Very high112 Ų11257.7 Ų57.778%0.78333%0.331SS*.G310 helixtrans-70-15.1179.658.30000114.3H446H446-S448 PolarHBondContact O-N 3.3Å
449Q87.8Confident93.7Very high113 Ų11362.1 Ų62.153%0.52836%0.358SS..G310 helixtrans-101.79.5-176.6-58.5179.333.600112.7R397 H446 R447R397-Q449 HydrophobicContact CB-CB 4Å; R397-Q449 HydrophobicContact CG-CB 4.02Å; H446-Q449 PolarHBondContact O-N 3.49Å; R447-Q449 PolarHBondContact O-N 2.97Å
450G89Confident93.8Very high43 Ų4361 Ų6144%0.44335%0.352SS..  trans90.6-172.6178.900000114.2R447R447-G450 PolarHBondContact O-N 3.44Å
451S92.5Very high93.8Very high83 Ų8358.7 Ų58.758%0.5834%0.337SS*.  trans-53.6146.5176.7-179.90000110.5R397 L453R397-S451 PolarHBondContact NE-O 2.7Å; R397-S451 PolarHBondContact NH2-O 3.13Å; S451-L453 PolarHBondContact OG-N 3.39Å; S451-L453 PolarHBondContact OG-O 3.13Å
452L94.6Very high93.8Very high14 Ų1463.8 Ų63.87%0.07336%0.362CS..SBendtrans-79-32.3173.4-67.6-175.4000112.8R397 A400 L404 L442 H446R397-L452 HydrophobicContact CB-CD2 4.47Å; R397-L452 HydrophobicContact CG-CD2 3.67Å; R397-L452 PolarHBondContact NH2-O 2.93Å; A400-L452 HydrophobicContact CB-CD2 4.07Å; L404-L452 HydrophobicContact CD1-CB 4.16Å; L404-L452 HydrophobicContact CD1-CD1 3.58Å; L442-L452 HydrophobicContact CB-CD1 3.77Å; H446-L452 HydrophobicContact CB-CD2 3.77Å
453L95.6Very high93.8Very high15 Ų1564.8 Ų64.88%0.07937%0.372CS..SBendtrans-118.1149.2-172.8-60.9176.5000111.3L404 V405 F439 S451 E457 V458 L461L404-L453 HydrophobicContact CB-CD2 4.33Å; L404-L453 HydrophobicContact CD1-CD1 4.42Å; L404-L453 HydrophobicContact CD1-CG 4.4Å; V405-L453 HydrophobicContact CG2-CD2 3.86Å; F439-L453 HydrophobicContact CD1-CD1 4.31Å; F439-L453 HydrophobicContact CE1-CD1 3.44Å; F439-L453 VanDerWaalsContact CE1-CD1 3.44Å; F439-L453 HydrophobicContact CZ-CD1 4.09Å; S451-L453 PolarHBondContact OG-N 3.39Å; S451-L453 PolarHBondContact OG-O 3.13Å; L453-E457 WeakPolarHBondContact CA-OE2 3.09Å; L453-E457 HydrophobicContact CB-CB 4.19Å; L453-E457 HydrophobicContact CD2-CB 4.23Å; L453-E457 WeakPolarHBondContact CD2-OE2 3.42Å; L453-V458 HydrophobicContact CB-CG2 4.01Å; L453-V458 HydrophobicContact CD1-CG2 4.37Å; L453-L461 HydrophobicContact CD1-CD1 3.65Å
454C94.6Very high93.8Very high47 Ų4764 Ų6432%0.31836%0.363SS..  trans-84.5160.3168.579.40000110.6M456 E457 V458C454-M456 PolarHBondContact O-N 3.04Å; C454-E457 PolarHBondContact N-OE2 3.4Å; C454-E457 WeakPolarHBondContact O-CB 3.34Å; C454-E457 PolarHBondContact O-N 3.04Å; C454-E457 VanDerWaalsContact SG-CD 3.57Å; C454-E457 WeakPolarHBondContact SG-CG 3.26Å; C454-E457 PolarHBondContact SG-N 3.45Å; C454-V458 PolarHBondContact O-N 3.1Å; C454-V458 VanDerWaalsContact O-N 3.1Å
455P95.5Very high93.9Very high99 Ų9962.7 Ų62.764%0.64336%0.363SS*.Hα-helixtrans-55.6-36.8-178.9-27.835.9000113.7V458 V459P455-V458 PolarHBondContact O-N 3.29Å; P455-V459 WeakPolarHBondContact O-CG2 3.45Å; P455-V459 PolarHBondContact O-N 3.35Å
456M96Very high94Very high144 Ų14463.7 Ų63.771%0.70938%0.377SS*.Hα-helixtrans-66.4-37.8178-63.9-63.3128.200112.4C454 V458 V459 Y460C454-M456 PolarHBondContact O-N 3.04Å; M456-V458 VanDerWaalsContact C-N 3.33Å; M456-V459 PolarHBondContact O-N 3.18Å; M456-Y460 WeakPolarHBondContact O-CB 3.23Å; M456-Y460 PolarHBondContact O-N 2.97Å
457E96.7Very high94.1Very high8 Ų864.5 Ų64.54%0.03738%0.382CS..Hα-helixtrans-65.6-39.1174.3-71.6164.416200111V405 L453 C454 Y460 L461 Y502 R506V405-E457 HydrophobicContact CG2-CB 4.37Å; V405-E457 HydrophobicContact CG2-CG 4.26Å; L453-E457 WeakPolarHBondContact CA-OE2 3.09Å; L453-E457 HydrophobicContact CB-CB 4.19Å; L453-E457 HydrophobicContact CD2-CB 4.23Å; L453-E457 WeakPolarHBondContact CD2-OE2 3.42Å; C454-E457 PolarHBondContact N-OE2 3.4Å; C454-E457 WeakPolarHBondContact O-CB 3.34Å; C454-E457 PolarHBondContact O-N 3.04Å; C454-E457 VanDerWaalsContact SG-CD 3.57Å; C454-E457 WeakPolarHBondContact SG-CG 3.26Å; C454-E457 PolarHBondContact SG-N 3.45Å; E457-Y460 PolarHBondContact O-N 2.93Å; E457-L461 WeakPolarHBondContact O-CB 3.33Å; E457-L461 VanDerWaalsContact O-CG 3.22Å; E457-L461 WeakPolarHBondContact O-CG 3.36Å; E457-L461 PolarHBondContact O-N 2.88Å; E457-Y502 HydrophobicContact CG-CE1 3.75Å; E457-Y502 VanDerWaalsContact OE1-CE1 3.28Å; E457-Y502 WeakPolarHBondContact OE1-CE1 3.47Å; E457-Y502 PolarHBondContact OE1-OH 2.5Å; E457-R506 IonicContact OE1-CZ 3.99Å; E457-R506 IonicContact OE1-NE 2.89Å; E457-R506 IonicContact OE1-NH1 2.78Å; E457-R506 PolarHBondContact OE1-NH1 3.3Å; E457-R506 IonicContact OE1-NH2 3.15Å; E457-R506 IonicContact OE2-NH1 3.2Å
458V95.9Very high94.3Very high65 Ų6557.2 Ų57.239%0.39436%0.359SS..Hα-helixtrans-63.8-48175.4177.10000110.7L453 C454 P455 M456 Y460 L461 L462L453-V458 HydrophobicContact CB-CG2 4.01Å; L453-V458 HydrophobicContact CD1-CG2 4.37Å; C454-V458 PolarHBondContact O-N 3.1Å; C454-V458 VanDerWaalsContact O-N 3.1Å; P455-V458 PolarHBondContact O-N 3.29Å; M456-V458 VanDerWaalsContact C-N 3.33Å; V458-Y460 VanDerWaalsContact C-N 3.3Å; V458-Y460 PolarHBondContact O-N 3.43Å; V458-L461 PolarHBondContact O-N 2.87Å; V458-L462 HydrophobicContact CG1-CD1 4.06Å; V458-L462 HydrophobicContact CG1-CG 4.38Å; V458-L462 WeakPolarHBondContact O-CG 3.33Å; V458-L462 PolarHBondContact O-N 3.19Å
459V97.1Very high94.6Very high93 Ų9356.3 Ų56.356%0.56435%0.345SS*.Hα-helixtrans-59.6-42.7177.3171.60000111.1P455 M456 L462 G463P455-V459 WeakPolarHBondContact O-CG2 3.45Å; P455-V459 PolarHBondContact O-N 3.35Å; M456-V459 PolarHBondContact O-N 3.18Å; V459-L462 PolarHBondContact O-N 3.18Å; V459-G463 PolarHBondContact O-N 3.07Å
460Y97.7Very high94.9Very high40 Ų4052.9 Ų52.916%0.15734%0.336CS..Hα-helixtrans-61.6-45.7175171-99.1000112V405 T409 M456 E457 V458 L462 G463 L464 Y495 V498 G499V405-Y460 HydrophobicContact CG1-CE1 4.33Å; T409-Y460 HydrophobicContact CG2-CE1 3.52Å; T409-Y460 VanDerWaalsContact CG2-OH 3.3Å; T409-Y460 WeakPolarHBondContact CG2-OH 3.38Å; M456-Y460 WeakPolarHBondContact O-CB 3.23Å; M456-Y460 PolarHBondContact O-N 2.97Å; E457-Y460 PolarHBondContact O-N 2.93Å; V458-Y460 VanDerWaalsContact C-N 3.3Å; V458-Y460 PolarHBondContact O-N 3.43Å; Y460-L462 VanDerWaalsContact C-N 3.34Å; Y460-L462 PolarHBondContact O-N 3.4Å; Y460-G463 PolarHBondContact O-N 3.38Å; Y460-L464 PolarHBondContact O-N 2.92Å; Y460-L464 VanDerWaalsContact O-N 3.07Å; Y460-Y495 AromaticContact CD2-CE1 3.97Å; Y460-Y495 HydrophobicContact CD2-CE1 3.97Å; Y460-Y495 AromaticContact CD2-CZ 3.88Å; Y460-Y495 AromaticContact CE2-CD1 3.96Å; Y460-Y495 HydrophobicContact CE2-CD1 3.96Å; Y460-Y495 AromaticContact CE2-CE1 3.42Å; Y460-Y495 HydrophobicContact CE2-CE1 3.42Å; Y460-Y495 VanDerWaalsContact CE2-CE1 3.42Å; Y460-Y495 HydrophobicContact CE2-CE2 4.45Å; Y460-Y495 AromaticContact CE2-CZ 3.72Å; Y460-Y495 AromaticContact CZ-CE1 3.76Å; Y460-Y495 PolarHBondContact O-OH 3.33Å; Y460-Y495 PolarHBondContact OH-O 3.13Å; Y460-V498 HydrophobicContact CE2-CB 4.29Å; Y460-V498 HydrophobicContact CE2-CG1 4.19Å; Y460-G499 WeakPolarHBondContact OH-CA 3.4Å; Y460-G499 PolarHBondContact OH-N 2.91Å
461L96.6Very high95Very high21 Ų2151.5 Ų51.511%0.1132%0.319CS..Hα-helixtrans-68.2-32.8178.7-68.6166.9000112.8V405 T408 F439 L453 E457 V458 L464V405-L461 HydrophobicContact CG2-CD1 4.37Å; T408-L461 HydrophobicContact CG2-CD2 3.98Å; F439-L461 HydrophobicContact CE1-CD1 4.19Å; F439-L461 HydrophobicContact CZ-CD1 3.79Å; L453-L461 HydrophobicContact CD1-CD1 3.65Å; E457-L461 WeakPolarHBondContact O-CB 3.33Å; E457-L461 VanDerWaalsContact O-CG 3.22Å; E457-L461 WeakPolarHBondContact O-CG 3.36Å; E457-L461 PolarHBondContact O-N 2.88Å; V458-L461 PolarHBondContact O-N 2.87Å; L461-L464 VanDerWaalsContact O-CB 3.23Å; L461-L464 WeakPolarHBondContact O-CB 3.27Å; L461-L464 PolarHBondContact O-N 2.93Å
462L95.5Very high94.9Very high117 Ų11749.6 Ų49.661%0.61330%0.301SS*.Hα-helixtrans-66.6-38.7171.2-70.9173.7000111.6V458 V459 Y460 L464 A465 A466V458-L462 HydrophobicContact CG1-CD1 4.06Å; V458-L462 HydrophobicContact CG1-CG 4.38Å; V458-L462 WeakPolarHBondContact O-CG 3.33Å; V458-L462 PolarHBondContact O-N 3.19Å; V459-L462 PolarHBondContact O-N 3.18Å; Y460-L462 VanDerWaalsContact C-N 3.34Å; Y460-L462 PolarHBondContact O-N 3.4Å; L462-L464 PolarHBondContact O-N 3.48Å; L462-A465 WeakPolarHBondContact O-CB 3.31Å; L462-A465 PolarHBondContact O-N 3.45Å; L462-A465 VanDerWaalsContact O-N 3.1Å; L462-A466 PolarHBondContact O-N 2.84Å
463G96.4Very high94.6Very high21 Ų2153.1 Ų53.122%0.21632%0.316CS..Hα-helixtrans-62.1-30.6173.300000112.8V459 Y460 A465 A466 V467 Y495V459-G463 PolarHBondContact O-N 3.07Å; Y460-G463 PolarHBondContact O-N 3.38Å; G463-A465 VanDerWaalsContact C-N 3.29Å; G463-A465 PolarHBondContact O-N 3.47Å; G463-A466 WeakPolarHBondContact O-CB 3.33Å; G463-A466 PolarHBondContact O-N 3.44Å; G463-A466 VanDerWaalsContact O-N 3.13Å; G463-V467 WeakPolarHBondContact O-CG2 3.41Å; G463-V467 PolarHBondContact O-N 3.26Å; G463-Y495 VanDerWaalsContact CA-OH 3.25Å; G463-Y495 WeakPolarHBondContact CA-OH 3.5Å
464L95.1Very high94.4Very high9 Ų957.1 Ų57.15%0.04734%0.336CS..Hα-helixtrans-60-39.2172.5-164.672.3000112T408 T409 Y412 Y460 L461 L462 A466 V467 A468 Y495T408-L464 HydrophobicContact CG2-CD2 3.78Å; T409-L464 HydrophobicContact CG2-CD2 4.42Å; Y412-L464 HydrophobicContact CD1-CD1 3.48Å; Y412-L464 VanDerWaalsContact CD1-CD1 3.48Å; Y412-L464 HydrophobicContact CD1-CD2 4.34Å; Y412-L464 HydrophobicContact CD1-CG 3.9Å; Y412-L464 HydrophobicContact CE1-CD1 4.03Å; Y412-L464 HydrophobicContact CE1-CG 4.5Å; Y412-L464 HydrophobicContact CG-CD1 4.21Å; Y412-L464 HydrophobicContact CG-CD2 4.26Å; Y412-L464 HydrophobicContact CG-CG 4.18Å; Y460-L464 PolarHBondContact O-N 2.92Å; Y460-L464 VanDerWaalsContact O-N 3.07Å; L461-L464 VanDerWaalsContact O-CB 3.23Å; L461-L464 WeakPolarHBondContact O-CB 3.27Å; L461-L464 PolarHBondContact O-N 2.93Å; L462-L464 PolarHBondContact O-N 3.48Å; L464-A466 VanDerWaalsContact C-N 3.33Å; L464-V467 PolarHBondContact O-N 3.26Å; L464-A468 WeakPolarHBondContact O-CB 3.42Å; L464-A468 PolarHBondContact O-N 3.04Å; L464-Y495 HydrophobicContact CB-CE1 3.89Å; L464-Y495 HydrophobicContact CD1-CD1 3.38Å; L464-Y495 HydrophobicContact CD1-CE1 3.59Å; L464-Y495 HydrophobicContact CG-CE1 4.39Å; L464-Y495 PolarHBondContact N-OH 3.14Å
465A93.6Very high94.1Very high52 Ų5255.8 Ų55.843%0.4333%0.325SS..Hα-helixtrans-65.1-38.3175.400000111.5L462 G463 A468 I469L462-A465 WeakPolarHBondContact O-CB 3.31Å; L462-A465 PolarHBondContact O-N 3.45Å; L462-A465 VanDerWaalsContact O-N 3.1Å; G463-A465 VanDerWaalsContact C-N 3.29Å; G463-A465 PolarHBondContact O-N 3.47Å; A465-A468 PolarHBondContact O-N 3.27Å; A465-I469 VanDerWaalsContact O-CG1 3.3Å; A465-I469 WeakPolarHBondContact O-CG1 3.46Å; A465-I469 PolarHBondContact O-N 2.78Å
466A94.7Very high93.7Very high61 Ų6153.6 Ų53.650%0.50431%0.311SS..Hα-helixtrans-64.1-41.8173.600000111.8L462 G463 L464 A468 I469 A470L462-A466 PolarHBondContact O-N 2.84Å; G463-A466 WeakPolarHBondContact O-CB 3.33Å; G463-A466 PolarHBondContact O-N 3.44Å; G463-A466 VanDerWaalsContact O-N 3.13Å; L464-A466 VanDerWaalsContact C-N 3.33Å; A466-A468 VanDerWaalsContact C-N 3.34Å; A466-I469 PolarHBondContact O-N 3.05Å; A466-A470 VanDerWaalsContact O-CB 3.28Å; A466-A470 WeakPolarHBondContact O-CB 3.46Å; A466-A470 PolarHBondContact O-N 3.33Å
467V95.3Very high93.3Very high24 Ų2454.2 Ų54.215%0.14532%0.316CS..Hα-helixtrans-61.9-42.5173.8174.30000111Y412 G463 L464 A470 C471 Y495Y412-V467 HydrophobicContact CE1-CG1 4.12Å; G463-V467 WeakPolarHBondContact O-CG2 3.41Å; G463-V467 PolarHBondContact O-N 3.26Å; L464-V467 PolarHBondContact O-N 3.26Å; V467-A470 PolarHBondContact O-N 3.42Å; V467-C471 VanDerWaalsContact O-CB 3.26Å; V467-C471 WeakPolarHBondContact O-CB 3.4Å; V467-C471 PolarHBondContact O-N 3.49Å; V467-C471 PolarHBondContact O-SG 2.82Å; V467-Y495 HydrophobicContact CG2-CD1 4.3Å; V467-Y495 HydrophobicContact CG2-CD2 3.62Å; V467-Y495 HydrophobicContact CG2-CE2 3.87Å; V467-Y495 HydrophobicContact CG2-CG 3.84Å
468A93.3Very high92.9Very high20 Ų2054.7 Ų54.717%0.16532%0.321CS..Hα-helixtrans-60.8-48.5176.300000112.4Y412 L464 A465 A466 A470 C471 E472Y412-A468 HydrophobicContact CD2-CB 4.23Å; Y412-A468 HydrophobicContact CE2-CB 3.44Å; Y412-A468 VanDerWaalsContact CE2-CB 3.44Å; Y412-A468 VanDerWaalsContact OH-CA 3.25Å; Y412-A468 WeakPolarHBondContact OH-CA 3.3Å; L464-A468 WeakPolarHBondContact O-CB 3.42Å; L464-A468 PolarHBondContact O-N 3.04Å; A465-A468 PolarHBondContact O-N 3.27Å; A466-A468 VanDerWaalsContact C-N 3.34Å; A468-A470 VanDerWaalsContact C-N 3.33Å; A468-A470 PolarHBondContact O-N 3.48Å; A468-C471 PolarHBondContact O-N 2.93Å; A468-E472 VanDerWaalsContact O-CB 3.29Å; A468-E472 WeakPolarHBondContact O-CB 3.31Å; A468-E472 PolarHBondContact O-N 3.34Å
469I93Very high92.5Very high94 Ų9456.7 Ų56.748%0.48234%0.335SS..Hα-helixtrans-61.1-45.3176.8-67.1165.1000110.4A465 A466 F473 I474A465-I469 VanDerWaalsContact O-CG1 3.3Å; A465-I469 WeakPolarHBondContact O-CG1 3.46Å; A465-I469 PolarHBondContact O-N 2.78Å; A466-I469 PolarHBondContact O-N 3.05Å; I469-F473 WeakPolarHBondContact O-CB 3.4Å; I469-F473 PolarHBondContact O-N 3.29Å; I469-F473 VanDerWaalsContact O-N 3.1Å; I469-I474 HydrophobicContact CG2-CD1 4.09Å; I469-I474 HydrophobicContact CG2-CG1 4.26Å; I469-I474 PolarHBondContact O-N 2.86Å
470A93.4Very high91.8Very high41 Ų4159.3 Ų59.334%0.33934%0.335SS..Iπ-helixtrans-63.1-45.8179.500000112.6A466 V467 A468 I474 F475A466-A470 VanDerWaalsContact O-CB 3.28Å; A466-A470 WeakPolarHBondContact O-CB 3.46Å; A466-A470 PolarHBondContact O-N 3.33Å; V467-A470 PolarHBondContact O-N 3.42Å; A468-A470 VanDerWaalsContact C-N 3.33Å; A468-A470 PolarHBondContact O-N 3.48Å; A470-I474 PolarHBondContact O-N 3.34Å; A470-F475 VanDerWaalsContact O-CB 3.27Å; A470-F475 WeakPolarHBondContact O-CB 3.37Å; A470-F475 PolarHBondContact O-N 3.2Å
471C92.3Very high90.9Very high13 Ų1365 Ų659%0.08836%0.356CS..Iπ-helixtrans-79.4-40.7-173.9-66.60000113.3V467 A468 P476 P488V467-C471 VanDerWaalsContact O-CB 3.26Å; V467-C471 WeakPolarHBondContact O-CB 3.4Å; V467-C471 PolarHBondContact O-N 3.49Å; V467-C471 PolarHBondContact O-SG 2.82Å; A468-C471 PolarHBondContact O-N 2.93Å; C471-P476 WeakPolarHBondContact O-CD 3.26Å; C471-P488 HydrophobicContact CB-CB 3.99Å
472E89.8Confident90.1Very high43 Ų4372.9 Ų72.920%0.20139%0.392CS..Iπ-helixtrans-91.3-26.4-173.3-61.4-76.3156.900112.7F415 K427 A468 P476F415-E472 HydrophobicContact CD2-CG 4.32Å; K427-E472 WeakPolarHBondContact CE-OE2 3.28Å; K427-E472 IonicContact NZ-OE1 2.74Å; K427-E472 PolarHBondContact NZ-OE1 3.04Å; K427-E472 IonicContact NZ-OE2 3.58Å; K427-E472 PolarHBondContact NZ-OE2 2.85Å; A468-E472 VanDerWaalsContact O-CB 3.29Å; A468-E472 WeakPolarHBondContact O-CB 3.31Å; A468-E472 PolarHBondContact O-N 3.34Å; E472-P476 WeakPolarHBondContact O-CG 3.37Å
473F88.6Confident89.3Confident89 Ų8975.5 Ų75.539%0.3940%0.398SS..Iπ-helixtrans-116.5-53-175.6-60.9-93.1000113.1M424 I469 L477M424-F473 HydrophobicContact CE-CD1 4.22Å; M424-F473 HydrophobicContact CE-CE1 3.34Å; M424-F473 HydrophobicContact CE-CZ 3.7Å; M424-F473 HydrophobicContact SD-CE1 3.97Å; M424-F473 HydrophobicContact SD-CZ 3.64Å; I469-F473 WeakPolarHBondContact O-CB 3.4Å; I469-F473 PolarHBondContact O-N 3.29Å; I469-F473 VanDerWaalsContact O-N 3.1Å; F473-L477 WeakPolarHBondContact O-CD1 3.36Å; F473-L477 VanDerWaalsContact O-CG 3.25Å; F473-L477 WeakPolarHBondContact O-CG 3.16Å
474I90.6Very high88.7Confident99 Ų9978.8 Ų78.851%0.50841%0.411SS..Iπ-helixtrans-71.5-49.2-174.1-58.9177.4000110.8I469 A470 L477 S478I469-I474 HydrophobicContact CG2-CD1 4.09Å; I469-I474 HydrophobicContact CG2-CG1 4.26Å; I469-I474 PolarHBondContact O-N 2.86Å; A470-I474 PolarHBondContact O-N 3.34Å; I474-L477 PolarHBondContact O-N 2.65Å; I474-S478 WeakPolarHBondContact O-CB 3.47Å; I474-S478 PolarHBondContact O-N 3.1Å; I474-S478 VanDerWaalsContact O-N 3.1Å
475F90.1Very high87.9Confident18 Ų1881.8 Ų81.88%0.07943%0.43CS..Hα-helixtrans-64.2-45-173.5-171.2-86.5000113.4A470 L477 S478 W480 R481 L484 L487 P488A470-F475 VanDerWaalsContact O-CB 3.27Å; A470-F475 WeakPolarHBondContact O-CB 3.37Å; A470-F475 PolarHBondContact O-N 3.2Å; F475-L477 PolarHBondContact O-N 3.47Å; F475-S478 WeakPolarHBondContact O-CB 3.25Å; F475-S478 PolarHBondContact O-N 2.93Å; F475-S478 PolarHBondContact O-OG 2.89Å; F475-W480 HydrophobicContact CD2-CB 4.38Å; F475-W480 HydrophobicContact CD2-CE3 4.48Å; F475-W480 HydrophobicContact CE2-CB 3.69Å; F475-W480 HydrophobicContact CZ-CB 4.12Å; F475-R481 HydrophobicContact CE1-CB 4.27Å; F475-L484 HydrophobicContact CZ-CB 4.3Å; F475-L484 WeakPolarHBondContact CZ-O 3.26Å; F475-L487 HydrophobicContact CE2-CB 4.13Å; F475-L487 HydrophobicContact CE2-CD2 3.92Å; F475-L487 HydrophobicContact CE2-CG 4.46Å; F475-L487 HydrophobicContact CZ-CB 4.25Å; F475-P488 HydrophobicContact CB-CG 4.07Å; F475-P488 HydrophobicContact CD1-CB 4.47Å; F475-P488 HydrophobicContact CD1-CG 3.09Å; F475-P488 HydrophobicContact CD2-CG 4.07Å; F475-P488 HydrophobicContact CE1-CG 3.39Å; F475-P488 HydrophobicContact CE2-CG 4.33Å; F475-P488 HydrophobicContact CG-CG 3.47Å; F475-P488 VanDerWaalsContact CG-CG 3.47Å; F475-P488 HydrophobicContact CZ-CG 4.03Å
476P86.6Confident87.3Confident53 Ų5382.8 Ų82.834%0.34443%0.425SS..Hα-helixtrans-63.6-26.2178.8-25.538.3000113.8C471 E472C471-P476 WeakPolarHBondContact O-CD 3.26Å; E472-P476 WeakPolarHBondContact O-CG 3.37Å
477L87.4Confident86.9Confident157 Ų15783.3 Ų83.382%0.82242%0.419SS*.Hα-helixtrans-86.1-12175.6-62.1176.6000113.2F473 I474 F475F473-L477 WeakPolarHBondContact O-CD1 3.36Å; F473-L477 VanDerWaalsContact O-CG 3.25Å; F473-L477 WeakPolarHBondContact O-CG 3.16Å; I474-L477 PolarHBondContact O-N 2.65Å; F475-L477 PolarHBondContact O-N 3.47Å
478S88.8Confident86.7Confident19 Ų1983.2 Ų83.213%0.13342%0.419CS..SBendtrans-87.3154-177.279.30000112.6I474 F475 W480 R481I474-S478 WeakPolarHBondContact O-CB 3.47Å; I474-S478 PolarHBondContact O-N 3.1Å; I474-S478 VanDerWaalsContact O-N 3.1Å; F475-S478 WeakPolarHBondContact O-CB 3.25Å; F475-S478 PolarHBondContact O-N 2.93Å; F475-S478 PolarHBondContact O-OG 2.89Å; S478-W480 PolarHBondContact O-N 3.31Å; S478-W480 VanDerWaalsContact O-N 3.11Å; S478-W480 PolarHBondContact OG-N 2.95Å; S478-R481 PolarHBondContact O-N 3.11Å
479P86.5Confident86.4Confident106 Ų10684 Ų8469%0.68842%0.42SS*.THydrogen-bonded Turntrans-65.8-11.2172.927.1-34.5000113.3R481P479-R481 PolarHBondContact O-N 3.5Å
480W82.1Confident86.2Confident149 Ų14981.3 Ų81.356%0.56441%0.407SS*.Hα-helixtrans-71.2-15.8178.1-57.7-36.2000113.5F475 S478 Q482 K483 L484F475-W480 HydrophobicContact CD2-CB 4.38Å; F475-W480 HydrophobicContact CD2-CE3 4.48Å; F475-W480 HydrophobicContact CE2-CB 3.69Å; F475-W480 HydrophobicContact CZ-CB 4.12Å; S478-W480 PolarHBondContact O-N 3.31Å; S478-W480 VanDerWaalsContact O-N 3.11Å; S478-W480 PolarHBondContact OG-N 2.95Å; W480-Q482 PolarHBondContact O-N 3.47Å; W480-K483 PolarHBondContact O-N 2.94Å; W480-L484 PolarHBondContact O-N 2.98Å
481R80.2Confident86.2Confident160 Ų16081.1 Ų81.160%0.60441%0.405SS*.Hα-helixtrans-53.5-40.1177.2-176.9179.7177.1-174.9-1.5113F475 S478 P479 P485F475-R481 HydrophobicContact CE1-CB 4.27Å; S478-R481 PolarHBondContact O-N 3.11Å; P479-R481 PolarHBondContact O-N 3.5Å; R481-P485 WeakPolarHBondContact O-CA 3.44Å
482Q77.9Confident86.3Confident185 Ų18580.6 Ų80.686%0.86440%0.401SS*.Hα-helixtrans-78.1-31.4179.9-65.7179.3-400112.4W480W480-Q482 PolarHBondContact O-N 3.47Å
483K80.6Confident86.5Confident172 Ų17278.7 Ų78.775%0.74839%0.393SS*.Hα-helixtrans-84.1-35.4-176.4-65.5-173.8178.4-176.80113W480W480-K483 PolarHBondContact O-N 2.94Å
484L82.8Confident86.7Confident91 Ų9176.3 Ų76.348%0.47639%0.386SS..  trans-13656.3-171.7-62.7174.5000112.2F475 W480 F486 L487F475-L484 HydrophobicContact CZ-CB 4.3Å; F475-L484 WeakPolarHBondContact CZ-O 3.26Å; W480-L484 PolarHBondContact O-N 2.98Å; L484-F486 PolarHBondContact O-N 3.49Å; L484-L487 HydrophobicContact CB-CB 3.99Å; L484-L487 HydrophobicContact CB-CD2 4.48Å; L484-L487 HydrophobicContact CD1-CD2 4.04Å; L484-L487 WeakPolarHBondContact O-CB 3.25Å; L484-L487 PolarHBondContact O-N 3.27Å
485P78Confident87Confident71 Ų7174.3 Ų74.346%0.46137%0.372SS..THydrogen-bonded Turntrans-57.3-26.5-170.220.7-32.5000114.8R481R481-P485 WeakPolarHBondContact O-CA 3.44Å
486F81.8Confident87.4Confident74 Ų7473.4 Ų73.433%0.32537%0.368SS..THydrogen-bonded Turntrans-94.2-2.8-178.4-58.9-81.7000114.4T314 L484 L489 L490T314-F486 VanDerWaalsContact CB-CE2 3.48Å; T314-F486 HydrophobicContact CG2-CD2 3.63Å; T314-F486 HydrophobicContact CG2-CE2 4.15Å; T314-F486 HydrophobicContact CG2-CG 4.26Å; T314-F486 WeakPolarHBondContact O-CE2 3.29Å; T314-F486 WeakPolarHBondContact O-CZ 3.45Å; L484-F486 PolarHBondContact O-N 3.49Å; F486-L489 HydrophobicContact CD1-CD1 4.09Å; F486-L489 PolarHBondContact O-N 2.9Å; F486-L490 WeakPolarHBondContact O-CB 3.25Å; F486-L490 PolarHBondContact O-N 3.32Å
487L86.1Confident87.9Confident72 Ų7270.9 Ų70.938%0.37735%0.352SS..Hα-helixtrans-61.3-41.7-177.2-178.465000113.5F475 L484 L489 L490 A491F475-L487 HydrophobicContact CE2-CB 4.13Å; F475-L487 HydrophobicContact CE2-CD2 3.92Å; F475-L487 HydrophobicContact CE2-CG 4.46Å; F475-L487 HydrophobicContact CZ-CB 4.25Å; L484-L487 HydrophobicContact CB-CB 3.99Å; L484-L487 HydrophobicContact CB-CD2 4.48Å; L484-L487 HydrophobicContact CD1-CD2 4.04Å; L484-L487 WeakPolarHBondContact O-CB 3.25Å; L484-L487 PolarHBondContact O-N 3.27Å; L487-L489 VanDerWaalsContact C-N 3.32Å; L487-L489 PolarHBondContact O-N 2.75Å; L487-L490 HydrophobicContact CD1-CD2 4.27Å; L487-L490 PolarHBondContact O-N 3.39Å; L487-A491 VanDerWaalsContact O-CB 3.32Å; L487-A491 WeakPolarHBondContact O-CB 3.3Å; L487-A491 PolarHBondContact O-N 3.48Å
488P90.1Very high88.4Confident22 Ų2266.8 Ų66.814%0.14333%0.333CS..Hα-helixtrans-62.4-38.7176.8-25.236.3000113.1C471 F475 T492C471-P488 HydrophobicContact CB-CB 3.99Å; F475-P488 HydrophobicContact CB-CG 4.07Å; F475-P488 HydrophobicContact CD1-CB 4.47Å; F475-P488 HydrophobicContact CD1-CG 3.09Å; F475-P488 HydrophobicContact CD2-CG 4.07Å; F475-P488 HydrophobicContact CE1-CG 3.39Å; F475-P488 HydrophobicContact CE2-CG 4.33Å; F475-P488 HydrophobicContact CG-CG 3.47Å; F475-P488 VanDerWaalsContact CG-CG 3.47Å; F475-P488 HydrophobicContact CZ-CG 4.03Å; P488-T492 VanDerWaalsContact O-CB 3.26Å; P488-T492 WeakPolarHBondContact O-CB 3.35Å; P488-T492 PolarHBondContact O-N 2.82Å; P488-T492 PolarHBondContact O-OG1 3.45Å
489L88.3Confident88.8Confident35 Ų3565.9 Ų65.918%0.18333%0.327CS..Hα-helixtrans-64.6-48.7176.6-63.6176.8000110.3Y277 P416 F486 L487 A491 T492 S493Y277-L489 HydrophobicContact CD1-CD2 4.19Å; P416-L489 HydrophobicContact CB-CD2 3.46Å; P416-L489 VanDerWaalsContact CB-CD2 3.46Å; P416-L489 HydrophobicContact CG-CD2 3.75Å; F486-L489 HydrophobicContact CD1-CD1 4.09Å; F486-L489 PolarHBondContact O-N 2.9Å; L487-L489 VanDerWaalsContact C-N 3.32Å; L487-L489 PolarHBondContact O-N 2.75Å; L489-A491 PolarHBondContact O-N 3.32Å; L489-T492 PolarHBondContact O-N 3.48Å; L489-S493 VanDerWaalsContact O-CB 3.26Å; L489-S493 WeakPolarHBondContact O-CB 3.19Å; L489-S493 PolarHBondContact O-N 2.9Å; L489-S493 PolarHBondContact O-OG 3.28Å
490L88.8Confident89.3Confident39 Ų3960.9 Ų60.920%0.20429%0.294CS..Hα-helixtrans-56.3-52175.5174.966.6000111.4W278 F486 L487 T492 S493 V494W278-L490 HydrophobicContact CD2-CD1 4.48Å; W278-L490 HydrophobicContact CE3-CD1 3.65Å; W278-L490 HydrophobicContact CH2-CD1 3.32Å; W278-L490 HydrophobicContact CZ2-CD1 4.18Å; W278-L490 HydrophobicContact CZ3-CD1 3.01Å; W278-L490 HydrophobicContact CZ3-CG 4.47Å; F486-L490 WeakPolarHBondContact O-CB 3.25Å; F486-L490 PolarHBondContact O-N 3.32Å; L487-L490 HydrophobicContact CD1-CD2 4.27Å; L487-L490 PolarHBondContact O-N 3.39Å; L490-T492 PolarHBondContact O-N 3.42Å; L490-S493 PolarHBondContact O-N 3.31Å; L490-V494 HydrophobicContact CD1-CG2 3.78Å; L490-V494 HydrophobicContact CG-CG2 4.36Å; L490-V494 WeakPolarHBondContact O-CB 3.41Å; L490-V494 VanDerWaalsContact O-CG2 3.25Å; L490-V494 WeakPolarHBondContact O-CG2 3.4Å; L490-V494 PolarHBondContact O-N 2.92Å
491A92.6Very high90.1Very high36 Ų3654.9 Ų54.930%0.29828%0.275SS..Hα-helixtrans-61.3-46.9-177.600000111.7L487 L489 S493 Y495L487-A491 VanDerWaalsContact O-CB 3.32Å; L487-A491 WeakPolarHBondContact O-CB 3.3Å; L487-A491 PolarHBondContact O-N 3.48Å; L489-A491 PolarHBondContact O-N 3.32Å; A491-S493 VanDerWaalsContact C-N 3.35Å; A491-S493 PolarHBondContact O-N 2.86Å; A491-Y495 WeakPolarHBondContact O-CB 3.39Å; A491-Y495 PolarHBondContact O-N 2.81Å
492T94.1Very high90.9Very high2 Ų251.6 Ų51.61%0.01226%0.263CS..Hα-helixtrans-59.1-47.3176.7-65.70000111.2Y412 P416 P488 L489 L490 C496Y412-T492 HydrophobicContact CD1-CG2 4.05Å; Y412-T492 HydrophobicContact CE1-CG2 3.56Å; Y412-T492 PolarHBondContact OH-OG1 3.41Å; P416-T492 HydrophobicContact CG-CG2 4.29Å; P488-T492 VanDerWaalsContact O-CB 3.26Å; P488-T492 WeakPolarHBondContact O-CB 3.35Å; P488-T492 PolarHBondContact O-N 2.82Å; P488-T492 PolarHBondContact O-OG1 3.45Å; L489-T492 PolarHBondContact O-N 3.48Å; L490-T492 PolarHBondContact O-N 3.42Å; T492-C496 VanDerWaalsContact O-CB 3.3Å; T492-C496 WeakPolarHBondContact O-CB 3.48Å; T492-C496 PolarHBondContact O-N 2.93Å; T492-C496 PolarHBondContact O-SG 2.92Å
493S93.6Very high91.8Very high3 Ų342.8 Ų42.82%0.02122%0.222CC..Hα-helixtrans-68.2-47.4-175.6-540000112.4W278 L489 L490 A491 C496 A497W278-S493 VanDerWaalsContact CB-OG 3.31Å; W278-S493 WeakPolarHBondContact CB-OG 3.4Å; W278-S493 WeakPolarHBondContact O-CB 3.4Å; W278-S493 PolarHBondContact O-OG 3.04Å; L489-S493 VanDerWaalsContact O-CB 3.26Å; L489-S493 WeakPolarHBondContact O-CB 3.19Å; L489-S493 PolarHBondContact O-N 2.9Å; L489-S493 PolarHBondContact O-OG 3.28Å; L490-S493 PolarHBondContact O-N 3.31Å; A491-S493 VanDerWaalsContact C-N 3.35Å; A491-S493 PolarHBondContact O-N 2.86Å; S493-C496 PolarHBondContact O-N 2.83Å; S493-A497 WeakPolarHBondContact O-CB 3.44Å; S493-A497 PolarHBondContact O-N 3.34Å
494V94.5Very high92.7Very high40 Ų4035.2 Ų35.224%0.24219%0.189CC..Hα-helixtrans-62.5-46.3177.4171.10000110.3A284 L285 L490 C496 A497 V498A284-V494 WeakPolarHBondContact O-CG2 3.05Å; L285-V494 HydrophobicContact CD2-CG1 4.07Å; L285-V494 WeakPolarHBondContact CD2-O 3.12Å; L490-V494 HydrophobicContact CD1-CG2 3.78Å; L490-V494 HydrophobicContact CG-CG2 4.36Å; L490-V494 WeakPolarHBondContact O-CB 3.41Å; L490-V494 VanDerWaalsContact O-CG2 3.25Å; L490-V494 WeakPolarHBondContact O-CG2 3.4Å; L490-V494 PolarHBondContact O-N 2.92Å; V494-C496 PolarHBondContact O-N 2.83Å; V494-A497 PolarHBondContact O-N 2.79Å; V494-V498 PolarHBondContact O-N 3.16Å
495Y96.9Very high93.3Very high56 Ų5636.1 Ų36.122%0.2219%0.194CC..Hα-helixtrans-63.8-44.5-179.1-165.2-84.2000112.1Y460 G463 L464 V467 A491 V498Y460-Y495 AromaticContact CD2-CE1 3.97Å; Y460-Y495 HydrophobicContact CD2-CE1 3.97Å; Y460-Y495 AromaticContact CD2-CZ 3.88Å; Y460-Y495 AromaticContact CE2-CD1 3.96Å; Y460-Y495 HydrophobicContact CE2-CD1 3.96Å; Y460-Y495 AromaticContact CE2-CE1 3.42Å; Y460-Y495 HydrophobicContact CE2-CE1 3.42Å; Y460-Y495 VanDerWaalsContact CE2-CE1 3.42Å; Y460-Y495 HydrophobicContact CE2-CE2 4.45Å; Y460-Y495 AromaticContact CE2-CZ 3.72Å; Y460-Y495 AromaticContact CZ-CE1 3.76Å; Y460-Y495 PolarHBondContact O-OH 3.33Å; Y460-Y495 PolarHBondContact OH-O 3.13Å; G463-Y495 VanDerWaalsContact CA-OH 3.25Å; G463-Y495 WeakPolarHBondContact CA-OH 3.5Å; L464-Y495 HydrophobicContact CB-CE1 3.89Å; L464-Y495 HydrophobicContact CD1-CD1 3.38Å; L464-Y495 HydrophobicContact CD1-CE1 3.59Å; L464-Y495 HydrophobicContact CG-CE1 4.39Å; L464-Y495 PolarHBondContact N-OH 3.14Å; V467-Y495 HydrophobicContact CG2-CD1 4.3Å; V467-Y495 HydrophobicContact CG2-CD2 3.62Å; V467-Y495 HydrophobicContact CG2-CE2 3.87Å; V467-Y495 HydrophobicContact CG2-CG 3.84Å; A491-Y495 WeakPolarHBondContact O-CB 3.39Å; A491-Y495 PolarHBondContact O-N 2.81Å; Y495-V498 PolarHBondContact O-N 2.8Å
496C97.3Very high94.2Very high0 Ų034.5 Ų34.50%018%0.179CC..Hα-helixtrans-67.2-36.7176.9-67.60000112.1P280 T409 Y412 T492 S493 V494 V498 G499 V500P280-C496 HydrophobicContact CB-CB 3.51Å; P280-C496 HydrophobicContact CG-CB 4.3Å; T409-C496 PolarHBondContact O-SG 2.84Å; Y412-C496 VanDerWaalsContact CD1-SG 3.57Å; T492-C496 VanDerWaalsContact O-CB 3.3Å; T492-C496 WeakPolarHBondContact O-CB 3.48Å; T492-C496 PolarHBondContact O-N 2.93Å; T492-C496 PolarHBondContact O-SG 2.92Å; S493-C496 PolarHBondContact O-N 2.83Å; V494-C496 PolarHBondContact O-N 2.83Å; C496-V498 PolarHBondContact O-N 3.38Å; C496-G499 PolarHBondContact O-N 3.38Å; C496-V500 WeakPolarHBondContact O-CG2 2.94Å; C496-V500 PolarHBondContact O-N 2.86Å
497A97Very high94.8Very high0 Ų031 Ų310%016%0.164CC..Hα-helixtrans-61.2-32.1179.600000112.5P280 N281 A284 L285 S493 V494 S501P280-A497 VanDerWaalsContact C-CB 3.45Å; P280-A497 HydrophobicContact CB-CB 4.19Å; P280-A497 WeakPolarHBondContact O-CA 3.29Å; N281-A497 WeakPolarHBondContact O-CB 3.29Å; A284-A497 HydrophobicContact CB-CB 4.32Å; L285-A497 HydrophobicContact CD1-CB 4.26Å; L285-A497 HydrophobicContact CD2-CB 3.71Å; L285-A497 HydrophobicContact CG-CB 3.67Å; S493-A497 WeakPolarHBondContact O-CB 3.44Å; S493-A497 PolarHBondContact O-N 3.34Å; V494-A497 PolarHBondContact O-N 2.79Å; A497-S501 WeakPolarHBondContact O-CB 3.49Å; A497-S501 PolarHBondContact O-N 2.86Å; A497-S501 PolarHBondContact O-OG 3Å
498V97.6Very high95.1Very high70 Ų7029 Ų2942%0.42415%0.151SC..Hα-helixtrans-60.2-48.3171.51770000110.7L285 Y460 V494 Y495 C496 S501 Y502L285-V498 HydrophobicContact CD2-CG2 3.74Å; Y460-V498 HydrophobicContact CE2-CB 4.29Å; Y460-V498 HydrophobicContact CE2-CG1 4.19Å; V494-V498 PolarHBondContact O-N 3.16Å; Y495-V498 PolarHBondContact O-N 2.8Å; C496-V498 PolarHBondContact O-N 3.38Å; V498-S501 PolarHBondContact O-N 3.13Å; V498-Y502 VanDerWaalsContact O-CB 3.22Å; V498-Y502 WeakPolarHBondContact O-CB 3.32Å; V498-Y502 PolarHBondContact O-N 2.97Å
499G97.3Very high95.3Very high1 Ų129.7 Ų29.71%0.0116%0.158CC..Hα-helixtrans-68.6-39.1-17900000113.6Y460 C496 Y502 S503Y460-G499 WeakPolarHBondContact OH-CA 3.4Å; Y460-G499 PolarHBondContact OH-N 2.91Å; C496-G499 PolarHBondContact O-N 3.38Å; G499-Y502 PolarHBondContact O-N 3.33Å; G499-S503 WeakPolarHBondContact O-CB 3.34Å; G499-S503 PolarHBondContact O-N 3.18Å; G499-S503 PolarHBondContact O-OG 3.42Å; G499-S503 VanDerWaalsContact O-OG 3.12Å
500V97.9Very high95.3Very high0 Ų028.2 Ų28.20%015%0.151CC..Hα-helixtrans-64.6-46.1174.21790000110.5P280 L368 F371 L372 I382 L406 C496 Y502 S503 F504P280-V500 HydrophobicContact CB-CG2 4.47Å; P280-V500 HydrophobicContact CG-CG2 4.34Å; L368-V500 HydrophobicContact CD2-CG1 4.19Å; F371-V500 HydrophobicContact CD1-CG1 3.97Å; F371-V500 HydrophobicContact CE1-CG1 3.91Å; L372-V500 HydrophobicContact CD2-CB 4.48Å; L372-V500 HydrophobicContact CD2-CG1 3.85Å; L372-V500 HydrophobicContact CG-CG1 4.4Å; I382-V500 HydrophobicContact CD1-CG1 3.95Å; I382-V500 HydrophobicContact CD1-CG2 4.16Å; L406-V500 HydrophobicContact CD1-CB 4.36Å; L406-V500 HydrophobicContact CD1-CG1 4.07Å; L406-V500 HydrophobicContact CD1-CG2 4.19Å; C496-V500 WeakPolarHBondContact O-CG2 2.94Å; C496-V500 PolarHBondContact O-N 2.86Å; V500-Y502 VanDerWaalsContact C-N 3.34Å; V500-Y502 PolarHBondContact O-N 3.28Å; V500-S503 PolarHBondContact O-N 3.48Å; V500-F504 PolarHBondContact O-N 2.85Å
501S97.9Very high95.1Very high23 Ų2326.4 Ų26.416%0.16114%0.141CC..Hα-helixtrans-62.5-42.2177.2-59.50000111.5A497 V498 F504 L505A497-S501 WeakPolarHBondContact O-CB 3.49Å; A497-S501 PolarHBondContact O-N 2.86Å; A497-S501 PolarHBondContact O-OG 3Å; V498-S501 PolarHBondContact O-N 3.13Å; S501-F504 WeakPolarHBondContact O-CB 3.27Å; S501-F504 PolarHBondContact O-N 3.2Å; S501-L505 VanDerWaalsContact O-CG 3.32Å; S501-L505 WeakPolarHBondContact O-CG 3.28Å; S501-L505 PolarHBondContact O-N 3.1Å
502Y97.7Very high94.7Very high91 Ų9128.8 Ų28.836%0.35715%0.148SC..Hα-helixtrans-60.9-47.3175.6177.5-103.3000112.1V405 E457 V498 G499 V500 F504 L505 R506V405-Y502 HydrophobicContact CG1-CD1 4.25Å; E457-Y502 HydrophobicContact CG-CE1 3.75Å; E457-Y502 VanDerWaalsContact OE1-CE1 3.28Å; E457-Y502 WeakPolarHBondContact OE1-CE1 3.47Å; E457-Y502 PolarHBondContact OE1-OH 2.5Å; V498-Y502 VanDerWaalsContact O-CB 3.22Å; V498-Y502 WeakPolarHBondContact O-CB 3.32Å; V498-Y502 PolarHBondContact O-N 2.97Å; G499-Y502 PolarHBondContact O-N 3.33Å; V500-Y502 VanDerWaalsContact C-N 3.34Å; V500-Y502 PolarHBondContact O-N 3.28Å; Y502-F504 VanDerWaalsContact C-N 3.33Å; Y502-F504 PolarHBondContact O-N 3.49Å; Y502-L505 PolarHBondContact O-N 2.83Å; Y502-R506 HydrophobicContact CD1-CG 4.41Å; Y502-R506 HydrophobicContact CE1-CG 4.03Å; Y502-R506 HydrophobicContact CE2-CG 4.27Å; Y502-R506 VanDerWaalsContact CZ-CD 3.45Å; Y502-R506 WeakPolarHBondContact O-CG 3.26Å; Y502-R506 PolarHBondContact O-N 2.9Å
503S97.9Very high94.1Very high0 Ų036.3 Ų36.30%018%0.177CC..Hα-helixtrans-60.7-40.8175.9-71.50000112.3L406 G499 V500 R506 L507L406-S503 PolarHBondContact N-OG 3.28Å; G499-S503 WeakPolarHBondContact O-CB 3.34Å; G499-S503 PolarHBondContact O-N 3.18Å; G499-S503 PolarHBondContact O-OG 3.42Å; G499-S503 VanDerWaalsContact O-OG 3.12Å; V500-S503 PolarHBondContact O-N 3.48Å; S503-R506 PolarHBondContact O-N 2.79Å; S503-L507 WeakPolarHBondContact O-CB 3.38Å; S503-L507 PolarHBondContact O-N 3.4Å
504F97.8Very high93Very high13 Ų1338.5 Ų38.56%0.05719%0.192CC..Hα-helixtrans-60.3-50.6173.4171.7-107.8000111.8A341 L365 L368 A369 L372 F373 V500 S501 Y502 R506 L507 Y508A341-F504 HydrophobicContact CB-CZ 4.26Å; L365-F504 HydrophobicContact CD2-CD2 3.92Å; L365-F504 HydrophobicContact CD2-CE2 3.81Å; L368-F504 HydrophobicContact CB-CB 4.38Å; L368-F504 HydrophobicContact CB-CD2 3.59Å; L368-F504 HydrophobicContact CB-CE2 4.32Å; L368-F504 HydrophobicContact CB-CG 4.37Å; L368-F504 HydrophobicContact CD1-CB 4.28Å; L368-F504 HydrophobicContact CD1-CD2 4.35Å; A369-F504 HydrophobicContact CB-CE2 4.03Å; A369-F504 HydrophobicContact CB-CZ 4.24Å; L372-F504 HydrophobicContact CD1-CB 3.51Å; L372-F504 HydrophobicContact CD1-CD1 3.55Å; L372-F504 HydrophobicContact CD1-CD2 4.16Å; L372-F504 HydrophobicContact CD1-CE1 4.29Å; L372-F504 HydrophobicContact CD1-CG 3.47Å; L372-F504 VanDerWaalsContact CD1-CG 3.47Å; F373-F504 HydrophobicContact CE2-CE1 4.14Å; F373-F504 HydrophobicContact CE2-CZ 4.46Å; V500-F504 PolarHBondContact O-N 2.85Å; S501-F504 WeakPolarHBondContact O-CB 3.27Å; S501-F504 PolarHBondContact O-N 3.2Å; Y502-F504 VanDerWaalsContact C-N 3.33Å; Y502-F504 PolarHBondContact O-N 3.49Å; F504-R506 VanDerWaalsContact C-N 3.33Å; F504-R506 PolarHBondContact O-N 3.04Å; F504-L507 PolarHBondContact O-N 2.91Å; F504-Y508 HydrophobicContact CE1-CD2 4.1Å; F504-Y508 AromaticContact CE2-CD2 3.8Å; F504-Y508 HydrophobicContact CE2-CD2 3.8Å; F504-Y508 HydrophobicContact CE2-CE2 4.11Å; F504-Y508 AromaticContact CZ-CD2 3.55Å; F504-Y508 HydrophobicContact CZ-CD2 3.55Å; F504-Y508 AromaticContact CZ-CE2 3.7Å; F504-Y508 HydrophobicContact CZ-CE2 3.7Å; F504-Y508 WeakPolarHBondContact O-CB 3.43Å; F504-Y508 PolarHBondContact O-N 3.42Å
505L96.9Very high91.4Very high110 Ų11038.5 Ų38.558%0.57619%0.19SC*.Hα-helixtrans-61.8-39.7179.3-69.6174.3000112.2S501 Y502 Y508 A509S501-L505 VanDerWaalsContact O-CG 3.32Å; S501-L505 WeakPolarHBondContact O-CG 3.28Å; S501-L505 PolarHBondContact O-N 3.1Å; Y502-L505 PolarHBondContact O-N 2.83Å; L505-Y508 WeakPolarHBondContact O-CB 3.35Å; L505-Y508 PolarHBondContact O-N 3.4Å; L505-A509 WeakPolarHBondContact O-CB 3.14Å; L505-A509 PolarHBondContact O-N 3.01Å
506R95.8Very high89.5Confident38 Ų3840.3 Ų40.314%0.14320%0.204CC..Hα-helixtrans-61.9-50.3174.2-78-17167.4-172.316.3111.8I402 E457 Y502 S503 F504 Y508 A509 T510I402-R506 HydrophobicContact CD1-CB 3.94Å; I402-R506 HydrophobicContact CG1-CB 3.91Å; E457-R506 IonicContact OE1-CZ 3.99Å; E457-R506 IonicContact OE1-NE 2.89Å; E457-R506 IonicContact OE1-NH1 2.78Å; E457-R506 PolarHBondContact OE1-NH1 3.3Å; E457-R506 IonicContact OE1-NH2 3.15Å; E457-R506 IonicContact OE2-NH1 3.2Å; Y502-R506 HydrophobicContact CD1-CG 4.41Å; Y502-R506 HydrophobicContact CE1-CG 4.03Å; Y502-R506 HydrophobicContact CE2-CG 4.27Å; Y502-R506 VanDerWaalsContact CZ-CD 3.45Å; Y502-R506 WeakPolarHBondContact O-CG 3.26Å; Y502-R506 PolarHBondContact O-N 2.9Å; S503-R506 PolarHBondContact O-N 2.79Å; F504-R506 VanDerWaalsContact C-N 3.33Å; F504-R506 PolarHBondContact O-N 3.04Å; R506-Y508 PolarHBondContact O-N 2.94Å; R506-A509 WeakPolarHBondContact O-CB 3.38Å; R506-A509 PolarHBondContact O-N 3Å; R506-A509 VanDerWaalsContact O-N 3.1Å; R506-T510 PolarHBondContact O-N 3.25Å; R506-T510 PolarHBondContact O-OG1 2.93Å
507L94.8Very high87.6Confident1 Ų147.7 Ų47.71%0.00524%0.236CC..Hα-helixtrans-59.3-38178.2-172.363.9000111.2R361 L364 L365 L368 I402 S503 F504 T510 L511R361-L507 HydrophobicContact CG-CD1 4.37Å; L364-L507 HydrophobicContact CB-CD2 3.68Å; L364-L507 HydrophobicContact CD1-CD2 4.46Å; L365-L507 HydrophobicContact CD2-CB 4.09Å; L365-L507 HydrophobicContact CD2-CD2 3.86Å; L365-L507 HydrophobicContact CD2-CG 3.87Å; L365-L507 HydrophobicContact CG-CD2 4Å; L365-L507 HydrophobicContact CG-CG 4.13Å; L368-L507 HydrophobicContact CD1-CD2 4.11Å; I402-L507 HydrophobicContact CD1-CB 4.24Å; I402-L507 HydrophobicContact CD1-CD1 4.28Å; S503-L507 WeakPolarHBondContact O-CB 3.38Å; S503-L507 PolarHBondContact O-N 3.4Å; F504-L507 PolarHBondContact O-N 2.91Å; L507-T510 PolarHBondContact O-N 3.04Å; L507-L511 PolarHBondContact O-N 3.1Å; L507-L511 VanDerWaalsContact O-N 3.13Å
508Y93.1Very high85.4Confident30 Ų3051.2 Ų51.212%0.11825%0.249CC..Hα-helixtrans-63.4-46.3174-137-80.4000112.5A341 P344 L365 F504 L505 R506 T510 L511 L512A341-Y508 VanDerWaalsContact O-CE2 3.29Å; A341-Y508 WeakPolarHBondContact O-CE2 3.28Å; A341-Y508 PolarHBondContact O-OH 3.45Å; P344-Y508 HydrophobicContact CB-CE1 4.03Å; P344-Y508 WeakPolarHBondContact CB-OH 3.33Å; P344-Y508 WeakPolarHBondContact CD-OH 3.48Å; P344-Y508 HydrophobicContact CG-CE1 4.37Å; P344-Y508 WeakPolarHBondContact CG-OH 2.95Å; L365-Y508 HydrophobicContact CD1-CD2 4.32Å; L365-Y508 HydrophobicContact CD2-CD2 3.58Å; L365-Y508 HydrophobicContact CD2-CE2 4.24Å; L365-Y508 HydrophobicContact CD2-CG 4.31Å; F504-Y508 HydrophobicContact CE1-CD2 4.1Å; F504-Y508 AromaticContact CE2-CD2 3.8Å; F504-Y508 HydrophobicContact CE2-CD2 3.8Å; F504-Y508 HydrophobicContact CE2-CE2 4.11Å; F504-Y508 AromaticContact CZ-CD2 3.55Å; F504-Y508 HydrophobicContact CZ-CD2 3.55Å; F504-Y508 AromaticContact CZ-CE2 3.7Å; F504-Y508 HydrophobicContact CZ-CE2 3.7Å; F504-Y508 WeakPolarHBondContact O-CB 3.43Å; F504-Y508 PolarHBondContact O-N 3.42Å; L505-Y508 WeakPolarHBondContact O-CB 3.35Å; L505-Y508 PolarHBondContact O-N 3.4Å; R506-Y508 PolarHBondContact O-N 2.94Å; Y508-T510 VanDerWaalsContact C-N 3.32Å; Y508-T510 PolarHBondContact O-N 3.3Å; Y508-L511 VanDerWaalsContact O-CB 3.31Å; Y508-L511 WeakPolarHBondContact O-CB 3.34Å; Y508-L511 PolarHBondContact O-N 3.13Å; Y508-L511 VanDerWaalsContact O-N 3.14Å; Y508-L512 HydrophobicContact CD1-CD1 4.03Å; Y508-L512 HydrophobicContact CD1-CG 4.17Å; Y508-L512 HydrophobicContact CE1-CD1 4.49Å; Y508-L512 WeakPolarHBondContact O-CG 3.38Å; Y508-L512 PolarHBondContact O-N 2.81Å
509A92.8Very high83Confident35 Ų3556.1 Ų56.129%0.28927%0.265SS..Hα-helixtrans-62.2-40.7178.600000111.4L505 R506 L511 L512 R513L505-A509 WeakPolarHBondContact O-CB 3.14Å; L505-A509 PolarHBondContact O-N 3.01Å; R506-A509 WeakPolarHBondContact O-CB 3.38Å; R506-A509 PolarHBondContact O-N 3Å; R506-A509 VanDerWaalsContact O-N 3.1Å; A509-L511 VanDerWaalsContact C-N 3.29Å; A509-L511 PolarHBondContact O-N 3.18Å; A509-L512 PolarHBondContact O-N 2.87Å; A509-R513 WeakPolarHBondContact O-CB 3.3Å; A509-R513 VanDerWaalsContact O-CG 3.32Å; A509-R513 WeakPolarHBondContact O-CG 3.46Å; A509-R513 PolarHBondContact O-N 3.35Å
510T88.8Confident80.1Confident5 Ų564.1 Ų64.13%0.03130%0.302CS..Hα-helixtrans-60.2-40.6174.3-49.90000111.4E398 R506 L507 Y508 S514E398-T510 PolarHBondContact OE1-OG1 3.02Å; E398-T510 WeakPolarHBondContact OE2-CG2 3.47Å; R506-T510 PolarHBondContact O-N 3.25Å; R506-T510 PolarHBondContact O-OG1 2.93Å; L507-T510 PolarHBondContact O-N 3.04Å; Y508-T510 VanDerWaalsContact C-N 3.32Å; Y508-T510 PolarHBondContact O-N 3.3Å; T510-S514 WeakPolarHBondContact O-CB 3.37Å; T510-S514 PolarHBondContact O-N 2.72Å
511L85.3Confident77.3Confident1 Ų173.8 Ų73.81%0.00535%0.353CS..Hα-helixtrans-60.9-51.6173.2-174.279.7000110.7A345 S348 R352 L365 L507 Y508 A509 R513 S514 N515A345-L511 HydrophobicContact CB-CD2 4.15Å; S348-L511 WeakPolarHBondContact OG-CD1 3.25Å; R352-L511 PolarHBondContact NH2-O 3.04Å; L365-L511 HydrophobicContact CD1-CB 4.19Å; L365-L511 HydrophobicContact CD1-CD2 3.67Å; L365-L511 HydrophobicContact CD1-CG 4.36Å; L507-L511 PolarHBondContact O-N 3.1Å; L507-L511 VanDerWaalsContact O-N 3.13Å; Y508-L511 VanDerWaalsContact O-CB 3.31Å; Y508-L511 WeakPolarHBondContact O-CB 3.34Å; Y508-L511 PolarHBondContact O-N 3.13Å; Y508-L511 VanDerWaalsContact O-N 3.14Å; A509-L511 VanDerWaalsContact C-N 3.29Å; A509-L511 PolarHBondContact O-N 3.18Å; L511-R513 PolarHBondContact O-N 3.37Å; L511-S514 PolarHBondContact O-N 3.47Å; L511-N515 PolarHBondContact O-N 3.49Å
512L83.1Confident76.2Confident85 Ų8576.3 Ų76.345%0.44536%0.362SS..Hα-helixtrans-62.8-42.9-177.4-66.7175.6000112.9Y508 A509 S514 N515 N516Y508-L512 HydrophobicContact CD1-CD1 4.03Å; Y508-L512 HydrophobicContact CD1-CG 4.17Å; Y508-L512 HydrophobicContact CE1-CD1 4.49Å; Y508-L512 WeakPolarHBondContact O-CG 3.38Å; Y508-L512 PolarHBondContact O-N 2.81Å; A509-L512 PolarHBondContact O-N 2.87Å; L512-S514 VanDerWaalsContact C-N 3.29Å; L512-S514 PolarHBondContact O-N 3.25Å; L512-N515 WeakPolarHBondContact O-CB 3.35Å; L512-N515 PolarHBondContact O-N 3.07Å; L512-N516 PolarHBondContact O-N 3.03Å
513R82.9Confident75.1Confident161 Ų16175.5 Ų75.561%0.60836%0.363SS*.Hα-helixtrans-59.5-40.4176.8-73174.2-175.9177.7-0.5112.3A509 L511 N515 N516 K517A509-R513 WeakPolarHBondContact O-CB 3.3Å; A509-R513 VanDerWaalsContact O-CG 3.32Å; A509-R513 WeakPolarHBondContact O-CG 3.46Å; A509-R513 PolarHBondContact O-N 3.35Å; L511-R513 PolarHBondContact O-N 3.37Å; R513-N515 PolarHBondContact O-N 3.22Å; R513-N516 PolarHBondContact O-N 3.08Å; R513-K517 PolarHBondContact O-N 3.18Å
514S70.2Confident73.9Confident48 Ų4879.7 Ų79.734%0.33638%0.383SS..Hα-helixtrans-67.2-22.8176.5172.50000113.1R352 T510 L511 L512R352-S514 PolarHBondContact NH1-OG 2.82Å; R352-S514 PolarHBondContact NH2-OG 3Å; T510-S514 WeakPolarHBondContact O-CB 3.37Å; T510-S514 PolarHBondContact O-N 2.72Å; L511-S514 PolarHBondContact O-N 3.47Å; L512-S514 VanDerWaalsContact C-N 3.29Å; L512-S514 PolarHBondContact O-N 3.25Å
515N59.9Low72.4Confident40 Ų4083.6 Ų83.621%0.21440%0.402CS..Hα-helixtrans-76.3-39.5171.5-82.4-18.9000111.8S348 R352 L511 L512 R513 R518 K519S348-N515 PolarHBondContact OG-ND2 3.32Å; S348-N515 PolarHBondContact OG-OD1 3.38Å; R352-N515 PolarHBondContact NE-OD1 3.11Å; R352-N515 VanDerWaalsContact NH2-N 3.15Å; R352-N515 PolarHBondContact NH2-OD1 3.47Å; L511-N515 PolarHBondContact O-N 3.49Å; L512-N515 WeakPolarHBondContact O-CB 3.35Å; L512-N515 PolarHBondContact O-N 3.07Å; R513-N515 PolarHBondContact O-N 3.22Å; N515-R518 PolarHBondContact O-N 2.88Å; N515-K519 PolarHBondContact O-N 3.35Å
516N57.9Low70.9Confident95 Ų9582 Ų8251%0.50839%0.391SS..Hα-helixtrans-67.8-38.8-177.8-76.6-6.7000112.8L512 R513 R518 K519 Q520L512-N516 PolarHBondContact O-N 3.03Å; R513-N516 PolarHBondContact O-N 3.08Å; N516-R518 PolarHBondContact O-N 3.18Å; N516-R518 VanDerWaalsContact O-N 3.07Å; N516-K519 PolarHBondContact O-N 3.49Å; N516-Q520 PolarHBondContact O-N 3.04Å
517K57.2Low69.3Low154 Ų15484.9 Ų84.967%0.6741%0.407SS*.Hα-helixtrans-56.9-25.1174.1-73.8-169.8177.4-173.30113.5R513 L521R513-K517 PolarHBondContact O-N 3.18Å; K517-L521 WeakPolarHBondContact O-CD1 3.48Å
518R49.9Very low67.4Low75 Ų7590.9 Ų90.928%0.28344%0.436SS..Hα-helixtrans-85.6-21.9176.4-173.5176.8170.1-1553.1113.8D222 G223 R351 N515 N516D222-R518 PolarHBondContact O-NE 3.22Å; D222-R518 PolarHBondContact O-NH2 3.07Å; G223-R518 PolarHBondContact O-NH2 3.17Å; R351-R518 PolarHBondContact O-NH1 3.36Å; R351-R518 PolarHBondContact O-NH2 3.35Å; N515-R518 PolarHBondContact O-N 2.88Å; N516-R518 PolarHBondContact O-N 3.18Å; N516-R518 VanDerWaalsContact O-N 3.07Å
519K46.9Very low65.5Low172 Ų17295.6 Ų95.675%0.74846%0.461SS*.Hα-helixtrans-75.7-16.4173.2-71.5-174.4176.1-176.80112.2N515 N516N515-K519 PolarHBondContact O-N 3.35Å; N516-K519 PolarHBondContact O-N 3.49Å
520Q37.3Very low63.2Low169 Ų169100.7 Ų100.779%0.7948%0.475SS*.  trans-99.8-2.8-178.1-67.6178.7-26.900113.5N516N516-Q520 PolarHBondContact O-N 3.04Å
521L38.7Very low60.9Low203 Ų203109.4 Ų109.4100%1.06352%0.515SS*.  trans-116.30174.7-72.9165.8000108.1K517K517-L521 WeakPolarHBondContact O-CD1 3.48Å

Retrieved 521 of 521 residues in 119.1 ms (Link to these results)

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