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Hippocalcin-like protein 4

May be involved in the calcium-dependent regulation of rhodopsin phosphorylation.

AlphaFold DB , UniProt , Accession Q9UM19, Species HUMAN (Homo sapiens, Human), Gene HPCAL4, Length 191 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
1M37.1Very low67.8Low243 Ų243121.5 Ų121.5100%1.19767%0.673SS**  094.60-77.4170.6134.500107.8K3M1-K3 PolarHBondContact O-N 3.49Å
2G40.9Very low69.8Low75 Ų75116.4 Ų116.477%0.77365%0.647SS**  trans-71.4126.3-179.600000109.6T4G2-T4 PolarHBondContact O-N 3.24Å
3K45.7Very low71.7Confident206 Ų206108.7 Ų108.790%0.89660%0.604SS**  trans-60.8108.3166.6-73.7177.8176.51770106.4M1 N5M1-K3 PolarHBondContact O-N 3.49Å; K3-N5 PolarHBondContact O-N 2.83Å; K3-N5 VanDerWaalsContact O-N 3.08Å
4T54.6Low73.3Confident116 Ų116109.7 Ų109.771%0.71260%0.602SS**  trans-54.5117.3165.633.30000106.6G2 S6G2-T4 PolarHBondContact O-N 3.24Å; T4-S6 PolarHBondContact O-N 3.08Å; T4-S6 PolarHBondContact O-OG 3.11Å; T4-S6 VanDerWaalsContact O-OG 3.11Å
5N57.7Low74.8Confident132 Ų132105.7 Ų105.771%0.70658%0.579SS**  trans-66.496.3-170.5-1526.8000107.3K3 K7K3-N5 PolarHBondContact O-N 2.83Å; K3-N5 VanDerWaalsContact O-N 3.08Å; N5-K7 PolarHBondContact O-N 3.03Å
6S68.9Low76.1Confident86 Ų8699.1 Ų99.160%0.60154%0.543SS*.  trans-73.418.8-170.5-33.10000113.2T4T4-S6 PolarHBondContact O-N 3.08Å; T4-S6 PolarHBondContact O-OG 3.11Å; T4-S6 VanDerWaalsContact O-OG 3.11Å
7K80.6Confident77.3Confident164 Ų16497.1 Ų97.171%0.71353%0.534SS*.SBendtrans-131.8135.7-175.9-64.2-175.4179.8-177.90108.2N5N5-K7 PolarHBondContact O-N 3.03Å
8L86.9Confident78.3Confident24 Ų24100.3 Ų100.313%0.12655%0.545CS..  trans-57.1137168.3-67.9165.3000109.5V12 L13 L16 Y31 F82L8-V12 HydrophobicContact CD2-CG1 4.03Å; L8-L13 HydrophobicContact CB-CB 4.32Å; L8-L13 HydrophobicContact CD1-CD1 3.97Å; L8-L16 HydrophobicContact CD1-CD1 4.1Å; L8-L16 HydrophobicContact CD2-CD1 4.34Å; L8-Y31 HydrophobicContact CD1-CD1 4.43Å; L8-Y31 HydrophobicContact CD1-CG 4.08Å; L8-Y31 HydrophobicContact CD2-CD1 4.02Å; L8-Y31 HydrophobicContact CD2-CD2 3.55Å; L8-Y31 HydrophobicContact CD2-CE1 4.03Å; L8-Y31 HydrophobicContact CD2-CE2 3.58Å; L8-Y31 HydrophobicContact CD2-CG 3.75Å; L8-Y31 HydrophobicContact CG-CD1 3.65Å; L8-Y31 HydrophobicContact CG-CD2 4Å; L8-Y31 HydrophobicContact CG-CE1 3.98Å; L8-Y31 HydrophobicContact CG-CE2 4.31Å; L8-Y31 HydrophobicContact CG-CG 3.63Å; L8-F82 HydrophobicContact CD1-CE1 3.95Å; L8-F82 HydrophobicContact CD2-CD1 3.89Å; L8-F82 HydrophobicContact CD2-CE1 4.04Å
9A90Very high79.2Confident42 Ų4299.6 Ų99.635%0.34754%0.541SS..  trans-61.2145.1168.700000109.3E11 V12 L13A9-E11 VanDerWaalsContact C-N 3.26Å; A9-E11 PolarHBondContact O-N 3.38Å; A9-V12 HydrophobicContact CB-CG2 4.15Å; A9-V12 PolarHBondContact O-N 3.05Å; A9-V12 VanDerWaalsContact O-N 3.11Å; A9-L13 PolarHBondContact O-N 3.18Å
10P91Very high80Confident93 Ų9395.1 Ų95.160%0.60452%0.517SS*.Hα-helixtrans-53.3-42.1-178.8-27.735.5000113.4V12 L13 E14P10-V12 PolarHBondContact O-N 2.89Å; P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 3.11Å; P10-E14 WeakPolarHBondContact O-CG 3.47Å; P10-E14 PolarHBondContact O-N 2.73Å
11E92Very high80.6Confident156 Ų15696 Ų9673%0.72952%0.518SS*.Hα-helixtrans-61.7-42.5178.7-64.2149.6-170.600112.4A9 E14 D15A9-E11 VanDerWaalsContact C-N 3.26Å; A9-E11 PolarHBondContact O-N 3.38Å; E11-E14 PolarHBondContact O-N 2.93Å; E11-D15 PolarHBondContact O-N 3.11Å
12V92.1Very high83.4Confident60 Ų6084.9 Ų84.936%0.36446%0.462SS..Hα-helixtrans-67.2-40.8176.3178.10000110.2L8 A9 P10 D15 L16L8-V12 HydrophobicContact CD2-CG1 4.03Å; A9-V12 HydrophobicContact CB-CG2 4.15Å; A9-V12 PolarHBondContact O-N 3.05Å; A9-V12 VanDerWaalsContact O-N 3.11Å; P10-V12 PolarHBondContact O-N 2.89Å; V12-D15 PolarHBondContact O-N 3.2Å; V12-L16 HydrophobicContact CG1-CD1 4.09Å; V12-L16 HydrophobicContact CG1-CG 4.3Å; V12-L16 WeakPolarHBondContact O-CB 3.41Å; V12-L16 VanDerWaalsContact O-CG 3.22Å; V12-L16 WeakPolarHBondContact O-CG 3.22Å; V12-L16 PolarHBondContact O-N 3.47Å
13L94.3Very high86Confident16 Ų1684 Ų848%0.08444%0.444CS..Hα-helixtrans-64.9-40.7178.8-176.960.4000111.7L8 A9 P10 L16 V17 E24 L27L8-L13 HydrophobicContact CB-CB 4.32Å; L8-L13 HydrophobicContact CD1-CD1 3.97Å; A9-L13 PolarHBondContact O-N 3.18Å; P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 3.11Å; L13-L16 PolarHBondContact O-N 2.89Å; L13-V17 VanDerWaalsContact O-CG2 3.28Å; L13-V17 WeakPolarHBondContact O-CG2 3.4Å; L13-V17 PolarHBondContact O-N 3.47Å; L13-E24 HydrophobicContact CD1-CG 3.83Å; L13-E24 HydrophobicContact CD2-CG 3.52Å; L13-E24 HydrophobicContact CG-CG 3.79Å; L13-L27 HydrophobicContact CD1-CB 3.93Å; L13-L27 HydrophobicContact CD1-CD1 3.94Å
14E94.6Very high88.4Confident123 Ų12378.9 Ų78.958%0.57542%0.423SS*.Hα-helixtrans-62.1-46174-74.7174.4-162.400111.8P10 E11 L16 V17 Q18P10-E14 WeakPolarHBondContact O-CG 3.47Å; P10-E14 PolarHBondContact O-N 2.73Å; E11-E14 PolarHBondContact O-N 2.93Å; E14-L16 PolarHBondContact O-N 3.46Å; E14-V17 PolarHBondContact O-N 2.95Å; E14-Q18 WeakPolarHBondContact O-CG 3.37Å; E14-Q18 PolarHBondContact O-N 2.82Å; E14-Q18 VanDerWaalsContact O-N 3.08Å
15D95.5Very high90.3Very high49 Ų4980.4 Ų80.426%0.26242%0.423SS..Hα-helixtrans-57.5-46.5173.7170.574.8000111.7E11 V12 V17 Q18 N19 R83E11-D15 PolarHBondContact O-N 3.11Å; V12-D15 PolarHBondContact O-N 3.2Å; D15-V17 PolarHBondContact O-N 3.44Å; D15-Q18 PolarHBondContact O-N 2.64Å; D15-N19 WeakPolarHBondContact O-CB 3.34Å; D15-N19 PolarHBondContact O-N 2.87Å; D15-N19 PolarHBondContact O-ND2 3.07Å; D15-N19 PolarHBondContact OD1-ND2 2.91Å; D15-R83 IonicContact OD1-NH2 3.49Å; D15-R83 PolarHBondContact OD1-NH2 2.97Å; D15-R83 IonicContact OD2-CZ 2.82Å; D15-R83 IonicContact OD2-NE 3.59Å; D15-R83 PolarHBondContact OD2-NE 2.85Å; D15-R83 IonicContact OD2-NH2 3.17Å; D15-R83 PolarHBondContact OD2-NH2 3.32Å; D15-R83 VanDerWaalsContact OD2-NH2 3.11Å
16L96.5Very high92.1Very high0 Ų076.6 Ų76.60%040%0.401CS..Hα-helixtrans-65.9-37.2-179.9-69.3179.4000112.7L8 V12 L13 E14 Q18 N19 T20 L27 F82 R83 I86L8-L16 HydrophobicContact CD1-CD1 4.1Å; L8-L16 HydrophobicContact CD2-CD1 4.34Å; V12-L16 HydrophobicContact CG1-CD1 4.09Å; V12-L16 HydrophobicContact CG1-CG 4.3Å; V12-L16 WeakPolarHBondContact O-CB 3.41Å; V12-L16 VanDerWaalsContact O-CG 3.22Å; V12-L16 WeakPolarHBondContact O-CG 3.22Å; V12-L16 PolarHBondContact O-N 3.47Å; L13-L16 PolarHBondContact O-N 2.89Å; E14-L16 PolarHBondContact O-N 3.46Å; L16-Q18 VanDerWaalsContact C-N 3.28Å; L16-Q18 PolarHBondContact O-N 3.44Å; L16-N19 PolarHBondContact O-N 2.93Å; L16-T20 WeakPolarHBondContact O-CB 3.21Å; L16-T20 WeakPolarHBondContact O-CG2 3.47Å; L16-T20 PolarHBondContact O-N 2.88Å; L16-T20 PolarHBondContact O-OG1 3.15Å; L16-L27 HydrophobicContact CB-CD1 3.71Å; L16-L27 HydrophobicContact CB-CD2 4.13Å; L16-L27 HydrophobicContact CD1-CD2 4.45Å; L16-F82 HydrophobicContact CD1-CD1 4Å; L16-F82 HydrophobicContact CD1-CE1 3.68Å; L16-R83 HydrophobicContact CD2-CB 4.15Å; L16-R83 HydrophobicContact CD2-CG 3.76Å; L16-I86 HydrophobicContact CD1-CG2 4.3Å; L16-I86 HydrophobicContact CD2-CG2 3.58Å; L16-I86 HydrophobicContact CG-CG2 4.49Å
17V96Very high93.4Very high65 Ų6572.5 Ų72.539%0.39437%0.372SS..Hα-helixtrans-65.7-33.8174.7169.90000111.2L13 E14 D15 E24 L27L13-V17 VanDerWaalsContact O-CG2 3.28Å; L13-V17 WeakPolarHBondContact O-CG2 3.4Å; L13-V17 PolarHBondContact O-N 3.47Å; E14-V17 PolarHBondContact O-N 2.95Å; D15-V17 PolarHBondContact O-N 3.44Å; V17-E24 HydrophobicContact CG2-CB 4.32Å; V17-L27 HydrophobicContact CB-CD1 4.46Å; V17-L27 HydrophobicContact CG2-CD1 3.54Å
18Q95.2Very high94.1Very high155 Ų15569.7 Ų69.772%0.72436%0.36SS*.Hα-helixtrans-76.5-29.6178.4-71.1176.711.200113.3E14 D15 L16E14-Q18 WeakPolarHBondContact O-CG 3.37Å; E14-Q18 PolarHBondContact O-N 2.82Å; E14-Q18 VanDerWaalsContact O-N 3.08Å; D15-Q18 PolarHBondContact O-N 2.64Å; L16-Q18 VanDerWaalsContact C-N 3.28Å; L16-Q18 PolarHBondContact O-N 3.44Å
19N94.4Very high94.4Very high87 Ų8775 Ų7547%0.46538%0.384SS..Hα-helixtrans-106.41.8-172.9-67.5-76.3000114.2D15 L16D15-N19 WeakPolarHBondContact O-CB 3.34Å; D15-N19 PolarHBondContact O-N 2.87Å; D15-N19 PolarHBondContact O-ND2 3.07Å; D15-N19 PolarHBondContact OD1-ND2 2.91Å; L16-N19 PolarHBondContact O-N 2.93Å
20T95.3Very high94.7Very high10 Ų1078 Ų786%0.06139%0.387CS..SBendtrans-136.3159.4179.2740000112.3L16 F22 I86 S90L16-T20 WeakPolarHBondContact O-CB 3.21Å; L16-T20 WeakPolarHBondContact O-CG2 3.47Å; L16-T20 PolarHBondContact O-N 2.88Å; L16-T20 PolarHBondContact O-OG1 3.15Å; T20-F22 PolarHBondContact O-N 2.81Å; T20-F22 PolarHBondContact OG1-N 3.42Å; T20-I86 HydrophobicContact CG2-CG2 4.28Å; T20-S90 WeakPolarHBondContact CA-OG 3.37Å
21E94.3Very high94.8Very high115 Ų11575.6 Ų75.654%0.53737%0.366SS..SBendtrans-87.524.2175.9-59.5-60.8150.600111.8S90 R94E21-S90 PolarHBondContact N-OG 3.02Å; E21-R94 HydrophobicContact CB-CB 3.62Å; E21-R94 HydrophobicContact CB-CG 4.37Å; E21-R94 HydrophobicContact CG-CB 4.06Å; E21-R94 VanDerWaalsContact O-CD 3.32Å; E21-R94 WeakPolarHBondContact O-CD 3.49Å; E21-R94 PolarHBondContact O-NH1 3.37Å
22F95.1Very high94.9Very high9 Ų975.9 Ų75.94%0.03936%0.364CS..  trans-106.6136.9178.8-68.2-71.8000111.1T20 E26 L27 W30 I86 L89T20-F22 PolarHBondContact O-N 2.81Å; T20-F22 PolarHBondContact OG1-N 3.42Å; F22-E26 HydrophobicContact CB-CB 4.23Å; F22-E26 HydrophobicContact CD1-CB 4.11Å; F22-L27 HydrophobicContact CB-CD2 3.74Å; F22-L27 HydrophobicContact CB-CG 3.84Å; F22-L27 HydrophobicContact CD2-CD2 4.46Å; F22-L27 HydrophobicContact CG-CD2 4.43Å; F22-W30 AromaticContact CE1-NE1 3.6Å; F22-I86 HydrophobicContact CD2-CD1 3.67Å; F22-I86 HydrophobicContact CD2-CG1 3.83Å; F22-I86 HydrophobicContact CE2-CD1 3.53Å; F22-I86 HydrophobicContact CE2-CG1 4.05Å; F22-I86 HydrophobicContact CG-CD1 4.4Å; F22-I86 HydrophobicContact CZ-CD1 4.18Å; F22-L89 HydrophobicContact CE2-CD2 4.47Å; F22-L89 HydrophobicContact CE2-CG 4.35Å; F22-L89 HydrophobicContact CZ-CD2 4.06Å; F22-L89 HydrophobicContact CZ-CG 4.05Å
23S95.3Very high94.8Very high56 Ų5674.4 Ų74.439%0.39236%0.361SS..  trans-67.9158.3171.364.70000111.6Q25 E26 L27S23-Q25 PolarHBondContact O-N 3.47Å; S23-Q25 VanDerWaalsContact O-N 3.11Å; S23-E26 PolarHBondContact N-OE2 3.08Å; S23-E26 PolarHBondContact O-N 3.17Å; S23-E26 VanDerWaalsContact OG-CG 3.24Å; S23-E26 WeakPolarHBondContact OG-CG 3.28Å; S23-E26 PolarHBondContact OG-N 3.46Å; S23-E26 PolarHBondContact OG-OE2 3.34Å; S23-L27 WeakPolarHBondContact O-CG 3.41Å; S23-L27 PolarHBondContact O-N 2.58Å
24E95.3Very high94.7Very high98 Ų9874.3 Ų74.346%0.45836%0.36SS..Hα-helixtrans-52.3-37175.7-164.5-167140.200112.8L13 V17 K28L13-E24 HydrophobicContact CD1-CG 3.83Å; L13-E24 HydrophobicContact CD2-CG 3.52Å; L13-E24 HydrophobicContact CG-CG 3.79Å; V17-E24 HydrophobicContact CG2-CB 4.32Å; E24-K28 WeakPolarHBondContact O-CG 3.37Å; E24-K28 PolarHBondContact O-N 3.02Å; E24-K28 VanDerWaalsContact OE1-CE 3.29Å; E24-K28 WeakPolarHBondContact OE1-CE 3.29Å; E24-K28 IonicContact OE1-NZ 3.31Å; E24-K28 PolarHBondContact OE1-NZ 3.45Å
25Q95.1Very high94.6Very high148 Ų14870.4 Ų70.469%0.69234%0.343SS*.Hα-helixtrans-69.5-42.3178.6-65.2-175.22.700112S23 K28 Q29S23-Q25 PolarHBondContact O-N 3.47Å; S23-Q25 VanDerWaalsContact O-N 3.11Å; Q25-K28 PolarHBondContact O-N 3.38Å; Q25-Q29 WeakPolarHBondContact O-CG 3.48Å; Q25-Q29 PolarHBondContact O-N 2.96Å; Q25-Q29 VanDerWaalsContact O-N 3.15Å
26E96Very high94.3Very high53 Ų5376.1 Ų76.125%0.24837%0.366CS..Hα-helixtrans-65.5-43.6176.7-70.5169.512700111.2F22 S23 K28 Q29 W30 R94F22-E26 HydrophobicContact CB-CB 4.23Å; F22-E26 HydrophobicContact CD1-CB 4.11Å; S23-E26 PolarHBondContact N-OE2 3.08Å; S23-E26 PolarHBondContact O-N 3.17Å; S23-E26 VanDerWaalsContact OG-CG 3.24Å; S23-E26 WeakPolarHBondContact OG-CG 3.28Å; S23-E26 PolarHBondContact OG-N 3.46Å; S23-E26 PolarHBondContact OG-OE2 3.34Å; E26-K28 VanDerWaalsContact C-N 3.32Å; E26-K28 PolarHBondContact O-N 3.19Å; E26-Q29 WeakPolarHBondContact O-CB 3.26Å; E26-Q29 PolarHBondContact O-N 3.37Å; E26-W30 VanDerWaalsContact O-CD1 3.31Å; E26-W30 PolarHBondContact O-N 2.94Å; E26-R94 IonicContact OE1-CZ 3.11Å; E26-R94 IonicContact OE1-NH1 2.65Å; E26-R94 PolarHBondContact OE1-NH1 3.03Å; E26-R94 VanDerWaalsContact OE1-NH1 3.14Å; E26-R94 IonicContact OE1-NH2 2.58Å; E26-R94 PolarHBondContact OE1-NH2 3.05Å; E26-R94 IonicContact OE2-CZ 3.35Å; E26-R94 IonicContact OE2-NH1 3.47Å; E26-R94 PolarHBondContact OE2-NH1 3.44Å; E26-R94 IonicContact OE2-NH2 2.73Å
27L96.4Very high93.8Very high0 Ų081.7 Ų81.70%040%0.395CS..Hα-helixtrans-57.6-43.9177-70171.6000111.7L13 L16 V17 F22 S23 Q29 W30 Y31 I86L13-L27 HydrophobicContact CD1-CB 3.93Å; L13-L27 HydrophobicContact CD1-CD1 3.94Å; L16-L27 HydrophobicContact CB-CD1 3.71Å; L16-L27 HydrophobicContact CB-CD2 4.13Å; L16-L27 HydrophobicContact CD1-CD2 4.45Å; V17-L27 HydrophobicContact CB-CD1 4.46Å; V17-L27 HydrophobicContact CG2-CD1 3.54Å; F22-L27 HydrophobicContact CB-CD2 3.74Å; F22-L27 HydrophobicContact CB-CG 3.84Å; F22-L27 HydrophobicContact CD2-CD2 4.46Å; F22-L27 HydrophobicContact CG-CD2 4.43Å; S23-L27 WeakPolarHBondContact O-CG 3.41Å; S23-L27 PolarHBondContact O-N 2.58Å; L27-Q29 VanDerWaalsContact C-N 3.32Å; L27-Q29 PolarHBondContact O-N 3.3Å; L27-W30 PolarHBondContact O-N 2.67Å; L27-Y31 VanDerWaalsContact O-CB 3.31Å; L27-Y31 WeakPolarHBondContact O-CB 3.45Å; L27-Y31 PolarHBondContact O-N 3.34Å; L27-I86 HydrophobicContact CD2-CD1 4.41Å; L27-I86 HydrophobicContact CD2-CG1 3.6Å; L27-I86 HydrophobicContact CD2-CG2 4.49Å
28K94.1Very high93.4Very high104 Ų10479 Ų7945%0.45238%0.379SS..Hα-helixtrans-63.3-37175.2-72.6174.3-174170.10112.7E24 Q25 E26 K32E24-K28 WeakPolarHBondContact O-CG 3.37Å; E24-K28 PolarHBondContact O-N 3.02Å; E24-K28 VanDerWaalsContact OE1-CE 3.29Å; E24-K28 WeakPolarHBondContact OE1-CE 3.29Å; E24-K28 IonicContact OE1-NZ 3.31Å; E24-K28 PolarHBondContact OE1-NZ 3.45Å; Q25-K28 PolarHBondContact O-N 3.38Å; E26-K28 VanDerWaalsContact C-N 3.32Å; E26-K28 PolarHBondContact O-N 3.19Å; K28-K32 WeakPolarHBondContact O-CB 3.33Å; K28-K32 PolarHBondContact O-N 3.47Å; K28-K32 VanDerWaalsContact O-N 3.11Å
29Q94.8Very high93.1Very high137 Ų13776.6 Ų76.664%0.6438%0.377SS*.Hα-helixtrans-69.7-46.9177.5-71.2175.813.800111.4Q25 E26 L27 Y31 K32 G33Q25-Q29 WeakPolarHBondContact O-CG 3.48Å; Q25-Q29 PolarHBondContact O-N 2.96Å; Q25-Q29 VanDerWaalsContact O-N 3.15Å; E26-Q29 WeakPolarHBondContact O-CB 3.26Å; E26-Q29 PolarHBondContact O-N 3.37Å; L27-Q29 VanDerWaalsContact C-N 3.32Å; L27-Q29 PolarHBondContact O-N 3.3Å; Q29-Y31 VanDerWaalsContact C-N 3.34Å; Q29-Y31 PolarHBondContact O-N 2.76Å; Q29-K32 PolarHBondContact O-N 2.83Å; Q29-G33 PolarHBondContact O-N 3.43Å
30W94.6Very high93Very high105 Ų10576.2 Ų76.240%0.39838%0.382SS..Hα-helixtrans-58.4-45.7174.2-83115.5000111.5F22 E26 L27 K32 G33 F34 F82 F85 I86 L89F22-W30 AromaticContact CE1-NE1 3.6Å; E26-W30 VanDerWaalsContact O-CD1 3.31Å; E26-W30 PolarHBondContact O-N 2.94Å; L27-W30 PolarHBondContact O-N 2.67Å; W30-K32 VanDerWaalsContact C-N 3.33Å; W30-K32 PolarHBondContact O-N 3.48Å; W30-G33 PolarHBondContact O-N 3.41Å; W30-G33 VanDerWaalsContact O-N 3.14Å; W30-F34 WeakPolarHBondContact O-CB 3.26Å; W30-F34 PolarHBondContact O-N 3.13Å; W30-F82 HydrophobicContact CB-CE2 3.99Å; W30-F82 HydrophobicContact CB-CZ 3.96Å; W30-F85 AromaticContact CE3-CE1 3.94Å; W30-F85 HydrophobicContact CE3-CE1 3.94Å; W30-F85 HydrophobicContact CE3-CZ 4.32Å; W30-F85 HydrophobicContact CZ3-CE1 4.23Å; W30-F85 HydrophobicContact CZ3-CZ 4.14Å; W30-I86 HydrophobicContact CB-CD1 3.96Å; W30-I86 HydrophobicContact CD2-CD1 4.3Å; W30-I86 HydrophobicContact CG-CD1 3.76Å; W30-L89 HydrophobicContact CD2-CD2 4.18Å; W30-L89 HydrophobicContact CE3-CD2 4.28Å; W30-L89 HydrophobicContact CH2-CD2 3.73Å; W30-L89 HydrophobicContact CZ2-CD2 3.6Å; W30-L89 HydrophobicContact CZ3-CD2 4.07Å
31Y94.4Very high92.8Very high42 Ų4276.8 Ų76.817%0.16539%0.389CS..Hα-helixtrans-61-42.2178.4-172.2-119.1000112.4L8 L27 Q29 G33 F34 L35 F82L8-Y31 HydrophobicContact CD1-CD1 4.43Å; L8-Y31 HydrophobicContact CD1-CG 4.08Å; L8-Y31 HydrophobicContact CD2-CD1 4.02Å; L8-Y31 HydrophobicContact CD2-CD2 3.55Å; L8-Y31 HydrophobicContact CD2-CE1 4.03Å; L8-Y31 HydrophobicContact CD2-CE2 3.58Å; L8-Y31 HydrophobicContact CD2-CG 3.75Å; L8-Y31 HydrophobicContact CG-CD1 3.65Å; L8-Y31 HydrophobicContact CG-CD2 4Å; L8-Y31 HydrophobicContact CG-CE1 3.98Å; L8-Y31 HydrophobicContact CG-CE2 4.31Å; L8-Y31 HydrophobicContact CG-CG 3.63Å; L27-Y31 VanDerWaalsContact O-CB 3.31Å; L27-Y31 WeakPolarHBondContact O-CB 3.45Å; L27-Y31 PolarHBondContact O-N 3.34Å; Q29-Y31 VanDerWaalsContact C-N 3.34Å; Q29-Y31 PolarHBondContact O-N 2.76Å; Y31-G33 VanDerWaalsContact C-N 3.34Å; Y31-G33 PolarHBondContact O-N 2.98Å; Y31-F34 PolarHBondContact O-N 2.86Å; Y31-L35 HydrophobicContact CD1-CD1 4.07Å; Y31-L35 HydrophobicContact CD2-CG 4.47Å; Y31-L35 HydrophobicContact CE1-CD1 3.5Å; Y31-L35 VanDerWaalsContact CE1-CD1 3.5Å; Y31-L35 HydrophobicContact CE1-CG 4.26Å; Y31-L35 HydrophobicContact CE2-CD1 4.19Å; Y31-L35 HydrophobicContact CE2-CD2 4.39Å; Y31-L35 HydrophobicContact CE2-CG 4.13Å; Y31-L35 PolarHBondContact O-N 2.97Å; Y31-F82 VanDerWaalsContact CA-CE2 3.41Å; Y31-F82 VanDerWaalsContact CA-CZ 3.48Å; Y31-F82 HydrophobicContact CD2-CB 4.08Å; Y31-F82 AromaticContact CD2-CD1 3.43Å; Y31-F82 HydrophobicContact CD2-CD1 3.43Å; Y31-F82 VanDerWaalsContact CD2-CD1 3.43Å; Y31-F82 AromaticContact CD2-CD2 3.84Å; Y31-F82 HydrophobicContact CD2-CD2 3.84Å; Y31-F82 AromaticContact CD2-CE1 3.73Å; Y31-F82 HydrophobicContact CD2-CE1 3.73Å; Y31-F82 HydrophobicContact CD2-CE2 4.12Å; Y31-F82 AromaticContact CD2-CG 3.48Å; Y31-F82 HydrophobicContact CD2-CG 3.48Å; Y31-F82 VanDerWaalsContact CD2-CG 3.48Å; Y31-F82 HydrophobicContact CD2-CZ 4.06Å; Y31-F82 HydrophobicContact CE2-CB 4.13Å; Y31-F82 HydrophobicContact CE2-CD1 4.06Å; Y31-F82 HydrophobicContact CE2-CG 4.02Å; Y31-F82 HydrophobicContact CG-CD1 4.33Å; Y31-F82 HydrophobicContact CG-CE1 4.19Å; Y31-F82 HydrophobicContact CG-CZ 4.34Å; Y31-F82 VanDerWaalsContact N-CZ 3.34Å
32K92.9Very high92.8Very high162 Ų16274.8 Ų74.870%0.70438%0.382SS*.Hα-helixtrans-63.7-39.8175.7-174.8-178.5177.8-1750111.9K28 Q29 W30 K36K28-K32 WeakPolarHBondContact O-CB 3.33Å; K28-K32 PolarHBondContact O-N 3.47Å; K28-K32 VanDerWaalsContact O-N 3.11Å; Q29-K32 PolarHBondContact O-N 2.83Å; W30-K32 VanDerWaalsContact C-N 3.33Å; W30-K32 PolarHBondContact O-N 3.48Å; K32-K36 WeakPolarHBondContact O-CB 3.25Å; K32-K36 PolarHBondContact O-N 3.45Å
33G91.9Very high92.7Very high29 Ų2974.6 Ų74.630%0.29938%0.381SS..Hα-helixtrans-65.3-47174.400000111.7Q29 W30 Y31 L35 K36 D37Q29-G33 PolarHBondContact O-N 3.43Å; W30-G33 PolarHBondContact O-N 3.41Å; W30-G33 VanDerWaalsContact O-N 3.14Å; Y31-G33 VanDerWaalsContact C-N 3.34Å; Y31-G33 PolarHBondContact O-N 2.98Å; G33-L35 PolarHBondContact O-N 2.97Å; G33-K36 WeakPolarHBondContact O-CB 3.3Å; G33-K36 PolarHBondContact O-N 3.44Å; G33-D37 PolarHBondContact O-N 3.11Å
34F91.5Very high92.7Very high13 Ų1374.3 Ų74.36%0.05738%0.375CS..Hα-helixtrans-58.5-48.9179.2-171-90.7000111.8W30 Y31 K36 D37 C38 G41 L43 F82 F85W30-F34 WeakPolarHBondContact O-CB 3.26Å; W30-F34 PolarHBondContact O-N 3.13Å; Y31-F34 PolarHBondContact O-N 2.86Å; F34-K36 PolarHBondContact O-N 2.85Å; F34-D37 PolarHBondContact O-N 2.75Å; F34-C38 HydrophobicContact CE1-CB 4.27Å; F34-C38 WeakPolarHBondContact O-CA 3.41Å; F34-C38 WeakPolarHBondContact O-CB 3.31Å; F34-C38 PolarHBondContact O-N 2.99Å; F34-G41 WeakPolarHBondContact CE1-O 3.47Å; F34-L43 HydrophobicContact CZ-CB 4.35Å; F34-F82 HydrophobicContact CB-CD2 3.67Å; F34-F82 HydrophobicContact CB-CE2 3.98Å; F34-F82 HydrophobicContact CD1-CB 4.09Å; F34-F82 AromaticContact CD1-CD2 3.96Å; F34-F82 HydrophobicContact CD1-CD2 3.96Å; F34-F82 HydrophobicContact CD1-CG 4.47Å; F34-F82 HydrophobicContact CD2-CD2 4.04Å; F34-F82 HydrophobicContact CE1-CB 4.11Å; F34-F82 AromaticContact CG-CD2 3.63Å; F34-F82 HydrophobicContact CG-CD2 3.63Å; F34-F82 HydrophobicContact CG-CE2 4.37Å; F34-F85 HydrophobicContact CD2-CB 4.4Å; F34-F85 AromaticContact CD2-CD1 3.81Å; F34-F85 HydrophobicContact CD2-CD1 3.81Å; F34-F85 HydrophobicContact CD2-CE1 4.27Å; F34-F85 HydrophobicContact CD2-CG 4.03Å; F34-F85 HydrophobicContact CE2-CB 3.89Å; F34-F85 HydrophobicContact CE2-CD1 4.15Å; F34-F85 HydrophobicContact CE2-CD2 4.43Å; F34-F85 AromaticContact CE2-CG 3.89Å; F34-F85 HydrophobicContact CE2-CG 3.89Å
35L92.1Very high92.6Very high42 Ų4271.7 Ų71.722%0.2236%0.364CS..Hα-helixtrans-68.1-21.6176.1-70.1-175.9000114.1Y31 G33 P39Y31-L35 HydrophobicContact CD1-CD1 4.07Å; Y31-L35 HydrophobicContact CD2-CG 4.47Å; Y31-L35 HydrophobicContact CE1-CD1 3.5Å; Y31-L35 VanDerWaalsContact CE1-CD1 3.5Å; Y31-L35 HydrophobicContact CE1-CG 4.26Å; Y31-L35 HydrophobicContact CE2-CD1 4.19Å; Y31-L35 HydrophobicContact CE2-CD2 4.39Å; Y31-L35 HydrophobicContact CE2-CG 4.13Å; Y31-L35 PolarHBondContact O-N 2.97Å; G33-L35 PolarHBondContact O-N 2.97Å; L35-P39 WeakPolarHBondContact O-CA 3.2Å
36K89.5Confident92.5Very high168 Ų16870.6 Ų70.673%0.7336%0.359SS*.Hα-helixtrans-72.8-41.3174.5-179.2-171.2171.1-163.80110.6K32 G33 F34K32-K36 WeakPolarHBondContact O-CB 3.25Å; K32-K36 PolarHBondContact O-N 3.45Å; G33-K36 WeakPolarHBondContact O-CB 3.3Å; G33-K36 PolarHBondContact O-N 3.44Å; F34-K36 PolarHBondContact O-N 2.85Å
37D85.4Confident92.3Very high117 Ų11771.7 Ų71.763%0.62636%0.364SS*.Hα-helixtrans-86.4-31.1-177.8-64.4-22.2000112G33 F34G33-D37 PolarHBondContact O-N 3.11Å; F34-D37 PolarHBondContact O-N 2.75Å
38C88.4Confident92.1Very high9 Ų972.1 Ų72.16%0.06137%0.366CS..  trans-126.678.4178.9-53.90000110.2F34 S40 G41 L43F34-C38 HydrophobicContact CE1-CB 4.27Å; F34-C38 WeakPolarHBondContact O-CA 3.41Å; F34-C38 WeakPolarHBondContact O-CB 3.31Å; F34-C38 PolarHBondContact O-N 2.99Å; C38-S40 PolarHBondContact O-N 2.9Å; C38-G41 PolarHBondContact O-N 3.45Å; C38-L43 WeakPolarHBondContact SG-CD1 3.43Å
39P89.3Confident92Very high105 Ų10569.1 Ų69.168%0.68235%0.353SS*.THydrogen-bonded Turntrans-60.4-20.2-176.2-25.835.8000115L35 G41L35-P39 WeakPolarHBondContact O-CA 3.2Å; P39-G41 VanDerWaalsContact C-N 3.26Å
40S91Very high91.7Very high79 Ų7967.6 Ų67.655%0.55235%0.346SS*.THydrogen-bonded Turntrans-67.1-23.1172.750.40000113.2C38 I42C38-S40 PolarHBondContact O-N 2.9Å; S40-I42 VanDerWaalsContact C-N 3.28Å; S40-I42 PolarHBondContact OG-N 3.37Å; S40-I42 PolarHBondContact OG-O 2.95Å
41G91.9Very high91.2Very high22 Ų2265.2 Ų65.223%0.22734%0.341CS..SBendtrans80.86.1-17200000114.5F34 C38 P39F34-G41 WeakPolarHBondContact CE1-O 3.47Å; C38-G41 PolarHBondContact O-N 3.45Å; P39-G41 VanDerWaalsContact C-N 3.26Å
42I93.8Very high90.7Very high73 Ų7365.4 Ų65.437%0.37434%0.342SS..EExtended strand (participates in β ladder)trans-137150.7177.355175.5000109S40 T79 D81S40-I42 VanDerWaalsContact C-N 3.28Å; S40-I42 PolarHBondContact OG-N 3.37Å; S40-I42 PolarHBondContact OG-O 2.95Å; I42-T79 HydrophobicContact CD1-CG2 4.24Å; I42-D81 HydrophobicContact CG2-CB 4.49Å
43L93.5Very high90.4Very high4 Ų460.9 Ų60.92%0.02133%0.325CS..EExtended strand (participates in β ladder)trans-118.1118.9177.5-17773000109F34 C38 E47 F48 L51 T79 I80F34-L43 HydrophobicContact CZ-CB 4.35Å; C38-L43 WeakPolarHBondContact SG-CD1 3.43Å; L43-E47 HydrophobicContact CD1-CB 3.29Å; L43-E47 HydrophobicContact CD1-CG 4.43Å; L43-E47 HydrophobicContact CG-CB 4.22Å; L43-F48 HydrophobicContact CD2-CB 3.93Å; L43-F48 HydrophobicContact CD2-CD2 3.52Å; L43-F48 HydrophobicContact CD2-CE2 4.5Å; L43-F48 HydrophobicContact CD2-CG 4.21Å; L43-F48 HydrophobicContact CG-CB 4.12Å; L43-L51 HydrophobicContact CD1-CD1 4.45Å; L43-L51 HydrophobicContact CD2-CD1 3.99Å; L43-T79 WeakPolarHBondContact O-CA 3.32Å; L43-I80 HydrophobicContact CB-CB 4.35Å; L43-I80 PolarHBondContact N-O 3.02Å; L43-I80 PolarHBondContact O-N 2.9Å
44N94.6Very high90Very high50 Ų5066.9 Ų66.927%0.26734%0.343SS..EExtended strand (participates in β ladder)trans-84.1171.41746349.1000111.7E46 E47 F48N44-E46 VanDerWaalsContact C-N 3.33Å; N44-E46 PolarHBondContact O-N 3.3Å; N44-E46 PolarHBondContact OD1-N 2.88Å; N44-E46 VanDerWaalsContact OD1-N 3.15Å; N44-E46 PolarHBondContact OD1-OE2 2.84Å; N44-E47 PolarHBondContact N-OE2 3.49Å; N44-E47 PolarHBondContact ND2-OE2 2.88Å; N44-E47 VanDerWaalsContact ND2-OE2 3.17Å; N44-E47 PolarHBondContact O-N 3.22Å; N44-E47 WeakPolarHBondContact OD1-CB 3.41Å; N44-E47 VanDerWaalsContact OD1-CG 3.26Å; N44-E47 WeakPolarHBondContact OD1-CG 3.41Å; N44-E47 PolarHBondContact OD1-N 2.85Å; N44-F48 WeakPolarHBondContact O-CB 3.3Å; N44-F48 PolarHBondContact O-N 3.39Å
45L94.5Very high89.4Confident44 Ų4473.9 Ų73.923%0.2337%0.373CS..Hα-helixtrans-59.4-41.9-178.9176.660.3000112.4E47 F48 Q49 Q66 F69L45-E47 PolarHBondContact O-N 3.02Å; L45-F48 PolarHBondContact O-N 2.75Å; L45-Q49 HydrophobicContact CD1-CG 4.11Å; L45-Q49 HydrophobicContact CG-CG 4.48Å; L45-Q49 WeakPolarHBondContact O-CB 3.4Å; L45-Q49 WeakPolarHBondContact O-CG 3.34Å; L45-Q49 PolarHBondContact O-N 3.25Å; L45-Q66 HydrophobicContact CD1-CB 4.19Å; L45-Q66 HydrophobicContact CD1-CG 4.38Å; L45-Q66 HydrophobicContact CD2-CG 4.14Å; L45-F69 HydrophobicContact CB-CD2 4.3Å; L45-F69 HydrophobicContact CB-CE2 4.26Å; L45-F69 HydrophobicContact CB-CZ 4.42Å; L45-F69 HydrophobicContact CD1-CB 3.77Å; L45-F69 HydrophobicContact CD1-CD1 4.45Å; L45-F69 HydrophobicContact CD1-CD2 4.03Å; L45-F69 HydrophobicContact CD1-CG 3.83Å
46E92.9Very high88.8Confident125 Ų12574 Ų7458%0.58437%0.372SS*.Hα-helixtrans-62.2-45.6179.2-66.589.2179.800111.5N44 Q49 Q50N44-E46 VanDerWaalsContact C-N 3.33Å; N44-E46 PolarHBondContact O-N 3.3Å; N44-E46 PolarHBondContact OD1-N 2.88Å; N44-E46 VanDerWaalsContact OD1-N 3.15Å; N44-E46 PolarHBondContact OD1-OE2 2.84Å; E46-Q49 PolarHBondContact O-N 3.25Å; E46-Q50 WeakPolarHBondContact O-CG 3.42Å; E46-Q50 PolarHBondContact O-N 3.15Å
47E91.6Very high88.2Confident76 Ų7669.8 Ų69.836%0.35536%0.362SS..Hα-helixtrans-64.1-41.6177.9-68.1166.8156.300111.3L43 N44 L45 Q50 L51L43-E47 HydrophobicContact CD1-CB 3.29Å; L43-E47 HydrophobicContact CD1-CG 4.43Å; L43-E47 HydrophobicContact CG-CB 4.22Å; N44-E47 PolarHBondContact N-OE2 3.49Å; N44-E47 PolarHBondContact ND2-OE2 2.88Å; N44-E47 VanDerWaalsContact ND2-OE2 3.17Å; N44-E47 PolarHBondContact O-N 3.22Å; N44-E47 WeakPolarHBondContact OD1-CB 3.41Å; N44-E47 VanDerWaalsContact OD1-CG 3.26Å; N44-E47 WeakPolarHBondContact OD1-CG 3.41Å; N44-E47 PolarHBondContact OD1-N 2.85Å; L45-E47 PolarHBondContact O-N 3.02Å; E47-Q50 WeakPolarHBondContact O-CB 3.33Å; E47-Q50 PolarHBondContact O-N 3.17Å; E47-L51 PolarHBondContact O-N 3.29Å
48F91.7Very high88.1Confident8 Ų874.7 Ų74.74%0.03537%0.373CS..Hα-helixtrans-62.8-42175.4-171.2-106000111.8L43 N44 L45 Q50 L51 Y52 A65 A68 F69 F72 I80L43-F48 HydrophobicContact CD2-CB 3.93Å; L43-F48 HydrophobicContact CD2-CD2 3.52Å; L43-F48 HydrophobicContact CD2-CE2 4.5Å; L43-F48 HydrophobicContact CD2-CG 4.21Å; L43-F48 HydrophobicContact CG-CB 4.12Å; N44-F48 WeakPolarHBondContact O-CB 3.3Å; N44-F48 PolarHBondContact O-N 3.39Å; L45-F48 PolarHBondContact O-N 2.75Å; F48-Q50 VanDerWaalsContact C-N 3.33Å; F48-Q50 PolarHBondContact O-N 3.47Å; F48-L51 WeakPolarHBondContact O-CB 3.43Å; F48-L51 PolarHBondContact O-N 2.94Å; F48-L51 VanDerWaalsContact O-N 3.12Å; F48-Y52 HydrophobicContact CD1-CD2 4.24Å; F48-Y52 HydrophobicContact CD1-CE2 4.1Å; F48-Y52 HydrophobicContact CE1-CD2 4.03Å; F48-Y52 AromaticContact CE1-CE2 3.44Å; F48-Y52 HydrophobicContact CE1-CE2 3.44Å; F48-Y52 VanDerWaalsContact CE1-CE2 3.44Å; F48-Y52 HydrophobicContact CE2-CE2 4.23Å; F48-Y52 HydrophobicContact CZ-CD2 4.41Å; F48-Y52 AromaticContact CZ-CE2 3.54Å; F48-Y52 HydrophobicContact CZ-CE2 3.54Å; F48-Y52 PolarHBondContact O-N 3.15Å; F48-A65 HydrophobicContact CD1-CB 4.2Å; F48-A65 WeakPolarHBondContact CD1-O 3.24Å; F48-A65 HydrophobicContact CE1-CB 4.4Å; F48-A65 VanDerWaalsContact CE1-O 3.27Å; F48-A65 WeakPolarHBondContact CE1-O 3.47Å; F48-A68 HydrophobicContact CE1-CB 3.97Å; F48-A68 HydrophobicContact CZ-CB 4.25Å; F48-F69 HydrophobicContact CB-CD2 3.74Å; F48-F69 HydrophobicContact CB-CE2 4.19Å; F48-F69 HydrophobicContact CD1-CB 3.93Å; F48-F69 AromaticContact CD1-CD2 3.9Å; F48-F69 HydrophobicContact CD1-CD2 3.9Å; F48-F69 HydrophobicContact CD1-CG 4.44Å; F48-F69 HydrophobicContact CE1-CB 4.08Å; F48-F69 AromaticContact CG-CD2 3.84Å; F48-F69 HydrophobicContact CG-CD2 3.84Å; F48-F72 HydrophobicContact CE2-CD1 4.3Å; F48-F72 HydrophobicContact CE2-CE1 4.4Å; F48-F72 HydrophobicContact CZ-CD1 4.48Å; F48-I80 HydrophobicContact CD2-CD1 4.08Å; F48-I80 HydrophobicContact CE2-CD1 4.14Å; F48-I80 HydrophobicContact CG-CD1 4.47Å
49Q91.5Very high87.8Confident41 Ų4175.6 Ų75.619%0.19238%0.384CS..Hα-helixtrans-61.1-39.7173.5-76.3178-20.700112.1L45 E46 L51 Y52 I53 S62 A65L45-Q49 HydrophobicContact CD1-CG 4.11Å; L45-Q49 HydrophobicContact CG-CG 4.48Å; L45-Q49 WeakPolarHBondContact O-CB 3.4Å; L45-Q49 WeakPolarHBondContact O-CG 3.34Å; L45-Q49 PolarHBondContact O-N 3.25Å; E46-Q49 PolarHBondContact O-N 3.25Å; Q49-L51 PolarHBondContact O-N 2.84Å; Q49-Y52 PolarHBondContact O-N 2.89Å; Q49-Y52 VanDerWaalsContact O-N 3.11Å; Q49-I53 WeakPolarHBondContact O-CG1 3.49Å; Q49-I53 PolarHBondContact O-N 3.02Å; Q49-S62 PolarHBondContact NE2-O 3.42Å; Q49-A65 HydrophobicContact CG-CB 3.81Å
50Q88.3Confident87.8Confident105 Ų10574 Ų7449%0.49137%0.37SS..Hα-helixtrans-62-30.8175.3-68.3-56.3-47.200112.8E46 E47 F48 K54E46-Q50 WeakPolarHBondContact O-CG 3.42Å; E46-Q50 PolarHBondContact O-N 3.15Å; E47-Q50 WeakPolarHBondContact O-CB 3.33Å; E47-Q50 PolarHBondContact O-N 3.17Å; F48-Q50 VanDerWaalsContact C-N 3.33Å; F48-Q50 PolarHBondContact O-N 3.47Å; Q50-K54 WeakPolarHBondContact O-CG 3.44Å; Q50-K54 PolarHBondContact O-N 3.11Å
51L85.3Confident87.7Confident55 Ų5570.4 Ų70.429%0.28835%0.345SS..Hα-helixtrans-64-46.5172.3-61.1177.3000110.7L43 E47 F48 Q49 K54 F55L43-L51 HydrophobicContact CD1-CD1 4.45Å; L43-L51 HydrophobicContact CD2-CD1 3.99Å; E47-L51 PolarHBondContact O-N 3.29Å; F48-L51 WeakPolarHBondContact O-CB 3.43Å; F48-L51 PolarHBondContact O-N 2.94Å; F48-L51 VanDerWaalsContact O-N 3.12Å; Q49-L51 PolarHBondContact O-N 2.84Å; L51-K54 WeakPolarHBondContact O-CB 3.44Å; L51-K54 PolarHBondContact O-N 3.35Å; L51-F55 WeakPolarHBondContact O-CD2 3.43Å
52Y84Confident87.7Confident46 Ų4671.1 Ų71.118%0.1835%0.346CS..Hα-helixtrans-64.3-39.9178.6-88.7-97.8000113.2F48 Q49 K54 F55 F56 A61 F64 A65 M131F48-Y52 HydrophobicContact CD1-CD2 4.24Å; F48-Y52 HydrophobicContact CD1-CE2 4.1Å; F48-Y52 HydrophobicContact CE1-CD2 4.03Å; F48-Y52 AromaticContact CE1-CE2 3.44Å; F48-Y52 HydrophobicContact CE1-CE2 3.44Å; F48-Y52 VanDerWaalsContact CE1-CE2 3.44Å; F48-Y52 HydrophobicContact CE2-CE2 4.23Å; F48-Y52 HydrophobicContact CZ-CD2 4.41Å; F48-Y52 AromaticContact CZ-CE2 3.54Å; F48-Y52 HydrophobicContact CZ-CE2 3.54Å; F48-Y52 PolarHBondContact O-N 3.15Å; Q49-Y52 PolarHBondContact O-N 2.89Å; Q49-Y52 VanDerWaalsContact O-N 3.11Å; Y52-K54 PolarHBondContact O-N 3.47Å; Y52-F55 PolarHBondContact O-N 2.65Å; Y52-F56 HydrophobicContact CD1-CD2 4.22Å; Y52-F56 HydrophobicContact CD1-CE2 4.18Å; Y52-F56 PolarHBondContact O-N 3.4Å; Y52-A61 HydrophobicContact CD1-CB 4.17Å; Y52-A61 HydrophobicContact CG-CB 4.39Å; Y52-F64 HydrophobicContact CD1-CD1 4.23Å; Y52-F64 AromaticContact CE1-CD1 3.58Å; Y52-F64 HydrophobicContact CE1-CD1 3.58Å; Y52-F64 AromaticContact CE1-CE1 3.7Å; Y52-F64 HydrophobicContact CE1-CE1 3.7Å; Y52-A65 HydrophobicContact CD1-CB 4.38Å; Y52-A65 HydrophobicContact CD2-CB 3.74Å; Y52-A65 HydrophobicContact CE2-CB 4.28Å; Y52-A65 HydrophobicContact CG-CB 3.8Å; Y52-M131 HydrophobicContact CD1-SD 4.16Å; Y52-M131 HydrophobicContact CE1-SD 4.29Å
53I85.6Confident87.7Confident67 Ų6771.4 Ų71.434%0.34435%0.345SS..Hα-helixtrans-58.9-35.3177.4-69.8166.5000111.4Q49 F55 F56 P57Q49-I53 WeakPolarHBondContact O-CG1 3.49Å; Q49-I53 PolarHBondContact O-N 3.02Å; I53-F55 VanDerWaalsContact C-N 3.31Å; I53-F55 PolarHBondContact O-N 3.22Å; I53-F56 CarbonylContact O-C 3.44Å; I53-P57 WeakPolarHBondContact O-CA 3.26Å
54K83.5Confident87.6Confident156 Ų15672.3 Ų72.368%0.67835%0.348SS*.Hα-helixtrans-65.5-33176.2-68.4170.2-174.8171.40112.7Q50 L51 Y52Q50-K54 WeakPolarHBondContact O-CG 3.44Å; Q50-K54 PolarHBondContact O-N 3.11Å; L51-K54 WeakPolarHBondContact O-CB 3.44Å; L51-K54 PolarHBondContact O-N 3.35Å; Y52-K54 PolarHBondContact O-N 3.47Å
55F79.2Confident87.5Confident159 Ų15969.9 Ų69.970%0.69734%0.336SS*.Hα-helixtrans-84.6-32.9179.1-68.5-68.5000113.1L51 Y52 I53 P57L51-F55 WeakPolarHBondContact O-CD2 3.43Å; Y52-F55 PolarHBondContact O-N 2.65Å; I53-F55 VanDerWaalsContact C-N 3.31Å; I53-F55 PolarHBondContact O-N 3.22Å; F55-P57 VanDerWaalsContact O-CD 3.26Å; F55-P57 WeakPolarHBondContact O-CD 3.45Å
56F78.7Confident87.5Confident44 Ų4472.5 Ų72.519%0.19335%0.347CS..  trans-120.160.5-178.7-59.9-83.8000111.5Y52 I53 Y58 G59 A61 M131 M189Y52-F56 HydrophobicContact CD1-CD2 4.22Å; Y52-F56 HydrophobicContact CD1-CE2 4.18Å; Y52-F56 PolarHBondContact O-N 3.4Å; I53-F56 CarbonylContact O-C 3.44Å; F56-Y58 PolarHBondContact O-N 2.96Å; F56-G59 PolarHBondContact O-N 3.49Å; F56-A61 HydrophobicContact CB-CB 4.34Å; F56-A61 HydrophobicContact CD2-CB 4.46Å; F56-M131 HydrophobicContact CB-CG 4.27Å; F56-M131 HydrophobicContact CD1-CG 3.96Å; F56-M131 HydrophobicContact CD2-CG 3.96Å; F56-M131 HydrophobicContact CD2-SD 3.98Å; F56-M131 HydrophobicContact CE1-CE 4.37Å; F56-M131 HydrophobicContact CE1-CG 4.29Å; F56-M131 HydrophobicContact CE1-SD 4.44Å; F56-M131 HydrophobicContact CE2-CE 4.45Å; F56-M131 HydrophobicContact CE2-CG 4.29Å; F56-M131 HydrophobicContact CE2-SD 3.8Å; F56-M131 HydrophobicContact CG-CG 3.79Å; F56-M131 HydrophobicContact CG-SD 4.38Å; F56-M131 HydrophobicContact CZ-CE 4.11Å; F56-M131 HydrophobicContact CZ-CG 4.44Å; F56-M131 HydrophobicContact CZ-SD 4.05Å; F56-M189 HydrophobicContact CE1-SD 4.05Å; F56-M189 HydrophobicContact CZ-SD 3.76Å
57P78.7Confident87.5Confident81 Ų8167.1 Ų67.153%0.52632%0.322SS..THydrogen-bonded Turntrans-66.8-13.4-171.927.6-36.4000114.2I53 F55I53-P57 WeakPolarHBondContact O-CA 3.26Å; F55-P57 VanDerWaalsContact O-CD 3.26Å; F55-P57 WeakPolarHBondContact O-CD 3.45Å
58Y81.4Confident87.6Confident219 Ų21963.5 Ų63.586%0.85931%0.305SS*.THydrogen-bonded Turntrans-107.1-1-177.6-56.6-67.7000113.9F56F56-Y58 PolarHBondContact O-N 2.96Å
59G83.7Confident87.7Confident28 Ų2863.8 Ų63.829%0.28931%0.306SS..SBendtrans-123-176.6175.100000111.8F56 M131F56-G59 PolarHBondContact O-N 3.49Å; G59-M131 WeakPolarHBondContact CA-O 3.04Å
60D88.9Confident87.8Confident73 Ų7365.7 Ų65.739%0.3931%0.311SS..  trans-111.894.5174.5177.910.7000109.4S62 K130 M131D60-S62 VanDerWaalsContact C-N 3.27Å; D60-S62 WeakPolarHBondContact OD1-CB 3.36Å; D60-S62 PolarHBondContact OD1-N 3.48Å; D60-S62 PolarHBondContact OD1-OG 3.22Å; D60-K130 HydrophobicContact CB-CB 4.4Å; D60-K130 PolarHBondContact N-O 2.85Å; D60-K130 CarbonylContact O-C 3.38Å; D60-M131 VanDerWaalsContact O-CA 3.29Å; D60-M131 WeakPolarHBondContact O-CA 3.44Å; D60-M131 PolarHBondContact O-N 3.42Å
61A89.3Confident88Confident2 Ų260.9 Ų60.92%0.01729%0.289CS..  trans-82.8-1.5179.200000113.3Y52 F56 K63 F64 A65 M131Y52-A61 HydrophobicContact CD1-CB 4.17Å; Y52-A61 HydrophobicContact CG-CB 4.39Å; F56-A61 HydrophobicContact CB-CB 4.34Å; F56-A61 HydrophobicContact CD2-CB 4.46Å; A61-K63 PolarHBondContact O-N 2.85Å; A61-F64 PolarHBondContact O-N 2.97Å; A61-A65 VanDerWaalsContact O-CB 3.25Å; A61-A65 WeakPolarHBondContact O-CB 3.32Å; A61-A65 PolarHBondContact O-N 3.28Å; A61-M131 HydrophobicContact CB-CB 4.32Å; A61-M131 HydrophobicContact CB-CG 3.7Å; A61-M131 HydrophobicContact CB-SD 4.2Å
62S92Very high88.4Confident37 Ų3759 Ų5926%0.25928%0.279SS..Hα-helixtrans-61-44.7-166.4-45.80000112.5Q49 D60 Q66Q49-S62 PolarHBondContact NE2-O 3.42Å; D60-S62 VanDerWaalsContact C-N 3.27Å; D60-S62 WeakPolarHBondContact OD1-CB 3.36Å; D60-S62 PolarHBondContact OD1-N 3.48Å; D60-S62 PolarHBondContact OD1-OG 3.22Å; S62-Q66 PolarHBondContact O-N 3.05Å
63K92.2Very high89Confident80 Ų8057.8 Ų57.835%0.34828%0.275SS..Hα-helixtrans-66.8-45.8176.2-77.1-162.7166.2-148.50112.3A61 A65 Q66 H67 A127A61-K63 PolarHBondContact O-N 2.85Å; K63-A65 VanDerWaalsContact C-N 3.32Å; K63-A65 PolarHBondContact O-N 2.89Å; K63-Q66 WeakPolarHBondContact O-CB 3.24Å; K63-Q66 PolarHBondContact O-N 3.29Å; K63-Q66 VanDerWaalsContact O-N 3.12Å; K63-H67 PolarHBondContact O-CD2 2.83Å; K63-H67 PolarHBondContact O-N 2.76Å; K63-H67 VanDerWaalsContact O-N 3.1Å; K63-A127 HydrophobicContact CB-CB 3.83Å
64F91.8Very high89.3Confident22 Ų2260.5 Ų60.510%0.09629%0.285CS..Hα-helixtrans-62.2-44179.4-177.1-92.1000111Y52 A61 Q66 H67 A68 M107 A127 I128 M131Y52-F64 HydrophobicContact CD1-CD1 4.23Å; Y52-F64 AromaticContact CE1-CD1 3.58Å; Y52-F64 HydrophobicContact CE1-CD1 3.58Å; Y52-F64 AromaticContact CE1-CE1 3.7Å; Y52-F64 HydrophobicContact CE1-CE1 3.7Å; A61-F64 PolarHBondContact O-N 2.97Å; F64-Q66 VanDerWaalsContact C-N 3.28Å; F64-Q66 PolarHBondContact O-N 3.05Å; F64-H67 PolarHBondContact O-N 2.87Å; F64-A68 HydrophobicContact CE1-CB 4.44Å; F64-A68 WeakPolarHBondContact O-CB 3.17Å; F64-A68 PolarHBondContact O-N 3.24Å; F64-M107 HydrophobicContact CE2-CE 4.5Å; F64-M107 HydrophobicContact CE2-SD 3.81Å; F64-M107 HydrophobicContact CZ-CE 4.09Å; F64-M107 HydrophobicContact CZ-SD 3.84Å; F64-A127 HydrophobicContact CB-CB 4.22Å; F64-I128 HydrophobicContact CD2-CG1 3.6Å; F64-I128 HydrophobicContact CE2-CD1 4.19Å; F64-I128 HydrophobicContact CE2-CG1 3.66Å; F64-M131 HydrophobicContact CB-CB 4.37Å; F64-M131 HydrophobicContact CB-SD 3.94Å; F64-M131 HydrophobicContact CD1-CE 4.02Å; F64-M131 HydrophobicContact CD1-SD 3.42Å; F64-M131 WeakPolarHBondContact CD1-SD 3.16Å; F64-M131 HydrophobicContact CD2-CE 4.39Å; F64-M131 HydrophobicContact CE1-CE 4.21Å; F64-M131 HydrophobicContact CE1-SD 4.06Å; F64-M131 HydrophobicContact CG-CE 4.11Å; F64-M131 HydrophobicContact CG-SD 3.69Å; F64-M131 HydrophobicContact CZ-CE 4.48Å
65A92.6Very high89.8Confident0 Ų057.5 Ų57.50%028%0.276CS..Hα-helixtrans-60-36.6174.400000112F48 Q49 Y52 A61 K63 A68 F69F48-A65 HydrophobicContact CD1-CB 4.2Å; F48-A65 WeakPolarHBondContact CD1-O 3.24Å; F48-A65 HydrophobicContact CE1-CB 4.4Å; F48-A65 VanDerWaalsContact CE1-O 3.27Å; F48-A65 WeakPolarHBondContact CE1-O 3.47Å; Q49-A65 HydrophobicContact CG-CB 3.81Å; Y52-A65 HydrophobicContact CD1-CB 4.38Å; Y52-A65 HydrophobicContact CD2-CB 3.74Å; Y52-A65 HydrophobicContact CE2-CB 4.28Å; Y52-A65 HydrophobicContact CG-CB 3.8Å; A61-A65 VanDerWaalsContact O-CB 3.25Å; A61-A65 WeakPolarHBondContact O-CB 3.32Å; A61-A65 PolarHBondContact O-N 3.28Å; K63-A65 VanDerWaalsContact C-N 3.32Å; K63-A65 PolarHBondContact O-N 2.89Å; A65-A68 PolarHBondContact O-N 3.35Å; A65-F69 VanDerWaalsContact O-CB 3.22Å; A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.14Å
66Q94.5Very high90.5Very high99 Ų9952.8 Ų52.846%0.46327%0.273SS..Hα-helixtrans-63.7-44.1174.2-175.1-179.914.200112.7L45 S62 K63 F64 F69 R70L45-Q66 HydrophobicContact CD1-CB 4.19Å; L45-Q66 HydrophobicContact CD1-CG 4.38Å; L45-Q66 HydrophobicContact CD2-CG 4.14Å; S62-Q66 PolarHBondContact O-N 3.05Å; K63-Q66 WeakPolarHBondContact O-CB 3.24Å; K63-Q66 PolarHBondContact O-N 3.29Å; K63-Q66 VanDerWaalsContact O-N 3.12Å; F64-Q66 VanDerWaalsContact C-N 3.28Å; F64-Q66 PolarHBondContact O-N 3.05Å; Q66-F69 WeakPolarHBondContact O-CB 3.22Å; Q66-F69 PolarHBondContact O-N 3.07Å; Q66-R70 PolarHBondContact O-N 3.04Å; Q66-R70 VanDerWaalsContact O-N 3.16Å
67H93.4Very high91.3Very high12 Ų1255.1 Ų55.16%0.05629%0.287CS..Hα-helixtrans-69.3-39.1176.8-61.1-62.3000112.2K63 F64 F69 R70 T71 E123 I124K63-H67 PolarHBondContact O-CD2 2.83Å; K63-H67 PolarHBondContact O-N 2.76Å; K63-H67 VanDerWaalsContact O-N 3.1Å; F64-H67 PolarHBondContact O-N 2.87Å; H67-F69 VanDerWaalsContact C-N 3.31Å; H67-F69 PolarHBondContact O-N 3.02Å; H67-R70 WeakPolarHBondContact O-CB 3.3Å; H67-R70 PolarHBondContact O-N 3.2Å; H67-T71 PolarHBondContact O-N 3.32Å; H67-E123 IonicContact CE1-OE1 3.91Å; H67-E123 PolarHBondContact CE1-OE1 3.24Å; H67-E123 IonicContact NE2-OE1 3.93Å; H67-I124 HydrophobicContact CB-CD1 3.64Å; H67-I124 WeakPolarHBondContact CD2-CD1 3.48Å
68A92.6Very high92.2Very high0 Ų053.1 Ų53.10%028%0.281CS..Hα-helixtrans-64-36.817300000112F48 F64 A65 R70 T71 F72 M107F48-A68 HydrophobicContact CE1-CB 3.97Å; F48-A68 HydrophobicContact CZ-CB 4.25Å; F64-A68 HydrophobicContact CE1-CB 4.44Å; F64-A68 WeakPolarHBondContact O-CB 3.17Å; F64-A68 PolarHBondContact O-N 3.24Å; A65-A68 PolarHBondContact O-N 3.35Å; A68-R70 PolarHBondContact O-N 2.78Å; A68-T71 PolarHBondContact O-N 2.99Å; A68-T71 PolarHBondContact O-OG1 2.89Å; A68-F72 WeakPolarHBondContact O-CD2 3.32Å; A68-F72 PolarHBondContact O-N 3.35Å; A68-M107 HydrophobicContact CB-CE 3.74Å
69F94.6Very high92.9Very high13 Ų1344.1 Ų44.16%0.05725%0.249CC..Hα-helixtrans-59.8-46.5175.1-172.3-81.8000111.1L45 F48 A65 Q66 H67 T71 F72 D73 G78 I80L45-F69 HydrophobicContact CB-CD2 4.3Å; L45-F69 HydrophobicContact CB-CE2 4.26Å; L45-F69 HydrophobicContact CB-CZ 4.42Å; L45-F69 HydrophobicContact CD1-CB 3.77Å; L45-F69 HydrophobicContact CD1-CD1 4.45Å; L45-F69 HydrophobicContact CD1-CD2 4.03Å; L45-F69 HydrophobicContact CD1-CG 3.83Å; F48-F69 HydrophobicContact CB-CD2 3.74Å; F48-F69 HydrophobicContact CB-CE2 4.19Å; F48-F69 HydrophobicContact CD1-CB 3.93Å; F48-F69 AromaticContact CD1-CD2 3.9Å; F48-F69 HydrophobicContact CD1-CD2 3.9Å; F48-F69 HydrophobicContact CD1-CG 4.44Å; F48-F69 HydrophobicContact CE1-CB 4.08Å; F48-F69 AromaticContact CG-CD2 3.84Å; F48-F69 HydrophobicContact CG-CD2 3.84Å; A65-F69 VanDerWaalsContact O-CB 3.22Å; A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.14Å; Q66-F69 WeakPolarHBondContact O-CB 3.22Å; Q66-F69 PolarHBondContact O-N 3.07Å; H67-F69 VanDerWaalsContact C-N 3.31Å; H67-F69 PolarHBondContact O-N 3.02Å; F69-T71 PolarHBondContact O-N 3.4Å; F69-F72 PolarHBondContact O-N 3.49Å; F69-D73 HydrophobicContact CD1-CB 4.18Å; F69-D73 HydrophobicContact CE1-CB 3.9Å; F69-D73 WeakPolarHBondContact O-CB 3.48Å; F69-D73 PolarHBondContact O-N 2.94Å; F69-G78 WeakPolarHBondContact CZ-O 3.5Å; F69-I80 HydrophobicContact CD2-CD1 3.34Å; F69-I80 HydrophobicContact CD2-CG1 4.01Å; F69-I80 HydrophobicContact CE1-CG1 4.38Å; F69-I80 HydrophobicContact CE2-CB 4.47Å; F69-I80 HydrophobicContact CE2-CD1 3.46Å; F69-I80 VanDerWaalsContact CE2-CD1 3.46Å; F69-I80 HydrophobicContact CE2-CG1 3.65Å; F69-I80 HydrophobicContact CG-CD1 3.94Å; F69-I80 HydrophobicContact CZ-CD1 4.14Å; F69-I80 HydrophobicContact CZ-CG1 3.87Å
70R94.4Very high93.5Very high81 Ų8142.8 Ų42.831%0.30624%0.236SC..Hα-helixtrans-56.3-36.8176.9-174.1-168.468.1-139.2-5.3112.8Q66 H67 A68 F72 E106 M107 D109 L110Q66-R70 PolarHBondContact O-N 3.04Å; Q66-R70 VanDerWaalsContact O-N 3.16Å; H67-R70 WeakPolarHBondContact O-CB 3.3Å; H67-R70 PolarHBondContact O-N 3.2Å; A68-R70 PolarHBondContact O-N 2.78Å; R70-F72 VanDerWaalsContact C-N 3.33Å; R70-E106 PolarHBondContact NH2-O 3.44Å; R70-M107 PolarHBondContact NH2-O 3.16Å; R70-D109 PolarHBondContact NH2-O 3.1Å; R70-D109 VanDerWaalsContact NH2-O 3.12Å; R70-L110 PolarHBondContact NH1-O 3.17Å
71T92.4Very high93.8Very high5 Ų542 Ų423%0.03123%0.231CC..Hα-helixtrans-79.6-18.2179.664.50000113.5H67 A68 F69 K74 W103 E106 M107H67-T71 PolarHBondContact O-N 3.32Å; A68-T71 PolarHBondContact O-N 2.99Å; A68-T71 PolarHBondContact O-OG1 2.89Å; F69-T71 PolarHBondContact O-N 3.4Å; T71-K74 WeakPolarHBondContact O-CE 3.36Å; T71-K74 PolarHBondContact O-NZ 3.19Å; T71-W103 PolarHBondContact OG1-NE1 2.87Å; T71-E106 HydrophobicContact CG2-CB 4.16Å; T71-E106 WeakPolarHBondContact CG2-O 3.34Å; T71-M107 HydrophobicContact CG2-CB 4.07Å
72F93.9Very high94Very high16 Ų1642.4 Ų42.47%0.0723%0.233CC..Hα-helixtrans-86.9-43.1175.8-82.9-132000111.6F48 A68 F69 R70 K74 I80 E84 F85 A88 W103F48-F72 HydrophobicContact CE2-CD1 4.3Å; F48-F72 HydrophobicContact CE2-CE1 4.4Å; F48-F72 HydrophobicContact CZ-CD1 4.48Å; A68-F72 WeakPolarHBondContact O-CD2 3.32Å; A68-F72 PolarHBondContact O-N 3.35Å; F69-F72 PolarHBondContact O-N 3.49Å; R70-F72 VanDerWaalsContact C-N 3.33Å; F72-K74 PolarHBondContact O-N 3.31Å; F72-I80 HydrophobicContact CB-CD1 3.43Å; F72-I80 VanDerWaalsContact CB-CD1 3.43Å; F72-I80 HydrophobicContact CB-CG1 3.88Å; F72-I80 HydrophobicContact CB-CG2 4.49Å; F72-I80 HydrophobicContact CD1-CD1 4.2Å; F72-I80 HydrophobicContact CG-CD1 4.18Å; F72-E84 WeakPolarHBondContact O-CB 3.26Å; F72-F85 HydrophobicContact CE1-CD2 4.4Å; F72-A88 HydrophobicContact CB-CB 4.38Å; F72-A88 HydrophobicContact CD1-CB 3.5Å; F72-A88 VanDerWaalsContact CD1-CB 3.5Å; F72-A88 HydrophobicContact CD2-CB 3.63Å; F72-A88 HydrophobicContact CE1-CB 3.5Å; F72-A88 HydrophobicContact CE2-CB 3.63Å; F72-A88 HydrophobicContact CG-CB 3.56Å; F72-A88 HydrophobicContact CZ-CB 3.57Å; F72-W103 HydrophobicContact CD2-CZ2 4.47Å; F72-W103 AromaticContact CE2-CZ2 3.8Å; F72-W103 HydrophobicContact CE2-CZ2 3.8Å
73D95.5Very high94.2Very high20 Ų2045.4 Ų45.411%0.10724%0.238CC..  trans-70.486.1175.1178.64.2000109.6F69 N75 G76 D77 G78 I80F69-D73 HydrophobicContact CD1-CB 4.18Å; F69-D73 HydrophobicContact CE1-CB 3.9Å; F69-D73 WeakPolarHBondContact O-CB 3.48Å; F69-D73 PolarHBondContact O-N 2.94Å; D73-N75 PolarHBondContact OD1-OD1 2.83Å; D73-G76 WeakPolarHBondContact OD1-CA 3.46Å; D73-G76 PolarHBondContact OD1-N 3.37Å; D73-D77 PolarHBondContact OD1-N 3.05Å; D73-D77 VanDerWaalsContact OD1-N 3.15Å; D73-D77 PolarHBondContact OD2-N 2.84Å; D73-G78 VanDerWaalsContact OD2-CA 3.3Å; D73-G78 WeakPolarHBondContact OD2-CA 2.8Å; D73-G78 PolarHBondContact OD2-N 2.84Å; D73-I80 HydrophobicContact CB-CG1 4.31Å
74K92.4Very high94.4Very high123 Ų12342.1 Ų42.154%0.53522%0.224SC..SBendtrans-79-24.7-174.1-71.6-55.8-172.2-174.80111.8T71 F72 E84 E106T71-K74 WeakPolarHBondContact O-CE 3.36Å; T71-K74 PolarHBondContact O-NZ 3.19Å; F72-K74 PolarHBondContact O-N 3.31Å; K74-E84 HydrophobicContact CB-CG 4.5Å; K74-E84 PolarHBondContact N-OE1 2.61Å; K74-E106 IonicContact NZ-OE1 2.86Å; K74-E106 PolarHBondContact NZ-OE1 3.24Å; K74-E106 IonicContact NZ-OE2 3.18Å; K74-E106 PolarHBondContact NZ-OE2 3.21Å
75N93.8Very high94.5Very high93 Ų9342.7 Ų42.750%0.49723%0.227SC..SBendtrans-91.4-13.4179.175.412.1000113.1D73 D77 E84D73-N75 PolarHBondContact OD1-OD1 2.83Å; N75-D77 PolarHBondContact ND2-OD2 2.81Å; N75-D77 WeakPolarHBondContact OD1-CB 3.33Å; N75-D77 PolarHBondContact OD1-N 2.89Å; N75-D77 PolarHBondContact OD1-OD1 3.39Å; N75-D77 PolarHBondContact OD1-OD2 3.14Å; N75-E84 PolarHBondContact N-OE1 2.89Å; N75-E84 VanDerWaalsContact N-OE1 3.13Å
76G93.9Very high94.6Very high61 Ų6142.7 Ų42.763%0.62923%0.227SC*.  trans73.723.617800000114D73 G78D73-G76 WeakPolarHBondContact OD1-CA 3.46Å; D73-G76 PolarHBondContact OD1-N 3.37Å; G76-G78 VanDerWaalsContact C-N 3.29Å
77D96.2Very high94.6Very high92 Ų9239.3 Ų39.349%0.49221%0.213SC..SBendtrans-84.9-2.2-176.177.517.4000113.8D73 N75 T79D73-D77 PolarHBondContact OD1-N 3.05Å; D73-D77 VanDerWaalsContact OD1-N 3.15Å; D73-D77 PolarHBondContact OD2-N 2.84Å; N75-D77 PolarHBondContact ND2-OD2 2.81Å; N75-D77 WeakPolarHBondContact OD1-CB 3.33Å; N75-D77 PolarHBondContact OD1-N 2.89Å; N75-D77 PolarHBondContact OD1-OD1 3.39Å; N75-D77 PolarHBondContact OD1-OD2 3.14Å; D77-T79 VanDerWaalsContact C-N 3.33Å; D77-T79 WeakPolarHBondContact OD1-CA 3.45Å; D77-T79 WeakPolarHBondContact OD1-CB 3.34Å; D77-T79 PolarHBondContact OD1-N 2.68Å; D77-T79 PolarHBondContact OD1-OG1 2.98Å
78G95.7Very high94.5Very high40 Ų4039.1 Ų39.141%0.41221%0.214SC..SBendtrans82.99.1-18000000113.6F69 D73 G76F69-G78 WeakPolarHBondContact CZ-O 3.5Å; D73-G78 VanDerWaalsContact OD2-CA 3.3Å; D73-G78 WeakPolarHBondContact OD2-CA 2.8Å; D73-G78 PolarHBondContact OD2-N 2.84Å; G76-G78 VanDerWaalsContact C-N 3.29Å
79T96.5Very high94.5Very high30 Ų3040.8 Ų40.818%0.18422%0.223CC..EExtended strand (participates in β ladder)trans-132.7156.717670.50000110.4I42 L43 D77I42-T79 HydrophobicContact CD1-CG2 4.24Å; L43-T79 WeakPolarHBondContact O-CA 3.32Å; D77-T79 VanDerWaalsContact C-N 3.33Å; D77-T79 WeakPolarHBondContact OD1-CA 3.45Å; D77-T79 WeakPolarHBondContact OD1-CB 3.34Å; D77-T79 PolarHBondContact OD1-N 2.68Å; D77-T79 PolarHBondContact OD1-OG1 2.98Å
80I96.2Very high94.5Very high0 Ų040.5 Ų40.50%022%0.222CC..EExtended strand (participates in β ladder)trans-110.9114.2172-65.4165.6000107.3L43 F48 F69 F72 D73 E84 F85L43-I80 HydrophobicContact CB-CB 4.35Å; L43-I80 PolarHBondContact N-O 3.02Å; L43-I80 PolarHBondContact O-N 2.9Å; F48-I80 HydrophobicContact CD2-CD1 4.08Å; F48-I80 HydrophobicContact CE2-CD1 4.14Å; F48-I80 HydrophobicContact CG-CD1 4.47Å; F69-I80 HydrophobicContact CD2-CD1 3.34Å; F69-I80 HydrophobicContact CD2-CG1 4.01Å; F69-I80 HydrophobicContact CE1-CG1 4.38Å; F69-I80 HydrophobicContact CE2-CB 4.47Å; F69-I80 HydrophobicContact CE2-CD1 3.46Å; F69-I80 VanDerWaalsContact CE2-CD1 3.46Å; F69-I80 HydrophobicContact CE2-CG1 3.65Å; F69-I80 HydrophobicContact CG-CD1 3.94Å; F69-I80 HydrophobicContact CZ-CD1 4.14Å; F69-I80 HydrophobicContact CZ-CG1 3.87Å; F72-I80 HydrophobicContact CB-CD1 3.43Å; F72-I80 VanDerWaalsContact CB-CD1 3.43Å; F72-I80 HydrophobicContact CB-CG1 3.88Å; F72-I80 HydrophobicContact CB-CG2 4.49Å; F72-I80 HydrophobicContact CD1-CD1 4.2Å; F72-I80 HydrophobicContact CG-CD1 4.18Å; D73-I80 HydrophobicContact CB-CG1 4.31Å; I80-E84 WeakPolarHBondContact CA-OE2 3.48Å; I80-E84 HydrophobicContact CG2-CB 3.9Å; I80-F85 HydrophobicContact CG2-CB 3.8Å
81D95.2Very high94.3Very high55 Ų5538.3 Ų38.329%0.29422%0.218SC..EExtended strand (participates in β ladder)trans-79.4174.4171.780.123000111.9I42 R83 E84 F85I42-D81 HydrophobicContact CG2-CB 4.49Å; D81-R83 VanDerWaalsContact C-N 3.27Å; D81-R83 PolarHBondContact O-N 3.45Å; D81-R83 VanDerWaalsContact OD1-CA 3.3Å; D81-R83 WeakPolarHBondContact OD1-CA 3.25Å; D81-R83 VanDerWaalsContact OD1-CB 3.25Å; D81-R83 WeakPolarHBondContact OD1-CB 3.42Å; D81-R83 PolarHBondContact OD1-N 3.21Å; D81-E84 PolarHBondContact N-OE2 3.38Å; D81-E84 PolarHBondContact O-N 3.26Å; D81-E84 PolarHBondContact OD1-N 2.97Å; D81-F85 WeakPolarHBondContact O-CB 3.39Å; D81-F85 PolarHBondContact O-N 3.39Å
82F95Very high94.1Very high12 Ų1240.2 Ų40.25%0.05323%0.229CC..Hα-helixtrans-62.1-35-179.9179.6-110000113.4L8 L16 W30 Y31 F34 F85 I86L8-F82 HydrophobicContact CD1-CE1 3.95Å; L8-F82 HydrophobicContact CD2-CD1 3.89Å; L8-F82 HydrophobicContact CD2-CE1 4.04Å; L16-F82 HydrophobicContact CD1-CD1 4Å; L16-F82 HydrophobicContact CD1-CE1 3.68Å; W30-F82 HydrophobicContact CB-CE2 3.99Å; W30-F82 HydrophobicContact CB-CZ 3.96Å; Y31-F82 VanDerWaalsContact CA-CE2 3.41Å; Y31-F82 VanDerWaalsContact CA-CZ 3.48Å; Y31-F82 HydrophobicContact CD2-CB 4.08Å; Y31-F82 AromaticContact CD2-CD1 3.43Å; Y31-F82 HydrophobicContact CD2-CD1 3.43Å; Y31-F82 VanDerWaalsContact CD2-CD1 3.43Å; Y31-F82 AromaticContact CD2-CD2 3.84Å; Y31-F82 HydrophobicContact CD2-CD2 3.84Å; Y31-F82 AromaticContact CD2-CE1 3.73Å; Y31-F82 HydrophobicContact CD2-CE1 3.73Å; Y31-F82 HydrophobicContact CD2-CE2 4.12Å; Y31-F82 AromaticContact CD2-CG 3.48Å; Y31-F82 HydrophobicContact CD2-CG 3.48Å; Y31-F82 VanDerWaalsContact CD2-CG 3.48Å; Y31-F82 HydrophobicContact CD2-CZ 4.06Å; Y31-F82 HydrophobicContact CE2-CB 4.13Å; Y31-F82 HydrophobicContact CE2-CD1 4.06Å; Y31-F82 HydrophobicContact CE2-CG 4.02Å; Y31-F82 HydrophobicContact CG-CD1 4.33Å; Y31-F82 HydrophobicContact CG-CE1 4.19Å; Y31-F82 HydrophobicContact CG-CZ 4.34Å; Y31-F82 VanDerWaalsContact N-CZ 3.34Å; F34-F82 HydrophobicContact CB-CD2 3.67Å; F34-F82 HydrophobicContact CB-CE2 3.98Å; F34-F82 HydrophobicContact CD1-CB 4.09Å; F34-F82 AromaticContact CD1-CD2 3.96Å; F34-F82 HydrophobicContact CD1-CD2 3.96Å; F34-F82 HydrophobicContact CD1-CG 4.47Å; F34-F82 HydrophobicContact CD2-CD2 4.04Å; F34-F82 HydrophobicContact CE1-CB 4.11Å; F34-F82 AromaticContact CG-CD2 3.63Å; F34-F82 HydrophobicContact CG-CD2 3.63Å; F34-F82 HydrophobicContact CG-CE2 4.37Å; F82-F85 HydrophobicContact CD2-CD1 4.4Å; F82-F85 HydrophobicContact CE2-CD1 4.44Å; F82-I86 HydrophobicContact CE1-CB 4.48Å; F82-I86 HydrophobicContact CE1-CG2 4.3Å; F82-I86 HydrophobicContact CE2-CB 4.4Å; F82-I86 HydrophobicContact CZ-CB 4.22Å; F82-I86 HydrophobicContact CZ-CG1 4.29Å; F82-I86 WeakPolarHBondContact O-CB 3.25Å; F82-I86 VanDerWaalsContact O-CG2 3.26Å; F82-I86 WeakPolarHBondContact O-CG2 3.38Å; F82-I86 PolarHBondContact O-N 3.18Å
83R95.3Very high93.8Very high99 Ų9942.1 Ų42.137%0.37425%0.245SC..Hα-helixtrans-67.4-47.2-179.6178.4178.7-164.9-73-3.4109.9D15 L16 D81 I86 C87D15-R83 IonicContact OD1-NH2 3.49Å; D15-R83 PolarHBondContact OD1-NH2 2.97Å; D15-R83 IonicContact OD2-CZ 2.82Å; D15-R83 IonicContact OD2-NE 3.59Å; D15-R83 PolarHBondContact OD2-NE 2.85Å; D15-R83 IonicContact OD2-NH2 3.17Å; D15-R83 PolarHBondContact OD2-NH2 3.32Å; D15-R83 VanDerWaalsContact OD2-NH2 3.11Å; L16-R83 HydrophobicContact CD2-CB 4.15Å; L16-R83 HydrophobicContact CD2-CG 3.76Å; D81-R83 VanDerWaalsContact C-N 3.27Å; D81-R83 PolarHBondContact O-N 3.45Å; D81-R83 VanDerWaalsContact OD1-CA 3.3Å; D81-R83 WeakPolarHBondContact OD1-CA 3.25Å; D81-R83 VanDerWaalsContact OD1-CB 3.25Å; D81-R83 WeakPolarHBondContact OD1-CB 3.42Å; D81-R83 PolarHBondContact OD1-N 3.21Å; R83-I86 WeakPolarHBondContact O-CG2 3.48Å; R83-I86 PolarHBondContact O-N 3.13Å; R83-C87 VanDerWaalsContact O-CB 3.26Å; R83-C87 WeakPolarHBondContact O-CB 3.33Å; R83-C87 PolarHBondContact O-N 2.82Å; R83-C87 PolarHBondContact O-SG 3.06Å
84E96.1Very high93.6Very high12 Ų1246.3 Ų46.36%0.05626%0.259CS..Hα-helixtrans-59.4-49175.6-73.6176.5139.300111.7F72 K74 N75 I80 D81 I86 C87 A88F72-E84 WeakPolarHBondContact O-CB 3.26Å; K74-E84 HydrophobicContact CB-CG 4.5Å; K74-E84 PolarHBondContact N-OE1 2.61Å; N75-E84 PolarHBondContact N-OE1 2.89Å; N75-E84 VanDerWaalsContact N-OE1 3.13Å; I80-E84 WeakPolarHBondContact CA-OE2 3.48Å; I80-E84 HydrophobicContact CG2-CB 3.9Å; D81-E84 PolarHBondContact N-OE2 3.38Å; D81-E84 PolarHBondContact O-N 3.26Å; D81-E84 PolarHBondContact OD1-N 2.97Å; E84-I86 PolarHBondContact O-N 3.49Å; E84-C87 PolarHBondContact O-N 3.47Å; E84-A88 VanDerWaalsContact O-CB 3.32Å; E84-A88 WeakPolarHBondContact O-CB 3.39Å; E84-A88 PolarHBondContact O-N 2.99Å
85F94.2Very high93.4Very high34 Ų3440.8 Ų40.815%0.14924%0.237CC..Hα-helixtrans-55.7-50.7176.4172-102.4000112.2W30 F34 F72 I80 D81 F82 L89W30-F85 AromaticContact CE3-CE1 3.94Å; W30-F85 HydrophobicContact CE3-CE1 3.94Å; W30-F85 HydrophobicContact CE3-CZ 4.32Å; W30-F85 HydrophobicContact CZ3-CE1 4.23Å; W30-F85 HydrophobicContact CZ3-CZ 4.14Å; F34-F85 HydrophobicContact CD2-CB 4.4Å; F34-F85 AromaticContact CD2-CD1 3.81Å; F34-F85 HydrophobicContact CD2-CD1 3.81Å; F34-F85 HydrophobicContact CD2-CE1 4.27Å; F34-F85 HydrophobicContact CD2-CG 4.03Å; F34-F85 HydrophobicContact CE2-CB 3.89Å; F34-F85 HydrophobicContact CE2-CD1 4.15Å; F34-F85 HydrophobicContact CE2-CD2 4.43Å; F34-F85 AromaticContact CE2-CG 3.89Å; F34-F85 HydrophobicContact CE2-CG 3.89Å; F72-F85 HydrophobicContact CE1-CD2 4.4Å; I80-F85 HydrophobicContact CG2-CB 3.8Å; D81-F85 WeakPolarHBondContact O-CB 3.39Å; D81-F85 PolarHBondContact O-N 3.39Å; F82-F85 HydrophobicContact CD2-CD1 4.4Å; F82-F85 HydrophobicContact CE2-CD1 4.44Å; F85-L89 HydrophobicContact CE1-CD2 4.13Å; F85-L89 HydrophobicContact CZ-CD2 4.08Å; F85-L89 VanDerWaalsContact O-CB 3.24Å; F85-L89 WeakPolarHBondContact O-CB 3.46Å; F85-L89 PolarHBondContact O-N 2.8Å
86I94.8Very high93.2Very high0 Ų039.1 Ų39.10%023%0.233CC..Hα-helixtrans-75.3-32.8-173.3-160.459.7000112.5L16 T20 F22 L27 W30 F82 R83 E84 L89 S90L16-I86 HydrophobicContact CD1-CG2 4.3Å; L16-I86 HydrophobicContact CD2-CG2 3.58Å; L16-I86 HydrophobicContact CG-CG2 4.49Å; T20-I86 HydrophobicContact CG2-CG2 4.28Å; F22-I86 HydrophobicContact CD2-CD1 3.67Å; F22-I86 HydrophobicContact CD2-CG1 3.83Å; F22-I86 HydrophobicContact CE2-CD1 3.53Å; F22-I86 HydrophobicContact CE2-CG1 4.05Å; F22-I86 HydrophobicContact CG-CD1 4.4Å; F22-I86 HydrophobicContact CZ-CD1 4.18Å; L27-I86 HydrophobicContact CD2-CD1 4.41Å; L27-I86 HydrophobicContact CD2-CG1 3.6Å; L27-I86 HydrophobicContact CD2-CG2 4.49Å; W30-I86 HydrophobicContact CB-CD1 3.96Å; W30-I86 HydrophobicContact CD2-CD1 4.3Å; W30-I86 HydrophobicContact CG-CD1 3.76Å; F82-I86 HydrophobicContact CE1-CB 4.48Å; F82-I86 HydrophobicContact CE1-CG2 4.3Å; F82-I86 HydrophobicContact CE2-CB 4.4Å; F82-I86 HydrophobicContact CZ-CB 4.22Å; F82-I86 HydrophobicContact CZ-CG1 4.29Å; F82-I86 WeakPolarHBondContact O-CB 3.25Å; F82-I86 VanDerWaalsContact O-CG2 3.26Å; F82-I86 WeakPolarHBondContact O-CG2 3.38Å; F82-I86 PolarHBondContact O-N 3.18Å; R83-I86 WeakPolarHBondContact O-CG2 3.48Å; R83-I86 PolarHBondContact O-N 3.13Å; E84-I86 PolarHBondContact O-N 3.49Å; I86-L89 HydrophobicContact CD1-CD2 4.14Å; I86-S90 VanDerWaalsContact O-CB 3.25Å; I86-S90 WeakPolarHBondContact O-CB 3.48Å; I86-S90 PolarHBondContact O-N 3.23Å
87C94.5Very high92.8Very high27 Ų2741.5 Ų41.518%0.18223%0.226CC..Hα-helixtrans-65.6-47.7172.6-75.60000111.2R83 E84 L89 S90 V91R83-C87 VanDerWaalsContact O-CB 3.26Å; R83-C87 WeakPolarHBondContact O-CB 3.33Å; R83-C87 PolarHBondContact O-N 2.82Å; R83-C87 PolarHBondContact O-SG 3.06Å; E84-C87 PolarHBondContact O-N 3.47Å; C87-L89 PolarHBondContact O-N 3.17Å; C87-S90 WeakPolarHBondContact O-CB 3.25Å; C87-S90 PolarHBondContact O-N 3.12Å; C87-V91 WeakPolarHBondContact O-CG2 3.46Å; C87-V91 PolarHBondContact O-N 3.36Å
88A92.2Very high92.5Very high8 Ų841.7 Ų41.77%0.06622%0.224CC..Hα-helixtrans-64.5-40.3176.900000111.9F72 E84 S90 V91 T92F72-A88 HydrophobicContact CB-CB 4.38Å; F72-A88 HydrophobicContact CD1-CB 3.5Å; F72-A88 VanDerWaalsContact CD1-CB 3.5Å; F72-A88 HydrophobicContact CD2-CB 3.63Å; F72-A88 HydrophobicContact CE1-CB 3.5Å; F72-A88 HydrophobicContact CE2-CB 3.63Å; F72-A88 HydrophobicContact CG-CB 3.56Å; F72-A88 HydrophobicContact CZ-CB 3.57Å; E84-A88 VanDerWaalsContact O-CB 3.32Å; E84-A88 WeakPolarHBondContact O-CB 3.39Å; E84-A88 PolarHBondContact O-N 2.99Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3Å; A88-V91 PolarHBondContact O-N 2.8Å; A88-T92 WeakPolarHBondContact O-CB 3.43Å; A88-T92 WeakPolarHBondContact O-CG2 3.35Å; A88-T92 PolarHBondContact O-N 2.89Å; A88-T92 PolarHBondContact O-OG1 3.21Å
89L92.1Very high92.3Very high36 Ų3643.6 Ų43.619%0.18822%0.222CC..Hα-helixtrans-62.7-40.4173.6-176.262.5000111.7F22 W30 F85 I86 C87 T92 S93F22-L89 HydrophobicContact CE2-CD2 4.47Å; F22-L89 HydrophobicContact CE2-CG 4.35Å; F22-L89 HydrophobicContact CZ-CD2 4.06Å; F22-L89 HydrophobicContact CZ-CG 4.05Å; W30-L89 HydrophobicContact CD2-CD2 4.18Å; W30-L89 HydrophobicContact CE3-CD2 4.28Å; W30-L89 HydrophobicContact CH2-CD2 3.73Å; W30-L89 HydrophobicContact CZ2-CD2 3.6Å; W30-L89 HydrophobicContact CZ3-CD2 4.07Å; F85-L89 HydrophobicContact CE1-CD2 4.13Å; F85-L89 HydrophobicContact CZ-CD2 4.08Å; F85-L89 VanDerWaalsContact O-CB 3.24Å; F85-L89 WeakPolarHBondContact O-CB 3.46Å; F85-L89 PolarHBondContact O-N 2.8Å; I86-L89 HydrophobicContact CD1-CD2 4.14Å; C87-L89 PolarHBondContact O-N 3.17Å; L89-T92 WeakPolarHBondContact CA-OG1 3.16Å; L89-T92 PolarHBondContact O-N 3.1Å; L89-T92 PolarHBondContact O-OG1 3.12Å; L89-S93 VanDerWaalsContact O-CB 3.25Å; L89-S93 WeakPolarHBondContact O-CB 3.36Å; L89-S93 PolarHBondContact O-N 3.49Å; L89-S93 PolarHBondContact O-OG 3.48Å
90S93.9Very high91.9Very high6 Ų645.7 Ų45.74%0.04223%0.229CC..Hα-helixtrans-59.5-48.7176.6-178.50000111T20 E21 I86 C87 A88 R94 G95T20-S90 WeakPolarHBondContact CA-OG 3.37Å; E21-S90 PolarHBondContact N-OG 3.02Å; I86-S90 VanDerWaalsContact O-CB 3.25Å; I86-S90 WeakPolarHBondContact O-CB 3.48Å; I86-S90 PolarHBondContact O-N 3.23Å; C87-S90 WeakPolarHBondContact O-CB 3.25Å; C87-S90 PolarHBondContact O-N 3.12Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3Å; S90-R94 CarbonylContact O-C 3.44Å; S90-R94 WeakPolarHBondContact O-CA 3.46Å; S90-R94 PolarHBondContact O-N 3.33Å; S90-G95 PolarHBondContact O-N 3.49Å
91V90.6Very high91.6Very high35 Ų3546.1 Ų46.121%0.21223%0.231CC..Hα-helixtrans-61.5-51.1178.21710000111.4C87 A88 S93 G95 Q99 K100 W103C87-V91 WeakPolarHBondContact O-CG2 3.46Å; C87-V91 PolarHBondContact O-N 3.36Å; A88-V91 PolarHBondContact O-N 2.8Å; V91-S93 PolarHBondContact O-N 3.49Å; V91-G95 VanDerWaalsContact O-CA 3.31Å; V91-G95 WeakPolarHBondContact O-CA 3.44Å; V91-G95 PolarHBondContact O-N 3.32Å; V91-G95 VanDerWaalsContact O-N 3.1Å; V91-Q99 HydrophobicContact CG1-CB 4.19Å; V91-K100 WeakPolarHBondContact O-CE 3.34Å; V91-K100 WeakPolarHBondContact O-CG 3.38Å; V91-W103 HydrophobicContact CG1-CB 3.78Å; V91-W103 HydrophobicContact CG1-CG 4.23Å
92T87.1Confident91.5Very high45 Ų4545.8 Ų45.828%0.27623%0.229SC..Hα-helixtrans-70.4-33.1-174.352.80000113.1A88 L89 K100 W103A88-T92 WeakPolarHBondContact O-CB 3.43Å; A88-T92 WeakPolarHBondContact O-CG2 3.35Å; A88-T92 PolarHBondContact O-N 2.89Å; A88-T92 PolarHBondContact O-OG1 3.21Å; L89-T92 WeakPolarHBondContact CA-OG1 3.16Å; L89-T92 PolarHBondContact O-N 3.1Å; L89-T92 PolarHBondContact O-OG1 3.12Å; T92-K100 VanDerWaalsContact O-CE 3.29Å; T92-K100 WeakPolarHBondContact O-CE 3.42Å; T92-W103 HydrophobicContact CG2-CD2 3.6Å; T92-W103 HydrophobicContact CG2-CE3 3.77Å; T92-W103 HydrophobicContact CG2-CG 4.26Å; T92-W103 HydrophobicContact CG2-CH2 3.86Å; T92-W103 HydrophobicContact CG2-CZ2 3.74Å; T92-W103 HydrophobicContact CG2-CZ3 3.89Å
93S88.5Confident91.3Very high57 Ų5747.4 Ų47.440%0.39924%0.235SC..Hα-helixtrans-92.1-49.2-179.767.60000113.5L89 V91 K100L89-S93 VanDerWaalsContact O-CB 3.25Å; L89-S93 WeakPolarHBondContact O-CB 3.36Å; L89-S93 PolarHBondContact O-N 3.49Å; L89-S93 PolarHBondContact O-OG 3.48Å; V91-S93 PolarHBondContact O-N 3.49Å; S93-K100 PolarHBondContact O-NZ 3.05Å
94R90.8Very high91.1Very high107 Ų10743.7 Ų43.740%0.40423%0.225SC..Hα-helixtrans-115.8-8.9-168.9-65.4178.8-174.6-166.1-0.2114.4E21 E26 S90E21-R94 HydrophobicContact CB-CB 3.62Å; E21-R94 HydrophobicContact CB-CG 4.37Å; E21-R94 HydrophobicContact CG-CB 4.06Å; E21-R94 VanDerWaalsContact O-CD 3.32Å; E21-R94 WeakPolarHBondContact O-CD 3.49Å; E21-R94 PolarHBondContact O-NH1 3.37Å; E26-R94 IonicContact OE1-CZ 3.11Å; E26-R94 IonicContact OE1-NH1 2.65Å; E26-R94 PolarHBondContact OE1-NH1 3.03Å; E26-R94 VanDerWaalsContact OE1-NH1 3.14Å; E26-R94 IonicContact OE1-NH2 2.58Å; E26-R94 PolarHBondContact OE1-NH2 3.05Å; E26-R94 IonicContact OE2-CZ 3.35Å; E26-R94 IonicContact OE2-NH1 3.47Å; E26-R94 PolarHBondContact OE2-NH1 3.44Å; E26-R94 IonicContact OE2-NH2 2.73Å; S90-R94 CarbonylContact O-C 3.44Å; S90-R94 WeakPolarHBondContact O-CA 3.46Å; S90-R94 PolarHBondContact O-N 3.33Å
95G88Confident91Very high7 Ų743.6 Ų43.67%0.07223%0.225CC..  trans-59.6153.7179.800000113S90 V91 K100S90-G95 PolarHBondContact O-N 3.49Å; V91-G95 VanDerWaalsContact O-CA 3.31Å; V91-G95 WeakPolarHBondContact O-CA 3.44Å; V91-G95 PolarHBondContact O-N 3.32Å; V91-G95 VanDerWaalsContact O-N 3.1Å; G95-K100 WeakPolarHBondContact O-CE 3.4Å; G95-K100 PolarHBondContact O-NZ 3.28Å
96S90Very high90.9Very high59 Ų5945.8 Ų45.841%0.41324%0.235SC..  trans-57.6162.8169.265.50000111.6E98 Q99 K100S96-E98 PolarHBondContact O-N 3.12Å; S96-Q99 PolarHBondContact O-N 3.43Å; S96-Q99 WeakPolarHBondContact OG-CG 3.44Å; S96-Q99 PolarHBondContact OG-N 3.11Å; S96-Q99 PolarHBondContact OG-OE1 3.32Å; S96-K100 WeakPolarHBondContact O-CG 3.25Å; S96-K100 PolarHBondContact O-N 3.4Å
97F86.8Confident90.8Very high110 Ų11046.2 Ų46.248%0.48224%0.238SC..Hα-helixtrans-53.7-42.9175.7-178.9-108000112.1K100 L101 A175 K176 V182F97-K100 PolarHBondContact O-N 2.96Å; F97-L101 HydrophobicContact CD1-CD1 3.88Å; F97-L101 HydrophobicContact CD1-CG 4.47Å; F97-L101 HydrophobicContact CE1-CD1 3.36Å; F97-L101 HydrophobicContact CE1-CG 4.15Å; F97-L101 HydrophobicContact CE2-CD1 4.48Å; F97-L101 HydrophobicContact CE2-CG 4.49Å; F97-L101 HydrophobicContact CZ-CD1 3.71Å; F97-L101 HydrophobicContact CZ-CD2 4.34Å; F97-L101 HydrophobicContact CZ-CG 4.16Å; F97-L101 WeakPolarHBondContact O-CG 3.27Å; F97-L101 PolarHBondContact O-N 3.27Å; F97-A175 HydrophobicContact CZ-CB 4.45Å; F97-K176 HydrophobicContact CE1-CG 4.18Å; F97-V182 HydrophobicContact CE2-CG2 4.29Å; F97-V182 HydrophobicContact CZ-CG2 4.26Å
98E89.6Confident90.8Very high96 Ų9645.2 Ų45.245%0.44923%0.23SC..Hα-helixtrans-67.2-42.9179.2-178.9165.6-166.100112.9S96 K100 L101 N102 K172S96-E98 PolarHBondContact O-N 3.12Å; E98-K100 VanDerWaalsContact C-N 3.26Å; E98-K100 PolarHBondContact O-N 2.82Å; E98-L101 PolarHBondContact O-N 2.91Å; E98-N102 VanDerWaalsContact O-CG 3.31Å; E98-N102 PolarHBondContact O-N 2.93Å; E98-N102 PolarHBondContact O-ND2 3.45Å; E98-K172 IonicContact OE1-NZ 3.37Å; E98-K172 PolarHBondContact OE1-NZ 3.01Å
99Q90.4Very high90.9Very high80 Ų8045.5 Ų45.537%0.37423%0.23SC..Hα-helixtrans-59.8-39.5175.3-74.6165.8-54.100111.6V91 S96 N102 W103V91-Q99 HydrophobicContact CG1-CB 4.19Å; S96-Q99 PolarHBondContact O-N 3.43Å; S96-Q99 WeakPolarHBondContact OG-CG 3.44Å; S96-Q99 PolarHBondContact OG-N 3.11Å; S96-Q99 PolarHBondContact OG-OE1 3.32Å; Q99-N102 PolarHBondContact O-N 3.49Å; Q99-W103 PolarHBondContact O-N 2.98Å
100K88.9Confident91.1Very high75 Ų7545.4 Ų45.433%0.32623%0.23SC..Hα-helixtrans-67.3-38.4176.8-71.6174.7176175.40112.4V91 T92 S93 G95 S96 F97 E98 A104V91-K100 WeakPolarHBondContact O-CE 3.34Å; V91-K100 WeakPolarHBondContact O-CG 3.38Å; T92-K100 VanDerWaalsContact O-CE 3.29Å; T92-K100 WeakPolarHBondContact O-CE 3.42Å; S93-K100 PolarHBondContact O-NZ 3.05Å; G95-K100 WeakPolarHBondContact O-CE 3.4Å; G95-K100 PolarHBondContact O-NZ 3.28Å; S96-K100 WeakPolarHBondContact O-CG 3.25Å; S96-K100 PolarHBondContact O-N 3.4Å; F97-K100 PolarHBondContact O-N 2.96Å; E98-K100 VanDerWaalsContact C-N 3.26Å; E98-K100 PolarHBondContact O-N 2.82Å; K100-A104 WeakPolarHBondContact O-CB 3.42Å; K100-A104 PolarHBondContact O-N 3.29Å
101L90Very high91.1Very high9 Ų950.5 Ų50.55%0.04726%0.257CS..Hα-helixtrans-66.6-42.3174.3-72179.5000112.3F97 E98 A104 F105 F171 K172 A175 V182F97-L101 HydrophobicContact CD1-CD1 3.88Å; F97-L101 HydrophobicContact CD1-CG 4.47Å; F97-L101 HydrophobicContact CE1-CD1 3.36Å; F97-L101 HydrophobicContact CE1-CG 4.15Å; F97-L101 HydrophobicContact CE2-CD1 4.48Å; F97-L101 HydrophobicContact CE2-CG 4.49Å; F97-L101 HydrophobicContact CZ-CD1 3.71Å; F97-L101 HydrophobicContact CZ-CD2 4.34Å; F97-L101 HydrophobicContact CZ-CG 4.16Å; F97-L101 WeakPolarHBondContact O-CG 3.27Å; F97-L101 PolarHBondContact O-N 3.27Å; E98-L101 PolarHBondContact O-N 2.91Å; L101-A104 PolarHBondContact O-N 3.35Å; L101-F105 WeakPolarHBondContact O-CB 3.37Å; L101-F105 PolarHBondContact O-N 3.24Å; L101-F171 HydrophobicContact CB-CE1 4.44Å; L101-F171 HydrophobicContact CD2-CD1 4.49Å; L101-F171 HydrophobicContact CD2-CE1 3.94Å; L101-K172 HydrophobicContact CD1-CG 4.37Å; L101-A175 HydrophobicContact CD1-CB 3.77Å; L101-A175 HydrophobicContact CD2-CB 3.57Å; L101-A175 HydrophobicContact CG-CB 4.34Å; L101-V182 HydrophobicContact CD2-CG2 4.5Å
102N92.4Very high91.3Very high47 Ų4751.6 Ų51.625%0.25128%0.276SS..Hα-helixtrans-59.8-47.7175.5-68-25.5000110.9E98 Q99 A104 F105 E106 K172E98-N102 VanDerWaalsContact O-CG 3.31Å; E98-N102 PolarHBondContact O-N 2.93Å; E98-N102 PolarHBondContact O-ND2 3.45Å; Q99-N102 PolarHBondContact O-N 3.49Å; N102-A104 VanDerWaalsContact C-N 3.34Å; N102-A104 PolarHBondContact O-N 2.91Å; N102-F105 WeakPolarHBondContact O-CB 3.39Å; N102-F105 PolarHBondContact O-N 3.22Å; N102-E106 WeakPolarHBondContact O-CG 3.29Å; N102-E106 PolarHBondContact O-N 3.02Å; N102-K172 WeakPolarHBondContact OD1-CE 3.29Å; N102-K172 PolarHBondContact OD1-NZ 2.69Å
103W91.3Very high91.7Very high47 Ų4753.6 Ų53.618%0.17829%0.285CS..Hα-helixtrans-64.4-38177.7179.381.6000112.6T71 F72 V91 T92 Q99 F105 E106 M107T71-W103 PolarHBondContact OG1-NE1 2.87Å; F72-W103 HydrophobicContact CD2-CZ2 4.47Å; F72-W103 AromaticContact CE2-CZ2 3.8Å; F72-W103 HydrophobicContact CE2-CZ2 3.8Å; V91-W103 HydrophobicContact CG1-CB 3.78Å; V91-W103 HydrophobicContact CG1-CG 4.23Å; T92-W103 HydrophobicContact CG2-CD2 3.6Å; T92-W103 HydrophobicContact CG2-CE3 3.77Å; T92-W103 HydrophobicContact CG2-CG 4.26Å; T92-W103 HydrophobicContact CG2-CH2 3.86Å; T92-W103 HydrophobicContact CG2-CZ2 3.74Å; T92-W103 HydrophobicContact CG2-CZ3 3.89Å; Q99-W103 PolarHBondContact O-N 2.98Å; W103-F105 VanDerWaalsContact C-N 3.33Å; W103-E106 PolarHBondContact O-N 3.23Å; W103-M107 HydrophobicContact CH2-CE 3.22Å; W103-M107 HydrophobicContact CH2-SD 4.08Å; W103-M107 HydrophobicContact CZ2-CE 3.43Å; W103-M107 VanDerWaalsContact CZ2-CE 3.43Å; W103-M107 HydrophobicContact CZ3-CE 4.05Å; W103-M107 HydrophobicContact CZ3-SD 4.38Å; W103-M107 PolarHBondContact O-N 2.92Å; W103-M107 VanDerWaalsContact O-N 3.13Å
104A90.9Very high92.1Very high20 Ų2052.6 Ų52.617%0.16528%0.283CS..Hα-helixtrans-62.9-41.4173.800000111.2K100 L101 N102 M107 Y108 F171K100-A104 WeakPolarHBondContact O-CB 3.42Å; K100-A104 PolarHBondContact O-N 3.29Å; L101-A104 PolarHBondContact O-N 3.35Å; N102-A104 VanDerWaalsContact C-N 3.34Å; N102-A104 PolarHBondContact O-N 2.91Å; A104-M107 WeakPolarHBondContact O-CB 3.49Å; A104-M107 PolarHBondContact O-N 3.2Å; A104-M107 VanDerWaalsContact O-N 3.14Å; A104-Y108 VanDerWaalsContact O-CD2 3.25Å; A104-Y108 WeakPolarHBondContact O-CD2 3.44Å; A104-Y108 PolarHBondContact O-N 3.01Å; A104-F171 HydrophobicContact CB-CE1 4.27Å; A104-F171 HydrophobicContact CB-CZ 4.15Å
105F93.1Very high92.4Very high10 Ų1051.7 Ų51.74%0.04428%0.28CS..Hα-helixtrans-59-48.9175.1-173-85.4000111.5L101 N102 W103 M107 Y108 D109 G114 I116 I166 T167 L168 F171L101-F105 WeakPolarHBondContact O-CB 3.37Å; L101-F105 PolarHBondContact O-N 3.24Å; N102-F105 WeakPolarHBondContact O-CB 3.39Å; N102-F105 PolarHBondContact O-N 3.22Å; W103-F105 VanDerWaalsContact C-N 3.33Å; F105-M107 PolarHBondContact O-N 3.36Å; F105-M107 VanDerWaalsContact O-N 3.14Å; F105-Y108 PolarHBondContact O-N 3.35Å; F105-D109 HydrophobicContact CD1-CB 4.13Å; F105-D109 HydrophobicContact CE1-CB 3.81Å; F105-D109 HydrophobicContact CZ-CB 4.48Å; F105-D109 WeakPolarHBondContact O-CB 3.13Å; F105-D109 PolarHBondContact O-N 3.04Å; F105-G114 WeakPolarHBondContact CZ-O 3.47Å; F105-I116 HydrophobicContact CD2-CD1 3.39Å; F105-I116 HydrophobicContact CD2-CG1 4.08Å; F105-I116 HydrophobicContact CE1-CG1 4.47Å; F105-I116 HydrophobicContact CE2-CD1 3.38Å; F105-I116 HydrophobicContact CE2-CG1 3.65Å; F105-I116 HydrophobicContact CG-CD1 4.11Å; F105-I116 HydrophobicContact CZ-CD1 4.1Å; F105-I116 HydrophobicContact CZ-CG1 3.86Å; F105-I166 WeakPolarHBondContact CE2-O 3.19Å; F105-T167 VanDerWaalsContact CE2-C 3.49Å; F105-L168 HydrophobicContact CB-CD1 3.65Å; F105-L168 HydrophobicContact CD1-CB 4.46Å; F105-L168 HydrophobicContact CD1-CD1 4.13Å; F105-L168 HydrophobicContact CD2-CB 4.22Å; F105-L168 HydrophobicContact CD2-CD1 3.84Å; F105-L168 HydrophobicContact CE1-CB 4.37Å; F105-L168 VanDerWaalsContact CE2-CA 3.49Å; F105-L168 HydrophobicContact CE2-CB 4.12Å; F105-L168 VanDerWaalsContact CE2-N 3.32Å; F105-L168 HydrophobicContact CG-CB 4.4Å; F105-L168 HydrophobicContact CG-CD1 3.59Å; F105-L168 HydrophobicContact CZ-CB 4.2Å; F105-F171 HydrophobicContact CB-CD1 4.39Å; F105-F171 HydrophobicContact CB-CE1 4.44Å; F105-F171 HydrophobicContact CD2-CB 3.82Å; F105-F171 HydrophobicContact CD2-CD1 4.28Å; F105-F171 HydrophobicContact CD2-CD2 4.19Å; F105-F171 AromaticContact CD2-CG 3.87Å; F105-F171 HydrophobicContact CD2-CG 3.87Å; F105-F171 HydrophobicContact CE2-CB 4.23Å
106E92.9Very high92.8Very high80 Ų8051.4 Ų51.437%0.37428%0.276SS..Hα-helixtrans-58.1-26.8175.6-67.9175.1170.700113.5R70 T71 K74 N102 W103R70-E106 PolarHBondContact NH2-O 3.44Å; T71-E106 HydrophobicContact CG2-CB 4.16Å; T71-E106 WeakPolarHBondContact CG2-O 3.34Å; K74-E106 IonicContact NZ-OE1 2.86Å; K74-E106 PolarHBondContact NZ-OE1 3.24Å; K74-E106 IonicContact NZ-OE2 3.18Å; K74-E106 PolarHBondContact NZ-OE2 3.21Å; N102-E106 WeakPolarHBondContact O-CG 3.29Å; N102-E106 PolarHBondContact O-N 3.02Å; W103-E106 PolarHBondContact O-N 3.23Å
107M92.8Very high93.1Very high10 Ų1050.4 Ų50.45%0.04927%0.268CS..Hα-helixtrans-73.1-37174.7177.6167.9-78.200111.9F64 A68 R70 T71 W103 A104 F105 L110 I124F64-M107 HydrophobicContact CE2-CE 4.5Å; F64-M107 HydrophobicContact CE2-SD 3.81Å; F64-M107 HydrophobicContact CZ-CE 4.09Å; F64-M107 HydrophobicContact CZ-SD 3.84Å; A68-M107 HydrophobicContact CB-CE 3.74Å; R70-M107 PolarHBondContact NH2-O 3.16Å; T71-M107 HydrophobicContact CG2-CB 4.07Å; W103-M107 HydrophobicContact CH2-CE 3.22Å; W103-M107 HydrophobicContact CH2-SD 4.08Å; W103-M107 HydrophobicContact CZ2-CE 3.43Å; W103-M107 VanDerWaalsContact CZ2-CE 3.43Å; W103-M107 HydrophobicContact CZ3-CE 4.05Å; W103-M107 HydrophobicContact CZ3-SD 4.38Å; W103-M107 PolarHBondContact O-N 2.92Å; W103-M107 VanDerWaalsContact O-N 3.13Å; A104-M107 WeakPolarHBondContact O-CB 3.49Å; A104-M107 PolarHBondContact O-N 3.2Å; A104-M107 VanDerWaalsContact O-N 3.14Å; F105-M107 PolarHBondContact O-N 3.36Å; F105-M107 VanDerWaalsContact O-N 3.14Å; M107-L110 WeakPolarHBondContact O-CD2 3.47Å; M107-I124 WeakPolarHBondContact O-CD1 3.4Å
108Y94Very high93.6Very high6 Ų648.6 Ų48.62%0.02426%0.258CS..Hα-helixtrans-82.5-38.8179.5-79.4-77.8000113.5A104 F105 L110 I116 E120 M121 I124 I125 F171 L185A104-Y108 VanDerWaalsContact O-CD2 3.25Å; A104-Y108 WeakPolarHBondContact O-CD2 3.44Å; A104-Y108 PolarHBondContact O-N 3.01Å; F105-Y108 PolarHBondContact O-N 3.35Å; Y108-L110 WeakPolarHBondContact O-CD2 3.31Å; Y108-L110 PolarHBondContact O-N 3.48Å; Y108-L110 VanDerWaalsContact O-N 3.17Å; Y108-I116 VanDerWaalsContact CB-CD1 3.48Å; Y108-I116 HydrophobicContact CG-CD1 4.37Å; Y108-E120 WeakPolarHBondContact O-CB 3.46Å; Y108-M121 HydrophobicContact CD1-CG 4.22Å; Y108-M121 HydrophobicContact CE1-CG 4.15Å; Y108-I124 HydrophobicContact CD1-CB 3.71Å; Y108-I124 HydrophobicContact CD1-CG1 3.88Å; Y108-I124 HydrophobicContact CD1-CG2 3.87Å; Y108-I124 HydrophobicContact CE1-CB 3.6Å; Y108-I124 HydrophobicContact CE1-CG1 4.28Å; Y108-I124 HydrophobicContact CE1-CG2 3.43Å; Y108-I124 VanDerWaalsContact CE1-CG2 3.43Å; Y108-I124 HydrophobicContact CE2-CG2 4.48Å; Y108-I125 HydrophobicContact CE1-CG1 4.5Å; Y108-F171 HydrophobicContact CD2-CE2 4.45Å; Y108-L185 HydrophobicContact CD2-CD2 4.2Å; Y108-L185 HydrophobicContact CE1-CD2 4.41Å; Y108-L185 HydrophobicContact CE2-CB 4.33Å; Y108-L185 HydrophobicContact CE2-CD2 3.46Å; Y108-L185 VanDerWaalsContact CE2-CD2 3.46Å; Y108-L185 HydrophobicContact CE2-CG 4.44Å
109D95.5Very high94Very high13 Ų1350.5 Ų50.57%0.0727%0.27CS..  trans-71.3101.8174.1177.9-2.6000108.5R70 F105 G112 D113 G114 I116R70-D109 PolarHBondContact NH2-O 3.1Å; R70-D109 VanDerWaalsContact NH2-O 3.12Å; F105-D109 HydrophobicContact CD1-CB 4.13Å; F105-D109 HydrophobicContact CE1-CB 3.81Å; F105-D109 HydrophobicContact CZ-CB 4.48Å; F105-D109 WeakPolarHBondContact O-CB 3.13Å; F105-D109 PolarHBondContact O-N 3.04Å; D109-G112 WeakPolarHBondContact OD1-CA 3.3Å; D109-G112 PolarHBondContact OD1-N 2.87Å; D109-G112 WeakPolarHBondContact OD2-CA 3.48Å; D109-D113 PolarHBondContact OD1-N 2.95Å; D109-G114 VanDerWaalsContact OD2-CA 3.26Å; D109-G114 WeakPolarHBondContact OD2-CA 3.35Å; D109-G114 PolarHBondContact OD2-N 2.85Å; D109-I116 HydrophobicContact CB-CG1 4.21Å
110L95.2Very high94.3Very high34 Ų3447.4 Ų47.418%0.17826%0.256CS..SBendtrans-84.2-30.7-168-56.5-171.8000113.1R70 M107 Y108 E120 E123 I124R70-L110 PolarHBondContact NH1-O 3.17Å; M107-L110 WeakPolarHBondContact O-CD2 3.47Å; Y108-L110 WeakPolarHBondContact O-CD2 3.31Å; Y108-L110 PolarHBondContact O-N 3.48Å; Y108-L110 VanDerWaalsContact O-N 3.17Å; L110-E120 WeakPolarHBondContact CA-OE1 3.47Å; L110-E120 HydrophobicContact CB-CG 3.94Å; L110-E120 WeakPolarHBondContact CB-OE1 3.44Å; L110-E120 HydrophobicContact CD1-CB 4.1Å; L110-E120 HydrophobicContact CD1-CG 3.95Å; L110-E120 HydrophobicContact CG-CB 3.82Å; L110-E120 HydrophobicContact CG-CG 3.7Å; L110-E120 PolarHBondContact N-OE1 2.97Å; L110-E123 HydrophobicContact CD1-CB 4.12Å; L110-E123 HydrophobicContact CD1-CG 4.12Å; L110-I124 HydrophobicContact CD2-CD1 3.63Å; L110-I124 HydrophobicContact CD2-CG1 3.9Å
111D94.5Very high94.5Very high113 Ų11343.8 Ų43.860%0.60424%0.24SC*.SBendtrans-99.9-10179.669.114.3000114D113 E120D111-D113 VanDerWaalsContact OD1-CB 3.3Å; D111-D113 WeakPolarHBondContact OD1-CB 3.48Å; D111-D113 PolarHBondContact OD1-N 3.14Å; D111-E120 PolarHBondContact N-OE1 3.33Å
112G94Very high94.8Very high59 Ų5944.9 Ų44.961%0.60825%0.246SC*.  trans78.222.1175.300000113.5D109 G114D109-G112 WeakPolarHBondContact OD1-CA 3.3Å; D109-G112 PolarHBondContact OD1-N 2.87Å; D109-G112 WeakPolarHBondContact OD2-CA 3.48Å; G112-G114 PolarHBondContact O-N 2.93Å
113D96.1Very high94.9Very high87 Ų8746.3 Ų46.347%0.46525%0.251SS..SBendtrans-78.1-4.2-179.585.5-6.4000113.8D109 D111 R115D109-D113 PolarHBondContact OD1-N 2.95Å; D111-D113 VanDerWaalsContact OD1-CB 3.3Å; D111-D113 WeakPolarHBondContact OD1-CB 3.48Å; D111-D113 PolarHBondContact OD1-N 3.14Å; D113-R115 WeakPolarHBondContact OD1-CA 3.25Å; D113-R115 VanDerWaalsContact OD1-CB 3.25Å; D113-R115 WeakPolarHBondContact OD1-CB 3.33Å; D113-R115 PolarHBondContact OD1-N 3.22Å
114G96.1Very high95Very high35 Ų3544 Ų4436%0.36124%0.242SC..SBendtrans88.712.7-179.700000113.7F105 D109 G112F105-G114 WeakPolarHBondContact CZ-O 3.47Å; D109-G114 VanDerWaalsContact OD2-CA 3.26Å; D109-G114 WeakPolarHBondContact OD2-CA 3.35Å; D109-G114 PolarHBondContact OD2-N 2.85Å; G112-G114 PolarHBondContact O-N 2.93Å
115R97Very high94.9Very high89 Ų8943.1 Ų43.134%0.33624%0.235SC..EExtended strand (participates in β ladder)trans-138147.2-178.4-49.3-173.3169.6-111.8-9.6110.1D113 D163 Q165 I166D113-R115 WeakPolarHBondContact OD1-CA 3.25Å; D113-R115 VanDerWaalsContact OD1-CB 3.25Å; D113-R115 WeakPolarHBondContact OD1-CB 3.33Å; D113-R115 PolarHBondContact OD1-N 3.22Å; R115-D163 IonicContact NH1-OD2 3.2Å; R115-D163 PolarHBondContact NH1-OD2 3.34Å; R115-Q165 HydrophobicContact CB-CB 4.35Å; R115-I166 WeakPolarHBondContact CA-O 3.35Å
116I96.7Very high94.8Very high0 Ų045.8 Ų45.80%025%0.247CC..EExtended strand (participates in β ladder)trans-107.2116.9174.4-58.4162.4000108.4F105 Y108 D109 E120 M121 F155 Q165 I166 F171F105-I116 HydrophobicContact CD2-CD1 3.39Å; F105-I116 HydrophobicContact CD2-CG1 4.08Å; F105-I116 HydrophobicContact CE1-CG1 4.47Å; F105-I116 HydrophobicContact CE2-CD1 3.38Å; F105-I116 HydrophobicContact CE2-CG1 3.65Å; F105-I116 HydrophobicContact CG-CD1 4.11Å; F105-I116 HydrophobicContact CZ-CD1 4.1Å; F105-I116 HydrophobicContact CZ-CG1 3.86Å; Y108-I116 VanDerWaalsContact CB-CD1 3.48Å; Y108-I116 HydrophobicContact CG-CD1 4.37Å; D109-I116 HydrophobicContact CB-CG1 4.21Å; I116-E120 HydrophobicContact CG2-CB 4.48Å; I116-M121 HydrophobicContact CG2-CB 4.03Å; I116-M121 HydrophobicContact CG2-CE 3.95Å; I116-F155 WeakPolarHBondContact O-CZ 3.41Å; I116-Q165 CarbonylContact O-C 3.6Å; I116-Q165 WeakPolarHBondContact O-CA 3.5Å; I116-I166 HydrophobicContact CB-CB 4.31Å; I116-I166 PolarHBondContact N-O 3.07Å; I116-I166 PolarHBondContact O-N 2.9Å; I116-F171 HydrophobicContact CD1-CD2 3.98Å; I116-F171 HydrophobicContact CD1-CE2 4.19Å
117T97.5Very high94.7Very high38 Ų3842 Ų4223%0.23323%0.229CC..EExtended strand (participates in β ladder)trans-84.3163.1172680000111.7L119 E120 M121T117-L119 PolarHBondContact O-N 3.14Å; T117-E120 WeakPolarHBondContact CB-OE2 3.48Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.49Å; T117-E120 PolarHBondContact N-OE2 3.47Å; T117-E120 PolarHBondContact O-N 2.92Å; T117-E120 VanDerWaalsContact OG1-CG 3.22Å; T117-E120 WeakPolarHBondContact OG1-CG 3.37Å; T117-E120 PolarHBondContact OG1-N 2.76Å; T117-E120 PolarHBondContact OG1-OE2 3.44Å; T117-M121 PolarHBondContact O-N 2.76Å
118R96.6Very high94.5Very high73 Ų7342 Ų4228%0.27523%0.229SC..Hα-helixtrans-57.5-37.6174.8-71.7-173.1-178.2-84.8-18.4113.4L122 V151 D152 F155 D164R118-L122 VanDerWaalsContact O-CB 3.26Å; R118-L122 WeakPolarHBondContact O-CB 3.22Å; R118-L122 PolarHBondContact O-N 3.37Å; R118-V151 HydrophobicContact CB-CG1 4.11Å; R118-V151 HydrophobicContact CG-CG1 4.17Å; R118-D152 IonicContact NH1-OD1 2.68Å; R118-D152 PolarHBondContact NH1-OD1 3.3Å; R118-F155 HydrophobicContact CB-CE2 4.25Å; R118-F155 HydrophobicContact CB-CZ 4.27Å; R118-F155 HydrophobicContact CG-CD1 3.98Å; R118-F155 HydrophobicContact CG-CD2 3.91Å; R118-F155 HydrophobicContact CG-CE1 3.79Å; R118-F155 HydrophobicContact CG-CE2 3.72Å; R118-F155 HydrophobicContact CG-CG 4.05Å; R118-F155 HydrophobicContact CG-CZ 3.67Å; R118-F155 VanDerWaalsContact N-CZ 3.33Å; R118-D164 IonicContact CZ-OD1 2.69Å; R118-D164 VanDerWaalsContact NE-CG 3.34Å; R118-D164 IonicContact NE-OD1 3.18Å; R118-D164 PolarHBondContact NE-OD1 2.76Å; R118-D164 IonicContact NE-OD2 2.64Å; R118-D164 PolarHBondContact NE-OD2 2.88Å; R118-D164 IonicContact NH2-OD1 2.9Å; R118-D164 PolarHBondContact NH2-OD1 3.33Å
119L97.3Very high94.1Very high136 Ų13643.1 Ų43.171%0.71223%0.234SC*.Hα-helixtrans-67.8-43.6-177.7-68.9177.1000110.9T117 L122 E123T117-L119 PolarHBondContact O-N 3.14Å; L119-L122 WeakPolarHBondContact O-CB 3.47Å; L119-L122 PolarHBondContact O-N 3.34Å; L119-E123 PolarHBondContact O-N 3.03Å
120E97.1Very high93.7Very high14 Ų1447.2 Ų47.27%0.06525%0.251CS..Hα-helixtrans-63.7-45.9176.3-71174.2121.300112Y108 L110 D111 I116 T117 L122 E123 I124Y108-E120 WeakPolarHBondContact O-CB 3.46Å; L110-E120 WeakPolarHBondContact CA-OE1 3.47Å; L110-E120 HydrophobicContact CB-CG 3.94Å; L110-E120 WeakPolarHBondContact CB-OE1 3.44Å; L110-E120 HydrophobicContact CD1-CB 4.1Å; L110-E120 HydrophobicContact CD1-CG 3.95Å; L110-E120 HydrophobicContact CG-CB 3.82Å; L110-E120 HydrophobicContact CG-CG 3.7Å; L110-E120 PolarHBondContact N-OE1 2.97Å; D111-E120 PolarHBondContact N-OE1 3.33Å; I116-E120 HydrophobicContact CG2-CB 4.48Å; T117-E120 WeakPolarHBondContact CB-OE2 3.48Å; T117-E120 WeakPolarHBondContact CG2-OE2 3.49Å; T117-E120 PolarHBondContact N-OE2 3.47Å; T117-E120 PolarHBondContact O-N 2.92Å; T117-E120 VanDerWaalsContact OG1-CG 3.22Å; T117-E120 WeakPolarHBondContact OG1-CG 3.37Å; T117-E120 PolarHBondContact OG1-N 2.76Å; T117-E120 PolarHBondContact OG1-OE2 3.44Å; E120-L122 VanDerWaalsContact C-N 3.3Å; E120-L122 PolarHBondContact O-N 3.22Å; E120-E123 PolarHBondContact O-N 3.39Å; E120-I124 PolarHBondContact O-N 3.17Å
121M94.3Very high93.2Very high0 Ų045.7 Ų45.70%024%0.243CC..Hα-helixtrans-60.5-42.2175.7-171.8173.6-70.400112Y108 I116 T117 E123 I125 V151 I154 F155 I166Y108-M121 HydrophobicContact CD1-CG 4.22Å; Y108-M121 HydrophobicContact CE1-CG 4.15Å; I116-M121 HydrophobicContact CG2-CB 4.03Å; I116-M121 HydrophobicContact CG2-CE 3.95Å; T117-M121 PolarHBondContact O-N 2.76Å; M121-E123 VanDerWaalsContact C-N 3.34Å; M121-I125 HydrophobicContact CG-CD1 3.83Å; M121-I125 WeakPolarHBondContact O-CB 3.41Å; M121-I125 VanDerWaalsContact O-CG1 3.3Å; M121-I125 WeakPolarHBondContact O-CG1 3.45Å; M121-I125 PolarHBondContact O-N 2.94Å; M121-V151 HydrophobicContact CB-CG1 4.44Å; M121-V151 HydrophobicContact CB-CG2 4.38Å; M121-V151 HydrophobicContact CG-CG2 4.11Å; M121-V151 HydrophobicContact SD-CG1 4.33Å; M121-I154 HydrophobicContact CE-CG2 3.6Å; M121-I154 HydrophobicContact SD-CB 3.7Å; M121-I154 HydrophobicContact SD-CD1 3.83Å; M121-I154 HydrophobicContact SD-CG1 4.39Å; M121-I154 HydrophobicContact SD-CG2 3.44Å; M121-I154 WeakPolarHBondContact SD-CG2 3.38Å; M121-F155 HydrophobicContact CB-CE2 4.05Å; M121-F155 HydrophobicContact CE-CD2 4.26Å; M121-F155 HydrophobicContact CE-CE2 3.73Å; M121-F155 HydrophobicContact CE-CZ 4.48Å; M121-F155 HydrophobicContact CG-CE2 4.46Å; M121-F155 HydrophobicContact SD-CD2 3.83Å; M121-F155 HydrophobicContact SD-CE2 3.62Å; M121-I166 HydrophobicContact CE-CD1 3.52Å
122L94.6Very high92.5Very high32 Ų3240.6 Ų40.617%0.16822%0.216CC..Hα-helixtrans-61.2-44.7177.2-178.660.9000111.3R118 L119 E120 I124 I125 E126 P147 Q148 V151R118-L122 VanDerWaalsContact O-CB 3.26Å; R118-L122 WeakPolarHBondContact O-CB 3.22Å; R118-L122 PolarHBondContact O-N 3.37Å; L119-L122 WeakPolarHBondContact O-CB 3.47Å; L119-L122 PolarHBondContact O-N 3.34Å; E120-L122 VanDerWaalsContact C-N 3.3Å; E120-L122 PolarHBondContact O-N 3.22Å; L122-I124 PolarHBondContact O-N 3.01Å; L122-I125 PolarHBondContact O-N 2.81Å; L122-E126 HydrophobicContact CD1-CG 4.06Å; L122-E126 HydrophobicContact CG-CG 4.32Å; L122-E126 WeakPolarHBondContact O-CB 3.36Å; L122-E126 WeakPolarHBondContact O-CG 3.42Å; L122-E126 PolarHBondContact O-N 3.28Å; L122-P147 HydrophobicContact CD1-CB 3.59Å; L122-Q148 HydrophobicContact CD1-CG 3.92Å; L122-Q148 HydrophobicContact CD2-CG 4.13Å; L122-V151 HydrophobicContact CB-CG2 3.89Å; L122-V151 HydrophobicContact CD1-CG2 3.98Å
123E95.1Very high91.7Very high76 Ų7638.4 Ų38.436%0.35519%0.193SC..Hα-helixtrans-60.1-45.8-179177.7157.4-171.400112.1H67 L110 L119 E120 M121 E126 A127H67-E123 IonicContact CE1-OE1 3.91Å; H67-E123 PolarHBondContact CE1-OE1 3.24Å; H67-E123 IonicContact NE2-OE1 3.93Å; L110-E123 HydrophobicContact CD1-CB 4.12Å; L110-E123 HydrophobicContact CD1-CG 4.12Å; L119-E123 PolarHBondContact O-N 3.03Å; E120-E123 PolarHBondContact O-N 3.39Å; M121-E123 VanDerWaalsContact C-N 3.34Å; E123-E126 PolarHBondContact O-N 3.2Å; E123-A127 WeakPolarHBondContact O-CB 3.24Å; E123-A127 PolarHBondContact O-N 3.34Å
124I92.8Very high90.6Very high0 Ų039.2 Ų39.20%020%0.201CC..Hα-helixtrans-65.2-44.1176.2-62.3-53.8000111.6H67 M107 Y108 L110 E120 L122 E126 A127 I128H67-I124 HydrophobicContact CB-CD1 3.64Å; H67-I124 WeakPolarHBondContact CD2-CD1 3.48Å; M107-I124 WeakPolarHBondContact O-CD1 3.4Å; Y108-I124 HydrophobicContact CD1-CB 3.71Å; Y108-I124 HydrophobicContact CD1-CG1 3.88Å; Y108-I124 HydrophobicContact CD1-CG2 3.87Å; Y108-I124 HydrophobicContact CE1-CB 3.6Å; Y108-I124 HydrophobicContact CE1-CG1 4.28Å; Y108-I124 HydrophobicContact CE1-CG2 3.43Å; Y108-I124 VanDerWaalsContact CE1-CG2 3.43Å; Y108-I124 HydrophobicContact CE2-CG2 4.48Å; L110-I124 HydrophobicContact CD2-CD1 3.63Å; L110-I124 HydrophobicContact CD2-CG1 3.9Å; E120-I124 PolarHBondContact O-N 3.17Å; L122-I124 PolarHBondContact O-N 3.01Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 3.04Å; I124-A127 WeakPolarHBondContact O-CB 3.33Å; I124-A127 PolarHBondContact O-N 3.44Å; I124-I128 HydrophobicContact CG2-CD1 3.9Å; I124-I128 HydrophobicContact CG2-CG1 4.42Å; I124-I128 WeakPolarHBondContact O-CG1 3.13Å; I124-I128 PolarHBondContact O-N 3.02Å
125I90Very high89.2Confident1 Ų142.3 Ų42.31%0.00521%0.213CC..Hα-helixtrans-62.1-43.1178.7-70.9172.5000110.6Y108 M121 L122 A127 I128 Y129 P147 R150 V151 I154Y108-I125 HydrophobicContact CE1-CG1 4.5Å; M121-I125 HydrophobicContact CG-CD1 3.83Å; M121-I125 WeakPolarHBondContact O-CB 3.41Å; M121-I125 VanDerWaalsContact O-CG1 3.3Å; M121-I125 WeakPolarHBondContact O-CG1 3.45Å; M121-I125 PolarHBondContact O-N 2.94Å; L122-I125 PolarHBondContact O-N 2.81Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.26Å; I125-I128 PolarHBondContact O-N 2.91Å; I125-Y129 HydrophobicContact CG2-CD2 3.79Å; I125-Y129 HydrophobicContact CG2-CE2 3.54Å; I125-Y129 WeakPolarHBondContact O-CB 3.17Å; I125-Y129 WeakPolarHBondContact O-CD2 3.34Å; I125-Y129 PolarHBondContact O-N 2.62Å; I125-P147 HydrophobicContact CG2-CB 3.9Å; I125-R150 HydrophobicContact CD1-CB 4.44Å; I125-R150 HydrophobicContact CD1-CG 4.09Å; I125-V151 HydrophobicContact CD1-CG2 3.76Å; I125-I154 HydrophobicContact CD1-CD1 3.81Å
126E91.2Very high88Confident66 Ų6641.6 Ų41.631%0.30822%0.215SC..Hα-helixtrans-63.5-38.4175.5-74.4-172.9170.700112.2L122 E123 I124 Y129 K130 P147 Q148L122-E126 HydrophobicContact CD1-CG 4.06Å; L122-E126 HydrophobicContact CG-CG 4.32Å; L122-E126 WeakPolarHBondContact O-CB 3.36Å; L122-E126 WeakPolarHBondContact O-CG 3.42Å; L122-E126 PolarHBondContact O-N 3.28Å; E123-E126 PolarHBondContact O-N 3.2Å; I124-E126 VanDerWaalsContact C-N 3.33Å; I124-E126 PolarHBondContact O-N 3.04Å; E126-Y129 PolarHBondContact O-N 3.36Å; E126-K130 WeakPolarHBondContact O-CG 3.32Å; E126-K130 PolarHBondContact O-N 2.88Å; E126-P147 HydrophobicContact CG-CB 3.76Å; E126-P147 HydrophobicContact CG-CG 4Å; E126-Q148 PolarHBondContact OE1-NE2 2.96Å; E126-Q148 VanDerWaalsContact OE1-NE2 3.14Å
127A91.4Very high86.7Confident0 Ų042.6 Ų42.60%022%0.22CC..Hα-helixtrans-63.1-43.2174.900000111.8K63 F64 E123 I124 I125 K130 M131K63-A127 HydrophobicContact CB-CB 3.83Å; F64-A127 HydrophobicContact CB-CB 4.22Å; E123-A127 WeakPolarHBondContact O-CB 3.24Å; E123-A127 PolarHBondContact O-N 3.34Å; I124-A127 WeakPolarHBondContact O-CB 3.33Å; I124-A127 PolarHBondContact O-N 3.44Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.26Å; A127-K130 PolarHBondContact O-N 3.5Å; A127-M131 WeakPolarHBondContact O-CB 3.3Å; A127-M131 PolarHBondContact O-N 2.86Å
128I86.7Confident85.3Confident10 Ų1047.8 Ų47.85%0.05124%0.244CC..Hα-helixtrans-62.9-45174.7-66.3166.1000110.5F64 I124 I125 K130 M131 V132 C187F64-I128 HydrophobicContact CD2-CG1 3.6Å; F64-I128 HydrophobicContact CE2-CD1 4.19Å; F64-I128 HydrophobicContact CE2-CG1 3.66Å; I124-I128 HydrophobicContact CG2-CD1 3.9Å; I124-I128 HydrophobicContact CG2-CG1 4.42Å; I124-I128 WeakPolarHBondContact O-CG1 3.13Å; I124-I128 PolarHBondContact O-N 3.02Å; I125-I128 PolarHBondContact O-N 2.91Å; I128-K130 VanDerWaalsContact C-N 3.28Å; I128-K130 PolarHBondContact O-N 3.38Å; I128-M131 WeakPolarHBondContact O-CB 3.14Å; I128-M131 PolarHBondContact O-N 2.87Å; I128-M131 VanDerWaalsContact O-N 3.12Å; I128-V132 VanDerWaalsContact O-CG2 3.28Å; I128-V132 WeakPolarHBondContact O-CG2 3.44Å; I128-V132 PolarHBondContact O-N 3.48Å; I128-C187 HydrophobicContact CG2-CB 3.6Å; I128-C187 VanDerWaalsContact CG2-SG 3.52Å
129Y85.5Confident84Confident30 Ų3053 Ų5312%0.11826%0.263CS..Hα-helixtrans-59.5-40179.4-85.7-138.6000111.9I125 E126 G133 M137 L145 P147 R150I125-Y129 HydrophobicContact CG2-CD2 3.79Å; I125-Y129 HydrophobicContact CG2-CE2 3.54Å; I125-Y129 WeakPolarHBondContact O-CB 3.17Å; I125-Y129 WeakPolarHBondContact O-CD2 3.34Å; I125-Y129 PolarHBondContact O-N 2.62Å; E126-Y129 PolarHBondContact O-N 3.36Å; Y129-G133 PolarHBondContact O-N 2.96Å; Y129-M137 VanDerWaalsContact CA-SD 3.53Å; Y129-M137 HydrophobicContact CD1-CE 3.06Å; Y129-M137 HydrophobicContact CD1-SD 3.97Å; Y129-M137 HydrophobicContact CD2-CE 3.53Å; Y129-M137 HydrophobicContact CD2-SD 3.71Å; Y129-M137 HydrophobicContact CE1-CE 3.09Å; Y129-M137 HydrophobicContact CE1-SD 4.43Å; Y129-M137 HydrophobicContact CE2-CE 3.57Å; Y129-M137 HydrophobicContact CE2-SD 4.21Å; Y129-M137 HydrophobicContact CG-CE 3.27Å; Y129-M137 HydrophobicContact CG-SD 3.57Å; Y129-M137 VanDerWaalsContact CG-SD 3.57Å; Y129-M137 WeakPolarHBondContact O-CG 3.5Å; Y129-L145 PolarHBondContact OH-O 3.34Å; Y129-L145 VanDerWaalsContact OH-O 3.09Å; Y129-P147 HydrophobicContact CD1-CG 3.55Å; Y129-P147 HydrophobicContact CE1-CG 3.62Å; Y129-P147 HydrophobicContact CG-CG 4.2Å; Y129-R150 PolarHBondContact OH-NE 3.2Å
130K87.7Confident82.6Confident99 Ų9948.2 Ų48.243%0.4324%0.238SC..Hα-helixtrans-68.8-41.4174.2-73.4-178.9-178.1-177.10112.4D60 E126 A127 I128 G133D60-K130 HydrophobicContact CB-CB 4.4Å; D60-K130 PolarHBondContact N-O 2.85Å; D60-K130 CarbonylContact O-C 3.38Å; E126-K130 WeakPolarHBondContact O-CG 3.32Å; E126-K130 PolarHBondContact O-N 2.88Å; A127-K130 PolarHBondContact O-N 3.5Å; I128-K130 VanDerWaalsContact C-N 3.28Å; I128-K130 PolarHBondContact O-N 3.38Å; K130-G133 PolarHBondContact O-N 2.98Å
131M85.7Confident81.4Confident2 Ų248.9 Ų48.91%0.0124%0.242CC..Hα-helixtrans-61.3-46.7-178.7177.1176.872.100112.7Y52 F56 G59 D60 A61 F64 A127 I128 G133 M189Y52-M131 HydrophobicContact CD1-SD 4.16Å; Y52-M131 HydrophobicContact CE1-SD 4.29Å; F56-M131 HydrophobicContact CB-CG 4.27Å; F56-M131 HydrophobicContact CD1-CG 3.96Å; F56-M131 HydrophobicContact CD2-CG 3.96Å; F56-M131 HydrophobicContact CD2-SD 3.98Å; F56-M131 HydrophobicContact CE1-CE 4.37Å; F56-M131 HydrophobicContact CE1-CG 4.29Å; F56-M131 HydrophobicContact CE1-SD 4.44Å; F56-M131 HydrophobicContact CE2-CE 4.45Å; F56-M131 HydrophobicContact CE2-CG 4.29Å; F56-M131 HydrophobicContact CE2-SD 3.8Å; F56-M131 HydrophobicContact CG-CG 3.79Å; F56-M131 HydrophobicContact CG-SD 4.38Å; F56-M131 HydrophobicContact CZ-CE 4.11Å; F56-M131 HydrophobicContact CZ-CG 4.44Å; F56-M131 HydrophobicContact CZ-SD 4.05Å; G59-M131 WeakPolarHBondContact CA-O 3.04Å; D60-M131 VanDerWaalsContact O-CA 3.29Å; D60-M131 WeakPolarHBondContact O-CA 3.44Å; D60-M131 PolarHBondContact O-N 3.42Å; A61-M131 HydrophobicContact CB-CB 4.32Å; A61-M131 HydrophobicContact CB-CG 3.7Å; A61-M131 HydrophobicContact CB-SD 4.2Å; F64-M131 HydrophobicContact CB-CB 4.37Å; F64-M131 HydrophobicContact CB-SD 3.94Å; F64-M131 HydrophobicContact CD1-CE 4.02Å; F64-M131 HydrophobicContact CD1-SD 3.42Å; F64-M131 WeakPolarHBondContact CD1-SD 3.16Å; F64-M131 HydrophobicContact CD2-CE 4.39Å; F64-M131 HydrophobicContact CE1-CE 4.21Å; F64-M131 HydrophobicContact CE1-SD 4.06Å; F64-M131 HydrophobicContact CG-CE 4.11Å; F64-M131 HydrophobicContact CG-SD 3.69Å; F64-M131 HydrophobicContact CZ-CE 4.48Å; A127-M131 WeakPolarHBondContact O-CB 3.3Å; A127-M131 PolarHBondContact O-N 2.86Å; I128-M131 WeakPolarHBondContact O-CB 3.14Å; I128-M131 PolarHBondContact O-N 2.87Å; I128-M131 VanDerWaalsContact O-N 3.12Å; M131-G133 VanDerWaalsContact C-N 3.29Å; M131-G133 PolarHBondContact O-N 3.46Å; M131-M189 HydrophobicContact CE-SD 3.99Å
132V79.8Confident80.2Confident6 Ų657.4 Ų57.44%0.03628%0.282CS..Hα-helixtrans-78.4-18.8-177.8-63.70000112.1I128 I136 M137 M140I128-V132 VanDerWaalsContact O-CG2 3.28Å; I128-V132 WeakPolarHBondContact O-CG2 3.44Å; I128-V132 PolarHBondContact O-N 3.48Å; V132-I136 HydrophobicContact CB-CB 3.9Å; V132-I136 HydrophobicContact CB-CG2 3.87Å; V132-I136 HydrophobicContact CG1-CG2 4.37Å; V132-I136 VanDerWaalsContact O-CB 3.29Å; V132-I136 WeakPolarHBondContact O-CB 3.31Å; V132-I136 WeakPolarHBondContact O-CD1 3.38Å; V132-I136 WeakPolarHBondContact O-CG1 3.38Å; V132-M137 HydrophobicContact CG2-CG 3.47Å; V132-M137 VanDerWaalsContact CG2-CG 3.47Å; V132-M137 HydrophobicContact CG2-SD 3.25Å; V132-M137 WeakPolarHBondContact CG2-SD 3.37Å; V132-M140 HydrophobicContact CB-SD 4.07Å; V132-M140 HydrophobicContact CG1-CE 4.1Å; V132-M140 HydrophobicContact CG1-SD 3.92Å; V132-M140 HydrophobicContact CG2-SD 3.86Å
133G76.8Confident79.4Confident12 Ų1259.3 Ų59.312%0.12429%0.292CS..Hα-helixtrans68.4168.8178.700000113.4Y129 K130 M131 V135 I136 M137Y129-G133 PolarHBondContact O-N 2.96Å; K130-G133 PolarHBondContact O-N 2.98Å; M131-G133 VanDerWaalsContact C-N 3.29Å; M131-G133 PolarHBondContact O-N 3.46Å; G133-V135 VanDerWaalsContact C-N 3.3Å; G133-V135 PolarHBondContact O-N 3.11Å; G133-V135 VanDerWaalsContact O-N 3.15Å; G133-I136 PolarHBondContact O-N 3.28Å; G133-M137 VanDerWaalsContact O-CB 3.26Å; G133-M137 WeakPolarHBondContact O-CB 3.33Å; G133-M137 VanDerWaalsContact O-CG 3.23Å; G133-M137 WeakPolarHBondContact O-CG 3.26Å; G133-M137 PolarHBondContact O-N 2.74Å
134T72.2Confident78.7Confident104 Ų10458.2 Ų58.264%0.63830%0.301SS*.Hα-helixtrans-56.6-38.5-168.5-50.40000114M138T134-M138 HydrophobicContact CG2-CE 3.89Å; T134-M138 HydrophobicContact CG2-SD 4.5Å; T134-M138 VanDerWaalsContact O-CG 3.3Å; T134-M138 WeakPolarHBondContact O-CG 3.48Å; T134-M138 PolarHBondContact O-N 3.19Å
135V68Low78.3Confident100 Ų10059.9 Ų59.961%0.60631%0.31SS*.Hα-helixtrans-70-46.4-175.1177.80000111.8G133 M137 M138 R139G133-V135 VanDerWaalsContact C-N 3.3Å; G133-V135 PolarHBondContact O-N 3.11Å; G133-V135 VanDerWaalsContact O-N 3.15Å; V135-M137 VanDerWaalsContact C-N 3.35Å; V135-M138 PolarHBondContact O-N 2.94Å; V135-R139 PolarHBondContact O-N 2.85Å
136I70.8Confident78.2Confident75 Ų7562.7 Ų62.739%0.38533%0.327SS..Hα-helixtrans-72.2-38179.1-55.3-180000108.8V132 G133 M138 R139 M140V132-I136 HydrophobicContact CB-CB 3.9Å; V132-I136 HydrophobicContact CB-CG2 3.87Å; V132-I136 HydrophobicContact CG1-CG2 4.37Å; V132-I136 VanDerWaalsContact O-CB 3.29Å; V132-I136 WeakPolarHBondContact O-CB 3.31Å; V132-I136 WeakPolarHBondContact O-CD1 3.38Å; V132-I136 WeakPolarHBondContact O-CG1 3.38Å; G133-I136 PolarHBondContact O-N 3.28Å; I136-M138 VanDerWaalsContact C-N 3.31Å; I136-M138 PolarHBondContact O-N 3.31Å; I136-R139 CarbonylContact O-C 3.6Å; I136-R139 WeakPolarHBondContact O-CA 3.36Å; I136-R139 WeakPolarHBondContact O-CB 3.43Å; I136-R139 PolarHBondContact O-N 3.28Å; I136-M140 HydrophobicContact CG2-CE 4.21Å; I136-M140 HydrophobicContact CG2-CG 3.87Å; I136-M140 HydrophobicContact CG2-SD 3.59Å; I136-M140 VanDerWaalsContact CG2-SD 3.59Å; I136-M140 WeakPolarHBondContact O-CG 3.3Å; I136-M140 PolarHBondContact O-N 3.05Å
137M68.9Low78.1Confident21 Ų2160.6 Ų60.610%0.10332%0.319CS..Hα-helixtrans-53-45171.7-81.1-53.4-57.200113.3Y129 V132 G133 V135 R139 M140 N141Y129-M137 VanDerWaalsContact CA-SD 3.53Å; Y129-M137 HydrophobicContact CD1-CE 3.06Å; Y129-M137 HydrophobicContact CD1-SD 3.97Å; Y129-M137 HydrophobicContact CD2-CE 3.53Å; Y129-M137 HydrophobicContact CD2-SD 3.71Å; Y129-M137 HydrophobicContact CE1-CE 3.09Å; Y129-M137 HydrophobicContact CE1-SD 4.43Å; Y129-M137 HydrophobicContact CE2-CE 3.57Å; Y129-M137 HydrophobicContact CE2-SD 4.21Å; Y129-M137 HydrophobicContact CG-CE 3.27Å; Y129-M137 HydrophobicContact CG-SD 3.57Å; Y129-M137 VanDerWaalsContact CG-SD 3.57Å; Y129-M137 WeakPolarHBondContact O-CG 3.5Å; V132-M137 HydrophobicContact CG2-CG 3.47Å; V132-M137 VanDerWaalsContact CG2-CG 3.47Å; V132-M137 HydrophobicContact CG2-SD 3.25Å; V132-M137 WeakPolarHBondContact CG2-SD 3.37Å; G133-M137 VanDerWaalsContact O-CB 3.26Å; G133-M137 WeakPolarHBondContact O-CB 3.33Å; G133-M137 VanDerWaalsContact O-CG 3.23Å; G133-M137 WeakPolarHBondContact O-CG 3.26Å; G133-M137 PolarHBondContact O-N 2.74Å; V135-M137 VanDerWaalsContact C-N 3.35Å; M137-R139 PolarHBondContact O-N 2.86Å; M137-M140 PolarHBondContact O-N 2.64Å; M137-N141 HydrophobicContact CE-CB 4.01Å; M137-N141 WeakPolarHBondContact O-CB 3.49Å; M137-N141 PolarHBondContact O-N 3.47Å
138M68.8Low78.1Confident147 Ų14764.7 Ų64.772%0.72434%0.339SS*.Hα-helixtrans-62.2-26.7176.4-75.2178174.200113.2T134 V135 I136T134-M138 HydrophobicContact CG2-CE 3.89Å; T134-M138 HydrophobicContact CG2-SD 4.5Å; T134-M138 VanDerWaalsContact O-CG 3.3Å; T134-M138 WeakPolarHBondContact O-CG 3.48Å; T134-M138 PolarHBondContact O-N 3.19Å; V135-M138 PolarHBondContact O-N 2.94Å; I136-M138 VanDerWaalsContact C-N 3.31Å; I136-M138 PolarHBondContact O-N 3.31Å
139R69.8Low78.4Confident182 Ų18268.6 Ų68.669%0.68736%0.357SS*.Hα-helixtrans-84.7-38.3177.3-63.8179.7-178.6-173.80.9112.5V135 I136 M137 Q142V135-R139 PolarHBondContact O-N 2.85Å; I136-R139 CarbonylContact O-C 3.6Å; I136-R139 WeakPolarHBondContact O-CA 3.36Å; I136-R139 WeakPolarHBondContact O-CB 3.43Å; I136-R139 PolarHBondContact O-N 3.28Å; M137-R139 PolarHBondContact O-N 2.86Å; R139-Q142 WeakPolarHBondContact O-CG 3.1Å
140M66.7Low78.5Confident36 Ų3667.9 Ų67.918%0.17735%0.353CS..Hα-helixtrans-78.1-40.3-178.3-65.4174.7128.700112.6V132 I136 M137 Q142 C187 D188 M189V132-M140 HydrophobicContact CB-SD 4.07Å; V132-M140 HydrophobicContact CG1-CE 4.1Å; V132-M140 HydrophobicContact CG1-SD 3.92Å; V132-M140 HydrophobicContact CG2-SD 3.86Å; I136-M140 HydrophobicContact CG2-CE 4.21Å; I136-M140 HydrophobicContact CG2-CG 3.87Å; I136-M140 HydrophobicContact CG2-SD 3.59Å; I136-M140 VanDerWaalsContact CG2-SD 3.59Å; I136-M140 WeakPolarHBondContact O-CG 3.3Å; I136-M140 PolarHBondContact O-N 3.05Å; M137-M140 PolarHBondContact O-N 2.64Å; M140-Q142 VanDerWaalsContact C-N 3.28Å; M140-Q142 PolarHBondContact O-N 3.44Å; M140-Q142 VanDerWaalsContact O-N 3.11Å; M140-C187 HydrophobicContact CE-CB 3.69Å; M140-C187 WeakPolarHBondContact CE-O 3.43Å; M140-C187 HydrophobicContact SD-CB 4.08Å; M140-D188 WeakPolarHBondContact CE-O 3.3Å; M140-M189 HydrophobicContact CE-CB 4.37Å; M140-M189 HydrophobicContact CE-CG 3.73Å
141N71.9Confident78.8Confident28 Ų2863.4 Ų63.415%0.1533%0.334CS..  trans-90.257.2-174.6-165.532.8000111M137 D143 G144 L145 R150M137-N141 HydrophobicContact CE-CB 4.01Å; M137-N141 WeakPolarHBondContact O-CB 3.49Å; M137-N141 PolarHBondContact O-N 3.47Å; N141-D143 PolarHBondContact O-N 2.91Å; N141-D143 PolarHBondContact OD1-OD1 3.31Å; N141-G144 PolarHBondContact O-N 3.35Å; N141-L145 PolarHBondContact ND2-N 2.9Å; N141-L145 PolarHBondContact ND2-O 3.04Å; N141-L145 PolarHBondContact OD1-N 3.19Å; N141-L145 PolarHBondContact OD1-O 3.14Å; N141-R150 PolarHBondContact OD1-NH2 3.04Å
142Q70.8Confident79.1Confident179 Ų17967.4 Ų67.484%0.83636%0.356SS*.THydrogen-bonded Turntrans-61.3-26.4-178.2-64.1-171.6-1.800113R139 M140 G144R139-Q142 WeakPolarHBondContact O-CG 3.1Å; M140-Q142 VanDerWaalsContact C-N 3.28Å; M140-Q142 PolarHBondContact O-N 3.44Å; M140-Q142 VanDerWaalsContact O-N 3.11Å; Q142-G144 VanDerWaalsContact C-N 3.29Å
143D77.7Confident79.6Confident71 Ų7170.8 Ų70.838%0.3837%0.37SS..THydrogen-bonded Turntrans-82.4-4174.858.7-1000113.6N141 L145 R150 K153N141-D143 PolarHBondContact O-N 2.91Å; N141-D143 PolarHBondContact OD1-OD1 3.31Å; D143-L145 HydrophobicContact CB-CG 4.13Å; D143-L145 VanDerWaalsContact CG-CG 3.5Å; D143-L145 PolarHBondContact O-N 3.12Å; D143-L145 WeakPolarHBondContact OD2-CD1 3.47Å; D143-R150 IonicContact OD1-NH2 2.98Å; D143-R150 PolarHBondContact OD1-NH2 2.83Å; D143-K153 IonicContact OD2-NZ 3.14Å; D143-K153 PolarHBondContact OD2-NZ 3.17Å
144G79.7Confident80.2Confident54 Ų5470.2 Ų70.256%0.55736%0.364SS*.  trans66.416.3174.600000114.4N141 Q142N141-G144 PolarHBondContact O-N 3.35Å; Q142-G144 VanDerWaalsContact C-N 3.29Å
145L83.9Confident81.3Confident34 Ų3465.4 Ų65.418%0.17833%0.334CS..  trans-71.3136.4-175.6-62.3-178.1000111.4Y129 N141 D143 Q149 K153Y129-L145 PolarHBondContact OH-O 3.34Å; Y129-L145 VanDerWaalsContact OH-O 3.09Å; N141-L145 PolarHBondContact ND2-N 2.9Å; N141-L145 PolarHBondContact ND2-O 3.04Å; N141-L145 PolarHBondContact OD1-N 3.19Å; N141-L145 PolarHBondContact OD1-O 3.14Å; D143-L145 HydrophobicContact CB-CG 4.13Å; D143-L145 VanDerWaalsContact CG-CG 3.5Å; D143-L145 PolarHBondContact O-N 3.12Å; D143-L145 WeakPolarHBondContact OD2-CD1 3.47Å; L145-Q149 HydrophobicContact CB-CB 4.05Å; L145-Q149 HydrophobicContact CD2-CB 4.05Å; L145-Q149 HydrophobicContact CG-CB 4.5Å; L145-K153 HydrophobicContact CD1-CD 3.59Å
146T88.1Confident82.4Confident61 Ų6169.6 Ų69.637%0.37435%0.345SS..  trans-64.6160.5166.270.90000110.3Q148 Q149 R150T146-Q148 PolarHBondContact O-N 2.93Å; T146-Q149 PolarHBondContact O-N 3.31Å; T146-Q149 VanDerWaalsContact O-N 3.16Å; T146-Q149 WeakPolarHBondContact OG1-CG 3.33Å; T146-Q149 PolarHBondContact OG1-N 2.89Å; T146-Q149 VanDerWaalsContact OG1-N 3.16Å; T146-R150 PolarHBondContact O-N 3.38Å
147P88.7Confident83.3Confident22 Ų2269.5 Ų69.514%0.14334%0.341CS..Hα-helixtrans-48.4-46171.5-30.137000112.7L122 I125 E126 Y129 R150 V151L122-P147 HydrophobicContact CD1-CB 3.59Å; I125-P147 HydrophobicContact CG2-CB 3.9Å; E126-P147 HydrophobicContact CG-CB 3.76Å; E126-P147 HydrophobicContact CG-CG 4Å; Y129-P147 HydrophobicContact CD1-CG 3.55Å; Y129-P147 HydrophobicContact CE1-CG 3.62Å; Y129-P147 HydrophobicContact CG-CG 4.2Å; P147-R150 WeakPolarHBondContact O-CB 3.28Å; P147-R150 PolarHBondContact O-N 2.99Å; P147-R150 VanDerWaalsContact O-N 3.17Å; P147-V151 WeakPolarHBondContact O-CG2 3.26Å; P147-V151 PolarHBondContact O-N 3.34Å
148Q92.8Very high84.4Confident86 Ų8668.5 Ų68.540%0.40234%0.336SS..Hα-helixtrans-62.5-45.7179.2-66.374.815.600112L122 E126 T146 R150 V151 D152L122-Q148 HydrophobicContact CD1-CG 3.92Å; L122-Q148 HydrophobicContact CD2-CG 4.13Å; E126-Q148 PolarHBondContact OE1-NE2 2.96Å; E126-Q148 VanDerWaalsContact OE1-NE2 3.14Å; T146-Q148 PolarHBondContact O-N 2.93Å; Q148-R150 PolarHBondContact O-N 3.18Å; Q148-V151 WeakPolarHBondContact O-CB 3.48Å; Q148-V151 PolarHBondContact O-N 2.89Å; Q148-D152 PolarHBondContact O-N 3.17Å
149Q91.4Very high85.6Confident92 Ų9262.1 Ų62.143%0.4331%0.305SS..Hα-helixtrans-64.9-31.2176.8-70.5172.9-33.500112.4L145 T146 K153L145-Q149 HydrophobicContact CB-CB 4.05Å; L145-Q149 HydrophobicContact CD2-CB 4.05Å; L145-Q149 HydrophobicContact CG-CB 4.5Å; T146-Q149 PolarHBondContact O-N 3.31Å; T146-Q149 VanDerWaalsContact O-N 3.16Å; T146-Q149 WeakPolarHBondContact OG1-CG 3.33Å; T146-Q149 PolarHBondContact OG1-N 2.89Å; T146-Q149 VanDerWaalsContact OG1-N 3.16Å; Q149-K153 WeakPolarHBondContact O-CB 3.4Å; Q149-K153 PolarHBondContact O-N 3.03Å
150R88.9Confident86.6Confident14 Ų1459.7 Ų59.75%0.05330%0.302CS..Hα-helixtrans-68.3-44.4174.1-172.4174.6-67-89-13110.9I125 Y129 N141 D143 T146 P147 Q148 D152 K153 I154I125-R150 HydrophobicContact CD1-CB 4.44Å; I125-R150 HydrophobicContact CD1-CG 4.09Å; Y129-R150 PolarHBondContact OH-NE 3.2Å; N141-R150 PolarHBondContact OD1-NH2 3.04Å; D143-R150 IonicContact OD1-NH2 2.98Å; D143-R150 PolarHBondContact OD1-NH2 2.83Å; T146-R150 PolarHBondContact O-N 3.38Å; P147-R150 WeakPolarHBondContact O-CB 3.28Å; P147-R150 PolarHBondContact O-N 2.99Å; P147-R150 VanDerWaalsContact O-N 3.17Å; Q148-R150 PolarHBondContact O-N 3.18Å; R150-D152 PolarHBondContact O-N 2.95Å; R150-K153 PolarHBondContact O-N 3.5Å; R150-I154 HydrophobicContact CG-CD1 4.03Å; R150-I154 VanDerWaalsContact O-CG1 3.3Å; R150-I154 WeakPolarHBondContact O-CG1 3.29Å; R150-I154 PolarHBondContact O-N 3Å
151V92.4Very high88Confident5 Ų563 Ų633%0.0332%0.32CS..Hα-helixtrans-56.2-50172175.20000110.3R118 M121 L122 I125 P147 Q148 K153 I154 F155R118-V151 HydrophobicContact CB-CG1 4.11Å; R118-V151 HydrophobicContact CG-CG1 4.17Å; M121-V151 HydrophobicContact CB-CG1 4.44Å; M121-V151 HydrophobicContact CB-CG2 4.38Å; M121-V151 HydrophobicContact CG-CG2 4.11Å; M121-V151 HydrophobicContact SD-CG1 4.33Å; L122-V151 HydrophobicContact CB-CG2 3.89Å; L122-V151 HydrophobicContact CD1-CG2 3.98Å; I125-V151 HydrophobicContact CD1-CG2 3.76Å; P147-V151 WeakPolarHBondContact O-CG2 3.26Å; P147-V151 PolarHBondContact O-N 3.34Å; Q148-V151 WeakPolarHBondContact O-CB 3.48Å; Q148-V151 PolarHBondContact O-N 2.89Å; V151-K153 VanDerWaalsContact C-N 3.28Å; V151-K153 PolarHBondContact O-N 3.36Å; V151-I154 PolarHBondContact O-N 2.85Å; V151-I154 VanDerWaalsContact O-N 3.07Å; V151-F155 HydrophobicContact CG1-CD2 3.71Å; V151-F155 HydrophobicContact CG1-CE2 3.93Å; V151-F155 WeakPolarHBondContact O-CD2 3.33Å; V151-F155 PolarHBondContact O-N 3.36Å
152D92.9Very high89Confident86 Ų8670 Ų7046%0.4635%0.349SS..Hα-helixtrans-57.4-41.6179.4-69.3-25.6000112.6R118 Q148 R150 K156R118-D152 IonicContact NH1-OD1 2.68Å; R118-D152 PolarHBondContact NH1-OD1 3.3Å; Q148-D152 PolarHBondContact O-N 3.17Å; R150-D152 PolarHBondContact O-N 2.95Å; D152-K156 VanDerWaalsContact O-CB 3.25Å; D152-K156 WeakPolarHBondContact O-CB 3.43Å; D152-K156 PolarHBondContact O-N 2.96Å
153K89.8Confident90.2Very high77 Ų7764.3 Ų64.334%0.33533%0.325SS..Hα-helixtrans-67.3-37.5177.5-175.8176176.1-179.40112.2D143 L145 Q149 R150 V151 K157D143-K153 IonicContact OD2-NZ 3.14Å; D143-K153 PolarHBondContact OD2-NZ 3.17Å; L145-K153 HydrophobicContact CD1-CD 3.59Å; Q149-K153 WeakPolarHBondContact O-CB 3.4Å; Q149-K153 PolarHBondContact O-N 3.03Å; R150-K153 PolarHBondContact O-N 3.5Å; V151-K153 VanDerWaalsContact C-N 3.28Å; V151-K153 PolarHBondContact O-N 3.36Å; K153-K157 WeakPolarHBondContact O-CG 3.46Å; K153-K157 PolarHBondContact O-N 3.15Å
154I90.5Very high91Very high1 Ų164.6 Ų64.61%0.00533%0.326CS..Hα-helixtrans-69.4-52177.4-68.1164.4000110M121 I125 R150 V151 K156 K157 M158 I166 L184M121-I154 HydrophobicContact CE-CG2 3.6Å; M121-I154 HydrophobicContact SD-CB 3.7Å; M121-I154 HydrophobicContact SD-CD1 3.83Å; M121-I154 HydrophobicContact SD-CG1 4.39Å; M121-I154 HydrophobicContact SD-CG2 3.44Å; M121-I154 WeakPolarHBondContact SD-CG2 3.38Å; I125-I154 HydrophobicContact CD1-CD1 3.81Å; R150-I154 HydrophobicContact CG-CD1 4.03Å; R150-I154 VanDerWaalsContact O-CG1 3.3Å; R150-I154 WeakPolarHBondContact O-CG1 3.29Å; R150-I154 PolarHBondContact O-N 3Å; V151-I154 PolarHBondContact O-N 2.85Å; V151-I154 VanDerWaalsContact O-N 3.07Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 3.38Å; I154-K157 WeakPolarHBondContact O-CA 3.48Å; I154-K157 WeakPolarHBondContact O-CB 3.39Å; I154-K157 PolarHBondContact O-N 3.33Å; I154-M158 HydrophobicContact CG2-CE 3.73Å; I154-M158 HydrophobicContact CG2-CG 3.95Å; I154-M158 HydrophobicContact CG2-SD 3.48Å; I154-M158 WeakPolarHBondContact CG2-SD 3.2Å; I154-M158 PolarHBondContact O-N 2.89Å; I154-I166 HydrophobicContact CG2-CD1 4.49Å; I154-L184 HydrophobicContact CD1-CB 4.34Å; I154-L184 HydrophobicContact CG1-CB 4.27Å; I154-L184 HydrophobicContact CG1-CD1 4.11Å
155F93.9Very high91.9Very high2 Ų264.8 Ų64.81%0.00931%0.313CS..Hα-helixtrans-57.2-44.8178.3-90.9-98.8000111.7I116 R118 M121 V151 K157 M158 D159 D164 I166I116-F155 WeakPolarHBondContact O-CZ 3.41Å; R118-F155 HydrophobicContact CB-CE2 4.25Å; R118-F155 HydrophobicContact CB-CZ 4.27Å; R118-F155 HydrophobicContact CG-CD1 3.98Å; R118-F155 HydrophobicContact CG-CD2 3.91Å; R118-F155 HydrophobicContact CG-CE1 3.79Å; R118-F155 HydrophobicContact CG-CE2 3.72Å; R118-F155 HydrophobicContact CG-CG 4.05Å; R118-F155 HydrophobicContact CG-CZ 3.67Å; R118-F155 VanDerWaalsContact N-CZ 3.33Å; M121-F155 HydrophobicContact CB-CE2 4.05Å; M121-F155 HydrophobicContact CE-CD2 4.26Å; M121-F155 HydrophobicContact CE-CE2 3.73Å; M121-F155 HydrophobicContact CE-CZ 4.48Å; M121-F155 HydrophobicContact CG-CE2 4.46Å; M121-F155 HydrophobicContact SD-CD2 3.83Å; M121-F155 HydrophobicContact SD-CE2 3.62Å; V151-F155 HydrophobicContact CG1-CD2 3.71Å; V151-F155 HydrophobicContact CG1-CE2 3.93Å; V151-F155 WeakPolarHBondContact O-CD2 3.33Å; V151-F155 PolarHBondContact O-N 3.36Å; F155-K157 PolarHBondContact O-N 2.97Å; F155-M158 PolarHBondContact O-N 3.01Å; F155-D159 HydrophobicContact CD1-CB 4.07Å; F155-D159 WeakPolarHBondContact O-CB 3.42Å; F155-D159 PolarHBondContact O-N 3.49Å; F155-D164 WeakPolarHBondContact CE1-O 3.23Å; F155-I166 HydrophobicContact CD1-CD1 3.96Å; F155-I166 HydrophobicContact CD1-CG1 4.14Å; F155-I166 HydrophobicContact CD2-CD1 3.88Å; F155-I166 HydrophobicContact CE1-CD1 3.77Å; F155-I166 HydrophobicContact CE1-CG1 3.82Å; F155-I166 HydrophobicContact CE2-CD1 3.69Å; F155-I166 HydrophobicContact CG-CD1 4.01Å; F155-I166 HydrophobicContact CZ-CD1 3.62Å; F155-I166 HydrophobicContact CZ-CG1 4.06Å
156K92.3Very high92.4Very high189 Ų18963.2 Ų63.282%0.82230%0.304SS*.Hα-helixtrans-56.7-25.4176.3-175.3175.3-180-179.30113.9D152 I154D152-K156 VanDerWaalsContact O-CB 3.25Å; D152-K156 WeakPolarHBondContact O-CB 3.43Å; D152-K156 PolarHBondContact O-N 2.96Å; I154-K156 VanDerWaalsContact C-N 3.32Å; I154-K156 PolarHBondContact O-N 3.38Å
157K89.4Confident92.9Very high72 Ų7262 Ų6231%0.31330%0.297SS..Hα-helixtrans-94.7-35.5179-73.9-172.8171.2-160.90113.4K153 I154 F155 Q160 D178 S180 I181K153-K157 WeakPolarHBondContact O-CG 3.46Å; K153-K157 PolarHBondContact O-N 3.15Å; I154-K157 WeakPolarHBondContact O-CA 3.48Å; I154-K157 WeakPolarHBondContact O-CB 3.39Å; I154-K157 PolarHBondContact O-N 3.33Å; F155-K157 PolarHBondContact O-N 2.97Å; K157-Q160 PolarHBondContact O-NE2 3.01Å; K157-D178 IonicContact NZ-OD2 2.88Å; K157-D178 PolarHBondContact NZ-OD2 3.18Å; K157-S180 PolarHBondContact NZ-OG 3.21Å; K157-I181 HydrophobicContact CB-CD1 3.93Å; K157-I181 HydrophobicContact CD-CD1 4.03Å; K157-I181 HydrophobicContact CD-CG1 4.02Å
158M92.4Very high93.1Very high0 Ų063.4 Ų63.40%030%0.303CS..Hα-helixtrans-93-48.9-171.9-67.6-170.7172.500113.1I154 F155 Q160 I166 F171 A174 I181 L185I154-M158 HydrophobicContact CG2-CE 3.73Å; I154-M158 HydrophobicContact CG2-CG 3.95Å; I154-M158 HydrophobicContact CG2-SD 3.48Å; I154-M158 WeakPolarHBondContact CG2-SD 3.2Å; I154-M158 PolarHBondContact O-N 2.89Å; F155-M158 PolarHBondContact O-N 3.01Å; M158-Q160 WeakPolarHBondContact O-CG 3.44Å; M158-Q160 PolarHBondContact O-N 2.94Å; M158-Q160 PolarHBondContact O-NE2 3.34Å; M158-I166 HydrophobicContact CB-CD1 3.76Å; M158-I166 HydrophobicContact CB-CG1 3.95Å; M158-I166 HydrophobicContact CB-CG2 4.22Å; M158-I166 HydrophobicContact CG-CD1 4.36Å; M158-I166 HydrophobicContact SD-CD1 3.75Å; M158-I166 HydrophobicContact SD-CG2 4.06Å; M158-F171 HydrophobicContact CE-CD2 3.84Å; M158-F171 HydrophobicContact CE-CE2 3.96Å; M158-F171 HydrophobicContact SD-CD2 3.89Å; M158-F171 HydrophobicContact SD-CE2 4.45Å; M158-A174 HydrophobicContact CB-CB 4.18Å; M158-A174 HydrophobicContact CG-CB 3.59Å; M158-I181 HydrophobicContact CE-CG2 3.05Å; M158-I181 HydrophobicContact CG-CD1 4.44Å; M158-L185 HydrophobicContact CE-CD1 4Å; M158-L185 HydrophobicContact CE-CD2 4.23Å; M158-L185 HydrophobicContact CE-CG 4.38Å
159D94.4Very high93.2Very high14 Ų1465.4 Ų65.48%0.07531%0.312CS..  trans-71.996.6-174.6174.45.9000109.3F155 K162 D163 D164 I166F155-D159 HydrophobicContact CD1-CB 4.07Å; F155-D159 WeakPolarHBondContact O-CB 3.42Å; F155-D159 PolarHBondContact O-N 3.49Å; D159-K162 WeakPolarHBondContact OD1-CA 3.41Å; D159-K162 PolarHBondContact OD1-N 2.92Å; D159-K162 WeakPolarHBondContact OD2-CA 3.49Å; D159-D163 PolarHBondContact OD1-N 3.06Å; D159-D164 WeakPolarHBondContact OD2-CA 3.48Å; D159-D164 PolarHBondContact OD2-N 3.16Å; D159-D164 VanDerWaalsContact OD2-N 3.11Å; D159-I166 HydrophobicContact CB-CG1 4.23Å
160Q90.9Very high93.4Very high131 Ų13162 Ų6261%0.61230%0.296SS*.SBendtrans-82.5-37.9-172-65.7-52.8-5700111.5K157 M158 E170K157-Q160 PolarHBondContact O-NE2 3.01Å; M158-Q160 WeakPolarHBondContact O-CG 3.44Å; M158-Q160 PolarHBondContact O-N 2.94Å; M158-Q160 PolarHBondContact O-NE2 3.34Å; Q160-E170 PolarHBondContact N-OE1 3.33Å
161D94.2Very high93.6Very high104 Ų10461.3 Ų61.356%0.55629%0.294SS*.SBendtrans-88.2-10.5-177.671.510000113.2D163D161-D163 VanDerWaalsContact C-N 3.34Å; D161-D163 WeakPolarHBondContact OD1-CB 3.49Å; D161-D163 VanDerWaalsContact OD1-CG 3.26Å; D161-D163 PolarHBondContact OD1-N 2.99Å
162K93.9Very high93.5Very high175 Ų17561.9 Ų61.976%0.76130%0.296SS*.  trans65.835.3177.2-54.1177.1-176.6172.20112.3D159D159-K162 WeakPolarHBondContact OD1-CA 3.41Å; D159-K162 PolarHBondContact OD1-N 2.92Å; D159-K162 WeakPolarHBondContact OD2-CA 3.49Å
163D96.4Very high93.5Very high61 Ų6163.3 Ų63.333%0.32630%0.3SS..SBendtrans-81.30.1173.782.4-5000113.4R115 D159 D161 Q165R115-D163 IonicContact NH1-OD2 3.2Å; R115-D163 PolarHBondContact NH1-OD2 3.34Å; D159-D163 PolarHBondContact OD1-N 3.06Å; D161-D163 VanDerWaalsContact C-N 3.34Å; D161-D163 WeakPolarHBondContact OD1-CB 3.49Å; D161-D163 VanDerWaalsContact OD1-CG 3.26Å; D161-D163 PolarHBondContact OD1-N 2.99Å; D163-Q165 PolarHBondContact O-N 2.92Å; D163-Q165 WeakPolarHBondContact OD1-CA 3.3Å; D163-Q165 VanDerWaalsContact OD1-CB 3.3Å; D163-Q165 WeakPolarHBondContact OD1-CB 3.39Å; D163-Q165 PolarHBondContact OD1-N 3.49Å; D163-Q165 VanDerWaalsContact OD1-O 3.13Å
164D95.1Very high93.6Very high77 Ų7759.8 Ų59.841%0.41229%0.285SS..SBendtrans67.120.2-178-144.749.8000114.2R118 F155 D159R118-D164 IonicContact CZ-OD1 2.69Å; R118-D164 VanDerWaalsContact NE-CG 3.34Å; R118-D164 IonicContact NE-OD1 3.18Å; R118-D164 PolarHBondContact NE-OD1 2.76Å; R118-D164 IonicContact NE-OD2 2.64Å; R118-D164 PolarHBondContact NE-OD2 2.88Å; R118-D164 IonicContact NH2-OD1 2.9Å; R118-D164 PolarHBondContact NH2-OD1 3.33Å; F155-D164 WeakPolarHBondContact CE1-O 3.23Å; D159-D164 WeakPolarHBondContact OD2-CA 3.48Å; D159-D164 PolarHBondContact OD2-N 3.16Å; D159-D164 VanDerWaalsContact OD2-N 3.11Å
165Q96.8Very high93.4Very high58 Ų5859.8 Ų59.827%0.27129%0.285SS..EExtended strand (participates in β ladder)trans-129.6160173.7-53.1-178.4-2400108.8R115 I116 D163R115-Q165 HydrophobicContact CB-CB 4.35Å; I116-Q165 CarbonylContact O-C 3.6Å; I116-Q165 WeakPolarHBondContact O-CA 3.5Å; D163-Q165 PolarHBondContact O-N 2.92Å; D163-Q165 WeakPolarHBondContact OD1-CA 3.3Å; D163-Q165 VanDerWaalsContact OD1-CB 3.3Å; D163-Q165 WeakPolarHBondContact OD1-CB 3.39Å; D163-Q165 PolarHBondContact OD1-N 3.49Å; D163-Q165 VanDerWaalsContact OD1-O 3.13Å
166I96.2Very high93.1Very high0 Ų065.4 Ų65.40%031%0.31CS..EExtended strand (participates in β ladder)trans-123.9116.9175.2-65.7159.7000107.9F105 R115 I116 M121 I154 F155 M158 D159 E170 F171F105-I166 WeakPolarHBondContact CE2-O 3.19Å; R115-I166 WeakPolarHBondContact CA-O 3.35Å; I116-I166 HydrophobicContact CB-CB 4.31Å; I116-I166 PolarHBondContact N-O 3.07Å; I116-I166 PolarHBondContact O-N 2.9Å; M121-I166 HydrophobicContact CE-CD1 3.52Å; I154-I166 HydrophobicContact CG2-CD1 4.49Å; F155-I166 HydrophobicContact CD1-CD1 3.96Å; F155-I166 HydrophobicContact CD1-CG1 4.14Å; F155-I166 HydrophobicContact CD2-CD1 3.88Å; F155-I166 HydrophobicContact CE1-CD1 3.77Å; F155-I166 HydrophobicContact CE1-CG1 3.82Å; F155-I166 HydrophobicContact CE2-CD1 3.69Å; F155-I166 HydrophobicContact CG-CD1 4.01Å; F155-I166 HydrophobicContact CZ-CD1 3.62Å; F155-I166 HydrophobicContact CZ-CG1 4.06Å; M158-I166 HydrophobicContact CB-CD1 3.76Å; M158-I166 HydrophobicContact CB-CG1 3.95Å; M158-I166 HydrophobicContact CB-CG2 4.22Å; M158-I166 HydrophobicContact CG-CD1 4.36Å; M158-I166 HydrophobicContact SD-CD1 3.75Å; M158-I166 HydrophobicContact SD-CG2 4.06Å; D159-I166 HydrophobicContact CB-CG1 4.23Å; I166-E170 HydrophobicContact CG2-CB 4.18Å; I166-F171 HydrophobicContact CG2-CB 3.98Å; I166-F171 HydrophobicContact CG2-CD2 4.37Å
167T96.9Very high92.8Very high36 Ų3660.4 Ų60.422%0.22130%0.299CS..EExtended strand (participates in β ladder)trans-79.5162.1174.462.30000111.6F105 E169 E170 F171F105-T167 VanDerWaalsContact CE2-C 3.49Å; T167-E169 PolarHBondContact O-N 3.21Å; T167-E170 PolarHBondContact N-OE2 3.26Å; T167-E170 PolarHBondContact O-N 2.95Å; T167-E170 WeakPolarHBondContact OG1-CG 3.03Å; T167-E170 PolarHBondContact OG1-N 3.26Å; T167-E170 PolarHBondContact OG1-OE2 2.78Å; T167-F171 WeakPolarHBondContact O-CB 3.14Å; T167-F171 PolarHBondContact O-N 3.27Å
168L94.4Very high92.3Very high51 Ų5159.2 Ų59.227%0.26730%0.296SS..Hα-helixtrans-56.9-36.3175.7179.662.1000112.4F105 F171 K172F105-L168 HydrophobicContact CB-CD1 3.65Å; F105-L168 HydrophobicContact CD1-CB 4.46Å; F105-L168 HydrophobicContact CD1-CD1 4.13Å; F105-L168 HydrophobicContact CD2-CB 4.22Å; F105-L168 HydrophobicContact CD2-CD1 3.84Å; F105-L168 HydrophobicContact CE1-CB 4.37Å; F105-L168 VanDerWaalsContact CE2-CA 3.49Å; F105-L168 HydrophobicContact CE2-CB 4.12Å; F105-L168 VanDerWaalsContact CE2-N 3.32Å; F105-L168 HydrophobicContact CG-CB 4.4Å; F105-L168 HydrophobicContact CG-CD1 3.59Å; F105-L168 HydrophobicContact CZ-CB 4.2Å; L168-F171 PolarHBondContact O-N 2.71Å; L168-K172 HydrophobicContact CD1-CD 4.42Å; L168-K172 HydrophobicContact CD1-CG 4.28Å; L168-K172 HydrophobicContact CG-CD 4.26Å; L168-K172 WeakPolarHBondContact O-CB 3.38Å; L168-K172 VanDerWaalsContact O-CG 3.29Å; L168-K172 WeakPolarHBondContact O-CG 3.44Å; L168-K172 PolarHBondContact O-N 3.34Å
169E94.7Very high91.5Very high129 Ų12963.6 Ų63.660%0.60332%0.324SS*.Hα-helixtrans-68.1-44.4178.6-64.8-54.4138.700111.7T167 F171 K172 E173T167-E169 PolarHBondContact O-N 3.21Å; E169-F171 VanDerWaalsContact C-N 3.35Å; E169-F171 PolarHBondContact O-N 3.17Å; E169-K172 PolarHBondContact O-N 2.93Å; E169-E173 VanDerWaalsContact O-CB 3.32Å; E169-E173 WeakPolarHBondContact O-CB 3.29Å; E169-E173 PolarHBondContact O-N 2.56Å
170E95.1Very high90.4Very high20 Ų2065 Ų659%0.09334%0.335CS..Hα-helixtrans-63.1-42174.1-72172.1120.900111.9Q160 I166 T167 K172 E173 A174Q160-E170 PolarHBondContact N-OE1 3.33Å; I166-E170 HydrophobicContact CG2-CB 4.18Å; T167-E170 PolarHBondContact N-OE2 3.26Å; T167-E170 PolarHBondContact O-N 2.95Å; T167-E170 WeakPolarHBondContact OG1-CG 3.03Å; T167-E170 PolarHBondContact OG1-N 3.26Å; T167-E170 PolarHBondContact OG1-OE2 2.78Å; E170-K172 PolarHBondContact O-N 3.34Å; E170-E173 PolarHBondContact O-N 3.43Å; E170-A174 WeakPolarHBondContact O-CB 3.41Å; E170-A174 PolarHBondContact O-N 2.95Å
171F92.9Very high89.5Confident0 Ų058.9 Ų58.90%031%0.307CS..Hα-helixtrans-59.9-46.7176.4-171.3-91.1000111.6L101 A104 F105 Y108 I116 M158 I166 T167 L168 E169 A175 L185L101-F171 HydrophobicContact CB-CE1 4.44Å; L101-F171 HydrophobicContact CD2-CD1 4.49Å; L101-F171 HydrophobicContact CD2-CE1 3.94Å; A104-F171 HydrophobicContact CB-CE1 4.27Å; A104-F171 HydrophobicContact CB-CZ 4.15Å; F105-F171 HydrophobicContact CB-CD1 4.39Å; F105-F171 HydrophobicContact CB-CE1 4.44Å; F105-F171 HydrophobicContact CD2-CB 3.82Å; F105-F171 HydrophobicContact CD2-CD1 4.28Å; F105-F171 HydrophobicContact CD2-CD2 4.19Å; F105-F171 AromaticContact CD2-CG 3.87Å; F105-F171 HydrophobicContact CD2-CG 3.87Å; F105-F171 HydrophobicContact CE2-CB 4.23Å; Y108-F171 HydrophobicContact CD2-CE2 4.45Å; I116-F171 HydrophobicContact CD1-CD2 3.98Å; I116-F171 HydrophobicContact CD1-CE2 4.19Å; M158-F171 HydrophobicContact CE-CD2 3.84Å; M158-F171 HydrophobicContact CE-CE2 3.96Å; M158-F171 HydrophobicContact SD-CD2 3.89Å; M158-F171 HydrophobicContact SD-CE2 4.45Å; I166-F171 HydrophobicContact CG2-CB 3.98Å; I166-F171 HydrophobicContact CG2-CD2 4.37Å; T167-F171 WeakPolarHBondContact O-CB 3.14Å; T167-F171 PolarHBondContact O-N 3.27Å; L168-F171 PolarHBondContact O-N 2.71Å; E169-F171 VanDerWaalsContact C-N 3.35Å; E169-F171 PolarHBondContact O-N 3.17Å; F171-A175 VanDerWaalsContact O-CB 3.3Å; F171-A175 WeakPolarHBondContact O-CB 3.25Å; F171-A175 PolarHBondContact O-N 3.37Å; F171-L185 HydrophobicContact CE1-CD1 4.14Å; F171-L185 HydrophobicContact CE2-CD1 3.62Å; F171-L185 HydrophobicContact CE2-CD2 3.83Å; F171-L185 HydrophobicContact CE2-CG 4.39Å; F171-L185 HydrophobicContact CZ-CD1 3.32Å; F171-L185 HydrophobicContact CZ-CD2 4.15Å; F171-L185 HydrophobicContact CZ-CG 4.34Å
172K91.4Very high88.3Confident16 Ų1654.8 Ų54.87%0.0729%0.285CS..Hα-helixtrans-64.8-44.8176.9-77.3178.8179.7-177.50112E98 L101 N102 L168 E169 E170 A175 K176E98-K172 IonicContact OE1-NZ 3.37Å; E98-K172 PolarHBondContact OE1-NZ 3.01Å; L101-K172 HydrophobicContact CD1-CG 4.37Å; N102-K172 WeakPolarHBondContact OD1-CE 3.29Å; N102-K172 PolarHBondContact OD1-NZ 2.69Å; L168-K172 HydrophobicContact CD1-CD 4.42Å; L168-K172 HydrophobicContact CD1-CG 4.28Å; L168-K172 HydrophobicContact CG-CD 4.26Å; L168-K172 WeakPolarHBondContact O-CB 3.38Å; L168-K172 VanDerWaalsContact O-CG 3.29Å; L168-K172 WeakPolarHBondContact O-CG 3.44Å; L168-K172 PolarHBondContact O-N 3.34Å; E169-K172 PolarHBondContact O-N 2.93Å; E170-K172 PolarHBondContact O-N 3.34Å; K172-A175 PolarHBondContact O-N 3.15Å; K172-K176 WeakPolarHBondContact O-CB 3.41Å; K172-K176 VanDerWaalsContact O-CG 3.24Å; K172-K176 WeakPolarHBondContact O-CG 3.23Å; K172-K176 PolarHBondContact O-N 2.93Å
173E92.4Very high87Confident116 Ų11650.7 Ų50.754%0.54227%0.271SS..Hα-helixtrans-64.8-42.7-179.9-175.557.5-15400111.2E169 E170 K176 S177E169-E173 VanDerWaalsContact O-CB 3.32Å; E169-E173 WeakPolarHBondContact O-CB 3.29Å; E169-E173 PolarHBondContact O-N 2.56Å; E170-E173 PolarHBondContact O-N 3.43Å; E173-K176 PolarHBondContact O-N 3.04Å; E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 2.94Å; E173-S177 PolarHBondContact O-OG 3.16Å
174A90.6Very high85.2Confident4 Ų448.6 Ų48.63%0.03326%0.26CS..Hα-helixtrans-63.4-45.8175.700000111.6M158 E170 K176 S177 D178 I181M158-A174 HydrophobicContact CB-CB 4.18Å; M158-A174 HydrophobicContact CG-CB 3.59Å; E170-A174 WeakPolarHBondContact O-CB 3.41Å; E170-A174 PolarHBondContact O-N 2.95Å; A174-K176 VanDerWaalsContact C-N 3.29Å; A174-K176 PolarHBondContact O-N 2.73Å; A174-S177 WeakPolarHBondContact CA-OG 3.26Å; A174-S177 PolarHBondContact O-N 3.18Å; A174-S177 PolarHBondContact O-OG 2.84Å; A174-D178 PolarHBondContact O-N 3.16Å; A174-I181 HydrophobicContact CB-CD1 3.68Å
175A87.8Confident83.7Confident1 Ų145.7 Ų45.71%0.00824%0.244CC..Hα-helixtrans-64.4-31.6177.900000113.4F97 L101 F171 K172 V182F97-A175 HydrophobicContact CZ-CB 4.45Å; L101-A175 HydrophobicContact CD1-CB 3.77Å; L101-A175 HydrophobicContact CD2-CB 3.57Å; L101-A175 HydrophobicContact CG-CB 4.34Å; F171-A175 VanDerWaalsContact O-CB 3.3Å; F171-A175 WeakPolarHBondContact O-CB 3.25Å; F171-A175 PolarHBondContact O-N 3.37Å; K172-A175 PolarHBondContact O-N 3.15Å; A175-V182 HydrophobicContact CB-CG2 3.85Å
176K86.5Confident82Confident120 Ų12048.6 Ų48.652%0.52226%0.258SS..Hα-helixtrans-76-42.1175.2-73.7170.7-175.8172.50112.5F97 K172 E173 A174F97-K176 HydrophobicContact CE1-CG 4.18Å; K172-K176 WeakPolarHBondContact O-CB 3.41Å; K172-K176 VanDerWaalsContact O-CG 3.24Å; K172-K176 WeakPolarHBondContact O-CG 3.23Å; K172-K176 PolarHBondContact O-N 2.93Å; E173-K176 PolarHBondContact O-N 3.04Å; A174-K176 VanDerWaalsContact C-N 3.29Å; A174-K176 PolarHBondContact O-N 2.73Å
177S85.7Confident79.7Confident84 Ų8449.2 Ų49.259%0.58726%0.262SS*.Hα-helixtrans-76.4-32.1-175.957.30000113.1E173 A174E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 2.94Å; E173-S177 PolarHBondContact O-OG 3.16Å; A174-S177 WeakPolarHBondContact CA-OG 3.26Å; A174-S177 PolarHBondContact O-N 3.18Å; A174-S177 PolarHBondContact O-OG 2.84Å
178D79.5Confident76.8Confident47 Ų4751.8 Ų51.825%0.25127%0.274SS..  trans-135.495.5179-175.3-4.4000110.6K157 A174 S180 I181K157-D178 IonicContact NZ-OD2 2.88Å; K157-D178 PolarHBondContact NZ-OD2 3.18Å; A174-D178 PolarHBondContact O-N 3.16Å; D178-S180 PolarHBondContact O-N 3.3Å; D178-S180 WeakPolarHBondContact OD1-CA 3.15Å; D178-S180 WeakPolarHBondContact OD1-CB 3.47Å; D178-S180 PolarHBondContact OD1-N 3.33Å; D178-S180 PolarHBondContact OD1-OG 3.09Å; D178-S180 PolarHBondContact OD2-OG 2.99Å; D178-I181 HydrophobicContact CB-CD1 3.92Å; D178-I181 HydrophobicContact CB-CG1 3.96Å; D178-I181 WeakPolarHBondContact O-CB 3.39Å; D178-I181 PolarHBondContact O-N 2.8Å
179P76.4Confident74.2Confident91 Ų9154.8 Ų54.859%0.59129%0.288SS*.Hα-helixtrans-56.6-19.9175.8-26.935.3000114.2I181 V182 L183P179-I181 PolarHBondContact O-N 3.37Å; P179-V182 WeakPolarHBondContact O-CB 3.25Å; P179-V182 PolarHBondContact O-N 2.84Å; P179-V182 VanDerWaalsContact O-N 3.15Å; P179-L183 PolarHBondContact O-N 3.11Å
180S71.9Confident71Confident44 Ų4456.7 Ų56.731%0.30830%0.297SS..Hα-helixtrans-66.3-22.8173.380.10000112.5K157 D178 V182 L183 L184K157-S180 PolarHBondContact NZ-OG 3.21Å; D178-S180 PolarHBondContact O-N 3.3Å; D178-S180 WeakPolarHBondContact OD1-CA 3.15Å; D178-S180 WeakPolarHBondContact OD1-CB 3.47Å; D178-S180 PolarHBondContact OD1-N 3.33Å; D178-S180 PolarHBondContact OD1-OG 3.09Å; D178-S180 PolarHBondContact OD2-OG 2.99Å; S180-V182 VanDerWaalsContact C-N 3.32Å; S180-L183 CarbonylContact O-C 3.53Å; S180-L183 WeakPolarHBondContact O-CA 3.38Å; S180-L183 WeakPolarHBondContact O-CB 3.47Å; S180-L183 PolarHBondContact O-N 3.31Å; S180-L183 VanDerWaalsContact O-N 3.16Å; S180-L184 WeakPolarHBondContact O-CG 3.13Å; S180-L184 PolarHBondContact O-N 3.43Å
181I70.8Confident67.9Low3 Ų368.7 Ų68.72%0.01535%0.349CS..Hα-helixtrans-65.1-39.9172.7-70.2-178.4000110.6K157 M158 A174 D178 P179 L183 L184 L185K157-I181 HydrophobicContact CB-CD1 3.93Å; K157-I181 HydrophobicContact CD-CD1 4.03Å; K157-I181 HydrophobicContact CD-CG1 4.02Å; M158-I181 HydrophobicContact CE-CG2 3.05Å; M158-I181 HydrophobicContact CG-CD1 4.44Å; A174-I181 HydrophobicContact CB-CD1 3.68Å; D178-I181 HydrophobicContact CB-CD1 3.92Å; D178-I181 HydrophobicContact CB-CG1 3.96Å; D178-I181 WeakPolarHBondContact O-CB 3.39Å; D178-I181 PolarHBondContact O-N 2.8Å; P179-I181 PolarHBondContact O-N 3.37Å; I181-L183 PolarHBondContact O-N 3.25Å; I181-L184 WeakPolarHBondContact O-CA 3.4Å; I181-L184 WeakPolarHBondContact O-CB 3.38Å; I181-L184 PolarHBondContact O-N 2.98Å; I181-L185 HydrophobicContact CG2-CD1 4.16Å; I181-L185 VanDerWaalsContact O-CG 3.31Å; I181-L185 WeakPolarHBondContact O-CG 3.36Å; I181-L185 PolarHBondContact O-N 2.87Å
182V69.7Low66.7Low17 Ų1772.1 Ų72.110%0.10337%0.366CS..Hα-helixtrans-61.1-36.8173.1-177.30000110.5F97 L101 A175 P179 S180 L184 L185 Q186F97-V182 HydrophobicContact CE2-CG2 4.29Å; F97-V182 HydrophobicContact CZ-CG2 4.26Å; L101-V182 HydrophobicContact CD2-CG2 4.5Å; A175-V182 HydrophobicContact CB-CG2 3.85Å; P179-V182 WeakPolarHBondContact O-CB 3.25Å; P179-V182 PolarHBondContact O-N 2.84Å; P179-V182 VanDerWaalsContact O-N 3.15Å; S180-V182 VanDerWaalsContact C-N 3.32Å; V182-L184 VanDerWaalsContact C-N 3.34Å; V182-L185 PolarHBondContact O-N 2.91Å; V182-Q186 HydrophobicContact CG1-CG 4.15Å; V182-Q186 VanDerWaalsContact O-CB 3.23Å; V182-Q186 WeakPolarHBondContact O-CB 3.14Å; V182-Q186 WeakPolarHBondContact O-CG 3.42Å; V182-Q186 PolarHBondContact O-N 3.49Å
183L65.5Low65.4Low90 Ų9075.1 Ų75.147%0.47138%0.382SS..Hα-helixtrans-71.4-24173.3-59.3173.9000113.7P179 S180 I181 L185 Q186P179-L183 PolarHBondContact O-N 3.11Å; S180-L183 CarbonylContact O-C 3.53Å; S180-L183 WeakPolarHBondContact O-CA 3.38Å; S180-L183 WeakPolarHBondContact O-CB 3.47Å; S180-L183 PolarHBondContact O-N 3.31Å; S180-L183 VanDerWaalsContact O-N 3.16Å; I181-L183 PolarHBondContact O-N 3.25Å; L183-L185 VanDerWaalsContact C-N 3.35Å; L183-Q186 CarbonylContact C-O 3.52Å; L183-Q186 CarbonylContact O-C 3.35Å
184L59.9Low63.9Low17 Ų1772.8 Ų72.89%0.08937%0.373CS..Hα-helixtrans-74.1-31.6173.1-69.9174.1000111.4I154 S180 I181 V182I154-L184 HydrophobicContact CD1-CB 4.34Å; I154-L184 HydrophobicContact CG1-CB 4.27Å; I154-L184 HydrophobicContact CG1-CD1 4.11Å; S180-L184 WeakPolarHBondContact O-CG 3.13Å; S180-L184 PolarHBondContact O-N 3.43Å; I181-L184 WeakPolarHBondContact O-CA 3.4Å; I181-L184 WeakPolarHBondContact O-CB 3.38Å; I181-L184 PolarHBondContact O-N 2.98Å; V182-L184 VanDerWaalsContact C-N 3.34Å
185L63.4Low62.3Low16 Ų1676.8 Ų76.88%0.08439%0.393CS..Hα-helixtrans-82.6-45.7177.5-61164.6000111.4Y108 M158 F171 I181 V182 L183 C187Y108-L185 HydrophobicContact CD2-CD2 4.2Å; Y108-L185 HydrophobicContact CE1-CD2 4.41Å; Y108-L185 HydrophobicContact CE2-CB 4.33Å; Y108-L185 HydrophobicContact CE2-CD2 3.46Å; Y108-L185 VanDerWaalsContact CE2-CD2 3.46Å; Y108-L185 HydrophobicContact CE2-CG 4.44Å; M158-L185 HydrophobicContact CE-CD1 4Å; M158-L185 HydrophobicContact CE-CD2 4.23Å; M158-L185 HydrophobicContact CE-CG 4.38Å; F171-L185 HydrophobicContact CE1-CD1 4.14Å; F171-L185 HydrophobicContact CE2-CD1 3.62Å; F171-L185 HydrophobicContact CE2-CD2 3.83Å; F171-L185 HydrophobicContact CE2-CG 4.39Å; F171-L185 HydrophobicContact CZ-CD1 3.32Å; F171-L185 HydrophobicContact CZ-CD2 4.15Å; F171-L185 HydrophobicContact CZ-CG 4.34Å; I181-L185 HydrophobicContact CG2-CD1 4.16Å; I181-L185 VanDerWaalsContact O-CG 3.31Å; I181-L185 WeakPolarHBondContact O-CG 3.36Å; I181-L185 PolarHBondContact O-N 2.87Å; V182-L185 PolarHBondContact O-N 2.91Å; L183-L185 VanDerWaalsContact C-N 3.35Å; L185-C187 VanDerWaalsContact C-N 3.33Å; L185-C187 PolarHBondContact O-N 2.88Å
186Q60.3Low60.7Low119 Ų11981.6 Ų81.656%0.55642%0.417SS*.SBendtrans-84.978.5168.6-59.7176.2-1.200106.9V182 L183 D188V182-Q186 HydrophobicContact CG1-CG 4.15Å; V182-Q186 VanDerWaalsContact O-CB 3.23Å; V182-Q186 WeakPolarHBondContact O-CB 3.14Å; V182-Q186 WeakPolarHBondContact O-CG 3.42Å; V182-Q186 PolarHBondContact O-N 3.49Å; L183-Q186 CarbonylContact C-O 3.52Å; L183-Q186 CarbonylContact O-C 3.35Å; Q186-D188 WeakPolarHBondContact O-CA 3.33Å; Q186-D188 PolarHBondContact O-N 3.21Å
187C47.6Very low59Low12 Ų1279 Ų798%0.08141%0.41CS..  trans-41.8110.6164.2-87.30000106.8I128 M140 L185 M189I128-C187 HydrophobicContact CG2-CB 3.6Å; I128-C187 VanDerWaalsContact CG2-SG 3.52Å; M140-C187 HydrophobicContact CE-CB 3.69Å; M140-C187 WeakPolarHBondContact CE-O 3.43Å; M140-C187 HydrophobicContact SD-CB 4.08Å; L185-C187 VanDerWaalsContact C-N 3.33Å; L185-C187 PolarHBondContact O-N 2.88Å; C187-M189 VanDerWaalsContact C-N 3.34Å; C187-M189 WeakPolarHBondContact O-CG 3.42Å; C187-M189 PolarHBondContact O-N 3.21Å
188D36.3Very low57.1Low90 Ų9078.6 Ų78.648%0.48140%0.398SS..  trans-5588.6-160.6-157.3-6.2000112M140 Q186 Q190M140-D188 WeakPolarHBondContact CE-O 3.3Å; Q186-D188 WeakPolarHBondContact O-CA 3.33Å; Q186-D188 PolarHBondContact O-N 3.21Å; D188-Q190 PolarHBondContact O-N 2.91Å
189M39.2Very low55.4Low114 Ų11481.1 Ų81.156%0.56241%0.409SS*.  trans-82.56.8-176.6-66.8-161.6-6200111.8F56 M131 M140 C187F56-M189 HydrophobicContact CE1-SD 4.05Å; F56-M189 HydrophobicContact CZ-SD 3.76Å; M131-M189 HydrophobicContact CE-SD 3.99Å; M140-M189 HydrophobicContact CE-CB 4.37Å; M140-M189 HydrophobicContact CE-CG 3.73Å; C187-M189 VanDerWaalsContact C-N 3.34Å; C187-M189 WeakPolarHBondContact O-CG 3.42Å; C187-M189 PolarHBondContact O-N 3.21Å
190Q29.1Very low53.6Low170 Ų17080.3 Ų80.379%0.79439%0.394SS*.  trans-117.471.1-174.2-66.5-164.3-17.400112.3D188D188-Q190 PolarHBondContact O-N 2.91Å
191K29.6Very low51.9Low271 Ų27183.5 Ų83.5100%1.17840%0.401SS*.  trans-151.50141.8-73.2-160-178.9170.10111.8

Retrieved 191 of 191 residues in 63.5 ms (Link to these results)

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