A0A5K4F6U6_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F6U6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 130 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
1M59.5Low79.5Confident212 Ų21263.2 Ų63.2100%1.04435%0.352SS*.  0129.70-82.3174.816500108.3V6M1-V6 HydrophobicContact CB-CG2 4.26Å; M1-V6 HydrophobicContact SD-CG2 4.46Å
2T81.1Confident79.9Confident96 Ų9667.4 Ų67.459%0.58937%0.367SS*.  trans-90.6154.3173.458.90000109.8G4 S5 V6T2-G4 PolarHBondContact O-N 3.17Å; T2-S5 PolarHBondContact N-OG 2.78Å; T2-S5 PolarHBondContact O-N 3.33Å; T2-S5 PolarHBondContact O-OG 3.41Å; T2-S5 WeakPolarHBondContact OG1-CB 3.24Å; T2-S5 PolarHBondContact OG1-N 3.07Å; T2-S5 PolarHBondContact OG1-OG 2.89Å; T2-V6 PolarHBondContact O-N 3.05Å
3L78.5Confident80.2Confident49 Ų4973.8 Ų73.826%0.25739%0.393SS..Hα-helixtrans-52.9-42.5176.4-168.197.4000111.6S5 V6 A7 Y23 I26 T27 L30L3-S5 PolarHBondContact O-N 3.24Å; L3-V6 PolarHBondContact O-N 3.23Å; L3-A7 PolarHBondContact O-N 3.3Å; L3-Y23 HydrophobicContact CB-CE2 4.28Å; L3-Y23 HydrophobicContact CD2-CD2 4.37Å; L3-Y23 HydrophobicContact CD2-CE2 3.75Å; L3-I26 HydrophobicContact CD2-CB 4.42Å; L3-I26 HydrophobicContact CD2-CG2 3.74Å; L3-I26 HydrophobicContact CG-CG2 4.28Å; L3-T27 WeakPolarHBondContact CD2-OG1 3.24Å; L3-L30 HydrophobicContact CD1-CD2 3.62Å; L3-L30 HydrophobicContact CG-CD2 4.33Å
4G79.3Confident80.4Confident26 Ų2673.4 Ų73.427%0.26839%0.386SS..Hα-helixtrans-58.6-45.117600000112.9T2 V6 A7 E8T2-G4 PolarHBondContact O-N 3.17Å; G4-V6 VanDerWaalsContact C-N 3.32Å; G4-V6 PolarHBondContact O-N 3.08Å; G4-A7 PolarHBondContact O-N 2.96Å; G4-E8 WeakPolarHBondContact O-CB 3.01Å; G4-E8 PolarHBondContact O-N 3.39Å
5S82Confident80.7Confident35 Ų3579.1 Ų79.125%0.24542%0.417CS..Hα-helixtrans-65.4-32.5178.266.60000113.6T2 L3 N9T2-S5 PolarHBondContact N-OG 2.78Å; T2-S5 PolarHBondContact O-N 3.33Å; T2-S5 PolarHBondContact O-OG 3.41Å; T2-S5 WeakPolarHBondContact OG1-CB 3.24Å; T2-S5 PolarHBondContact OG1-N 3.07Å; T2-S5 PolarHBondContact OG1-OG 2.89Å; L3-S5 PolarHBondContact O-N 3.24Å; S5-N9 WeakPolarHBondContact O-CB 3.45Å; S5-N9 PolarHBondContact O-N 3.32Å; S5-N9 PolarHBondContact O-ND2 3.3Å
6V81.5Confident80.9Confident57 Ų5776.8 Ų76.835%0.34541%0.405SS..Hα-helixtrans-71.9-44.2176.6175.30000110.3M1 T2 L3 G4 L10M1-V6 HydrophobicContact CB-CG2 4.26Å; M1-V6 HydrophobicContact SD-CG2 4.46Å; T2-V6 PolarHBondContact O-N 3.05Å; L3-V6 PolarHBondContact O-N 3.23Å; G4-V6 VanDerWaalsContact C-N 3.32Å; G4-V6 PolarHBondContact O-N 3.08Å; V6-L10 WeakPolarHBondContact O-CB 3.39Å; V6-L10 PolarHBondContact O-N 3.06Å
7A79.9Confident81.1Confident0 Ų078 Ų780%041%0.411CS..Hα-helixtrans-62.7-48.7176.300000111.5L3 G4 N9 L10 F11 I26L3-A7 PolarHBondContact O-N 3.3Å; G4-A7 PolarHBondContact O-N 2.96Å; A7-N9 VanDerWaalsContact C-N 3.34Å; A7-N9 PolarHBondContact O-N 3.39Å; A7-L10 PolarHBondContact O-N 3.27Å; A7-L10 VanDerWaalsContact O-N 3.08Å; A7-F11 HydrophobicContact CB-CD2 3.99Å; A7-F11 HydrophobicContact CB-CE2 4.11Å; A7-F11 WeakPolarHBondContact O-CB 2.94Å; A7-F11 WeakPolarHBondContact O-CD2 3.39Å; A7-F11 PolarHBondContact O-N 3.45Å; A7-I26 HydrophobicContact CB-CG2 3.45Å; A7-I26 VanDerWaalsContact CB-CG2 3.45Å
8E83Confident81.2Confident64 Ų6474 Ų7430%0.29939%0.39SS..Hα-helixtrans-55.4-49.6178.1-172.9174.1-165.300110.6G4 L10 F11 Q12 K19G4-E8 WeakPolarHBondContact O-CB 3.01Å; G4-E8 PolarHBondContact O-N 3.39Å; E8-L10 VanDerWaalsContact C-N 3.32Å; E8-L10 PolarHBondContact O-N 2.85Å; E8-F11 PolarHBondContact O-N 2.74Å; E8-Q12 WeakPolarHBondContact O-CA 3.5Å; E8-Q12 WeakPolarHBondContact O-CB 3.2Å; E8-Q12 PolarHBondContact O-N 3.36Å; E8-K19 WeakPolarHBondContact OE1-CE 3.09Å; E8-K19 IonicContact OE1-NZ 3.93Å
9N83.9Confident81.2Confident112 Ų11278.1 Ų78.160%0.59941%0.405SS*.Hα-helixtrans-59.8-38.7176.9-77.6-50.6000113.6S5 A7S5-N9 WeakPolarHBondContact O-CB 3.45Å; S5-N9 PolarHBondContact O-N 3.32Å; S5-N9 PolarHBondContact O-ND2 3.3Å; A7-N9 VanDerWaalsContact C-N 3.34Å; A7-N9 PolarHBondContact O-N 3.39Å
10L82.6Confident81.5Confident44 Ų4483.4 Ų83.423%0.2343%0.427CS..Hα-helixtrans-72.5-42.7-178.7-173.3147.7000112.1V6 A7 E8 F14 I119V6-L10 WeakPolarHBondContact O-CB 3.39Å; V6-L10 PolarHBondContact O-N 3.06Å; A7-L10 PolarHBondContact O-N 3.27Å; A7-L10 VanDerWaalsContact O-N 3.08Å; E8-L10 VanDerWaalsContact C-N 3.32Å; E8-L10 PolarHBondContact O-N 2.85Å; L10-F14 WeakPolarHBondContact O-CD2 3.36Å; L10-I119 HydrophobicContact CD2-CD1 3.98Å; L10-I119 HydrophobicContact CD2-CG1 4.01Å
11F83.9Confident81.8Confident0 Ų081 Ų810%041%0.413CS..Hα-helixtrans-87.9-30.8-174-71-65000112.9A7 E8 H13 F14 N15 I16 T18 W21 A29 I119 V123A7-F11 HydrophobicContact CB-CD2 3.99Å; A7-F11 HydrophobicContact CB-CE2 4.11Å; A7-F11 WeakPolarHBondContact O-CB 2.94Å; A7-F11 WeakPolarHBondContact O-CD2 3.39Å; A7-F11 PolarHBondContact O-N 3.45Å; E8-F11 PolarHBondContact O-N 2.74Å; F11-H13 PolarHBondContact O-N 2.86Å; F11-F14 CarbonylContact O-C 3.59Å; F11-F14 WeakPolarHBondContact O-CA 3.4Å; F11-F14 PolarHBondContact O-N 3.39Å; F11-N15 PolarHBondContact O-N 3.09Å; F11-I16 CarbonylContact C-O 3.43Å; F11-I16 HydrophobicContact CB-CB 3.97Å; F11-I16 HydrophobicContact CB-CG2 4.11Å; F11-I16 HydrophobicContact CD1-CD1 4.13Å; F11-I16 HydrophobicContact CD1-CG2 4.45Å; F11-I16 HydrophobicContact CG-CG2 4.5Å; F11-I16 PolarHBondContact O-N 3.36Å; F11-I16 VanDerWaalsContact O-N 3.08Å; F11-T18 HydrophobicContact CB-CG2 3.67Å; F11-T18 HydrophobicContact CD2-CG2 3.72Å; F11-T18 HydrophobicContact CG-CG2 3.9Å; F11-W21 HydrophobicContact CE2-CZ3 4.5Å; F11-A29 HydrophobicContact CE2-CB 4.21Å; F11-A29 HydrophobicContact CZ-CB 3.84Å; F11-I119 HydrophobicContact CD1-CG2 3.72Å; F11-I119 HydrophobicContact CE1-CG2 3.82Å; F11-V123 HydrophobicContact CD1-CG2 4.07Å; F11-V123 HydrophobicContact CE1-CG2 3.81Å
12Q83.9Confident83.3Confident114 Ų11473.8 Ų73.853%0.53338%0.384SS..Hα-helixtrans-63.3-31.4175.8-173.8179.97.600111.8E8 F14 N15E8-Q12 WeakPolarHBondContact O-CA 3.5Å; E8-Q12 WeakPolarHBondContact O-CB 3.2Å; E8-Q12 PolarHBondContact O-N 3.36Å; Q12-F14 PolarHBondContact O-N 2.9Å; Q12-N15 PolarHBondContact O-N 3.44Å
13H83.6Confident83.7Confident150 Ų15077.1 Ų77.169%0.69439%0.386SS*.THydrogen-bonded Turntrans-57.3-22.2171.2-170.178.7000112.8F11F11-H13 PolarHBondContact O-N 2.86Å
14F83.1Confident84.2Confident68 Ų6877.7 Ų77.730%0.29839%0.394SS..THydrogen-bonded Turntrans-110.118.6178.1-64.8-87.3000112.6L10 F11 Q12 I16 I115 P116 I119L10-F14 WeakPolarHBondContact O-CD2 3.36Å; F11-F14 CarbonylContact O-C 3.59Å; F11-F14 WeakPolarHBondContact O-CA 3.4Å; F11-F14 PolarHBondContact O-N 3.39Å; Q12-F14 PolarHBondContact O-N 2.9Å; F14-I16 HydrophobicContact CB-CD1 3.98Å; F14-I16 HydrophobicContact CB-CG1 4.41Å; F14-I16 PolarHBondContact O-N 3.47Å; F14-I115 HydrophobicContact CZ-CG2 3.98Å; F14-P116 HydrophobicContact CD1-CB 4.44Å; F14-P116 HydrophobicContact CE1-CB 3.9Å; F14-P116 HydrophobicContact CE1-CG 3.89Å; F14-I119 HydrophobicContact CB-CG2 4.42Å; F14-I119 HydrophobicContact CD2-CD1 3.35Å; F14-I119 HydrophobicContact CD2-CG2 4.18Å; F14-I119 HydrophobicContact CE1-CD1 4.31Å; F14-I119 HydrophobicContact CE2-CD1 2.98Å; F14-I119 HydrophobicContact CE2-CG1 4.41Å; F14-I119 HydrophobicContact CG-CD1 4.16Å; F14-I119 HydrophobicContact CG-CG2 4.22Å; F14-I119 HydrophobicContact CZ-CD1 3.53Å
15N84.8Confident84.8Confident160 Ų16079.7 Ų79.786%0.85639%0.394SS*.THydrogen-bonded Turntrans56.128.8-177.5-61.9-39.5000114.2F11 Q12F11-N15 PolarHBondContact O-N 3.09Å; Q12-N15 PolarHBondContact O-N 3.44Å
16I84.1Confident85.2Confident42 Ų4278.7 Ų78.722%0.21539%0.386CS..  trans-96.6112.3176.1-64.4159.4000107.9F11 F14 T18 W21 I119 V123F11-I16 CarbonylContact C-O 3.43Å; F11-I16 HydrophobicContact CB-CB 3.97Å; F11-I16 HydrophobicContact CB-CG2 4.11Å; F11-I16 HydrophobicContact CD1-CD1 4.13Å; F11-I16 HydrophobicContact CD1-CG2 4.45Å; F11-I16 HydrophobicContact CG-CG2 4.5Å; F11-I16 PolarHBondContact O-N 3.36Å; F11-I16 VanDerWaalsContact O-N 3.08Å; F14-I16 HydrophobicContact CB-CD1 3.98Å; F14-I16 HydrophobicContact CB-CG1 4.41Å; F14-I16 PolarHBondContact O-N 3.47Å; I16-T18 HydrophobicContact CG2-CG2 4.25Å; I16-T18 PolarHBondContact O-N 3.26Å; I16-W21 HydrophobicContact CG2-CH2 4.03Å; I16-W21 HydrophobicContact CG2-CZ2 3.65Å; I16-I119 HydrophobicContact CD1-CG2 3.82Å; I16-V123 HydrophobicContact CD1-CG2 3.79Å; I16-V123 HydrophobicContact CG2-CG2 4.38Å
17D84.4Confident85.6Confident97 Ų9777.9 Ų77.952%0.51938%0.381SS..  trans-79114.5176-170.6-0000110.6K19 W21D17-K19 VanDerWaalsContact OD1-CB 3.24Å; D17-K19 WeakPolarHBondContact OD1-CB 3.45Å; D17-K19 VanDerWaalsContact OD1-CG 3.24Å; D17-K19 WeakPolarHBondContact OD1-CG 3.39Å; D17-K19 PolarHBondContact OD1-N 3.11Å; D17-W21 PolarHBondContact O-NE1 3.09Å; D17-W21 VanDerWaalsContact O-NE1 3.17Å
18T82.2Confident86.2Confident6 Ų679.5 Ų79.54%0.03739%0.391CS..  trans-99.71.3178.259.90000113.2F11 I16 Q20 W21F11-T18 HydrophobicContact CB-CG2 3.67Å; F11-T18 HydrophobicContact CD2-CG2 3.72Å; F11-T18 HydrophobicContact CG-CG2 3.9Å; I16-T18 HydrophobicContact CG2-CG2 4.25Å; I16-T18 PolarHBondContact O-N 3.26Å; T18-Q20 PolarHBondContact O-N 3.02Å; T18-W21 HydrophobicContact CG2-CD2 3.96Å; T18-W21 HydrophobicContact CG2-CE3 3.92Å; T18-W21 HydrophobicContact CG2-CH2 4.15Å; T18-W21 HydrophobicContact CG2-CZ2 4.19Å; T18-W21 HydrophobicContact CG2-CZ3 4.02Å; T18-W21 WeakPolarHBondContact O-CB 3.4Å; T18-W21 PolarHBondContact O-N 2.79Å
19K82Confident86.5Confident152 Ų15276.4 Ų76.466%0.66138%0.376SS*.THydrogen-bonded Turntrans-62.1-31.4-174.6-71.7175.8-179.5179.30113.6E8 D17E8-K19 WeakPolarHBondContact OE1-CE 3.09Å; E8-K19 IonicContact OE1-NZ 3.93Å; D17-K19 VanDerWaalsContact OD1-CB 3.24Å; D17-K19 WeakPolarHBondContact OD1-CB 3.45Å; D17-K19 VanDerWaalsContact OD1-CG 3.24Å; D17-K19 WeakPolarHBondContact OD1-CG 3.39Å; D17-K19 PolarHBondContact OD1-N 3.11Å
20Q86.1Confident86.8Confident184 Ų18472.7 Ų72.786%0.8636%0.356SS*.THydrogen-bonded Turntrans-93.41.6178.9-61.6-175.4-2.300113.2T18T18-Q20 PolarHBondContact O-N 3.02Å
21W88.3Confident87.3Confident33 Ų3375.6 Ų75.613%0.12537%0.372CS..  trans-76.2139.8-178-70.418.6000110.6F11 I16 D17 T18 R25 I26 A29 V123F11-W21 HydrophobicContact CE2-CZ3 4.5Å; I16-W21 HydrophobicContact CG2-CH2 4.03Å; I16-W21 HydrophobicContact CG2-CZ2 3.65Å; D17-W21 PolarHBondContact O-NE1 3.09Å; D17-W21 VanDerWaalsContact O-NE1 3.17Å; T18-W21 HydrophobicContact CG2-CD2 3.96Å; T18-W21 HydrophobicContact CG2-CE3 3.92Å; T18-W21 HydrophobicContact CG2-CH2 4.15Å; T18-W21 HydrophobicContact CG2-CZ2 4.19Å; T18-W21 HydrophobicContact CG2-CZ3 4.02Å; T18-W21 WeakPolarHBondContact O-CB 3.4Å; T18-W21 PolarHBondContact O-N 2.79Å; W21-R25 HydrophobicContact CD2-CG 4.16Å; W21-R25 HydrophobicContact CE3-CG 3.84Å; W21-R25 HydrophobicContact CZ3-CG 4.38Å; W21-I26 HydrophobicContact CB-CD1 4.15Å; W21-I26 HydrophobicContact CB-CG1 3.73Å; W21-I26 HydrophobicContact CE3-CG1 4.14Å; W21-A29 HydrophobicContact CZ3-CB 3.84Å; W21-V123 HydrophobicContact CH2-CB 4.22Å; W21-V123 HydrophobicContact CH2-CG1 3.92Å; W21-V123 HydrophobicContact CH2-CG2 3.79Å; W21-V123 HydrophobicContact CZ2-CG1 4.05Å; W21-V123 HydrophobicContact CZ2-CG2 4.49Å
22S90.9Very high87.6Confident61 Ų6176.1 Ų76.143%0.42738%0.376SS..  trans-62.1151.1168.462.80000110.3S24 R25 I26S22-S24 PolarHBondContact O-N 3.2Å; S22-S24 PolarHBondContact OG-OG 3.08Å; S22-S24 VanDerWaalsContact OG-OG 3.09Å; S22-R25 PolarHBondContact O-N 3.01Å; S22-R25 VanDerWaalsContact O-N 3.11Å; S22-R25 WeakPolarHBondContact OG-CB 3.38Å; S22-R25 PolarHBondContact OG-N 3.47Å; S22-I26 PolarHBondContact O-N 3.18Å; S22-I26 VanDerWaalsContact O-N 3.09Å
23Y89.2Confident87.9Confident165 Ų16571.6 Ų71.665%0.64736%0.355SS*.Hα-helixtrans-57.7-36.6178-177.6-96.7000112.6L3 I26 T27L3-Y23 HydrophobicContact CB-CE2 4.28Å; L3-Y23 HydrophobicContact CD2-CD2 4.37Å; L3-Y23 HydrophobicContact CD2-CE2 3.75Å; Y23-I26 PolarHBondContact O-N 2.68Å; Y23-T27 WeakPolarHBondContact O-CB 3.48Å; Y23-T27 PolarHBondContact O-N 3.07Å; Y23-T27 PolarHBondContact O-OG1 3.37Å
24S90.2Very high88.3Confident61 Ų6169.2 Ų69.243%0.42734%0.344SS..Hα-helixtrans-61.1-47.5175.152.90000111.5S22 I26 T27 V28S22-S24 PolarHBondContact O-N 3.2Å; S22-S24 PolarHBondContact OG-OG 3.08Å; S22-S24 VanDerWaalsContact OG-OG 3.09Å; S24-I26 PolarHBondContact O-N 3.05Å; S24-T27 WeakPolarHBondContact O-CB 3.41Å; S24-T27 PolarHBondContact O-N 3.25Å; S24-T27 VanDerWaalsContact O-N 3.17Å; S24-V28 WeakPolarHBondContact O-CG2 3.18Å; S24-V28 PolarHBondContact O-N 3.25Å
25R91.2Very high88.7Confident69 Ų6969.6 Ų69.626%0.2636%0.355SS..Hα-helixtrans-60.8-44.7178.8-173.4179.3177.4174.61111.9W21 S22 T27 V28 A29 S126 C130W21-R25 HydrophobicContact CD2-CG 4.16Å; W21-R25 HydrophobicContact CE3-CG 3.84Å; W21-R25 HydrophobicContact CZ3-CG 4.38Å; S22-R25 PolarHBondContact O-N 3.01Å; S22-R25 VanDerWaalsContact O-N 3.11Å; S22-R25 WeakPolarHBondContact OG-CB 3.38Å; S22-R25 PolarHBondContact OG-N 3.47Å; R25-T27 VanDerWaalsContact C-N 3.3Å; R25-T27 PolarHBondContact O-N 3.25Å; R25-V28 PolarHBondContact O-N 2.8Å; R25-A29 WeakPolarHBondContact O-CB 3.2Å; R25-A29 PolarHBondContact O-N 3.09Å; R25-S126 PolarHBondContact NE-OG 3.37Å; R25-S126 WeakPolarHBondContact O-CB 3.46Å; R25-C130 HydrophobicContact CB-CB 4.07Å
26I89.8Confident89Confident14 Ų1465.8 Ų65.87%0.07233%0.331CS..Hα-helixtrans-59-45176.2-64.9171.2000110.7L3 A7 W21 S22 Y23 S24 A29 L30L3-I26 HydrophobicContact CD2-CB 4.42Å; L3-I26 HydrophobicContact CD2-CG2 3.74Å; L3-I26 HydrophobicContact CG-CG2 4.28Å; A7-I26 HydrophobicContact CB-CG2 3.45Å; A7-I26 VanDerWaalsContact CB-CG2 3.45Å; W21-I26 HydrophobicContact CB-CD1 4.15Å; W21-I26 HydrophobicContact CB-CG1 3.73Å; W21-I26 HydrophobicContact CE3-CG1 4.14Å; S22-I26 PolarHBondContact O-N 3.18Å; S22-I26 VanDerWaalsContact O-N 3.09Å; Y23-I26 PolarHBondContact O-N 2.68Å; S24-I26 PolarHBondContact O-N 3.05Å; I26-A29 PolarHBondContact O-N 3.21Å; I26-L30 WeakPolarHBondContact O-CB 3.48Å; I26-L30 PolarHBondContact O-N 3.45Å
27T91Very high89.3Confident39 Ų3964.7 Ų64.724%0.23933%0.33CS..Hα-helixtrans-63.4-47.1-179.8-54.30000111.4L3 Y23 S24 R25 A29 L30 L31L3-T27 WeakPolarHBondContact CD2-OG1 3.24Å; Y23-T27 WeakPolarHBondContact O-CB 3.48Å; Y23-T27 PolarHBondContact O-N 3.07Å; Y23-T27 PolarHBondContact O-OG1 3.37Å; S24-T27 WeakPolarHBondContact O-CB 3.41Å; S24-T27 PolarHBondContact O-N 3.25Å; S24-T27 VanDerWaalsContact O-N 3.17Å; R25-T27 VanDerWaalsContact C-N 3.3Å; R25-T27 PolarHBondContact O-N 3.25Å; T27-A29 PolarHBondContact O-N 2.89Å; T27-L30 PolarHBondContact O-N 3.18Å; T27-L31 HydrophobicContact CG2-CD1 4.06Å; T27-L31 HydrophobicContact CG2-CG 4.5Å; T27-L31 WeakPolarHBondContact O-CB 3.41Å; T27-L31 VanDerWaalsContact O-CG 3.32Å; T27-L31 WeakPolarHBondContact O-CG 3.36Å; T27-L31 PolarHBondContact O-N 2.85Å
28V91.6Very high89.6Confident34 Ų3465.1 Ų65.121%0.20633%0.332CS..Hα-helixtrans-62.2-43.3177.21740000111S24 R25 L30 L31 A32 V125 V129S24-V28 WeakPolarHBondContact O-CG2 3.18Å; S24-V28 PolarHBondContact O-N 3.25Å; R25-V28 PolarHBondContact O-N 2.8Å; V28-L30 PolarHBondContact O-N 3.38Å; V28-L31 PolarHBondContact O-N 3.43Å; V28-A32 VanDerWaalsContact O-CB 3.25Å; V28-A32 WeakPolarHBondContact O-CB 3.33Å; V28-A32 PolarHBondContact O-N 3.15Å; V28-V125 HydrophobicContact CG1-CG1 4.23Å; V28-V129 HydrophobicContact CG1-CB 4.23Å; V28-V129 HydrophobicContact CG1-CG1 4.33Å; V28-V129 HydrophobicContact CG2-CG1 4.24Å
29A90.7Very high90.1Very high0 Ų066.9 Ų66.90%035%0.351CS..Hα-helixtrans-60.7-45.217800000111.6F11 W21 R25 I26 T27 A32 H33 A122F11-A29 HydrophobicContact CE2-CB 4.21Å; F11-A29 HydrophobicContact CZ-CB 3.84Å; W21-A29 HydrophobicContact CZ3-CB 3.84Å; R25-A29 WeakPolarHBondContact O-CB 3.2Å; R25-A29 PolarHBondContact O-N 3.09Å; I26-A29 PolarHBondContact O-N 3.21Å; T27-A29 PolarHBondContact O-N 2.89Å; A29-A32 PolarHBondContact O-N 3.5Å; A29-H33 WeakPolarHBondContact O-CB 3.48Å; A29-H33 PolarHBondContact O-N 3.14Å; A29-A122 WeakPolarHBondContact O-CB 3.4Å
30L89.5Confident90.5Very high33 Ų3362.7 Ų62.717%0.17334%0.335CS..Hα-helixtrans-65.1-45.9178.6-170.869.3000111.6L3 I26 T27 V28 A32 H33 E34L3-L30 HydrophobicContact CD1-CD2 3.62Å; L3-L30 HydrophobicContact CG-CD2 4.33Å; I26-L30 WeakPolarHBondContact O-CB 3.48Å; I26-L30 PolarHBondContact O-N 3.45Å; T27-L30 PolarHBondContact O-N 3.18Å; V28-L30 PolarHBondContact O-N 3.38Å; L30-A32 VanDerWaalsContact C-N 3.32Å; L30-A32 PolarHBondContact O-N 3.33Å; L30-H33 WeakPolarHBondContact O-CB 3.4Å; L30-H33 PolarHBondContact O-N 3.29Å; L30-E34 PolarHBondContact O-N 3.45Å
31L92.1Very high90.7Very high106 Ų10655 Ų5556%0.55530%0.304SS*.Hα-helixtrans-61.5-41.2177.6-73.8174.2000112T27 V28 S35T27-L31 HydrophobicContact CG2-CD1 4.06Å; T27-L31 HydrophobicContact CG2-CG 4.5Å; T27-L31 WeakPolarHBondContact O-CB 3.41Å; T27-L31 VanDerWaalsContact O-CG 3.32Å; T27-L31 WeakPolarHBondContact O-CG 3.36Å; T27-L31 PolarHBondContact O-N 2.85Å; V28-L31 PolarHBondContact O-N 3.43Å; L31-S35 WeakPolarHBondContact O-CB 3.31Å; L31-S35 PolarHBondContact O-N 3.02Å; L31-S35 PolarHBondContact O-OG 3.41Å
32A91.9Very high90.8Very high11 Ų1156.8 Ų56.89%0.09132%0.318CS..Hα-helixtrans-62.7-47.2174.900000110.7V28 A29 L30 E34 S35 F36 A122 V125V28-A32 VanDerWaalsContact O-CB 3.25Å; V28-A32 WeakPolarHBondContact O-CB 3.33Å; V28-A32 PolarHBondContact O-N 3.15Å; A29-A32 PolarHBondContact O-N 3.5Å; L30-A32 VanDerWaalsContact C-N 3.32Å; L30-A32 PolarHBondContact O-N 3.33Å; A32-E34 PolarHBondContact O-N 3.21Å; A32-S35 PolarHBondContact O-N 2.95Å; A32-F36 HydrophobicContact CB-CD2 4.32Å; A32-F36 HydrophobicContact CB-CE2 4.07Å; A32-F36 WeakPolarHBondContact O-CB 3.25Å; A32-F36 WeakPolarHBondContact O-CD2 3.3Å; A32-F36 WeakPolarHBondContact O-CG 3.47Å; A32-F36 PolarHBondContact O-N 3.5Å; A32-A122 HydrophobicContact CB-CB 4.17Å; A32-V125 HydrophobicContact CB-CB 4.38Å; A32-V125 HydrophobicContact CB-CG1 4.24Å
33H90.3Very high90.8Very high19 Ų1955.2 Ų55.29%0.08831%0.311CS..Hα-helixtrans-56.3-49.2178.5-176.587.2000112.4A29 L30 G37 A122A29-H33 WeakPolarHBondContact O-CB 3.48Å; A29-H33 PolarHBondContact O-N 3.14Å; L30-H33 WeakPolarHBondContact O-CB 3.4Å; L30-H33 PolarHBondContact O-N 3.29Å; H33-G37 PolarHBondContact O-N 2.97Å; H33-A122 HydrophobicContact CB-CB 4.07Å
34E90.7Very high90.9Very high99 Ų9948.9 Ų48.946%0.46329%0.287SS..Hα-helixtrans-66.5-44.4-180-70.9-57144.500111.4L30 A32 F36 G37 I38L30-E34 PolarHBondContact O-N 3.45Å; A32-E34 PolarHBondContact O-N 3.21Å; E34-F36 PolarHBondContact O-N 3.44Å; E34-G37 CarbonylContact O-C 3.5Å; E34-G37 WeakPolarHBondContact O-CA 3.42Å; E34-G37 PolarHBondContact O-N 3.01Å; E34-I38 WeakPolarHBondContact O-CG1 3.31Å; E34-I38 PolarHBondContact O-N 2.95Å
35S91.7Very high90.8Very high77 Ų7750.4 Ų50.454%0.53828%0.284SS..Hα-helixtrans-62.2-43.3179.7-61.10000111.7L31 A32 G37 I38 G39L31-S35 WeakPolarHBondContact O-CB 3.31Å; L31-S35 PolarHBondContact O-N 3.02Å; L31-S35 PolarHBondContact O-OG 3.41Å; A32-S35 PolarHBondContact O-N 2.95Å; S35-G37 VanDerWaalsContact C-N 3.33Å; S35-I38 PolarHBondContact O-N 3.22Å; S35-G39 PolarHBondContact O-N 2.89Å
36F91.4Very high90.7Very high79 Ų7950.8 Ų50.835%0.34629%0.29SS..Hα-helixtrans-65.5-36.5172.4-69.9-55.7000112A32 E34 G39 L40 K118 L121 V125A32-F36 HydrophobicContact CB-CD2 4.32Å; A32-F36 HydrophobicContact CB-CE2 4.07Å; A32-F36 WeakPolarHBondContact O-CB 3.25Å; A32-F36 WeakPolarHBondContact O-CD2 3.3Å; A32-F36 WeakPolarHBondContact O-CG 3.47Å; A32-F36 PolarHBondContact O-N 3.5Å; E34-F36 PolarHBondContact O-N 3.44Å; F36-G39 PolarHBondContact O-N 2.98Å; F36-L40 WeakPolarHBondContact O-CB 3.4Å; F36-L40 WeakPolarHBondContact O-CG 3.32Å; F36-L40 PolarHBondContact O-N 3.36Å; F36-K118 HydrophobicContact CB-CD 4.02Å; F36-K118 HydrophobicContact CB-CG 3.9Å; F36-L121 HydrophobicContact CD2-CB 4.32Å; F36-L121 HydrophobicContact CE2-CB 3.97Å; F36-L121 HydrophobicContact CZ-CB 4.48Å; F36-V125 HydrophobicContact CE2-CG2 4.27Å; F36-V125 HydrophobicContact CZ-CG2 4.33Å
37G90.8Very high90.7Very high20 Ų2054.4 Ų54.421%0.20631%0.308CS..Hα-helixtrans-59.5-48.6174.600000112.9H33 E34 S35 A41H33-G37 PolarHBondContact O-N 2.97Å; E34-G37 CarbonylContact O-C 3.5Å; E34-G37 WeakPolarHBondContact O-CA 3.42Å; E34-G37 PolarHBondContact O-N 3.01Å; S35-G37 VanDerWaalsContact C-N 3.33Å; G37-A41 WeakPolarHBondContact O-CB 3.46Å; G37-A41 PolarHBondContact O-N 3.32Å
38I90.7Very high90.6Very high106 Ų10652.5 Ų52.554%0.54430%0.297SS..Hα-helixtrans-65.3-46.7176.9-65.3167.3000110.2E34 S35 L40 A41 V42E34-I38 WeakPolarHBondContact O-CG1 3.31Å; E34-I38 PolarHBondContact O-N 2.95Å; S35-I38 PolarHBondContact O-N 3.22Å; I38-L40 PolarHBondContact O-N 2.97Å; I38-A41 WeakPolarHBondContact O-CB 3.33Å; I38-A41 PolarHBondContact O-N 3.44Å; I38-A41 VanDerWaalsContact O-N 3.11Å; I38-V42 HydrophobicContact CG2-CG2 4.29Å; I38-V42 WeakPolarHBondContact O-CG2 3.5Å; I38-V42 PolarHBondContact O-N 3.38Å
39G92.4Very high90.4Very high43 Ų4353.5 Ų53.544%0.44330%0.297SS..Hα-helixtrans-57.4-46.3178.700000112.5S35 F36 G43S35-G39 PolarHBondContact O-N 2.89Å; F36-G39 PolarHBondContact O-N 2.98Å; G39-G43 PolarHBondContact O-N 3.47Å
40L91Very high90.3Very high63 Ų6360.9 Ų60.933%0.3333%0.33SS..Hα-helixtrans-62.6-45.9173.6-72.8-179.2000111.3F36 I38 V42 G43 F44 T114 K118F36-L40 WeakPolarHBondContact O-CB 3.4Å; F36-L40 WeakPolarHBondContact O-CG 3.32Å; F36-L40 PolarHBondContact O-N 3.36Å; I38-L40 PolarHBondContact O-N 2.97Å; L40-V42 VanDerWaalsContact C-N 3.34Å; L40-V42 PolarHBondContact O-N 2.9Å; L40-G43 PolarHBondContact O-N 3.35Å; L40-F44 HydrophobicContact CB-CD2 4.25Å; L40-F44 HydrophobicContact CB-CE2 4.27Å; L40-F44 HydrophobicContact CD2-CE2 4.13Å; L40-F44 WeakPolarHBondContact O-CB 3.29Å; L40-F44 WeakPolarHBondContact O-CD2 3.35Å; L40-F44 PolarHBondContact O-N 3.48Å; L40-T114 HydrophobicContact CD1-CG2 4.04Å; L40-K118 HydrophobicContact CD1-CD 3.82Å; L40-K118 HydrophobicContact CD1-CG 3.95Å
41A89.4Confident90.1Very high24 Ų2467.3 Ų67.320%0.19836%0.356CS..Hα-helixtrans-56.4-47.7179.700000112.5G37 I38 W45 R107G37-A41 WeakPolarHBondContact O-CB 3.46Å; G37-A41 PolarHBondContact O-N 3.32Å; I38-A41 WeakPolarHBondContact O-CB 3.33Å; I38-A41 PolarHBondContact O-N 3.44Å; I38-A41 VanDerWaalsContact O-N 3.11Å; A41-W45 WeakPolarHBondContact O-CB 3.45Å; A41-W45 PolarHBondContact O-N 2.93Å; A41-W45 VanDerWaalsContact O-N 3.12Å; A41-R107 VanDerWaalsContact CB-NH1 3.25Å
42V89.9Confident89.7Confident69 Ų6963.7 Ų63.742%0.41834%0.336SS..Hα-helixtrans-67.3-45.7177.8174.70000110.7I38 L40 W45 I46I38-V42 HydrophobicContact CG2-CG2 4.29Å; I38-V42 WeakPolarHBondContact O-CG2 3.5Å; I38-V42 PolarHBondContact O-N 3.38Å; L40-V42 VanDerWaalsContact C-N 3.34Å; L40-V42 PolarHBondContact O-N 2.9Å; V42-W45 PolarHBondContact O-N 2.86Å; V42-I46 HydrophobicContact CG1-CD1 3.7Å; V42-I46 HydrophobicContact CG1-CG1 4.31Å; V42-I46 WeakPolarHBondContact O-CG1 3.49Å; V42-I46 PolarHBondContact O-N 2.91Å
43G91.9Very high88.8Confident28 Ų2866 Ų6629%0.28935%0.35SS..Hα-helixtrans-58.7-50.3178.800000112.8G39 L40 W45 I46 I47G39-G43 PolarHBondContact O-N 3.47Å; L40-G43 PolarHBondContact O-N 3.35Å; G43-W45 VanDerWaalsContact C-N 3.3Å; G43-W45 PolarHBondContact O-N 3.39Å; G43-I46 PolarHBondContact O-N 2.96Å; G43-I47 WeakPolarHBondContact O-CD1 3.36Å; G43-I47 VanDerWaalsContact O-CG1 3.26Å; G43-I47 WeakPolarHBondContact O-CG1 3.44Å; G43-I47 PolarHBondContact O-N 3.17Å
44F91.7Very high88Confident33 Ų3366 Ų6615%0.14535%0.35CS..Hα-helixtrans-59.4-42.4175.4-82.5-69.4000111.9L40 I47 C48 L106 R107 L110L40-F44 HydrophobicContact CB-CD2 4.25Å; L40-F44 HydrophobicContact CB-CE2 4.27Å; L40-F44 HydrophobicContact CD2-CE2 4.13Å; L40-F44 WeakPolarHBondContact O-CB 3.29Å; L40-F44 WeakPolarHBondContact O-CD2 3.35Å; L40-F44 PolarHBondContact O-N 3.48Å; F44-I47 PolarHBondContact O-N 3.16Å; F44-C48 WeakPolarHBondContact O-CB 3.19Å; F44-C48 PolarHBondContact O-N 2.99Å; F44-C48 PolarHBondContact O-SG 3.22Å; F44-L106 HydrophobicContact CD1-CB 3.98Å; F44-L106 HydrophobicContact CD1-CD1 4.09Å; F44-L106 HydrophobicContact CE1-CB 4.25Å; F44-R107 HydrophobicContact CB-CG 4.17Å; F44-R107 HydrophobicContact CD2-CG 3.6Å; F44-R107 HydrophobicContact CE2-CG 4.23Å; F44-R107 HydrophobicContact CG-CG 3.91Å; F44-L110 HydrophobicContact CE1-CD1 3.37Å; F44-L110 HydrophobicContact CZ-CD1 3.34Å
45W88.2Confident87.1Confident93 Ų9367 Ų6735%0.35235%0.35SS..Hα-helixtrans-64.1-45.9178.8-179.659.2000112.5A41 V42 G43 I47 C48 Y49 I96 S99 S103A41-W45 WeakPolarHBondContact O-CB 3.45Å; A41-W45 PolarHBondContact O-N 2.93Å; A41-W45 VanDerWaalsContact O-N 3.12Å; V42-W45 PolarHBondContact O-N 2.86Å; G43-W45 VanDerWaalsContact C-N 3.3Å; G43-W45 PolarHBondContact O-N 3.39Å; W45-I47 VanDerWaalsContact C-N 3.32Å; W45-I47 PolarHBondContact O-N 3.12Å; W45-C48 PolarHBondContact O-N 3.31Å; W45-Y49 HydrophobicContact CZ2-CD2 4.5Å; W45-Y49 VanDerWaalsContact O-CB 3.29Å; W45-Y49 WeakPolarHBondContact O-CB 3.38Å; W45-Y49 PolarHBondContact O-N 3.43Å; W45-I96 HydrophobicContact CZ2-CG2 4.5Å; W45-S99 PolarHBondContact NE1-OG 2.8Å; W45-S103 PolarHBondContact N-OG 3.38Å
46I89.1Confident86.1Confident77 Ų7771.8 Ų71.840%0.39536%0.358SS..Hα-helixtrans-59.8-43.4176.5-68.7169.7000110.9V42 G43 Y49 K50V42-I46 HydrophobicContact CG1-CD1 3.7Å; V42-I46 HydrophobicContact CG1-CG1 4.31Å; V42-I46 WeakPolarHBondContact O-CG1 3.49Å; V42-I46 PolarHBondContact O-N 2.91Å; G43-I46 PolarHBondContact O-N 2.96Å; I46-Y49 PolarHBondContact O-N 3Å; I46-K50 HydrophobicContact CG2-CD 4.36Å; I46-K50 WeakPolarHBondContact O-CG 2.96Å; I46-K50 PolarHBondContact O-N 3.41Å
47I89.4Confident85.2Confident89 Ų8973.3 Ų73.346%0.45637%0.369SS..Hα-helixtrans-62.2-47.8178.2-67.9165.4000110.7G43 F44 W45 Y49 K50 K51G43-I47 WeakPolarHBondContact O-CD1 3.36Å; G43-I47 VanDerWaalsContact O-CG1 3.26Å; G43-I47 WeakPolarHBondContact O-CG1 3.44Å; G43-I47 PolarHBondContact O-N 3.17Å; F44-I47 PolarHBondContact O-N 3.16Å; W45-I47 VanDerWaalsContact C-N 3.32Å; W45-I47 PolarHBondContact O-N 3.12Å; I47-Y49 VanDerWaalsContact C-N 3.34Å; I47-Y49 PolarHBondContact O-N 2.79Å; I47-K50 PolarHBondContact O-N 2.77Å; I47-K51 PolarHBondContact O-N 2.95Å
48C89.3Confident84.3Confident0 Ų073.4 Ų73.40%037%0.365CS..Hα-helixtrans-66-38.4178.8-630000111.8F44 W45 K50 Q52 S99 E102 S103 L106F44-C48 WeakPolarHBondContact O-CB 3.19Å; F44-C48 PolarHBondContact O-N 2.99Å; F44-C48 PolarHBondContact O-SG 3.22Å; W45-C48 PolarHBondContact O-N 3.31Å; C48-K50 VanDerWaalsContact C-N 3.34Å; C48-K50 PolarHBondContact O-N 2.68Å; C48-Q52 WeakPolarHBondContact O-CA 3.25Å; C48-Q52 WeakPolarHBondContact O-CG 3.18Å; C48-Q52 PolarHBondContact O-N 3.22Å; C48-S99 WeakPolarHBondContact CB-O 3.3Å; C48-E102 HydrophobicContact CB-CB 3.99Å; C48-S103 PolarHBondContact SG-N 2.87Å; C48-L106 WeakPolarHBondContact SG-CD1 3.47Å
49Y87.3Confident83.5Confident55 Ų5572.3 Ų72.322%0.21637%0.367CS..Hα-helixtrans-60.3-45.7175.7-170.5-90.4000110.8W45 I46 I47 R95 I96 S99W45-Y49 HydrophobicContact CZ2-CD2 4.5Å; W45-Y49 VanDerWaalsContact O-CB 3.29Å; W45-Y49 WeakPolarHBondContact O-CB 3.38Å; W45-Y49 PolarHBondContact O-N 3.43Å; I46-Y49 PolarHBondContact O-N 3Å; I47-Y49 VanDerWaalsContact C-N 3.34Å; I47-Y49 PolarHBondContact O-N 2.79Å; Y49-R95 HydrophobicContact CD2-CG 3.97Å; Y49-R95 HydrophobicContact CE2-CB 4.07Å; Y49-R95 HydrophobicContact CE2-CG 3.66Å; Y49-R95 PolarHBondContact O-NE 3.26Å; Y49-R95 PolarHBondContact O-NH2 3.49Å; Y49-I96 HydrophobicContact CE2-CG1 3.98Å; Y49-S99 VanDerWaalsContact CA-CB 3.48Å
50K88Confident83Confident155 Ų15580 Ų8067%0.67438%0.384SS*.Hα-helixtrans-71.3-45.2180-73.2-173.8174.5-174.30113.5I46 I47 C48 R95I46-K50 HydrophobicContact CG2-CD 4.36Å; I46-K50 WeakPolarHBondContact O-CG 2.96Å; I46-K50 PolarHBondContact O-N 3.41Å; I47-K50 PolarHBondContact O-N 2.77Å; C48-K50 VanDerWaalsContact C-N 3.34Å; C48-K50 PolarHBondContact O-N 2.68Å; K50-R95 PolarHBondContact O-NH2 2.99Å
51K85.9Confident82.5Confident168 Ų16877.7 Ų77.773%0.7338%0.375SS*.Hα-helixtrans-104.5-23.6-167.5-66.4-169.4175.3-1740116.1I47I47-K51 PolarHBondContact O-N 2.95Å
52Q81.9Confident82.3Confident30 Ų3080.7 Ų80.714%0.1439%0.392CS..  trans44.255.2-172.8-64-168.4-25.800115.6C48 I54 R55 E102C48-Q52 WeakPolarHBondContact O-CA 3.25Å; C48-Q52 WeakPolarHBondContact O-CG 3.18Å; C48-Q52 PolarHBondContact O-N 3.22Å; Q52-I54 VanDerWaalsContact C-N 3.3Å; Q52-I54 PolarHBondContact O-N 2.9Å; Q52-R55 HydrophobicContact CB-CB 4.45Å; Q52-E102 VanDerWaalsContact CA-OE2 3.23Å; Q52-E102 WeakPolarHBondContact CA-OE2 3.36Å
53P74Confident82.2Confident58 Ų5882 Ų8238%0.37740%0.4SS..  trans-69.4-21.5-166.328.2-35.6000114.9E102 L106P53-E102 WeakPolarHBondContact CD-OE2 3.4Å; P53-L106 HydrophobicContact CG-CD1 4.48Å
54I74.5Confident81.9Confident19 Ų1985.6 Ų85.610%0.09742%0.416CS..SBendtrans-103.5-19.6-169.7-70171.3000111.6Q52 Y56 L57 T58 Y69 E102 V105 L106Q52-I54 VanDerWaalsContact C-N 3.3Å; Q52-I54 PolarHBondContact O-N 2.9Å; I54-Y56 PolarHBondContact O-N 3.43Å; I54-L57 PolarHBondContact O-N 2.7Å; I54-T58 HydrophobicContact CG2-CG2 3.52Å; I54-T58 PolarHBondContact O-N 3.33Å; I54-T58 PolarHBondContact O-OG1 2.92Å; I54-Y69 HydrophobicContact CG2-CD2 4.47Å; I54-E102 WeakPolarHBondContact CA-OE1 3.4Å; I54-E102 HydrophobicContact CB-CB 4.41Å; I54-E102 HydrophobicContact CB-CG 3.88Å; I54-E102 HydrophobicContact CD1-CB 4.33Å; I54-E102 HydrophobicContact CG2-CG 4.43Å; I54-E102 PolarHBondContact N-OE1 3.33Å; I54-V105 HydrophobicContact CD1-CB 4.18Å; I54-V105 HydrophobicContact CD1-CG1 3.92Å; I54-L106 HydrophobicContact CD1-CD2 3.78Å; I54-L106 HydrophobicContact CD1-CG 3.72Å
55R71Confident81.5Confident121 Ų12186.2 Ų86.246%0.45742%0.42SS..THydrogen-bonded Turntrans-48.4-38.4-175.8-175177.3177.8178.9-2.3114.4Q52 T58 E102Q52-R55 HydrophobicContact CB-CB 4.45Å; R55-T58 PolarHBondContact O-OG1 3.45Å; R55-E102 PolarHBondContact N-OE1 3.25Å
56Y70.5Confident81.4Confident178 Ų17885.8 Ų85.870%0.69842%0.422SS*.THydrogen-bonded Turntrans-89.2-17.3179.6-60.6-72.9000113.7I54I54-Y56 PolarHBondContact O-N 3.43Å
57L73.5Confident81.4Confident111 Ų11186.6 Ų86.658%0.58143%0.427SS*.THydrogen-bonded Turntrans-92.7-23.1-176.5-65.1174.3000112.3I54 S59 Y60 A61I54-L57 PolarHBondContact O-N 2.7Å; L57-S59 VanDerWaalsContact C-N 3.29Å; L57-S59 PolarHBondContact O-N 2.85Å; L57-Y60 CarbonylContact O-C 3.53Å; L57-Y60 PolarHBondContact O-N 2.89Å; L57-A61 WeakPolarHBondContact O-CB 3.23Å; L57-A61 PolarHBondContact O-N 3.05Å
58T72Confident81.3Confident21 Ų2184.3 Ų84.313%0.12942%0.415CS..THydrogen-bonded Turntrans-59.2-35-177.327.30000113.9I54 R55 Y60 A61 Y69I54-T58 HydrophobicContact CG2-CG2 3.52Å; I54-T58 PolarHBondContact O-N 3.33Å; I54-T58 PolarHBondContact O-OG1 2.92Å; R55-T58 PolarHBondContact O-OG1 3.45Å; T58-Y60 VanDerWaalsContact C-N 3.25Å; T58-Y60 PolarHBondContact O-N 3.38Å; T58-A61 PolarHBondContact O-N 3.04Å; T58-Y69 HydrophobicContact CG2-CD1 3.88Å; T58-Y69 HydrophobicContact CG2-CD2 3.66Å; T58-Y69 HydrophobicContact CG2-CE1 4.19Å; T58-Y69 HydrophobicContact CG2-CE2 3.99Å; T58-Y69 HydrophobicContact CG2-CG 3.6Å
59S72.8Confident81.2Confident83 Ų8385.8 Ų85.858%0.5842%0.421SS*.THydrogen-bonded Turntrans-66.7-27.5177.452.10000113.2L57L57-S59 VanDerWaalsContact C-N 3.29Å; L57-S59 PolarHBondContact O-N 2.85Å
60Y81.2Confident81.3Confident204 Ų20486 Ų8680%0.843%0.431SS*.THydrogen-bonded Turntrans-102.2-4178.8-59.3-77.5000112.6L57 T58L57-Y60 CarbonylContact O-C 3.53Å; L57-Y60 PolarHBondContact O-N 2.89Å; T58-Y60 VanDerWaalsContact C-N 3.25Å; T58-Y60 PolarHBondContact O-N 3.38Å
61A81Confident81.3Confident16 Ų1685.1 Ų85.113%0.13243%0.427CS..SBendtrans-74.1150-176.500000110.8L57 T58 I65 Q66L57-A61 WeakPolarHBondContact O-CB 3.23Å; L57-A61 PolarHBondContact O-N 3.05Å; T58-A61 PolarHBondContact O-N 3.04Å; A61-I65 HydrophobicContact CB-CB 3.87Å; A61-I65 HydrophobicContact CB-CD1 4.37Å; A61-I65 HydrophobicContact CB-CG2 3.82Å; A61-Q66 PolarHBondContact O-NE2 3.31Å
62P85Confident81.4Confident86 Ų8677.1 Ų77.156%0.55839%0.392SS*.  trans-53.1151.1172.3-26.133.7000112.7V64 I65 Q66P62-V64 PolarHBondContact O-N 3.04Å; P62-I65 PolarHBondContact O-N 3.44Å; P62-Q66 PolarHBondContact O-N 3.05Å; P62-Q66 VanDerWaalsContact O-N 3.15Å
63V87.3Confident81.7Confident98 Ų9878.1 Ų78.159%0.59440%0.398SS*.Hα-helixtrans-50.5-36-179.6177.50000112.4I65 Q66 N67V63-I65 PolarHBondContact O-N 2.89Å; V63-Q66 PolarHBondContact O-N 3Å; V63-N67 WeakPolarHBondContact O-CB 3.35Å; V63-N67 VanDerWaalsContact O-CG 3.32Å; V63-N67 PolarHBondContact O-N 3.45Å; V63-N67 PolarHBondContact O-ND2 2.86Å
64V86.6Confident82.5Confident102 Ų10280 Ų8062%0.61841%0.405SS*.Hα-helixtrans-59-45.5176.1179.50000111.7P62 N67 I68P62-V64 PolarHBondContact O-N 3.04Å; V64-N67 PolarHBondContact O-N 3.47Å; V64-I68 HydrophobicContact CG1-CD1 4.13Å; V64-I68 VanDerWaalsContact O-CG1 3.29Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 2.92Å
65I83.9Confident83Confident47 Ų4783.4 Ų83.424%0.24142%0.417CS..Hα-helixtrans-69.2-40.8179.3-60.5-172.1000110.2A61 P62 V63 N67 I68 Y69 V105A61-I65 HydrophobicContact CB-CB 3.87Å; A61-I65 HydrophobicContact CB-CD1 4.37Å; A61-I65 HydrophobicContact CB-CG2 3.82Å; P62-I65 PolarHBondContact O-N 3.44Å; V63-I65 PolarHBondContact O-N 2.89Å; I65-N67 VanDerWaalsContact C-N 3.28Å; I65-N67 PolarHBondContact O-N 3.44Å; I65-I68 PolarHBondContact O-N 2.85Å; I65-Y69 WeakPolarHBondContact O-CB 3.32Å; I65-Y69 PolarHBondContact O-N 3.39Å; I65-V105 HydrophobicContact CG2-CG1 4.1Å
66Q86.2Confident83.8Confident83 Ų8377.9 Ų77.939%0.38840%0.397SS..Hα-helixtrans-59.2-41.7175.8-61.7-177.218.400111.5A61 P62 V63 Y69 S70A61-Q66 PolarHBondContact O-NE2 3.31Å; P62-Q66 PolarHBondContact O-N 3.05Å; P62-Q66 VanDerWaalsContact O-N 3.15Å; V63-Q66 PolarHBondContact O-N 3Å; Q66-Y69 PolarHBondContact O-N 3.45Å; Q66-S70 WeakPolarHBondContact O-CB 3.34Å; Q66-S70 PolarHBondContact O-N 3.03Å
67N88.5Confident84.6Confident94 Ų9470.9 Ų70.950%0.50338%0.376SS..Hα-helixtrans-64.3-42.6175.4-75.6-21.5000112.4V63 V64 I65 Y69 S70 K71V63-N67 WeakPolarHBondContact O-CB 3.35Å; V63-N67 VanDerWaalsContact O-CG 3.32Å; V63-N67 PolarHBondContact O-N 3.45Å; V63-N67 PolarHBondContact O-ND2 2.86Å; V64-N67 PolarHBondContact O-N 3.47Å; I65-N67 VanDerWaalsContact C-N 3.28Å; I65-N67 PolarHBondContact O-N 3.44Å; N67-Y69 VanDerWaalsContact C-N 3.32Å; N67-S70 PolarHBondContact O-N 3.02Å; N67-K71 WeakPolarHBondContact O-CG 3.46Å; N67-K71 PolarHBondContact O-N 3.39Å
68I87.2Confident85.2Confident41 Ų4172.9 Ų72.921%0.2138%0.375CS..Hα-helixtrans-64.6-40.5175.3-63.8166.7000110.2V64 I65 K71 G72 Y104 V105 K108V64-I68 HydrophobicContact CG1-CD1 4.13Å; V64-I68 VanDerWaalsContact O-CG1 3.29Å; V64-I68 WeakPolarHBondContact O-CG1 3.42Å; V64-I68 PolarHBondContact O-N 2.92Å; I65-I68 PolarHBondContact O-N 2.85Å; I68-K71 PolarHBondContact O-N 2.9Å; I68-G72 PolarHBondContact O-N 2.92Å; I68-Y104 HydrophobicContact CG2-CD1 3.91Å; I68-Y104 HydrophobicContact CG2-CE1 3.89Å; I68-V105 HydrophobicContact CB-CG2 4.36Å; I68-V105 HydrophobicContact CG2-CB 4.37Å; I68-V105 HydrophobicContact CG2-CG2 3.81Å; I68-K108 HydrophobicContact CG2-CB 4.08Å; I68-K108 HydrophobicContact CG2-CG 4.15Å
69Y87.5Confident85.8Confident32 Ų3276.4 Ų76.413%0.12539%0.389CS..Hα-helixtrans-64.1-44.9177.9-173.8-100.6000111.7I54 T58 I65 Q66 N67 K71 G72 L73 A101 E102 V105I54-Y69 HydrophobicContact CG2-CD2 4.47Å; T58-Y69 HydrophobicContact CG2-CD1 3.88Å; T58-Y69 HydrophobicContact CG2-CD2 3.66Å; T58-Y69 HydrophobicContact CG2-CE1 4.19Å; T58-Y69 HydrophobicContact CG2-CE2 3.99Å; T58-Y69 HydrophobicContact CG2-CG 3.6Å; I65-Y69 WeakPolarHBondContact O-CB 3.32Å; I65-Y69 PolarHBondContact O-N 3.39Å; Q66-Y69 PolarHBondContact O-N 3.45Å; N67-Y69 VanDerWaalsContact C-N 3.32Å; Y69-K71 PolarHBondContact O-N 3.12Å; Y69-G72 CarbonylContact O-C 3.59Å; Y69-G72 WeakPolarHBondContact O-CA 3.49Å; Y69-G72 PolarHBondContact O-N 3.36Å; Y69-L73 HydrophobicContact CD1-CD1 3.89Å; Y69-L73 HydrophobicContact CD1-CG 4.2Å; Y69-L73 HydrophobicContact CE1-CD1 3.57Å; Y69-L73 HydrophobicContact CE1-CD2 4.26Å; Y69-L73 HydrophobicContact CE1-CG 3.88Å; Y69-L73 PolarHBondContact O-N 3.5Å; Y69-A101 HydrophobicContact CD2-CB 4.02Å; Y69-A101 HydrophobicContact CE2-CB 3.68Å; Y69-E102 HydrophobicContact CE2-CG 4.02Å; Y69-V105 HydrophobicContact CD2-CG2 3.92Å; Y69-V105 HydrophobicContact CG-CG2 4.38Å
70S88.3Confident86.2Confident59 Ų5974.3 Ų74.341%0.41337%0.371SS..Hα-helixtrans-60.2-43.2174.3177.60000112.2Q66 N67 G72 L73 N74Q66-S70 WeakPolarHBondContact O-CB 3.34Å; Q66-S70 PolarHBondContact O-N 3.03Å; N67-S70 PolarHBondContact O-N 3.02Å; S70-G72 VanDerWaalsContact C-N 3.29Å; S70-G72 PolarHBondContact O-N 2.83Å; S70-L73 PolarHBondContact O-N 3.17Å; S70-N74 PolarHBondContact O-N 3.36Å; S70-N74 PolarHBondContact O-ND2 2.86Å
71K89.3Confident86.2Confident137 Ų13775 Ų7560%0.59637%0.372SS*.Hα-helixtrans-60.3-40.7171.2-73.1177.5-179.1-179.90111.8N67 I68 Y69 N74 W75 Y104N67-K71 WeakPolarHBondContact O-CG 3.46Å; N67-K71 PolarHBondContact O-N 3.39Å; I68-K71 PolarHBondContact O-N 2.9Å; Y69-K71 PolarHBondContact O-N 3.12Å; K71-N74 PolarHBondContact O-N 3.11Å; K71-W75 WeakPolarHBondContact O-CB 3.35Å; K71-W75 PolarHBondContact O-N 3.28Å; K71-Y104 HydrophobicContact CB-CE1 4.33Å
72G87.3Confident86.3Confident0 Ų080.6 Ų80.60%040%0.396CS..Hα-helixtrans-58.8-49.517400000112.1I68 Y69 S70 N74 W75 S76I68-G72 PolarHBondContact O-N 2.92Å; Y69-G72 CarbonylContact O-C 3.59Å; Y69-G72 WeakPolarHBondContact O-CA 3.49Å; Y69-G72 PolarHBondContact O-N 3.36Å; S70-G72 VanDerWaalsContact C-N 3.29Å; S70-G72 PolarHBondContact O-N 2.83Å; G72-N74 PolarHBondContact O-N 3.41Å; G72-W75 PolarHBondContact O-N 2.85Å; G72-S76 WeakPolarHBondContact O-CB 3.28Å; G72-S76 PolarHBondContact O-N 2.85Å; G72-S76 PolarHBondContact O-OG 3.15Å; G72-S76 VanDerWaalsContact O-OG 3.08Å
73L88.8Confident85.9Confident50 Ų5079.2 Ų79.226%0.26238%0.383SS..Hα-helixtrans-57.6-47.2176-75.2173.4000111.6Y69 S70 W75 S76 A77 L97 A101Y69-L73 HydrophobicContact CD1-CD1 3.89Å; Y69-L73 HydrophobicContact CD1-CG 4.2Å; Y69-L73 HydrophobicContact CE1-CD1 3.57Å; Y69-L73 HydrophobicContact CE1-CD2 4.26Å; Y69-L73 HydrophobicContact CE1-CG 3.88Å; Y69-L73 PolarHBondContact O-N 3.5Å; S70-L73 PolarHBondContact O-N 3.17Å; L73-W75 VanDerWaalsContact C-N 3.34Å; L73-W75 PolarHBondContact O-N 3.19Å; L73-S76 PolarHBondContact O-N 2.8Å; L73-A77 VanDerWaalsContact O-CB 3.29Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 3.29Å; L73-L97 HydrophobicContact CD2-CD1 4.42Å; L73-L97 HydrophobicContact CD2-CD2 4.27Å; L73-L97 HydrophobicContact CD2-CG 3.9Å; L73-A101 HydrophobicContact CB-CB 4.43Å; L73-A101 HydrophobicContact CD2-CB 3.7Å; L73-A101 HydrophobicContact CG-CB 3.79Å
74N90Very high85.4Confident98 Ų9877.4 Ų77.452%0.52437%0.374SS..Hα-helixtrans-64-38.8178-74.7-30.4000112.4S70 K71 G72 R78S70-N74 PolarHBondContact O-N 3.36Å; S70-N74 PolarHBondContact O-ND2 2.86Å; K71-N74 PolarHBondContact O-N 3.11Å; G72-N74 PolarHBondContact O-N 3.41Å; N74-R78 WeakPolarHBondContact O-CG 3.17Å; N74-R78 PolarHBondContact O-N 3.38Å; N74-R78 VanDerWaalsContact O-N 3.15Å; N74-R78 PolarHBondContact O-NE 3.2Å
75W86.2Confident84.8Confident90 Ų9079.6 Ų79.634%0.34138%0.381SS..Hα-helixtrans-64.9-46.6174.1179.587.4000111.4K71 G72 L73 R78 K79K71-W75 WeakPolarHBondContact O-CB 3.35Å; K71-W75 PolarHBondContact O-N 3.28Å; G72-W75 PolarHBondContact O-N 2.85Å; L73-W75 VanDerWaalsContact C-N 3.34Å; L73-W75 PolarHBondContact O-N 3.19Å; W75-R78 PolarHBondContact O-N 3.22Å; W75-K79 HydrophobicContact CD2-CG 4.2Å; W75-K79 HydrophobicContact CH2-CG 4.16Å; W75-K79 HydrophobicContact CZ2-CD 4.41Å; W75-K79 HydrophobicContact CZ2-CG 3.86Å; W75-K79 HydrophobicContact CZ3-CG 4.48Å; W75-K79 WeakPolarHBondContact O-CG 3.32Å; W75-K79 PolarHBondContact O-N 2.86Å
76S86.7Confident84.2Confident5 Ų583.9 Ų83.94%0.03540%0.398CS..Hα-helixtrans-65.4-39.7178.9-660000112.5G72 L73 R78 K79 L80 G100 A101G72-S76 WeakPolarHBondContact O-CB 3.28Å; G72-S76 PolarHBondContact O-N 2.85Å; G72-S76 PolarHBondContact O-OG 3.15Å; G72-S76 VanDerWaalsContact O-OG 3.08Å; L73-S76 PolarHBondContact O-N 2.8Å; S76-R78 PolarHBondContact O-N 2.94Å; S76-K79 PolarHBondContact O-N 3.46Å; S76-L80 VanDerWaalsContact O-CB 3.28Å; S76-L80 WeakPolarHBondContact O-CB 3.33Å; S76-L80 PolarHBondContact O-N 3.28Å; S76-G100 WeakPolarHBondContact OG-CA 3.22Å; S76-A101 PolarHBondContact OG-N 2.89Å
77A87.9Confident83.3Confident31 Ų3181.8 Ų81.826%0.25639%0.391SS..Hα-helixtrans-61.7-43.5174.600000111.4L73 K79 L80 R81 L97L73-A77 VanDerWaalsContact O-CB 3.29Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 3.29Å; A77-K79 VanDerWaalsContact C-N 3.33Å; A77-K79 PolarHBondContact O-N 3.36Å; A77-L80 PolarHBondContact O-N 3Å; A77-R81 WeakPolarHBondContact O-CG 3.42Å; A77-R81 PolarHBondContact O-N 2.96Å; A77-L97 HydrophobicContact CB-CD1 3.76Å
78R86.6Confident82.3Confident153 Ų15379.5 Ų79.558%0.57738%0.383SS*.Hα-helixtrans-62.8-40.4174.8-74.3-176-65.2-171.31.9112N74 W75 S76N74-R78 WeakPolarHBondContact O-CG 3.17Å; N74-R78 PolarHBondContact O-N 3.38Å; N74-R78 VanDerWaalsContact O-N 3.15Å; N74-R78 PolarHBondContact O-NE 3.2Å; W75-R78 PolarHBondContact O-N 3.22Å; S76-R78 PolarHBondContact O-N 2.94Å
79K83.2Confident81.6Confident95 Ų9582.1 Ų82.141%0.41340%0.404SS..Hα-helixtrans-72.4-33.4178.2-72.7-71168.4-163.70113W75 S76 A77 R81 Q82 L83W75-K79 HydrophobicContact CD2-CG 4.2Å; W75-K79 HydrophobicContact CH2-CG 4.16Å; W75-K79 HydrophobicContact CZ2-CD 4.41Å; W75-K79 HydrophobicContact CZ2-CG 3.86Å; W75-K79 HydrophobicContact CZ3-CG 4.48Å; W75-K79 WeakPolarHBondContact O-CG 3.32Å; W75-K79 PolarHBondContact O-N 2.86Å; S76-K79 PolarHBondContact O-N 3.46Å; A77-K79 VanDerWaalsContact C-N 3.33Å; A77-K79 PolarHBondContact O-N 3.36Å; K79-R81 VanDerWaalsContact C-N 3.31Å; K79-R81 PolarHBondContact O-N 3.04Å; K79-Q82 CarbonylContact O-C 3.52Å; K79-Q82 WeakPolarHBondContact O-CA 3.42Å; K79-Q82 WeakPolarHBondContact O-CB 3.39Å; K79-Q82 PolarHBondContact O-N 3.42Å; K79-L83 PolarHBondContact O-N 3.42Å; K79-L83 VanDerWaalsContact O-N 3.12Å
80L82.3Confident81.1Confident39 Ų3988.8 Ų88.820%0.20444%0.436CS..Hα-helixtrans-63.3-37.4174.6-176.262.9000111.8S76 A77 Q82 L83 P93 I96S76-L80 VanDerWaalsContact O-CB 3.28Å; S76-L80 WeakPolarHBondContact O-CB 3.33Å; S76-L80 PolarHBondContact O-N 3.28Å; A77-L80 PolarHBondContact O-N 3Å; L80-Q82 PolarHBondContact O-N 3.49Å; L80-L83 HydrophobicContact CD1-CD1 3.72Å; L80-L83 WeakPolarHBondContact O-CB 3.4Å; L80-L83 PolarHBondContact O-N 2.8Å; L80-L83 VanDerWaalsContact O-N 3.14Å; L80-P93 HydrophobicContact CD1-CB 4.47Å; L80-P93 HydrophobicContact CD2-CB 3.95Å; L80-I96 HydrophobicContact CD1-CB 4.24Å; L80-I96 HydrophobicContact CD1-CD1 4.19Å; L80-I96 HydrophobicContact CD1-CG2 3.98Å
81R81.3Confident80.5Confident219 Ų21986.9 Ų86.983%0.82643%0.425SS*.THydrogen-bonded Turntrans-66-21.3172.7-67.2176.2-172.6178.51.5113.8A77 K79A77-R81 WeakPolarHBondContact O-CG 3.42Å; A77-R81 PolarHBondContact O-N 2.96Å; K79-R81 VanDerWaalsContact C-N 3.31Å; K79-R81 PolarHBondContact O-N 3.04Å
82Q82.8Confident80.1Confident133 Ų13384.3 Ų84.362%0.62142%0.417SS*.THydrogen-bonded Turntrans-95.1-4.4177.1-65178.5-12.300112.2K79 L80K79-Q82 CarbonylContact O-C 3.52Å; K79-Q82 WeakPolarHBondContact O-CA 3.42Å; K79-Q82 WeakPolarHBondContact O-CB 3.39Å; K79-Q82 PolarHBondContact O-N 3.42Å; L80-Q82 PolarHBondContact O-N 3.49Å
83L76.6Confident79.8Confident57 Ų5787.5 Ų87.530%0.29844%0.438SS..SBendtrans-71135.3-179.6-88.6169000109.6K79 L80 V87 I96K79-L83 PolarHBondContact O-N 3.42Å; K79-L83 VanDerWaalsContact O-N 3.12Å; L80-L83 HydrophobicContact CD1-CD1 3.72Å; L80-L83 WeakPolarHBondContact O-CB 3.4Å; L80-L83 PolarHBondContact O-N 2.8Å; L80-L83 VanDerWaalsContact O-N 3.14Å; L83-V87 HydrophobicContact CD2-CB 4.18Å; L83-V87 HydrophobicContact CD2-CG1 4.01Å; L83-V87 HydrophobicContact CD2-CG2 4.37Å; L83-I96 HydrophobicContact CD1-CD1 4.3Å; L83-I96 HydrophobicContact CD1-CG2 4.01Å
84P75.6Confident79.6Confident61 Ų6190.1 Ų90.140%0.39645%0.452SS..  trans-56.9143.8174.1-23.633.3000111.3F86 V87 S88P84-F86 HydrophobicContact CB-CD1 3.33Å; P84-F86 HydrophobicContact CB-CE1 3.1Å; P84-F86 HydrophobicContact CB-CG 4.24Å; P84-F86 HydrophobicContact CB-CZ 3.85Å; P84-F86 HydrophobicContact CG-CD1 4.32Å; P84-F86 HydrophobicContact CG-CE1 3.6Å; P84-F86 HydrophobicContact CG-CZ 3.96Å; P84-F86 PolarHBondContact O-N 3.05Å; P84-V87 HydrophobicContact CB-CG2 4.48Å; P84-V87 HydrophobicContact CG-CG2 4.49Å; P84-V87 PolarHBondContact O-N 3.42Å; P84-S88 PolarHBondContact O-N 3.33Å
85L73.8Confident79.4Confident148 Ų14889.4 Ų89.478%0.77544%0.442SS*.Hα-helixtrans-50.9-37.7-178.5-80161.2000112.8V87 S88 S89L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 2.92Å; L85-S88 VanDerWaalsContact CA-OG 3.32Å; L85-S88 WeakPolarHBondContact CA-OG 3.41Å; L85-S88 PolarHBondContact O-N 2.92Å; L85-S88 PolarHBondContact O-OG 3.39Å; L85-S89 PolarHBondContact O-N 3.06Å; L85-S89 PolarHBondContact O-OG 3.27Å
86F72Confident79.3Confident137 Ų13785.6 Ų85.660%0.60143%0.428SS*.Hα-helixtrans-63.2-31.5179.272.9-99.4000114.1P84 S89P84-F86 HydrophobicContact CB-CD1 3.33Å; P84-F86 HydrophobicContact CB-CE1 3.1Å; P84-F86 HydrophobicContact CB-CG 4.24Å; P84-F86 HydrophobicContact CB-CZ 3.85Å; P84-F86 HydrophobicContact CG-CD1 4.32Å; P84-F86 HydrophobicContact CG-CE1 3.6Å; P84-F86 HydrophobicContact CG-CZ 3.96Å; P84-F86 PolarHBondContact O-N 3.05Å; F86-S89 PolarHBondContact O-OG 2.84Å
87V68.5Low79.4Confident39 Ų3987.3 Ų87.324%0.23644%0.437CS..Hα-helixtrans-77.3-41.8175.2-175.30000109.4L83 P84 L85 S89 Q90 A91L83-V87 HydrophobicContact CD2-CB 4.18Å; L83-V87 HydrophobicContact CD2-CG1 4.01Å; L83-V87 HydrophobicContact CD2-CG2 4.37Å; P84-V87 HydrophobicContact CB-CG2 4.48Å; P84-V87 HydrophobicContact CG-CG2 4.49Å; P84-V87 PolarHBondContact O-N 3.42Å; L85-V87 VanDerWaalsContact C-N 3.31Å; L85-V87 PolarHBondContact O-N 2.92Å; V87-S89 VanDerWaalsContact C-N 3.29Å; V87-S89 PolarHBondContact O-N 3.01Å; V87-Q90 PolarHBondContact O-N 3.44Å; V87-A91 PolarHBondContact O-N 3.39Å
88S67.5Low79.4Confident46 Ų4687.2 Ų87.232%0.32243%0.432SS..Hα-helixtrans-67.2-27.5-178.567.10000113.6P84 L85P84-S88 PolarHBondContact O-N 3.33Å; L85-S88 VanDerWaalsContact CA-OG 3.32Å; L85-S88 WeakPolarHBondContact CA-OG 3.41Å; L85-S88 PolarHBondContact O-N 2.92Å; L85-S88 PolarHBondContact O-OG 3.39Å
89S71.5Confident79.5Confident95 Ų9579.9 Ų79.966%0.66440%0.404SS*.Hα-helixtrans-77.4-25.3179.661.60000113.5L85 F86 V87L85-S89 PolarHBondContact O-N 3.06Å; L85-S89 PolarHBondContact O-OG 3.27Å; F86-S89 PolarHBondContact O-OG 2.84Å; V87-S89 VanDerWaalsContact C-N 3.29Å; V87-S89 PolarHBondContact O-N 3.01Å
90Q76.2Confident79.8Confident172 Ų17275.6 Ų75.680%0.80439%0.386SS*.Hα-helixtrans-96.3-14.6-176.6-64.4-175.31400113.7V87V87-Q90 PolarHBondContact O-N 3.44Å
91A76.7Confident80.1Confident20 Ų2073.7 Ų73.717%0.16538%0.377CS..SBendtrans-126.7138.1-171.400000111.6V87 P93 I96V87-A91 PolarHBondContact O-N 3.39Å; A91-P93 WeakPolarHBondContact O-CD 3.29Å; A91-P93 VanDerWaalsContact O-N 3.13Å; A91-I96 HydrophobicContact CB-CD1 3.52Å; A91-I96 HydrophobicContact CB-CG1 4.16Å
92D80.9Confident80.5Confident83 Ų8363.3 Ų63.344%0.44434%0.337SS..  trans-59.1116.5174.4176.4-3000110.1N94 R95 I96D92-N94 VanDerWaalsContact C-N 3.26Å; D92-N94 PolarHBondContact O-N 2.84Å; D92-N94 WeakPolarHBondContact OD1-CB 3.45Å; D92-N94 PolarHBondContact OD1-N 3.03Å; D92-R95 HydrophobicContact CB-CB 3.87Å; D92-R95 WeakPolarHBondContact O-CB 3.46Å; D92-R95 PolarHBondContact O-N 2.92Å; D92-R95 VanDerWaalsContact O-N 3.1Å; D92-I96 PolarHBondContact O-N 3.11Å
93P81.3Confident80.8Confident66 Ų6657 Ų5743%0.42931%0.308SS..Hα-helixtrans-61.6-33.8-178.224.2-33.6000112.3L80 A91 R95 I96 L97L80-P93 HydrophobicContact CD1-CB 4.47Å; L80-P93 HydrophobicContact CD2-CB 3.95Å; A91-P93 WeakPolarHBondContact O-CD 3.29Å; A91-P93 VanDerWaalsContact O-N 3.13Å; P93-R95 VanDerWaalsContact C-N 3.34Å; P93-I96 PolarHBondContact O-N 3.28Å; P93-L97 WeakPolarHBondContact O-CB 3.4Å; P93-L97 PolarHBondContact O-N 2.95Å
94N84.3Confident81.5Confident105 Ų10557 Ų5756%0.56131%0.305SS*.Hα-helixtrans-67.2-39.5177-70.3-39.2000110.8D92 L97 I98D92-N94 VanDerWaalsContact C-N 3.26Å; D92-N94 PolarHBondContact O-N 2.84Å; D92-N94 WeakPolarHBondContact OD1-CB 3.45Å; D92-N94 PolarHBondContact OD1-N 3.03Å; N94-L97 PolarHBondContact O-N 3.3Å; N94-I98 WeakPolarHBondContact O-CG1 3.41Å; N94-I98 PolarHBondContact O-N 3.41Å
95R85Confident82.1Confident84 Ų8454.1 Ų54.132%0.31729%0.286SS..Hα-helixtrans-65.8-40.7176.4-166.5173.2-171.5-172.79.9111.8Y49 K50 D92 P93 L97 S99Y49-R95 HydrophobicContact CD2-CG 3.97Å; Y49-R95 HydrophobicContact CE2-CB 4.07Å; Y49-R95 HydrophobicContact CE2-CG 3.66Å; Y49-R95 PolarHBondContact O-NE 3.26Å; Y49-R95 PolarHBondContact O-NH2 3.49Å; K50-R95 PolarHBondContact O-NH2 2.99Å; D92-R95 HydrophobicContact CB-CB 3.87Å; D92-R95 WeakPolarHBondContact O-CB 3.46Å; D92-R95 PolarHBondContact O-N 2.92Å; D92-R95 VanDerWaalsContact O-N 3.1Å; P93-R95 VanDerWaalsContact C-N 3.34Å; R95-L97 VanDerWaalsContact C-N 3.35Å; R95-S99 VanDerWaalsContact O-CB 3.23Å; R95-S99 WeakPolarHBondContact O-CB 3.46Å; R95-S99 PolarHBondContact O-N 3.02Å; R95-S99 PolarHBondContact O-OG 3.46Å
96I85.3Confident82.8Confident10 Ų1048.8 Ų48.85%0.05126%0.258CS..Hα-helixtrans-62.5-44.4174-65.8168000110.6W45 Y49 L80 L83 A91 D92 P93 S99 G100W45-I96 HydrophobicContact CZ2-CG2 4.5Å; Y49-I96 HydrophobicContact CE2-CG1 3.98Å; L80-I96 HydrophobicContact CD1-CB 4.24Å; L80-I96 HydrophobicContact CD1-CD1 4.19Å; L80-I96 HydrophobicContact CD1-CG2 3.98Å; L83-I96 HydrophobicContact CD1-CD1 4.3Å; L83-I96 HydrophobicContact CD1-CG2 4.01Å; A91-I96 HydrophobicContact CB-CD1 3.52Å; A91-I96 HydrophobicContact CB-CG1 4.16Å; D92-I96 PolarHBondContact O-N 3.11Å; P93-I96 PolarHBondContact O-N 3.28Å; I96-S99 WeakPolarHBondContact CA-OG 3.49Å; I96-S99 PolarHBondContact O-OG 3.39Å; I96-G100 PolarHBondContact O-N 3.21Å
97L87.4Confident83.7Confident41 Ų4145.4 Ų45.422%0.21524%0.241CC..Hα-helixtrans-59.9-52179.7-177.270.1000111.7L73 A77 P93 N94 R95 G100 A101L73-L97 HydrophobicContact CD2-CD1 4.42Å; L73-L97 HydrophobicContact CD2-CD2 4.27Å; L73-L97 HydrophobicContact CD2-CG 3.9Å; A77-L97 HydrophobicContact CB-CD1 3.76Å; P93-L97 WeakPolarHBondContact O-CB 3.4Å; P93-L97 PolarHBondContact O-N 2.95Å; N94-L97 PolarHBondContact O-N 3.3Å; R95-L97 VanDerWaalsContact C-N 3.35Å; L97-G100 PolarHBondContact O-N 3.35Å; L97-A101 PolarHBondContact O-N 2.93Å; L97-A101 VanDerWaalsContact O-N 3.1Å
98I88.5Confident84.6Confident28 Ų2848.5 Ų48.514%0.14425%0.252CS..Hα-helixtrans-63.2-51.6-179.7-66.8168.4000110.1N94 G100 A101 E102N94-I98 WeakPolarHBondContact O-CG1 3.41Å; N94-I98 PolarHBondContact O-N 3.41Å; I98-G100 PolarHBondContact O-N 3.41Å; I98-A101 WeakPolarHBondContact O-CB 3.11Å; I98-A101 PolarHBondContact O-N 2.89Å; I98-E102 HydrophobicContact CG2-CG 4.17Å; I98-E102 WeakPolarHBondContact O-CG 3.45Å; I98-E102 PolarHBondContact O-N 3.03Å
99S89.3Confident85.6Confident0 Ų050.5 Ų50.50%026%0.258CS..Hα-helixtrans-61.2-33.9-178.859.10000113.2W45 C48 Y49 R95 I96 S103W45-S99 PolarHBondContact NE1-OG 2.8Å; C48-S99 WeakPolarHBondContact CB-O 3.3Å; Y49-S99 VanDerWaalsContact CA-CB 3.48Å; R95-S99 VanDerWaalsContact O-CB 3.23Å; R95-S99 WeakPolarHBondContact O-CB 3.46Å; R95-S99 PolarHBondContact O-N 3.02Å; R95-S99 PolarHBondContact O-OG 3.46Å; I96-S99 WeakPolarHBondContact CA-OG 3.49Å; I96-S99 PolarHBondContact O-OG 3.39Å; S99-S103 WeakPolarHBondContact O-CB 3.43Å; S99-S103 PolarHBondContact O-N 2.92Å
100G88.3Confident86.5Confident4 Ų448.8 Ų48.84%0.04124%0.241CC..Hα-helixtrans-66.3-41.9173.400000112.5S76 I96 L97 I98 Y104S76-G100 WeakPolarHBondContact OG-CA 3.22Å; I96-G100 PolarHBondContact O-N 3.21Å; L97-G100 PolarHBondContact O-N 3.35Å; I98-G100 PolarHBondContact O-N 3.41Å; G100-Y104 WeakPolarHBondContact O-CB 3.34Å; G100-Y104 PolarHBondContact O-N 3.43Å
101A89.1Confident87.1Confident0 Ų042 Ų420%021%0.213CC..Hα-helixtrans-66.8-43.9176.800000111.9Y69 L73 S76 L97 I98 Y104 V105Y69-A101 HydrophobicContact CD2-CB 4.02Å; Y69-A101 HydrophobicContact CE2-CB 3.68Å; L73-A101 HydrophobicContact CB-CB 4.43Å; L73-A101 HydrophobicContact CD2-CB 3.7Å; L73-A101 HydrophobicContact CG-CB 3.79Å; S76-A101 PolarHBondContact OG-N 2.89Å; L97-A101 PolarHBondContact O-N 2.93Å; L97-A101 VanDerWaalsContact O-N 3.1Å; I98-A101 WeakPolarHBondContact O-CB 3.11Å; I98-A101 PolarHBondContact O-N 2.89Å; A101-Y104 WeakPolarHBondContact O-CB 3.44Å; A101-Y104 PolarHBondContact O-N 3.43Å; A101-V105 WeakPolarHBondContact O-CG2 3.37Å; A101-V105 PolarHBondContact O-N 3.2Å
102E89.6Confident87.6Confident0 Ų045.8 Ų45.80%024%0.235CC..Hα-helixtrans-63.6-44.1175.9-64.5-174.8141.700111.9C48 Q52 P53 I54 R55 Y69 I98 Y104 V105 L106C48-E102 HydrophobicContact CB-CB 3.99Å; Q52-E102 VanDerWaalsContact CA-OE2 3.23Å; Q52-E102 WeakPolarHBondContact CA-OE2 3.36Å; P53-E102 WeakPolarHBondContact CD-OE2 3.4Å; I54-E102 WeakPolarHBondContact CA-OE1 3.4Å; I54-E102 HydrophobicContact CB-CB 4.41Å; I54-E102 HydrophobicContact CB-CG 3.88Å; I54-E102 HydrophobicContact CD1-CB 4.33Å; I54-E102 HydrophobicContact CG2-CG 4.43Å; I54-E102 PolarHBondContact N-OE1 3.33Å; R55-E102 PolarHBondContact N-OE1 3.25Å; Y69-E102 HydrophobicContact CE2-CG 4.02Å; I98-E102 HydrophobicContact CG2-CG 4.17Å; I98-E102 WeakPolarHBondContact O-CG 3.45Å; I98-E102 PolarHBondContact O-N 3.03Å; E102-Y104 VanDerWaalsContact C-N 3.26Å; E102-Y104 PolarHBondContact O-N 3.1Å; E102-V105 PolarHBondContact O-N 3.18Å; E102-L106 WeakPolarHBondContact O-CG 3.4Å; E102-L106 PolarHBondContact O-N 3.08Å
103S90.5Very high88Confident2 Ų248 Ų481%0.01425%0.247CC..Hα-helixtrans-61-36.8174.51730000111.6W45 C48 S99 R107W45-S103 PolarHBondContact N-OG 3.38Å; C48-S103 PolarHBondContact SG-N 2.87Å; S99-S103 WeakPolarHBondContact O-CB 3.43Å; S99-S103 PolarHBondContact O-N 2.92Å; S103-R107 VanDerWaalsContact O-CB 3.32Å; S103-R107 WeakPolarHBondContact O-CB 3.33Å; S103-R107 VanDerWaalsContact O-CG 3.22Å; S103-R107 WeakPolarHBondContact O-CG 3.39Å; S103-R107 PolarHBondContact O-N 2.81Å; S103-R107 PolarHBondContact O-NE 3.15Å
104Y90Very high88.4Confident55 Ų5546.3 Ų46.322%0.21624%0.235CC..Hα-helixtrans-63.9-46.5173.8-173.3-90.8000111.9I68 K71 G100 A101 E102 R107 K108I68-Y104 HydrophobicContact CG2-CD1 3.91Å; I68-Y104 HydrophobicContact CG2-CE1 3.89Å; K71-Y104 HydrophobicContact CB-CE1 4.33Å; G100-Y104 WeakPolarHBondContact O-CB 3.34Å; G100-Y104 PolarHBondContact O-N 3.43Å; A101-Y104 WeakPolarHBondContact O-CB 3.44Å; A101-Y104 PolarHBondContact O-N 3.43Å; E102-Y104 VanDerWaalsContact C-N 3.26Å; E102-Y104 PolarHBondContact O-N 3.1Å; Y104-R107 PolarHBondContact O-N 3.28Å; Y104-K108 HydrophobicContact CD1-CG 4.36Å; Y104-K108 HydrophobicContact CE1-CG 3.98Å; Y104-K108 WeakPolarHBondContact O-CG 3.5Å; Y104-K108 PolarHBondContact O-N 3.39Å
105V88.5Confident88.7Confident1 Ų144.7 Ų44.71%0.00623%0.226CC..Hα-helixtrans-61.5-51.5176.6172.10000111.1I54 I65 I68 Y69 A101 E102 R107 K108 I109I54-V105 HydrophobicContact CD1-CB 4.18Å; I54-V105 HydrophobicContact CD1-CG1 3.92Å; I65-V105 HydrophobicContact CG2-CG1 4.1Å; I68-V105 HydrophobicContact CB-CG2 4.36Å; I68-V105 HydrophobicContact CG2-CB 4.37Å; I68-V105 HydrophobicContact CG2-CG2 3.81Å; Y69-V105 HydrophobicContact CD2-CG2 3.92Å; Y69-V105 HydrophobicContact CG-CG2 4.38Å; A101-V105 WeakPolarHBondContact O-CG2 3.37Å; A101-V105 PolarHBondContact O-N 3.2Å; E102-V105 PolarHBondContact O-N 3.18Å; V105-R107 VanDerWaalsContact C-N 3.32Å; V105-R107 PolarHBondContact O-N 2.78Å; V105-K108 PolarHBondContact O-N 2.77Å; V105-I109 HydrophobicContact CG1-CD1 3.63Å; V105-I109 HydrophobicContact CG1-CG1 4.3Å; V105-I109 WeakPolarHBondContact O-CG1 3.26Å; V105-I109 PolarHBondContact O-N 3.22Å
106L88.5Confident88.8Confident37 Ų3743 Ų4319%0.19423%0.226CC..Hα-helixtrans-57.8-45.1180-75.5-179.4000111.6F44 C48 P53 I54 E102 K108 I109 L110F44-L106 HydrophobicContact CD1-CB 3.98Å; F44-L106 HydrophobicContact CD1-CD1 4.09Å; F44-L106 HydrophobicContact CE1-CB 4.25Å; C48-L106 WeakPolarHBondContact SG-CD1 3.47Å; P53-L106 HydrophobicContact CG-CD1 4.48Å; I54-L106 HydrophobicContact CD1-CD2 3.78Å; I54-L106 HydrophobicContact CD1-CG 3.72Å; E102-L106 WeakPolarHBondContact O-CG 3.4Å; E102-L106 PolarHBondContact O-N 3.08Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.48Å; L106-I109 PolarHBondContact O-N 2.98Å; L106-L110 VanDerWaalsContact O-CB 3.28Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 WeakPolarHBondContact O-CG 3.43Å; L106-L110 PolarHBondContact O-N 3.48Å
107R90Very high89Confident65 Ų6544 Ų4425%0.24524%0.238CC..Hα-helixtrans-64.9-32.5177.4-73.6-177-61170.41.2112.7A41 F44 S103 Y104 V105 S111A41-R107 VanDerWaalsContact CB-NH1 3.25Å; F44-R107 HydrophobicContact CB-CG 4.17Å; F44-R107 HydrophobicContact CD2-CG 3.6Å; F44-R107 HydrophobicContact CE2-CG 4.23Å; F44-R107 HydrophobicContact CG-CG 3.91Å; S103-R107 VanDerWaalsContact O-CB 3.32Å; S103-R107 WeakPolarHBondContact O-CB 3.33Å; S103-R107 VanDerWaalsContact O-CG 3.22Å; S103-R107 WeakPolarHBondContact O-CG 3.39Å; S103-R107 PolarHBondContact O-N 2.81Å; S103-R107 PolarHBondContact O-NE 3.15Å; Y104-R107 PolarHBondContact O-N 3.28Å; V105-R107 VanDerWaalsContact C-N 3.32Å; V105-R107 PolarHBondContact O-N 2.78Å; R107-S111 WeakPolarHBondContact O-CA 3.29Å; R107-S111 VanDerWaalsContact O-CB 3.23Å; R107-S111 WeakPolarHBondContact O-CB 3.48Å; R107-S111 PolarHBondContact O-N 3.04Å
108K89.3Confident89.2Confident104 Ų10443.6 Ų43.645%0.45224%0.235SC..Hα-helixtrans-71.6-44.1174.8-78.3-67.3-175.9-176.80111.9I68 Y104 V105 L106 L110 S111I68-K108 HydrophobicContact CG2-CB 4.08Å; I68-K108 HydrophobicContact CG2-CG 4.15Å; Y104-K108 HydrophobicContact CD1-CG 4.36Å; Y104-K108 HydrophobicContact CE1-CG 3.98Å; Y104-K108 WeakPolarHBondContact O-CG 3.5Å; Y104-K108 PolarHBondContact O-N 3.39Å; V105-K108 PolarHBondContact O-N 2.77Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.48Å; K108-L110 VanDerWaalsContact C-N 3.3Å; K108-L110 PolarHBondContact O-N 3.3Å; K108-S111 WeakPolarHBondContact O-CB 3.17Å; K108-S111 PolarHBondContact O-N 3.29Å; K108-S111 PolarHBondContact O-OG 3.12Å
109I87.6Confident89.3Confident89 Ų8942.4 Ų42.446%0.45623%0.229SC..Hα-helixtrans-61.5-42.3175.7-67.4171.2000110.6V105 L106 S111 P112V105-I109 HydrophobicContact CG1-CD1 3.63Å; V105-I109 HydrophobicContact CG1-CG1 4.3Å; V105-I109 WeakPolarHBondContact O-CG1 3.26Å; V105-I109 PolarHBondContact O-N 3.22Å; L106-I109 PolarHBondContact O-N 2.98Å; I109-S111 VanDerWaalsContact C-N 3.33Å; I109-P112 WeakPolarHBondContact O-CD 3.29Å
110L89.6Confident89.4Confident58 Ų5850 Ų5030%0.30426%0.259SS..THydrogen-bonded Turntrans-87.60-179.5-63.3170.8000113F44 L106 K108 L113 T114F44-L110 HydrophobicContact CE1-CD1 3.37Å; F44-L110 HydrophobicContact CZ-CD1 3.34Å; L106-L110 VanDerWaalsContact O-CB 3.28Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 WeakPolarHBondContact O-CG 3.43Å; L106-L110 PolarHBondContact O-N 3.48Å; K108-L110 VanDerWaalsContact C-N 3.3Å; K108-L110 PolarHBondContact O-N 3.3Å; L110-L113 PolarHBondContact O-N 3.46Å; L110-L113 VanDerWaalsContact O-N 3.12Å; L110-T114 HydrophobicContact CB-CG2 4.01Å; L110-T114 WeakPolarHBondContact O-CB 3.35Å; L110-T114 WeakPolarHBondContact O-CG2 3.47Å; L110-T114 PolarHBondContact O-N 3.32Å; L110-T114 PolarHBondContact O-OG1 3.18Å
111S89.5Confident89.4Confident30 Ų3053.4 Ų53.421%0.2128%0.275CS..Hα-helixtrans-60.3-37.9179.665.30000114R107 K108 I109 L113 T114 I115R107-S111 WeakPolarHBondContact O-CA 3.29Å; R107-S111 VanDerWaalsContact O-CB 3.23Å; R107-S111 WeakPolarHBondContact O-CB 3.48Å; R107-S111 PolarHBondContact O-N 3.04Å; K108-S111 WeakPolarHBondContact O-CB 3.17Å; K108-S111 PolarHBondContact O-N 3.29Å; K108-S111 PolarHBondContact O-OG 3.12Å; I109-S111 VanDerWaalsContact C-N 3.33Å; S111-L113 PolarHBondContact O-N 2.9Å; S111-L113 VanDerWaalsContact O-N 3.16Å; S111-T114 WeakPolarHBondContact CA-OG1 3.36Å; S111-I115 WeakPolarHBondContact O-CB 3.28Å; S111-I115 WeakPolarHBondContact O-CG1 3.48Å; S111-I115 PolarHBondContact O-N 3.5Å
112P88.2Confident89.5Confident99 Ų9953.4 Ų53.464%0.64328%0.275SS*.Hα-helixtrans-62.5-23.5176.6-21.635.5000113.1I109 P116I109-P112 WeakPolarHBondContact O-CD 3.29Å; P112-P116 WeakPolarHBondContact O-CD 3.37Å; P112-P116 WeakPolarHBondContact O-CG 3.17Å
113L89.1Confident89.5Confident130 Ų13054.8 Ų54.868%0.68128%0.283SS*.Hα-helixtrans-96.6-47.1177.7-177.564.9000112L110 S111 G117L110-L113 PolarHBondContact O-N 3.46Å; L110-L113 VanDerWaalsContact O-N 3.12Å; S111-L113 PolarHBondContact O-N 2.9Å; S111-L113 VanDerWaalsContact O-N 3.16Å; L113-G117 PolarHBondContact O-N 2.8Å
114T90.1Very high89.6Confident30 Ų3058.2 Ų58.218%0.18430%0.301CS..Hα-helixtrans-73.2-30.7-173.354.70000112.9L40 L110 S111 K118L40-T114 HydrophobicContact CD1-CG2 4.04Å; L110-T114 HydrophobicContact CB-CG2 4.01Å; L110-T114 WeakPolarHBondContact O-CB 3.35Å; L110-T114 WeakPolarHBondContact O-CG2 3.47Å; L110-T114 PolarHBondContact O-N 3.32Å; L110-T114 PolarHBondContact O-OG1 3.18Å; S111-T114 WeakPolarHBondContact CA-OG1 3.36Å; T114-K118 VanDerWaalsContact O-CB 3.3Å; T114-K118 WeakPolarHBondContact O-CB 3.34Å; T114-K118 WeakPolarHBondContact O-CE 3.44Å; T114-K118 WeakPolarHBondContact O-CG 3.48Å; T114-K118 PolarHBondContact O-N 3.45Å
115I89.2Confident89.6Confident71 Ų7157.8 Ų57.836%0.36430%0.304SS..Hα-helixtrans-70-56.4178.2-62.8172.2000110.6F14 S111 G117 K118 I119F14-I115 HydrophobicContact CZ-CG2 3.98Å; S111-I115 WeakPolarHBondContact O-CB 3.28Å; S111-I115 WeakPolarHBondContact O-CG1 3.48Å; S111-I115 PolarHBondContact O-N 3.5Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 2.91Å; I115-K118 PolarHBondContact O-N 2.98Å; I115-I119 HydrophobicContact CG2-CD1 4.08Å; I115-I119 WeakPolarHBondContact O-CG1 3.46Å; I115-I119 PolarHBondContact O-N 3.4Å
116P88.1Confident89.7Confident50 Ų5057.7 Ų57.733%0.32530%0.304SS..Hα-helixtrans-61.1-40.3176.8-1829.7000111.8F14 P112 K118 I119 Y120F14-P116 HydrophobicContact CD1-CB 4.44Å; F14-P116 HydrophobicContact CE1-CB 3.9Å; F14-P116 HydrophobicContact CE1-CG 3.89Å; P112-P116 WeakPolarHBondContact O-CD 3.37Å; P112-P116 WeakPolarHBondContact O-CG 3.17Å; P116-K118 PolarHBondContact O-N 3.17Å; P116-I119 PolarHBondContact O-N 2.95Å; P116-I119 VanDerWaalsContact O-N 3.14Å; P116-Y120 PolarHBondContact O-N 3.21Å
117G89.9Confident89.7Confident30 Ų3057.7 Ų57.731%0.30931%0.313SS..Hα-helixtrans-58.9-44.2178.300000113.1L113 I115 I119 Y120 L121L113-G117 PolarHBondContact O-N 2.8Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 2.91Å; G117-I119 VanDerWaalsContact C-N 3.33Å; G117-I119 PolarHBondContact O-N 2.72Å; G117-Y120 PolarHBondContact O-N 3.02Å; G117-L121 WeakPolarHBondContact O-CB 3.48Å; G117-L121 VanDerWaalsContact O-CG 3.29Å; G117-L121 WeakPolarHBondContact O-CG 3.48Å; G117-L121 PolarHBondContact O-N 3.38Å
118K91.5Very high89.7Confident32 Ų3261 Ų6114%0.13933%0.334CS..Hα-helixtrans-63.4-38175.2-79.9-172.7-68150.60112.8F36 L40 T114 I115 P116 A122F36-K118 HydrophobicContact CB-CD 4.02Å; F36-K118 HydrophobicContact CB-CG 3.9Å; L40-K118 HydrophobicContact CD1-CD 3.82Å; L40-K118 HydrophobicContact CD1-CG 3.95Å; T114-K118 VanDerWaalsContact O-CB 3.3Å; T114-K118 WeakPolarHBondContact O-CB 3.34Å; T114-K118 WeakPolarHBondContact O-CE 3.44Å; T114-K118 WeakPolarHBondContact O-CG 3.48Å; T114-K118 PolarHBondContact O-N 3.45Å; I115-K118 PolarHBondContact O-N 2.98Å; P116-K118 PolarHBondContact O-N 3.17Å; K118-A122 VanDerWaalsContact O-CB 3.31Å; K118-A122 WeakPolarHBondContact O-CB 3.33Å; K118-A122 PolarHBondContact O-N 2.95Å
119I90.2Very high89.6Confident4 Ų460.6 Ų60.62%0.02134%0.34CS..Hα-helixtrans-69-46.1-179.2-71.6173.1000110.1L10 F11 F14 I16 I115 P116 G117 L121 A122 V123L10-I119 HydrophobicContact CD2-CD1 3.98Å; L10-I119 HydrophobicContact CD2-CG1 4.01Å; F11-I119 HydrophobicContact CD1-CG2 3.72Å; F11-I119 HydrophobicContact CE1-CG2 3.82Å; F14-I119 HydrophobicContact CB-CG2 4.42Å; F14-I119 HydrophobicContact CD2-CD1 3.35Å; F14-I119 HydrophobicContact CD2-CG2 4.18Å; F14-I119 HydrophobicContact CE1-CD1 4.31Å; F14-I119 HydrophobicContact CE2-CD1 2.98Å; F14-I119 HydrophobicContact CE2-CG1 4.41Å; F14-I119 HydrophobicContact CG-CD1 4.16Å; F14-I119 HydrophobicContact CG-CG2 4.22Å; F14-I119 HydrophobicContact CZ-CD1 3.53Å; I16-I119 HydrophobicContact CD1-CG2 3.82Å; I115-I119 HydrophobicContact CG2-CD1 4.08Å; I115-I119 WeakPolarHBondContact O-CG1 3.46Å; I115-I119 PolarHBondContact O-N 3.4Å; P116-I119 PolarHBondContact O-N 2.95Å; P116-I119 VanDerWaalsContact O-N 3.14Å; G117-I119 VanDerWaalsContact C-N 3.33Å; G117-I119 PolarHBondContact O-N 2.72Å; I119-L121 VanDerWaalsContact C-N 3.34Å; I119-L121 PolarHBondContact O-N 3.02Å; I119-A122 WeakPolarHBondContact O-CB 3.43Å; I119-A122 PolarHBondContact O-N 3.32Å; I119-V123 WeakPolarHBondContact O-CG2 3.23Å; I119-V123 PolarHBondContact O-N 3.14Å
120Y89.9Confident89.3Confident160 Ų16060.5 Ų60.563%0.62735%0.346SS*.Hα-helixtrans-57.3-47.3173.6-177.9-98000111.8P116 G117 A122 V123 L124P116-Y120 PolarHBondContact O-N 3.21Å; G117-Y120 PolarHBondContact O-N 3.02Å; Y120-A122 PolarHBondContact O-N 2.92Å; Y120-V123 PolarHBondContact O-N 3.35Å; Y120-L124 HydrophobicContact CE1-CD1 4.02Å; Y120-L124 WeakPolarHBondContact O-CB 3.36Å; Y120-L124 PolarHBondContact O-N 2.87Å
121L90.3Very high89.3Confident75 Ų7560.7 Ų60.739%0.39335%0.349SS..Hα-helixtrans-62.1-40.6176.5-73.7172.4000112.5F36 G117 I119 V123 L124 V125F36-L121 HydrophobicContact CD2-CB 4.32Å; F36-L121 HydrophobicContact CE2-CB 3.97Å; F36-L121 HydrophobicContact CZ-CB 4.48Å; G117-L121 WeakPolarHBondContact O-CB 3.48Å; G117-L121 VanDerWaalsContact O-CG 3.29Å; G117-L121 WeakPolarHBondContact O-CG 3.48Å; G117-L121 PolarHBondContact O-N 3.38Å; I119-L121 VanDerWaalsContact C-N 3.34Å; I119-L121 PolarHBondContact O-N 3.02Å; L121-V123 PolarHBondContact O-N 2.8Å; L121-L124 PolarHBondContact O-N 3.1Å; L121-V125 WeakPolarHBondContact O-CB 3.48Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.23Å; L121-V125 PolarHBondContact O-N 2.94Å
122A90.9Very high89.2Confident0 Ų062.3 Ų62.30%036%0.356CS..Hα-helixtrans-61.6-43.6176.300000112.1A29 A32 H33 K118 I119 Y120 S126A29-A122 WeakPolarHBondContact O-CB 3.4Å; A32-A122 HydrophobicContact CB-CB 4.17Å; H33-A122 HydrophobicContact CB-CB 4.07Å; K118-A122 VanDerWaalsContact O-CB 3.31Å; K118-A122 WeakPolarHBondContact O-CB 3.33Å; K118-A122 PolarHBondContact O-N 2.95Å; I119-A122 WeakPolarHBondContact O-CB 3.43Å; I119-A122 PolarHBondContact O-N 3.32Å; Y120-A122 PolarHBondContact O-N 2.92Å; A122-S126 VanDerWaalsContact O-CB 3.31Å; A122-S126 WeakPolarHBondContact O-CB 3.37Å; A122-S126 PolarHBondContact O-N 3.19Å; A122-S126 PolarHBondContact O-OG 3.39Å
123V89.8Confident89.3Confident28 Ų2860.2 Ų60.217%0.1734%0.34CS..Hα-helixtrans-62.2-46.7176176.50000110.4F11 I16 W21 I119 Y120 L121 S126 G127F11-V123 HydrophobicContact CD1-CG2 4.07Å; F11-V123 HydrophobicContact CE1-CG2 3.81Å; I16-V123 HydrophobicContact CD1-CG2 3.79Å; I16-V123 HydrophobicContact CG2-CG2 4.38Å; W21-V123 HydrophobicContact CH2-CB 4.22Å; W21-V123 HydrophobicContact CH2-CG1 3.92Å; W21-V123 HydrophobicContact CH2-CG2 3.79Å; W21-V123 HydrophobicContact CZ2-CG1 4.05Å; W21-V123 HydrophobicContact CZ2-CG2 4.49Å; I119-V123 WeakPolarHBondContact O-CG2 3.23Å; I119-V123 PolarHBondContact O-N 3.14Å; Y120-V123 PolarHBondContact O-N 3.35Å; L121-V123 PolarHBondContact O-N 2.8Å; V123-S126 PolarHBondContact O-N 3.23Å; V123-S126 PolarHBondContact O-OG 3.34Å; V123-G127 PolarHBondContact O-N 2.92Å
124L91.4Very high89.3Confident74 Ų7456.1 Ų56.139%0.38732%0.32SS..Hα-helixtrans-62.9-48.1-179.4-174.1144.5000111.8Y120 L121 S126 G127 I128Y120-L124 HydrophobicContact CE1-CD1 4.02Å; Y120-L124 WeakPolarHBondContact O-CB 3.36Å; Y120-L124 PolarHBondContact O-N 2.87Å; L121-L124 PolarHBondContact O-N 3.1Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.88Å; L124-G127 PolarHBondContact O-N 3.31Å; L124-I128 HydrophobicContact CD2-CD1 3.51Å; L124-I128 HydrophobicContact CG-CD1 4.23Å; L124-I128 WeakPolarHBondContact O-CG1 3.32Å; L124-I128 PolarHBondContact O-N 3.39Å; L124-I128 VanDerWaalsContact O-N 3.15Å
125V90.6Very high89.3Confident46 Ų4657.8 Ų57.828%0.27933%0.328SS..Hα-helixtrans-60-44.3176170.70000110.6V28 A32 F36 L121 G127 I128 V129V28-V125 HydrophobicContact CG1-CG1 4.23Å; A32-V125 HydrophobicContact CB-CB 4.38Å; A32-V125 HydrophobicContact CB-CG1 4.24Å; F36-V125 HydrophobicContact CE2-CG2 4.27Å; F36-V125 HydrophobicContact CZ-CG2 4.33Å; L121-V125 WeakPolarHBondContact O-CB 3.48Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.23Å; L121-V125 PolarHBondContact O-N 2.94Å; V125-G127 VanDerWaalsContact C-N 3.29Å; V125-G127 PolarHBondContact O-N 3.16Å; V125-I128 PolarHBondContact O-N 2.76Å; V125-V129 HydrophobicContact CG1-CG2 4.26Å; V125-V129 VanDerWaalsContact O-CG2 3.3Å; V125-V129 WeakPolarHBondContact O-CG2 3.45Å; V125-V129 PolarHBondContact O-N 3.06Å; V125-V129 VanDerWaalsContact O-N 3.09Å
126S89.6Confident89.3Confident0 Ų056.9 Ų56.90%033%0.326CS..Hα-helixtrans-63.9-33.5179.776.80000113.4R25 A122 V123 L124 C130R25-S126 PolarHBondContact NE-OG 3.37Å; R25-S126 WeakPolarHBondContact O-CB 3.46Å; A122-S126 VanDerWaalsContact O-CB 3.31Å; A122-S126 WeakPolarHBondContact O-CB 3.37Å; A122-S126 PolarHBondContact O-N 3.19Å; A122-S126 PolarHBondContact O-OG 3.39Å; V123-S126 PolarHBondContact O-N 3.23Å; V123-S126 PolarHBondContact O-OG 3.34Å; L124-S126 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 2.88Å; S126-C130 WeakPolarHBondContact O-CB 3.32Å; S126-C130 PolarHBondContact O-N 3.36Å
127G88.5Confident89.4Confident37 Ų3757.4 Ų57.438%0.38133%0.326SS..Hα-helixtrans-80.6-14.7177.700000114.5V123 L124 V125V123-G127 PolarHBondContact O-N 2.92Å; L124-G127 PolarHBondContact O-N 3.31Å; V125-G127 VanDerWaalsContact C-N 3.29Å; V125-G127 PolarHBondContact O-N 3.16Å
128I90.2Very high89.3Confident133 Ų13359.5 Ų59.568%0.68233%0.327SS*.Hα-helixtrans-87.7-34.7173.3-67.9169.8000110.7L124 V125L124-I128 HydrophobicContact CD2-CD1 3.51Å; L124-I128 HydrophobicContact CG-CD1 4.23Å; L124-I128 WeakPolarHBondContact O-CG1 3.32Å; L124-I128 PolarHBondContact O-N 3.39Å; L124-I128 VanDerWaalsContact O-N 3.15Å; V125-I128 PolarHBondContact O-N 2.76Å
129V87Confident89.1Confident97 Ų9761.8 Ų61.859%0.58834%0.343SS*.Hα-helixtrans-87.1-23.5-174175.80000112.8V28 V125V28-V129 HydrophobicContact CG1-CB 4.23Å; V28-V129 HydrophobicContact CG1-CG1 4.33Å; V28-V129 HydrophobicContact CG2-CG1 4.24Å; V125-V129 HydrophobicContact CG1-CG2 4.26Å; V125-V129 VanDerWaalsContact O-CG2 3.3Å; V125-V129 WeakPolarHBondContact O-CG2 3.45Å; V125-V129 PolarHBondContact O-N 3.06Å; V125-V129 VanDerWaalsContact O-N 3.09Å
130C81.1Confident89Confident87 Ų8767 Ų6759%0.58837%0.372SS*.  trans-126.20-175.7-63.90000111.2R25 S126R25-C130 HydrophobicContact CB-CB 4.07Å; S126-C130 WeakPolarHBondContact O-CB 3.32Å; S126-C130 PolarHBondContact O-N 3.36Å

Retrieved 130 of 130 residues in 88.9 ms (Link to these results)

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