A0A3Q0KLN9_SCHMA Loading...

Elongation of very long chain fatty acids protein

AlphaFold DB , UniProt , Accession A0A3Q0KLN9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 329 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
1M47.7Very low56.8Low203 Ų203111.1 Ų111.1100%157%0.569SS**  0110.90-152.5152.4102.900107I3 W6M1-I3 PolarHBondContact O-N 3.33Å; M1-W6 HydrophobicContact CE-CB 4.33Å; M1-W6 HydrophobicContact CE-CG 4.23Å
2N58.7Low57.7Low118 Ų118106.6 Ų106.663%0.63155%0.547SS*.  trans-62.3122.8-174.1-134.1-18.1000108.1F4 N5 W6N2-F4 PolarHBondContact O-N 3.39Å; N2-N5 HydrophobicContact CB-CB 4.37Å; N2-N5 WeakPolarHBondContact O-CA 2.93Å; N2-N5 WeakPolarHBondContact O-CB 3.29Å; N2-N5 PolarHBondContact O-N 3.38Å; N2-W6 PolarHBondContact O-N 3.19Å
3I63.4Low58.3Low122 Ų122100.8 Ų100.863%0.62652%0.521SS*.Hα-helixtrans-56.1-30.1-174.3-147.4158.6000110.7M1 W6 L7M1-I3 PolarHBondContact O-N 3.33Å; I3-W6 PolarHBondContact O-N 3.43Å; I3-L7 HydrophobicContact CG1-CD1 4.47Å; I3-L7 HydrophobicContact CG2-CD1 4.31Å; I3-L7 VanDerWaalsContact O-CB 3.31Å; I3-L7 WeakPolarHBondContact O-CB 3.04Å; I3-L7 VanDerWaalsContact O-CG 3.24Å; I3-L7 WeakPolarHBondContact O-CG 3.49Å; I3-L7 PolarHBondContact O-N 3.39Å
4F54.3Low58.8Low153 Ų153104 Ų10467%0.67154%0.538SS*.Hα-helixtrans-62.5-39.1173.8-143-88000113.4N2 S8N2-F4 PolarHBondContact O-N 3.39Å; F4-S8 WeakPolarHBondContact O-CB 3.28Å; F4-S8 PolarHBondContact O-N 3.48Å; F4-S8 PolarHBondContact O-OG 2.9Å
5N51.6Low60.3Low87 Ų87108.7 Ų108.747%0.46555%0.553SS.*Hα-helixtrans-72.3-35.6176.1-81-14000111.8N2 S8 K9N2-N5 HydrophobicContact CB-CB 4.37Å; N2-N5 WeakPolarHBondContact O-CA 2.93Å; N2-N5 WeakPolarHBondContact O-CB 3.29Å; N2-N5 PolarHBondContact O-N 3.38Å; N5-S8 WeakPolarHBondContact CA-OG 3.41Å; N5-S8 PolarHBondContact O-OG 3.02Å; N5-K9 VanDerWaalsContact O-CB 3.26Å; N5-K9 WeakPolarHBondContact O-CB 3.01Å; N5-K9 WeakPolarHBondContact O-CG 3.17Å; N5-K9 PolarHBondContact O-N 3.2Å
6W60.6Low62Low142 Ų142105.1 Ų105.154%0.53854%0.538SS..Hα-helixtrans-69.5-44174.6-177.778.6000111.5M1 N2 I3 G10M1-W6 HydrophobicContact CE-CB 4.33Å; M1-W6 HydrophobicContact CE-CG 4.23Å; N2-W6 PolarHBondContact O-N 3.19Å; I3-W6 PolarHBondContact O-N 3.43Å; W6-G10 WeakPolarHBondContact O-CA 3.05Å; W6-G10 PolarHBondContact O-N 3.5Å
7L54.8Low63.7Low74 Ų7499.4 Ų99.439%0.38751%0.51SS..Hα-helixtrans-63.4-46.8175.2-74.2167.8000111.9I3 L11I3-L7 HydrophobicContact CG1-CD1 4.47Å; I3-L7 HydrophobicContact CG2-CD1 4.31Å; I3-L7 VanDerWaalsContact O-CB 3.31Å; I3-L7 WeakPolarHBondContact O-CB 3.04Å; I3-L7 VanDerWaalsContact O-CG 3.24Å; I3-L7 WeakPolarHBondContact O-CG 3.49Å; I3-L7 PolarHBondContact O-N 3.39Å; L7-L11 HydrophobicContact CD2-CD2 4.07Å; L7-L11 WeakPolarHBondContact O-CB 3.23Å; L7-L11 PolarHBondContact O-N 2.99Å
8S56.7Low65.1Low52 Ų5298.1 Ų98.136%0.36451%0.508SS..Hα-helixtrans-73.8-37.1-176.657.60000113.9F4 N5F4-S8 WeakPolarHBondContact O-CB 3.28Å; F4-S8 PolarHBondContact O-N 3.48Å; F4-S8 PolarHBondContact O-OG 2.9Å; N5-S8 WeakPolarHBondContact CA-OG 3.41Å; N5-S8 PolarHBondContact O-OG 3.02Å
9K54.4Low66.6Low153 Ų15395.1 Ų95.167%0.66549%0.49SS*.Hα-helixtrans-91-25.9-177.8-65.8-170.5174.8-172.20114.1N5N5-K9 VanDerWaalsContact O-CB 3.26Å; N5-K9 WeakPolarHBondContact O-CB 3.01Å; N5-K9 WeakPolarHBondContact O-CG 3.17Å; N5-K9 PolarHBondContact O-N 3.2Å
10G58.5Low67.8Low59 Ų5990.3 Ų90.361%0.60847%0.465SS*.Hα-helixtrans-103.6-25.9-172.700000114.9W6W6-G10 WeakPolarHBondContact O-CA 3.05Å; W6-G10 PolarHBondContact O-N 3.5Å
11L64.3Low68.8Low59 Ų5990.5 Ų90.531%0.30947%0.467SS..THydrogen-bonded Turntrans-97.1-52-166.4-144.882.3000112.8L7 I250L7-L11 HydrophobicContact CD2-CD2 4.07Å; L7-L11 WeakPolarHBondContact O-CB 3.23Å; L7-L11 PolarHBondContact O-N 2.99Å; L11-I250 HydrophobicContact CD1-CD1 3.98Å; L11-I250 HydrophobicContact CD2-CD1 3.61Å; L11-I250 HydrophobicContact CD2-CG1 3.88Å; L11-I250 HydrophobicContact CG-CB 4.1Å; L11-I250 HydrophobicContact CG-CD1 3.63Å; L11-I250 HydrophobicContact CG-CG1 3.74Å; L11-I250 VanDerWaalsContact O-CB 3.29Å; L11-I250 WeakPolarHBondContact O-CB 3.31Å; L11-I250 WeakPolarHBondContact O-CG2 3.48Å
12L67.3Low70.7Confident57 Ų5786.8 Ų86.830%0.29846%0.456SS..SBendtrans-103.4147.6-179.5-70167000110.4L14 W175 I250 F251L12-L14 PolarHBondContact O-N 2.84Å; L12-W175 HydrophobicContact CD1-CE3 4.3Å; L12-W175 HydrophobicContact CD1-CZ3 3.8Å; L12-W175 HydrophobicContact CD2-CE3 4.29Å; L12-I250 HydrophobicContact CD2-CG2 4.23Å; L12-F251 HydrophobicContact CD2-CE1 4.08Å; L12-F251 HydrophobicContact CD2-CZ 3.78Å
13P65.3Low72.4Confident32 Ų3282.1 Ų82.121%0.20843%0.43CS..  trans-58.5136.8168.623.2-27.8000109.1K15 Y179 P248 F251P13-K15 PolarHBondContact O-N 3.34Å; P13-K15 VanDerWaalsContact O-N 3.08Å; P13-Y179 HydrophobicContact CG-CD1 4.08Å; P13-Y179 HydrophobicContact CG-CG 4.39Å; P13-Y179 VanDerWaalsContact CG-O 3.28Å; P13-Y179 WeakPolarHBondContact CG-O 3.18Å; P13-P248 HydrophobicContact CG-CG 4.46Å; P13-F251 HydrophobicContact CG-CE2 4.17Å; P13-F251 HydrophobicContact CG-CZ 4.34Å
14L65.2Low73.8Confident145 Ų14580.5 Ų80.576%0.75943%0.427SS*.SBendtrans-60.1-23.4-170.6-82.6145.4000113.8L12L12-L14 PolarHBondContact O-N 2.84Å
15K81.2Confident75.6Confident175 Ų17575.8 Ų75.876%0.76141%0.409SS*.SBendtrans-131.3135.3-179.7-64.7-176.9-179.7-179.80109.7P13P13-K15 PolarHBondContact O-N 3.34Å; P13-K15 VanDerWaalsContact O-N 3.08Å
16P88.3Confident77.7Confident50 Ų5071.7 Ų71.733%0.32539%0.387SS..  trans-64.8160.3169.329.8-34000110.6P18 K178 Y179P16-P18 WeakPolarHBondContact O-CD 3.32Å; P16-K178 HydrophobicContact CB-CD 4Å; P16-K178 HydrophobicContact CB-CG 3.96Å; P16-Y179 HydrophobicContact CB-CD1 4.18Å; P16-Y179 HydrophobicContact CB-CE1 3.95Å
17D90Very high79Confident9 Ų969.6 Ų69.65%0.04839%0.394CS..  trans-67.6121.2175-166.4-51.9000109.7R19 K178 P181D17-R19 PolarHBondContact O-N 3.21Å; D17-R19 VanDerWaalsContact OD1-CB 3.25Å; D17-R19 WeakPolarHBondContact OD1-CB 3.45Å; D17-R19 WeakPolarHBondContact OD1-CG 2.79Å; D17-R19 IonicContact OD1-CZ 3.82Å; D17-R19 PolarHBondContact OD1-N 3.04Å; D17-R19 IonicContact OD1-NE 2.75Å; D17-R19 PolarHBondContact OD1-NE 3.27Å; D17-R19 IonicContact OD1-NH2 3.46Å; D17-R19 IonicContact OD2-CZ 2.72Å; D17-R19 IonicContact OD2-NE 3.76Å; D17-R19 PolarHBondContact OD2-NE 3.06Å; D17-R19 IonicContact OD2-NH2 3.39Å; D17-R19 PolarHBondContact OD2-NH2 3.36Å; D17-K178 PolarHBondContact N-O 2.72Å; D17-P181 HydrophobicContact CB-CG 3.98Å; D17-P181 WeakPolarHBondContact OD2-CG 3.31Å
18P90.2Very high80.8Confident75 Ų7568.3 Ų68.349%0.48739%0.392SS..G310 helixtrans-69.2-20.9-175.228.3-35.5000112.9P16 L20 D21 P120P16-P18 WeakPolarHBondContact O-CD 3.32Å; P18-L20 PolarHBondContact O-N 3.18Å; P18-L20 VanDerWaalsContact O-N 3.14Å; P18-D21 WeakPolarHBondContact O-CB 3.37Å; P18-D21 PolarHBondContact O-N 3Å; P18-D21 VanDerWaalsContact O-N 3.16Å; P18-P120 HydrophobicContact CG-CB 4.36Å
19R92.5Very high82.5Confident41 Ų4170.7 Ų70.716%0.15539%0.393CS..G310 helixtrans-66.5-18.3-177.2-63.8174.8-73.5-175-3.3113.1D17 F23 P120 S125 D126 V129D17-R19 PolarHBondContact O-N 3.21Å; D17-R19 VanDerWaalsContact OD1-CB 3.25Å; D17-R19 WeakPolarHBondContact OD1-CB 3.45Å; D17-R19 WeakPolarHBondContact OD1-CG 2.79Å; D17-R19 IonicContact OD1-CZ 3.82Å; D17-R19 PolarHBondContact OD1-N 3.04Å; D17-R19 IonicContact OD1-NE 2.75Å; D17-R19 PolarHBondContact OD1-NE 3.27Å; D17-R19 IonicContact OD1-NH2 3.46Å; D17-R19 IonicContact OD2-CZ 2.72Å; D17-R19 IonicContact OD2-NE 3.76Å; D17-R19 PolarHBondContact OD2-NE 3.06Å; D17-R19 IonicContact OD2-NH2 3.39Å; D17-R19 PolarHBondContact OD2-NH2 3.36Å; R19-F23 WeakPolarHBondContact O-CE2 3.36Å; R19-P120 WeakPolarHBondContact CD-O 3.21Å; R19-S125 PolarHBondContact NH1-OG 3.46Å; R19-D126 WeakPolarHBondContact CD-OD1 3.24Å; R19-D126 IonicContact CZ-OD1 3.93Å; R19-D126 IonicContact NE-OD1 2.98Å; R19-D126 IonicContact NH1-OD1 3.3Å; R19-D126 PolarHBondContact NH1-OD1 3.45Å; R19-V129 HydrophobicContact CB-CG1 4.29Å; R19-V129 HydrophobicContact CB-CG2 4.47Å
20L91.8Very high84.3Confident0 Ų067 Ų670%038%0.383CS..G310 helixtrans-94-0.1179.5-72.2162000113.8P18 T22 F23 M26 V129 V177 K178P18-L20 PolarHBondContact O-N 3.18Å; P18-L20 VanDerWaalsContact O-N 3.14Å; L20-T22 PolarHBondContact O-N 3.29Å; L20-F23 HydrophobicContact CD2-CB 4.33Å; L20-F23 HydrophobicContact CD2-CD1 3.92Å; L20-F23 HydrophobicContact CD2-CD2 4.43Å; L20-F23 HydrophobicContact CD2-CE1 4.24Å; L20-F23 HydrophobicContact CD2-CG 3.99Å; L20-F23 WeakPolarHBondContact O-CB 3.47Å; L20-F23 PolarHBondContact O-N 2.9Å; L20-F23 VanDerWaalsContact O-N 3.14Å; L20-M26 HydrophobicContact CB-CB 4.25Å; L20-M26 HydrophobicContact CD1-CE 3.86Å; L20-M26 HydrophobicContact CD2-CE 4.14Å; L20-M26 HydrophobicContact CD2-CG 4.29Å; L20-M26 HydrophobicContact CG-CE 4.42Å; L20-M26 WeakPolarHBondContact O-CB 3.25Å; L20-V129 HydrophobicContact CD1-CG1 4.07Å; L20-V129 HydrophobicContact CD2-CG1 3.43Å; L20-V129 VanDerWaalsContact CD2-CG1 3.43Å; L20-V129 HydrophobicContact CG-CG1 3.48Å; L20-V129 VanDerWaalsContact CG-CG1 3.48Å; L20-V177 HydrophobicContact CD1-CG1 3.8Å; L20-V177 WeakPolarHBondContact CD1-O 3.45Å; L20-V177 HydrophobicContact CD2-CG1 4.26Å; L20-K178 HydrophobicContact CB-CD 4.26Å; L20-K178 HydrophobicContact CD1-CD 4.47Å
21D87.9Confident86.1Confident94 Ų9466.3 Ų66.350%0.50337%0.368SS..THydrogen-bonded Turntrans-66.9-25.8-173.8-72.9-17.9000113.3P18 K178P18-D21 WeakPolarHBondContact O-CB 3.37Å; P18-D21 PolarHBondContact O-N 3Å; P18-D21 VanDerWaalsContact O-N 3.16Å; D21-K178 IonicContact OD1-NZ 2.76Å; D21-K178 PolarHBondContact OD1-NZ 3.43Å
22T88.8Confident87.6Confident126 Ų12663.5 Ų63.577%0.77335%0.353SS*.THydrogen-bonded Turntrans-88.7-7.8177.157.50000113.2L20L20-T22 PolarHBondContact O-N 3.29Å
23F92.8Very high88.9Confident20 Ų2061.9 Ų61.99%0.08835%0.348CS..SBendtrans-82.9133.8-171.5-78.6-128.6000111R19 L20 L25 M26 W130 Y133R19-F23 WeakPolarHBondContact O-CE2 3.36Å; L20-F23 HydrophobicContact CD2-CB 4.33Å; L20-F23 HydrophobicContact CD2-CD1 3.92Å; L20-F23 HydrophobicContact CD2-CD2 4.43Å; L20-F23 HydrophobicContact CD2-CE1 4.24Å; L20-F23 HydrophobicContact CD2-CG 3.99Å; L20-F23 WeakPolarHBondContact O-CB 3.47Å; L20-F23 PolarHBondContact O-N 2.9Å; L20-F23 VanDerWaalsContact O-N 3.14Å; F23-L25 PolarHBondContact O-N 2.9Å; F23-M26 HydrophobicContact CB-CB 3.95Å; F23-M26 HydrophobicContact CB-CG 3.82Å; F23-M26 PolarHBondContact O-N 3.16Å; F23-M26 VanDerWaalsContact O-N 3.14Å; F23-W130 HydrophobicContact CD1-CZ3 4.31Å; F23-W130 AromaticContact CE1-CD2 3.78Å; F23-W130 HydrophobicContact CE1-CD2 3.78Å; F23-W130 AromaticContact CE1-CE3 3.45Å; F23-W130 HydrophobicContact CE1-CE3 3.45Å; F23-W130 VanDerWaalsContact CE1-CE3 3.45Å; F23-W130 AromaticContact CE1-CH2 3.74Å; F23-W130 HydrophobicContact CE1-CH2 3.74Å; F23-W130 HydrophobicContact CE1-CZ2 4.05Å; F23-W130 AromaticContact CE1-CZ3 3.42Å; F23-W130 HydrophobicContact CE1-CZ3 3.42Å; F23-W130 VanDerWaalsContact CE1-CZ3 3.42Å; F23-W130 HydrophobicContact CE2-CH2 4.22Å; F23-W130 HydrophobicContact CE2-CZ2 4.06Å; F23-W130 AromaticContact CZ-CD2 3.63Å; F23-W130 HydrophobicContact CZ-CD2 3.63Å; F23-W130 AromaticContact CZ-CE2 3.43Å; F23-W130 VanDerWaalsContact CZ-CE2 3.43Å; F23-W130 AromaticContact CZ-CE3 3.74Å; F23-W130 HydrophobicContact CZ-CE3 3.74Å; F23-W130 HydrophobicContact CZ-CG 4.39Å; F23-W130 AromaticContact CZ-CH2 3.5Å; F23-W130 HydrophobicContact CZ-CH2 3.5Å; F23-W130 AromaticContact CZ-CZ2 3.38Å; F23-W130 HydrophobicContact CZ-CZ2 3.38Å; F23-W130 AromaticContact CZ-CZ3 3.68Å; F23-W130 HydrophobicContact CZ-CZ3 3.68Å; F23-Y133 HydrophobicContact CB-CD2 4.27Å; F23-Y133 HydrophobicContact CB-CE2 4.07Å; F23-Y133 AromaticContact CD1-CD1 3.55Å; F23-Y133 HydrophobicContact CD1-CD1 3.55Å; F23-Y133 AromaticContact CD1-CD2 3.59Å; F23-Y133 HydrophobicContact CD1-CD2 3.59Å; F23-Y133 AromaticContact CD1-CE1 3.89Å; F23-Y133 HydrophobicContact CD1-CE1 3.89Å; F23-Y133 AromaticContact CD1-CE2 3.93Å; F23-Y133 HydrophobicContact CD1-CE2 3.93Å; F23-Y133 AromaticContact CD1-CG 3.36Å; F23-Y133 HydrophobicContact CD1-CG 3.36Å; F23-Y133 AromaticContact CE1-CD1 3.8Å; F23-Y133 HydrophobicContact CE1-CD1 3.8Å; F23-Y133 HydrophobicContact CE1-CD2 4.42Å; F23-Y133 HydrophobicContact CE1-CE1 4.44Å; F23-Y133 AromaticContact CE1-CG 3.77Å; F23-Y133 HydrophobicContact CE1-CG 3.77Å; F23-Y133 HydrophobicContact CG-CD2 4.42Å
24P93.3Very high90.4Very high87 Ų8765 Ų6557%0.56536%0.363SS*.THydrogen-bonded Turntrans-55.5138.7176.2-24.132.1000111.7M26 Y133P24-M26 PolarHBondContact O-N 3.48Å; P24-Y133 WeakPolarHBondContact CD-OH 3.49Å; P24-Y133 WeakPolarHBondContact O-CE2 3.44Å; P24-Y133 PolarHBondContact O-OH 3.34Å
25L93.2Very high91.9Very high55 Ų5561.3 Ų61.329%0.28834%0.343SS..THydrogen-bonded Turntrans662.2-178.4-54.5169.6000115.8F23 P31 Y136 L140 W174F23-L25 PolarHBondContact O-N 2.9Å; L25-P31 HydrophobicContact CD2-CB 3.69Å; L25-P31 HydrophobicContact CD2-CG 4.4Å; L25-Y136 HydrophobicContact CB-CE1 4.19Å; L25-L140 HydrophobicContact CD1-CD1 3.84Å; L25-W174 PolarHBondContact O-NE1 3.46Å
26M93.8Very high92.6Very high0 Ų053.6 Ų53.60%031%0.31CS..  trans-100-2.6-179.8-62.9-58.5-69.800114.2L20 F23 P24 Y133 Y136 V177 K178L20-M26 HydrophobicContact CB-CB 4.25Å; L20-M26 HydrophobicContact CD1-CE 3.86Å; L20-M26 HydrophobicContact CD2-CE 4.14Å; L20-M26 HydrophobicContact CD2-CG 4.29Å; L20-M26 HydrophobicContact CG-CE 4.42Å; L20-M26 WeakPolarHBondContact O-CB 3.25Å; F23-M26 HydrophobicContact CB-CB 3.95Å; F23-M26 HydrophobicContact CB-CG 3.82Å; F23-M26 PolarHBondContact O-N 3.16Å; F23-M26 VanDerWaalsContact O-N 3.14Å; P24-M26 PolarHBondContact O-N 3.48Å; M26-Y133 HydrophobicContact CG-CD2 3.81Å; M26-Y133 HydrophobicContact CG-CE2 3.85Å; M26-Y133 HydrophobicContact SD-CD2 4.26Å; M26-Y136 HydrophobicContact SD-CD1 4.02Å; M26-Y136 HydrophobicContact SD-CE1 4.12Å; M26-V177 HydrophobicContact CE-CB 3.99Å; M26-V177 HydrophobicContact CE-CG1 3.64Å; M26-K178 HydrophobicContact CE-CB 3.99Å; M26-K178 HydrophobicContact CE-CD 4.44Å; M26-K178 WeakPolarHBondContact O-CD 3.36Å; M26-K178 WeakPolarHBondContact O-CE 3.24Å; M26-K178 PolarHBondContact O-NZ 3.08Å
27S89.5Confident93Very high98 Ų9855.8 Ų55.869%0.68532%0.319SS*.SBendtrans-74.7-30.217760.20000113.4
28S91.4Very high93.3Very high48 Ų4860 Ų6034%0.33635%0.345SS..  trans-150151.5178.4177.10000110.8T30 P31 W174S28-T30 VanDerWaalsContact C-N 3.29Å; S28-T30 PolarHBondContact OG-N 3.24Å; S28-T30 PolarHBondContact OG-OG1 3.44Å; S28-T30 VanDerWaalsContact OG-OG1 3.12Å; S28-P31 VanDerWaalsContact O-CD 3.3Å; S28-P31 WeakPolarHBondContact O-CD 3.43Å; S28-W174 WeakPolarHBondContact O-CZ2 3.31Å; S28-W174 PolarHBondContact O-NE1 3.31Å
29W91.8Very high93.6Very high101 Ų10157.4 Ų57.438%0.38333%0.326SS..SBendtrans-73.5-22.2174.7175.467.7000112.8T32 A33 W174 W175W29-T32 WeakPolarHBondContact O-CB 3.49Å; W29-T32 PolarHBondContact O-N 3.33Å; W29-T32 VanDerWaalsContact O-N 3.12Å; W29-A33 HydrophobicContact CD2-CB 4.14Å; W29-A33 HydrophobicContact CE3-CB 4.2Å; W29-A33 HydrophobicContact CH2-CB 3.82Å; W29-A33 HydrophobicContact CZ2-CB 3.75Å; W29-A33 HydrophobicContact CZ3-CB 4.05Å; W29-A33 PolarHBondContact O-N 3.06Å; W29-A33 VanDerWaalsContact O-N 3.07Å; W29-W174 HydrophobicContact CB-CD2 4.11Å; W29-W174 HydrophobicContact CB-CE3 3.76Å; W29-W174 HydrophobicContact CB-CH2 3.84Å; W29-W174 HydrophobicContact CB-CZ2 4.17Å; W29-W174 HydrophobicContact CB-CZ3 3.62Å; W29-W174 AromaticContact CD1-CE3 3.74Å; W29-W174 HydrophobicContact CG-CD2 4.49Å; W29-W174 HydrophobicContact CG-CE3 4.11Å; W29-W174 HydrophobicContact CG-CZ3 4.35Å; W29-W174 VanDerWaalsContact N-CZ2 3.27Å; W29-W175 AromaticContact CD1-CD1 4Å; W29-W175 AromaticContact CD1-NE1 3.46Å; W29-W175 AromaticContact CE2-NE1 3.89Å; W29-W175 HydrophobicContact CG-CZ2 4.36Å; W29-W175 AromaticContact CG-NE1 3.83Å; W29-W175 AromaticContact NE1-CD1 4Å; W29-W175 AromaticContact NE1-NE1 3.48Å
30T94.1Very high93.9Very high77 Ų7758.2 Ų58.247%0.47234%0.335SS..Hα-helixtrans-55.9-45.4-172.7-50.10000114S28 T32 A33 L34S28-T30 VanDerWaalsContact C-N 3.29Å; S28-T30 PolarHBondContact OG-N 3.24Å; S28-T30 PolarHBondContact OG-OG1 3.44Å; S28-T30 VanDerWaalsContact OG-OG1 3.12Å; T30-T32 VanDerWaalsContact C-N 3.33Å; T30-T32 PolarHBondContact O-N 3.29Å; T30-A33 PolarHBondContact O-N 3.19Å; T30-L34 HydrophobicContact CG2-CD1 4.08Å; T30-L34 HydrophobicContact CG2-CG 4.31Å; T30-L34 WeakPolarHBondContact O-CG 3.42Å; T30-L34 PolarHBondContact O-N 3.5Å
31P95.3Very high94.1Very high44 Ų4463.2 Ų63.229%0.28636%0.36SS..Hα-helixtrans-58.6-43.2176.8-24.836.6000112.6L25 S28 A33 L34 I35L25-P31 HydrophobicContact CD2-CB 3.69Å; L25-P31 HydrophobicContact CD2-CG 4.4Å; S28-P31 VanDerWaalsContact O-CD 3.3Å; S28-P31 WeakPolarHBondContact O-CD 3.43Å; P31-A33 PolarHBondContact O-N 2.8Å; P31-L34 PolarHBondContact O-N 3.22Å; P31-I35 VanDerWaalsContact O-CG1 3.24Å; P31-I35 WeakPolarHBondContact O-CG1 3.35Å; P31-I35 PolarHBondContact O-N 3.07Å
32T95.4Very high94.5Very high0 Ų060.5 Ų60.50%036%0.355CS..Hα-helixtrans-60.3-45.7176.5-520000111.3W29 T30 L34 I35 T36 Y136 P170 P171 W174W29-T32 WeakPolarHBondContact O-CB 3.49Å; W29-T32 PolarHBondContact O-N 3.33Å; W29-T32 VanDerWaalsContact O-N 3.12Å; T30-T32 VanDerWaalsContact C-N 3.33Å; T30-T32 PolarHBondContact O-N 3.29Å; T32-L34 VanDerWaalsContact C-N 3.35Å; T32-L34 PolarHBondContact O-N 3.3Å; T32-I35 PolarHBondContact O-N 3.37Å; T32-T36 WeakPolarHBondContact O-CG2 3.4Å; T32-T36 PolarHBondContact O-N 3.09Å; T32-T36 PolarHBondContact O-OG1 3.42Å; T32-Y136 HydrophobicContact CG2-CE2 3.94Å; T32-Y136 PolarHBondContact OG1-OH 3.18Å; T32-P170 HydrophobicContact CG2-CB 4.04Å; T32-P171 HydrophobicContact CG2-CB 4.46Å; T32-P171 HydrophobicContact CG2-CG 4.18Å; T32-W174 HydrophobicContact CG2-CB 4.43Å
33A95Very high94.9Very high23 Ų2354.9 Ų54.919%0.1932%0.32CS..Hα-helixtrans-63.8-39.5178.800000112.4W29 T30 P31 T36 L37W29-A33 HydrophobicContact CD2-CB 4.14Å; W29-A33 HydrophobicContact CE3-CB 4.2Å; W29-A33 HydrophobicContact CH2-CB 3.82Å; W29-A33 HydrophobicContact CZ2-CB 3.75Å; W29-A33 HydrophobicContact CZ3-CB 4.05Å; W29-A33 PolarHBondContact O-N 3.06Å; W29-A33 VanDerWaalsContact O-N 3.07Å; T30-A33 PolarHBondContact O-N 3.19Å; P31-A33 PolarHBondContact O-N 2.8Å; A33-T36 PolarHBondContact O-OG1 3.04Å; A33-L37 WeakPolarHBondContact O-CB 3.48Å; A33-L37 PolarHBondContact O-N 2.83Å
34L96.6Very high95Very high98 Ų9861.8 Ų61.851%0.51335%0.347SS..Hα-helixtrans-66.9-44.6176-70.9175.1000111.3T30 P31 T32 T36 L37 T38T30-L34 HydrophobicContact CG2-CD1 4.08Å; T30-L34 HydrophobicContact CG2-CG 4.31Å; T30-L34 WeakPolarHBondContact O-CG 3.42Å; T30-L34 PolarHBondContact O-N 3.5Å; P31-L34 PolarHBondContact O-N 3.22Å; T32-L34 VanDerWaalsContact C-N 3.35Å; T32-L34 PolarHBondContact O-N 3.3Å; L34-T36 VanDerWaalsContact C-N 3.33Å; L34-T36 PolarHBondContact O-N 3.21Å; L34-L37 PolarHBondContact O-N 3.35Å; L34-T38 WeakPolarHBondContact O-CB 3.47Å; L34-T38 PolarHBondContact O-N 3.33Å; L34-T38 PolarHBondContact O-OG1 2.91Å
35I96.6Very high95.2Very high66 Ų6660.4 Ų60.434%0.33834%0.343SS..Hα-helixtrans-57.8-47.5176.7-69.9163.7000110.4P31 T32 T38 Y39 L140 L143P31-I35 VanDerWaalsContact O-CG1 3.24Å; P31-I35 WeakPolarHBondContact O-CG1 3.35Å; P31-I35 PolarHBondContact O-N 3.07Å; T32-I35 PolarHBondContact O-N 3.37Å; I35-T38 PolarHBondContact O-N 2.93Å; I35-Y39 VanDerWaalsContact O-CB 3.29Å; I35-Y39 WeakPolarHBondContact O-CB 3.27Å; I35-Y39 PolarHBondContact O-N 3.47Å; I35-L140 HydrophobicContact CD1-CD2 4.46Å; I35-L140 HydrophobicContact CG2-CD2 4.18Å; I35-L143 HydrophobicContact CG2-CD1 3.77Å
36T96.3Very high95.3Very high14 Ų1462.1 Ų62.19%0.08635%0.345CS..Hα-helixtrans-71.2-34.4-179.658.20000113.2T32 A33 L34 Y39 V40 P170 P171T32-T36 WeakPolarHBondContact O-CG2 3.4Å; T32-T36 PolarHBondContact O-N 3.09Å; T32-T36 PolarHBondContact O-OG1 3.42Å; A33-T36 PolarHBondContact O-OG1 3.04Å; L34-T36 VanDerWaalsContact C-N 3.33Å; L34-T36 PolarHBondContact O-N 3.21Å; T36-Y39 WeakPolarHBondContact O-CB 3.31Å; T36-Y39 PolarHBondContact O-N 3.29Å; T36-V40 WeakPolarHBondContact O-CG2 3.11Å; T36-V40 PolarHBondContact O-N 3.45Å; T36-P170 HydrophobicContact CG2-CB 4.16Å; T36-P170 HydrophobicContact CG2-CG 4.06Å; T36-P171 HydrophobicContact CG2-CG 3.65Å
37L95.9Very high95.3Very high96 Ų9665.1 Ų65.150%0.50336%0.359SS..Hα-helixtrans-64.1-48.2173.4-179.163.2000111.4A33 L34 Y39 V40 I41A33-L37 WeakPolarHBondContact O-CB 3.48Å; A33-L37 PolarHBondContact O-N 2.83Å; L34-L37 PolarHBondContact O-N 3.35Å; L37-Y39 VanDerWaalsContact C-N 3.28Å; L37-Y39 PolarHBondContact O-N 3.36Å; L37-V40 PolarHBondContact O-N 3.4Å; L37-I41 HydrophobicContact CD1-CD1 4.02Å; L37-I41 HydrophobicContact CD1-CG1 4.45Å; L37-I41 HydrophobicContact CG-CD1 3.98Å; L37-I41 WeakPolarHBondContact O-CG1 3.17Å; L37-I41 PolarHBondContact O-N 3.01Å
38T96.8Very high95.5Very high96 Ų9662.7 Ų62.759%0.58934%0.339SS*.Hα-helixtrans-60.3-40.7175.5-61.40000111.1L34 I35 G42L34-T38 WeakPolarHBondContact O-CB 3.47Å; L34-T38 PolarHBondContact O-N 3.33Å; L34-T38 PolarHBondContact O-OG1 2.91Å; I35-T38 PolarHBondContact O-N 2.93Å; T38-G42 PolarHBondContact O-N 3.15Å
39Y97.6Very high95.6Very high22 Ų2263.9 Ų63.99%0.08634%0.34CS..Hα-helixtrans-58-51.3173.8163.8-97.1000111.9I35 T36 L37 I41 G42 V43 L143 T146 V163 H166 A167I35-Y39 VanDerWaalsContact O-CB 3.29Å; I35-Y39 WeakPolarHBondContact O-CB 3.27Å; I35-Y39 PolarHBondContact O-N 3.47Å; T36-Y39 WeakPolarHBondContact O-CB 3.31Å; T36-Y39 PolarHBondContact O-N 3.29Å; L37-Y39 VanDerWaalsContact C-N 3.28Å; L37-Y39 PolarHBondContact O-N 3.36Å; Y39-I41 PolarHBondContact O-N 3.44Å; Y39-G42 PolarHBondContact O-N 3.49Å; Y39-V43 HydrophobicContact CD2-CG2 3.81Å; Y39-V43 HydrophobicContact CE2-CG2 3.53Å; Y39-V43 HydrophobicContact CG-CG2 4.41Å; Y39-V43 VanDerWaalsContact O-CB 3.3Å; Y39-V43 WeakPolarHBondContact O-CB 3.3Å; Y39-V43 WeakPolarHBondContact O-CG2 3.49Å; Y39-V43 PolarHBondContact O-N 2.87Å; Y39-L143 HydrophobicContact CD1-CD2 4.19Å; Y39-L143 HydrophobicContact CD2-CB 4.01Å; Y39-L143 HydrophobicContact CD2-CD2 4Å; Y39-L143 HydrophobicContact CD2-CG 4.41Å; Y39-L143 HydrophobicContact CE1-CD2 4.25Å; Y39-L143 HydrophobicContact CE2-CB 4.2Å; Y39-L143 HydrophobicContact CE2-CD2 4.04Å; Y39-L143 HydrophobicContact CG-CD1 4.49Å; Y39-L143 HydrophobicContact CG-CD2 4.08Å; Y39-T146 HydrophobicContact CE2-CG2 4.33Å; Y39-T146 WeakPolarHBondContact CE2-OG1 3.45Å; Y39-T146 PolarHBondContact OH-OG1 3.17Å; Y39-V163 HydrophobicContact CE1-CG1 4.22Å; Y39-H166 HydrophobicContact CE1-CB 4.02Å; Y39-H166 WeakPolarHBondContact OH-CB 3.25Å; Y39-A167 HydrophobicContact CD1-CB 4.32Å; Y39-A167 HydrophobicContact CE1-CB 4.19Å
40V97.3Very high95.6Very high58 Ų5860 Ų6035%0.35233%0.327SS..Hα-helixtrans-61.6-47-178.8172.30000111.3T36 L37 Y44 A167T36-V40 WeakPolarHBondContact O-CG2 3.11Å; T36-V40 PolarHBondContact O-N 3.45Å; L37-V40 PolarHBondContact O-N 3.4Å; V40-Y44 WeakPolarHBondContact O-CB 3.33Å; V40-Y44 PolarHBondContact O-N 3.46Å; V40-A167 HydrophobicContact CG2-CB 3.54Å
41I97Very high95.3Very high104 Ų10459.8 Ų59.853%0.53332%0.323SS..Hα-helixtrans-62.8-47.9179.2-65.3169.6000110.4L37 Y39 Y44 A45L37-I41 HydrophobicContact CD1-CD1 4.02Å; L37-I41 HydrophobicContact CD1-CG1 4.45Å; L37-I41 HydrophobicContact CG-CD1 3.98Å; L37-I41 WeakPolarHBondContact O-CG1 3.17Å; L37-I41 PolarHBondContact O-N 3.01Å; Y39-I41 PolarHBondContact O-N 3.44Å; I41-Y44 PolarHBondContact O-N 2.98Å; I41-A45 WeakPolarHBondContact O-CB 3.47Å; I41-A45 PolarHBondContact O-N 3Å
42G96.7Very high95.1Very high37 Ų3763.7 Ų63.738%0.38134%0.335SS..Hα-helixtrans-62.6-45-178.800000112.5T38 Y39 Y44 A45 W46T38-G42 PolarHBondContact O-N 3.15Å; Y39-G42 PolarHBondContact O-N 3.49Å; G42-Y44 PolarHBondContact O-N 3.33Å; G42-A45 PolarHBondContact O-N 3.35Å; G42-W46 VanDerWaalsContact O-CB 3.22Å; G42-W46 WeakPolarHBondContact O-CB 3.32Å; G42-W46 PolarHBondContact O-N 3.27Å
43V97Very high94.7Very high9 Ų970.5 Ų70.56%0.05536%0.361CS..Hα-helixtrans-62-43.9176.8166.80000111.2Y39 K47 T146 L150 V158 V163Y39-V43 HydrophobicContact CD2-CG2 3.81Å; Y39-V43 HydrophobicContact CE2-CG2 3.53Å; Y39-V43 HydrophobicContact CG-CG2 4.41Å; Y39-V43 VanDerWaalsContact O-CB 3.3Å; Y39-V43 WeakPolarHBondContact O-CB 3.3Å; Y39-V43 WeakPolarHBondContact O-CG2 3.49Å; Y39-V43 PolarHBondContact O-N 2.87Å; V43-K47 WeakPolarHBondContact O-CB 3.44Å; V43-K47 PolarHBondContact O-N 3.39Å; V43-T146 HydrophobicContact CB-CG2 4.3Å; V43-T146 HydrophobicContact CG1-CG2 3.74Å; V43-T146 HydrophobicContact CG2-CG2 3.5Å; V43-L150 HydrophobicContact CB-CD1 4.44Å; V43-L150 HydrophobicContact CG1-CD1 4.29Å; V43-L150 HydrophobicContact CG2-CD1 4.27Å; V43-V158 HydrophobicContact CG1-CG1 3.65Å; V43-V163 HydrophobicContact CG1-CG2 3.85Å
44Y95.2Very high94.2Very high165 Ų16576 Ų7665%0.64738%0.378SS*.Hα-helixtrans-66.6-47.3179.4-173.3-95.5000111.9V40 I41 G42 W46 K47 V48V40-Y44 WeakPolarHBondContact O-CB 3.33Å; V40-Y44 PolarHBondContact O-N 3.46Å; I41-Y44 PolarHBondContact O-N 2.98Å; G42-Y44 PolarHBondContact O-N 3.33Å; Y44-W46 VanDerWaalsContact C-N 3.35Å; Y44-W46 PolarHBondContact O-N 3.02Å; Y44-K47 PolarHBondContact O-N 3.01Å; Y44-V48 HydrophobicContact CD1-CG2 4.27Å; Y44-V48 HydrophobicContact CE1-CG2 3.9Å; Y44-V48 WeakPolarHBondContact O-CG2 3.22Å; Y44-V48 PolarHBondContact O-N 2.89Å
45A96.3Very high93.6Very high57 Ų5776.8 Ų76.847%0.47138%0.379SS..Hα-helixtrans-59.5-45.6177.600000111.6I41 G42 V48 E49I41-A45 WeakPolarHBondContact O-CB 3.47Å; I41-A45 PolarHBondContact O-N 3Å; G42-A45 PolarHBondContact O-N 3.35Å; A45-V48 PolarHBondContact O-N 3.3Å; A45-E49 WeakPolarHBondContact O-CB 3.4Å; A45-E49 PolarHBondContact O-N 3.3Å
46W96Very high93.1Very high91 Ų9180.7 Ų80.735%0.34539%0.394SS..Hα-helixtrans-68.7-39179.3-168.73.6000111.9G42 Y44 V48 E49 C50 V147 L150 W151G42-W46 VanDerWaalsContact O-CB 3.22Å; G42-W46 WeakPolarHBondContact O-CB 3.32Å; G42-W46 PolarHBondContact O-N 3.27Å; Y44-W46 VanDerWaalsContact C-N 3.35Å; Y44-W46 PolarHBondContact O-N 3.02Å; W46-V48 PolarHBondContact O-N 3.15Å; W46-E49 PolarHBondContact O-N 2.86Å; W46-C50 PolarHBondContact NE1-SG 3.45Å; W46-C50 VanDerWaalsContact NE1-SG 3.45Å; W46-C50 WeakPolarHBondContact O-CB 3.17Å; W46-C50 PolarHBondContact O-N 3.45Å; W46-C50 PolarHBondContact O-SG 2.85Å; W46-C50 VanDerWaalsContact O-SG 3.36Å; W46-V147 HydrophobicContact CH2-CG1 4.09Å; W46-V147 HydrophobicContact CZ3-CB 4.4Å; W46-V147 HydrophobicContact CZ3-CG1 3.96Å; W46-L150 HydrophobicContact CB-CD1 4.06Å; W46-L150 HydrophobicContact CD2-CB 3.72Å; W46-L150 HydrophobicContact CD2-CD1 3.81Å; W46-L150 HydrophobicContact CD2-CG 4.34Å; W46-L150 HydrophobicContact CE3-CB 3.83Å; W46-L150 HydrophobicContact CE3-CD1 3.56Å; W46-L150 HydrophobicContact CE3-CG 4.35Å; W46-L150 HydrophobicContact CG-CB 4.31Å; W46-L150 HydrophobicContact CG-CD1 4.04Å; W46-L150 HydrophobicContact CH2-CB 4.13Å; W46-L150 HydrophobicContact CZ2-CB 4.02Å; W46-L150 HydrophobicContact CZ3-CB 4.03Å; W46-L150 HydrophobicContact CZ3-CD1 4.29Å; W46-W151 HydrophobicContact CH2-CB 4.07Å; W46-W151 HydrophobicContact CZ2-CB 4.14Å
47K94.2Very high92.2Very high64 Ų6483.7 Ų83.728%0.27841%0.407SS..Hα-helixtrans-57.9-47.2173.4178.4167.4-176.4174.90111.9V43 Y44 E49 C50 L51 L150 I155 V158V43-K47 WeakPolarHBondContact O-CB 3.44Å; V43-K47 PolarHBondContact O-N 3.39Å; Y44-K47 PolarHBondContact O-N 3.01Å; K47-E49 VanDerWaalsContact C-N 3.35Å; K47-C50 PolarHBondContact O-N 2.97Å; K47-L51 HydrophobicContact CG-CD1 4.41Å; K47-L51 WeakPolarHBondContact O-CG 3.45Å; K47-L51 PolarHBondContact O-N 3.38Å; K47-L150 HydrophobicContact CB-CD2 4.26Å; K47-I155 HydrophobicContact CD-CG2 4.08Å; K47-I155 HydrophobicContact CG-CG2 3.75Å; K47-V158 PolarHBondContact NZ-O 3.44Å
48V94.1Very high91.3Very high46 Ų4683.8 Ų83.828%0.27941%0.407SS..Hα-helixtrans-61.6-44177.3169.80000111.1Y44 A45 W46 C50 L51 K52Y44-V48 HydrophobicContact CD1-CG2 4.27Å; Y44-V48 HydrophobicContact CE1-CG2 3.9Å; Y44-V48 WeakPolarHBondContact O-CG2 3.22Å; Y44-V48 PolarHBondContact O-N 2.89Å; A45-V48 PolarHBondContact O-N 3.3Å; W46-V48 PolarHBondContact O-N 3.15Å; V48-C50 PolarHBondContact O-N 3.27Å; V48-L51 PolarHBondContact O-N 2.78Å; V48-K52 HydrophobicContact CG1-CD 4.31Å; V48-K52 WeakPolarHBondContact O-CG 3.36Å; V48-K52 PolarHBondContact O-N 2.96Å
49E93.3Very high90.5Very high74 Ų7487.4 Ų87.435%0.34642%0.415SS..Hα-helixtrans-63-41.5177.6179.356.4-15900112.2A45 W46 K47 L51 K52 R53A45-E49 WeakPolarHBondContact O-CB 3.4Å; A45-E49 PolarHBondContact O-N 3.3Å; W46-E49 PolarHBondContact O-N 2.86Å; K47-E49 VanDerWaalsContact C-N 3.35Å; E49-L51 VanDerWaalsContact C-N 3.35Å; E49-L51 PolarHBondContact O-N 3.4Å; E49-K52 PolarHBondContact O-N 2.81Å; E49-R53 VanDerWaalsContact O-CG 3.32Å; E49-R53 WeakPolarHBondContact O-CG 3.38Å; E49-R53 PolarHBondContact O-N 3.47Å; E49-R53 IonicContact OE1-CZ 3.45Å; E49-R53 IonicContact OE1-NE 2.8Å; E49-R53 PolarHBondContact OE1-NE 3.5Å; E49-R53 IonicContact OE1-NH2 3.19Å; E49-R53 PolarHBondContact OE1-NH2 2.96Å
50C90.4Very high89.1Confident18 Ų1890.9 Ų90.912%0.12244%0.435CS..Hα-helixtrans-62.9-40175.7-74.20000112.3W46 K47 V48 R53 Y54 I155W46-C50 PolarHBondContact NE1-SG 3.45Å; W46-C50 VanDerWaalsContact NE1-SG 3.45Å; W46-C50 WeakPolarHBondContact O-CB 3.17Å; W46-C50 PolarHBondContact O-N 3.45Å; W46-C50 PolarHBondContact O-SG 2.85Å; W46-C50 VanDerWaalsContact O-SG 3.36Å; K47-C50 PolarHBondContact O-N 2.97Å; V48-C50 PolarHBondContact O-N 3.27Å; C50-R53 PolarHBondContact O-N 2.96Å; C50-Y54 PolarHBondContact O-N 2.71Å; C50-I155 HydrophobicContact CB-CD1 3.44Å; C50-I155 VanDerWaalsContact CB-CD1 3.44Å; C50-I155 HydrophobicContact CB-CG1 3.93Å
51L89.5Confident87.6Confident74 Ų7495.8 Ų95.839%0.38745%0.451SS..Hα-helixtrans-65.1-43.8175.5-70171.9000112K47 V48 E49 R53 Y54 E55 I155K47-L51 HydrophobicContact CG-CD1 4.41Å; K47-L51 WeakPolarHBondContact O-CG 3.45Å; K47-L51 PolarHBondContact O-N 3.38Å; V48-L51 PolarHBondContact O-N 2.78Å; E49-L51 VanDerWaalsContact C-N 3.35Å; E49-L51 PolarHBondContact O-N 3.4Å; L51-R53 VanDerWaalsContact C-N 3.32Å; L51-R53 PolarHBondContact O-N 3.35Å; L51-Y54 WeakPolarHBondContact O-CB 3.5Å; L51-Y54 PolarHBondContact O-N 2.85Å; L51-Y54 VanDerWaalsContact O-N 3.15Å; L51-E55 PolarHBondContact O-N 3.18Å; L51-I155 HydrophobicContact CD2-CD1 3.88Å; L51-I155 HydrophobicContact CD2-CG2 4.38Å; L51-I155 HydrophobicContact CG-CD1 4.13Å
52K91Very high86Confident125 Ų12599.8 Ų99.854%0.54347%0.468SS..Hα-helixtrans-58.7-42.9174.8-72.3175.2-179.41770112.2V48 E49 Y54 E55 K56V48-K52 HydrophobicContact CG1-CD 4.31Å; V48-K52 WeakPolarHBondContact O-CG 3.36Å; V48-K52 PolarHBondContact O-N 2.96Å; E49-K52 PolarHBondContact O-N 2.81Å; K52-Y54 VanDerWaalsContact C-N 3.34Å; K52-E55 PolarHBondContact O-N 3.01Å; K52-K56 PolarHBondContact O-N 3.46Å
53R86.8Confident84.1Confident143 Ų143107 Ų10754%0.5449%0.491SS..Hα-helixtrans-63.2-40.7176.4-71.8175.7-173.5-156.92.6111.9E49 C50 L51 K56 Q57E49-R53 VanDerWaalsContact O-CG 3.32Å; E49-R53 WeakPolarHBondContact O-CG 3.38Å; E49-R53 PolarHBondContact O-N 3.47Å; E49-R53 IonicContact OE1-CZ 3.45Å; E49-R53 IonicContact OE1-NE 2.8Å; E49-R53 PolarHBondContact OE1-NE 3.5Å; E49-R53 IonicContact OE1-NH2 3.19Å; E49-R53 PolarHBondContact OE1-NH2 2.96Å; C50-R53 PolarHBondContact O-N 2.96Å; L51-R53 VanDerWaalsContact C-N 3.32Å; L51-R53 PolarHBondContact O-N 3.35Å; R53-K56 PolarHBondContact O-N 3.48Å; R53-Q57 WeakPolarHBondContact O-CG 3.44Å; R53-Q57 PolarHBondContact O-N 3.1Å; R53-Q57 VanDerWaalsContact O-N 3.08Å
54Y83.3Confident82.3Confident138 Ų138110.3 Ų110.354%0.54151%0.506SS..Hα-helixtrans-63.2-46.1177-179.2-107.3000111.9C50 L51 K52 K56 Q57 L58C50-Y54 PolarHBondContact O-N 2.71Å; L51-Y54 WeakPolarHBondContact O-CB 3.5Å; L51-Y54 PolarHBondContact O-N 2.85Å; L51-Y54 VanDerWaalsContact O-N 3.15Å; K52-Y54 VanDerWaalsContact C-N 3.34Å; Y54-K56 VanDerWaalsContact C-N 3.35Å; Y54-K56 PolarHBondContact O-N 3.49Å; Y54-Q57 PolarHBondContact O-N 2.93Å; Y54-L58 HydrophobicContact CD1-CD1 3.99Å; Y54-L58 HydrophobicContact CE1-CD1 3.54Å; Y54-L58 HydrophobicContact CE1-CG 4.36Å; Y54-L58 PolarHBondContact O-N 2.93Å; Y54-L58 VanDerWaalsContact O-N 3.09Å
55E85.5Confident80.7Confident115 Ų115106.3 Ų106.354%0.53750%0.495SS..Hα-helixtrans-61.3-40.6176.2-71.3176.6-177.300112.8L51 K52 Q57 L58 K59L51-E55 PolarHBondContact O-N 3.18Å; K52-E55 PolarHBondContact O-N 3.01Å; E55-Q57 PolarHBondContact O-N 2.87Å; E55-L58 PolarHBondContact O-N 2.87Å; E55-K59 PolarHBondContact O-N 3.32Å
56K84.6Confident79.2Confident148 Ų148107.9 Ų107.964%0.64350%0.503SS*.Hα-helixtrans-64.7-39177.1-170174.9-179.1178.30112K52 R53 Y54 L58 K59 N60K52-K56 PolarHBondContact O-N 3.46Å; R53-K56 PolarHBondContact O-N 3.48Å; Y54-K56 VanDerWaalsContact C-N 3.35Å; Y54-K56 PolarHBondContact O-N 3.49Å; K56-L58 VanDerWaalsContact C-N 3.34Å; K56-K59 PolarHBondContact O-N 2.9Å; K56-N60 PolarHBondContact O-N 3.44Å
57Q77.6Confident77.5Confident78 Ų78109.2 Ų109.236%0.36452%0.521SS..Hα-helixtrans-66.1-34.8176-74.3176.116.800112.4R53 Y54 E55 K59 F64R53-Q57 WeakPolarHBondContact O-CG 3.44Å; R53-Q57 PolarHBondContact O-N 3.1Å; R53-Q57 VanDerWaalsContact O-N 3.08Å; Y54-Q57 PolarHBondContact O-N 2.93Å; E55-Q57 PolarHBondContact O-N 2.87Å; Q57-K59 VanDerWaalsContact C-N 3.32Å; Q57-K59 PolarHBondContact O-N 3.43Å; Q57-F64 HydrophobicContact CG-CD1 4.44Å; Q57-F64 HydrophobicContact CG-CE1 4.03Å; Q57-F64 HydrophobicContact CG-CZ 4.33Å
58L77.8Confident76.2Confident98 Ų98110.3 Ų110.351%0.51353%0.528SS..Hα-helixtrans-65.5-33.7175.7-75.7170.1000112.8Y54 E55 K56Y54-L58 HydrophobicContact CD1-CD1 3.99Å; Y54-L58 HydrophobicContact CE1-CD1 3.54Å; Y54-L58 HydrophobicContact CE1-CG 4.36Å; Y54-L58 PolarHBondContact O-N 2.93Å; Y54-L58 VanDerWaalsContact O-N 3.09Å; E55-L58 PolarHBondContact O-N 2.87Å; K56-L58 VanDerWaalsContact C-N 3.34Å
59K79.2Confident74.8Confident172 Ų172114.2 Ų114.275%0.74854%0.541SS*.Hα-helixtrans-76-36.5178.5-68.3-178.9-178.6-179.30113E55 K56 Q57E55-K59 PolarHBondContact O-N 3.32Å; K56-K59 PolarHBondContact O-N 2.9Å; Q57-K59 VanDerWaalsContact C-N 3.32Å; Q57-K59 PolarHBondContact O-N 3.43Å
60N68.6Low73.5Confident95 Ų95116.6 Ų116.651%0.50856%0.556SS.*  trans-106.543.6-171.2-64.55.1000112.7K56 E62K56-N60 PolarHBondContact O-N 3.44Å; N60-E62 PolarHBondContact O-N 3.3Å
61K66.3Low72.5Confident160 Ų160118.6 Ų118.670%0.69657%0.574SS**THydrogen-bonded Turntrans-60.9-19.4-166.2-153.5172.3-178.9-179.70114.9N65K61-N65 PolarHBondContact O-ND2 3.45Å
62E63.1Low71.7Confident188 Ų188120.6 Ų120.688%0.87958%0.579SS**THydrogen-bonded Turntrans-92.3-31.9-168.9-64.9-173.9160.600114.4N60N60-E62 PolarHBondContact O-N 3.3Å
63E56.2Low70.9Confident188 Ų188117.7 Ų117.788%0.87958%0.575SS**THydrogen-bonded Turntrans-100.5-11.2-168.3-154.6176.1178.700114.7N65E63-N65 PolarHBondContact O-N 3.05Å
64F59.6Low70.4Confident80 Ų80117 Ų11735%0.35158%0.581SS.*  trans-89.74.1-161.7-164.9-110.8000115.9Q57 M68Q57-F64 HydrophobicContact CG-CD1 4.44Å; Q57-F64 HydrophobicContact CG-CE1 4.03Å; Q57-F64 HydrophobicContact CG-CZ 4.33Å; F64-M68 HydrophobicContact CD1-CB 4.1Å; F64-M68 HydrophobicContact CD1-CG 4.23Å; F64-M68 HydrophobicContact CD2-CE 4.2Å; F64-M68 HydrophobicContact CE1-CB 3.8Å; F64-M68 HydrophobicContact CE1-CE 4.25Å; F64-M68 HydrophobicContact CE1-CG 3.43Å; F64-M68 VanDerWaalsContact CE1-CG 3.43Å; F64-M68 HydrophobicContact CE2-CB 4.38Å; F64-M68 HydrophobicContact CE2-CE 3.19Å; F64-M68 HydrophobicContact CE2-CG 4.16Å; F64-M68 HydrophobicContact CE2-SD 4.41Å; F64-M68 HydrophobicContact CZ-CB 3.96Å; F64-M68 HydrophobicContact CZ-CE 3.23Å; F64-M68 HydrophobicContact CZ-CG 3.39Å; F64-M68 HydrophobicContact CZ-SD 3.9Å; F64-M68 WeakPolarHBondContact O-CB 3.5Å
65N62.2Low70.3Confident81 Ų81112.4 Ų112.443%0.43357%0.569SS.*SBendtrans-93.2-19.5-147.2-79.3-45.7000118.1K61 E63 K69K61-N65 PolarHBondContact O-ND2 3.45Å; E63-N65 PolarHBondContact O-N 3.05Å; N65-K69 WeakPolarHBondContact O-CD 3.35Å; N65-K69 WeakPolarHBondContact O-CE 3.36Å; N65-K69 WeakPolarHBondContact O-CG 3.34Å
66S63.1Low70.2Confident89 Ų89110.2 Ų110.262%0.62256%0.561SS**SBendtrans-101.2-59.1-173.860.40000113.6M68 K69 N70S66-M68 PolarHBondContact O-N 3.4Å; S66-K69 PolarHBondContact O-N 3Å; S66-N70 PolarHBondContact O-N 3.48Å
67V62.1Low70.3Confident119 Ų119107.3 Ų107.372%0.72155%0.552SS**Hα-helixtrans-63.9-41.8-176.9178.90000111.5K69 N70 A71V67-K69 VanDerWaalsContact C-N 3.29Å; V67-K69 PolarHBondContact O-N 2.92Å; V67-N70 PolarHBondContact O-N 3.49Å; V67-A71 PolarHBondContact O-N 3.34Å
68M66.2Low71Confident87 Ų87107.6 Ų107.643%0.42956%0.556SS.*Hα-helixtrans-69.6-27.1179.4-156.272.367.600112.5F64 S66 K72F64-M68 HydrophobicContact CD1-CB 4.1Å; F64-M68 HydrophobicContact CD1-CG 4.23Å; F64-M68 HydrophobicContact CD2-CE 4.2Å; F64-M68 HydrophobicContact CE1-CB 3.8Å; F64-M68 HydrophobicContact CE1-CE 4.25Å; F64-M68 HydrophobicContact CE1-CG 3.43Å; F64-M68 VanDerWaalsContact CE1-CG 3.43Å; F64-M68 HydrophobicContact CE2-CB 4.38Å; F64-M68 HydrophobicContact CE2-CE 3.19Å; F64-M68 HydrophobicContact CE2-CG 4.16Å; F64-M68 HydrophobicContact CE2-SD 4.41Å; F64-M68 HydrophobicContact CZ-CB 3.96Å; F64-M68 HydrophobicContact CZ-CE 3.23Å; F64-M68 HydrophobicContact CZ-CG 3.39Å; F64-M68 HydrophobicContact CZ-SD 3.9Å; F64-M68 WeakPolarHBondContact O-CB 3.5Å; S66-M68 PolarHBondContact O-N 3.4Å; M68-K72 WeakPolarHBondContact O-CB 3.37Å; M68-K72 PolarHBondContact O-N 3.07Å
69K65Low71.7Confident129 Ų129103 Ų10356%0.56153%0.532SS*.Hα-helixtrans-64.4-42.6176.7-84.6-177.7-162.9169.60111.5N65 S66 V67 K72 S73N65-K69 WeakPolarHBondContact O-CD 3.35Å; N65-K69 WeakPolarHBondContact O-CE 3.36Å; N65-K69 WeakPolarHBondContact O-CG 3.34Å; S66-K69 PolarHBondContact O-N 3Å; V67-K69 VanDerWaalsContact C-N 3.29Å; V67-K69 PolarHBondContact O-N 2.92Å; K69-K72 PolarHBondContact O-N 3.49Å; K69-S73 VanDerWaalsContact O-CB 3.28Å; K69-S73 WeakPolarHBondContact O-CB 3.28Å; K69-S73 PolarHBondContact O-N 2.94Å
70N65.7Low72.2Confident124 Ų12499 Ų9966%0.66352%0.515SS*.Hα-helixtrans-68-47.7179.6-71.9-11.7000111.7S66 V67 K72 S73 L74S66-N70 PolarHBondContact O-N 3.48Å; V67-N70 PolarHBondContact O-N 3.49Å; N70-K72 VanDerWaalsContact C-N 3.31Å; N70-K72 PolarHBondContact O-N 3.26Å; N70-S73 PolarHBondContact O-N 3.14Å; N70-L74 PolarHBondContact O-N 3.27Å
71A68.3Low73.4Confident59 Ų59100.9 Ų100.949%0.48852%0.52SS..Hα-helixtrans-60.5-40.917600000112.1V67 S75V67-A71 PolarHBondContact O-N 3.34Å; A71-S75 VanDerWaalsContact O-CB 3.29Å; A71-S75 WeakPolarHBondContact O-CB 3.48Å; A71-S75 PolarHBondContact O-N 3.41Å
72K73.3Confident74.8Confident117 Ų11796.2 Ų96.251%0.50950%0.503SS..Hα-helixtrans-67.6-37.5176.4-170.1169.6-174.5174.50112M68 K69 N70 N76M68-K72 WeakPolarHBondContact O-CB 3.37Å; M68-K72 PolarHBondContact O-N 3.07Å; K69-K72 PolarHBondContact O-N 3.49Å; N70-K72 VanDerWaalsContact C-N 3.31Å; N70-K72 PolarHBondContact O-N 3.26Å; K72-N76 VanDerWaalsContact O-CB 3.23Å; K72-N76 WeakPolarHBondContact O-CB 3.31Å; K72-N76 PolarHBondContact O-N 3Å; K72-N76 PolarHBondContact O-ND2 3.28Å; K72-N76 VanDerWaalsContact O-ND2 3.16Å; K72-N76 PolarHBondContact O-OD1 3.11Å
73S75.5Confident76.3Confident63 Ų6387.9 Ų87.944%0.44146%0.464SS..Hα-helixtrans-64.9-48.2176.3-178.30000111.9K69 N70 N76 N77K69-S73 VanDerWaalsContact O-CB 3.28Å; K69-S73 WeakPolarHBondContact O-CB 3.28Å; K69-S73 PolarHBondContact O-N 2.94Å; N70-S73 PolarHBondContact O-N 3.14Å; S73-N76 PolarHBondContact O-N 3.41Å; S73-N77 PolarHBondContact O-N 2.96Å
74L75.9Confident78.2Confident130 Ų13082.1 Ų82.168%0.68144%0.439SS*.Hα-helixtrans-61.5-47.6177.1-179.163.6000111.6N70 N76 N77 L78N70-L74 PolarHBondContact O-N 3.27Å; L74-N76 VanDerWaalsContact C-N 3.33Å; L74-N76 PolarHBondContact O-N 3.31Å; L74-N77 PolarHBondContact O-N 2.98Å; L74-L78 PolarHBondContact O-N 3.4Å
75S80.7Confident80Confident41 Ų4183.5 Ų83.529%0.28745%0.449SS..Hα-helixtrans-57.4-45.7175.7-177.50000111.4A71 N77 L78 I79A71-S75 VanDerWaalsContact O-CB 3.29Å; A71-S75 WeakPolarHBondContact O-CB 3.48Å; A71-S75 PolarHBondContact O-N 3.41Å; S75-N77 VanDerWaalsContact C-N 3.32Å; S75-N77 PolarHBondContact O-N 3.41Å; S75-L78 PolarHBondContact O-N 2.81Å; S75-I79 WeakPolarHBondContact O-CD1 3.19Å; S75-I79 WeakPolarHBondContact O-CG1 3.15Å; S75-I79 PolarHBondContact O-N 3.47Å
76N83.2Confident81.7Confident68 Ų6880.6 Ų80.636%0.36443%0.432SS..Hα-helixtrans-62-37.1177.7-73.9-18.6000112.8K72 S73 L74 K80K72-N76 VanDerWaalsContact O-CB 3.23Å; K72-N76 WeakPolarHBondContact O-CB 3.31Å; K72-N76 PolarHBondContact O-N 3Å; K72-N76 PolarHBondContact O-ND2 3.28Å; K72-N76 VanDerWaalsContact O-ND2 3.16Å; K72-N76 PolarHBondContact O-OD1 3.11Å; S73-N76 PolarHBondContact O-N 3.41Å; L74-N76 VanDerWaalsContact C-N 3.33Å; L74-N76 PolarHBondContact O-N 3.31Å; N76-K80 VanDerWaalsContact O-CB 3.24Å; N76-K80 WeakPolarHBondContact O-CB 3.32Å; N76-K80 PolarHBondContact O-N 2.93Å
77N87.3Confident83.3Confident87 Ų8776.6 Ų76.647%0.46540%0.404SS..Hα-helixtrans-67.1-44.1176.8-73.8-21.8000111.6S73 L74 S75 K80 Q81S73-N77 PolarHBondContact O-N 2.96Å; L74-N77 PolarHBondContact O-N 2.98Å; S75-N77 VanDerWaalsContact C-N 3.32Å; S75-N77 PolarHBondContact O-N 3.41Å; N77-K80 WeakPolarHBondContact O-CB 3.43Å; N77-K80 PolarHBondContact O-N 3.26Å; N77-Q81 WeakPolarHBondContact O-CG 3.32Å; N77-Q81 PolarHBondContact O-N 2.96Å
78L91.6Very high85Confident85 Ų8572.4 Ų72.445%0.44539%0.385SS..Hα-helixtrans-61.6-48.8175.4178.863.7000111.2L74 S75 K80 Q81 L82 W151L74-L78 PolarHBondContact O-N 3.4Å; S75-L78 PolarHBondContact O-N 2.81Å; L78-K80 VanDerWaalsContact C-N 3.28Å; L78-K80 PolarHBondContact O-N 2.83Å; L78-Q81 PolarHBondContact O-N 2.83Å; L78-L82 HydrophobicContact CD1-CD1 4.19Å; L78-L82 HydrophobicContact CD1-CG 4.25Å; L78-L82 HydrophobicContact CG-CD1 4.02Å; L78-L82 HydrophobicContact CG-CG 4.45Å; L78-L82 WeakPolarHBondContact O-CG 3.26Å; L78-L82 PolarHBondContact O-N 3.45Å; L78-W151 HydrophobicContact CD2-CH2 4.49Å
79I91.7Very high86.6Confident2 Ų272.7 Ų72.71%0.0139%0.387CS..Hα-helixtrans-57.7-43.9177.1-64.5162.2000110.2S75 Q81 L82 M83 W151 R152S75-I79 WeakPolarHBondContact O-CD1 3.19Å; S75-I79 WeakPolarHBondContact O-CG1 3.15Å; S75-I79 PolarHBondContact O-N 3.47Å; I79-Q81 PolarHBondContact O-N 2.93Å; I79-L82 PolarHBondContact O-N 3.16Å; I79-M83 HydrophobicContact CG2-CG 4.16Å; I79-M83 HydrophobicContact CG2-SD 3.98Å; I79-M83 WeakPolarHBondContact O-CB 3.34Å; I79-M83 VanDerWaalsContact O-CG 3.25Å; I79-M83 WeakPolarHBondContact O-CG 3.34Å; I79-M83 PolarHBondContact O-N 3.35Å; I79-W151 HydrophobicContact CD1-CB 4.5Å; I79-W151 VanDerWaalsContact CD1-CD1 3.45Å; I79-W151 HydrophobicContact CD1-CD2 3.89Å; I79-W151 HydrophobicContact CD1-CG 3.71Å; I79-W151 HydrophobicContact CD1-CZ2 4.48Å; I79-W151 HydrophobicContact CG1-CD2 3.58Å; I79-W151 VanDerWaalsContact CG1-CE2 3.49Å; I79-W151 HydrophobicContact CG1-CE3 4.03Å; I79-W151 HydrophobicContact CG1-CG 3.94Å; I79-W151 HydrophobicContact CG1-CH2 4.27Å; I79-W151 HydrophobicContact CG1-CZ2 3.86Å; I79-W151 HydrophobicContact CG1-CZ3 4.35Å; I79-R152 HydrophobicContact CG2-CB 4.49Å
80K91.5Very high88.2Confident88 Ų8866.6 Ų66.638%0.38336%0.36SS..Hα-helixtrans-58-49.1178.1-173.2-171.9-177.6-1700111.2N76 N77 L78 M83 I84 A207 A208N76-K80 VanDerWaalsContact O-CB 3.24Å; N76-K80 WeakPolarHBondContact O-CB 3.32Å; N76-K80 PolarHBondContact O-N 2.93Å; N77-K80 WeakPolarHBondContact O-CB 3.43Å; N77-K80 PolarHBondContact O-N 3.26Å; L78-K80 VanDerWaalsContact C-N 3.28Å; L78-K80 PolarHBondContact O-N 2.83Å; K80-M83 PolarHBondContact O-N 3.4Å; K80-I84 HydrophobicContact CG-CD1 4.07Å; K80-I84 VanDerWaalsContact O-CG1 3.27Å; K80-I84 WeakPolarHBondContact O-CG1 3.27Å; K80-I84 PolarHBondContact O-N 2.9Å; K80-A207 WeakPolarHBondContact CE-O 3.43Å; K80-A207 WeakPolarHBondContact CG-O 3.02Å; K80-A208 WeakPolarHBondContact CE-O 3.44Å; K80-A208 PolarHBondContact NZ-O 3.44Å
81Q93.6Very high89.7Confident134 Ų13462.2 Ų62.263%0.62634%0.338SS*.Hα-helixtrans-63.4-45.5179.4-71.8178.1-6.300111.8N77 L78 I79 M83 I84 L85N77-Q81 WeakPolarHBondContact O-CG 3.32Å; N77-Q81 PolarHBondContact O-N 2.96Å; L78-Q81 PolarHBondContact O-N 2.83Å; I79-Q81 PolarHBondContact O-N 2.93Å; Q81-M83 VanDerWaalsContact C-N 3.34Å; Q81-M83 PolarHBondContact O-N 3.31Å; Q81-I84 PolarHBondContact O-N 3.41Å; Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 PolarHBondContact O-N 3.37Å
82L95.9Very high91.2Very high62 Ų6264.5 Ų64.533%0.32534%0.341SS..Hα-helixtrans-61.7-41.6176.8-69.6175.7000111.8L78 I79 L85 Y86 F148 W151L78-L82 HydrophobicContact CD1-CD1 4.19Å; L78-L82 HydrophobicContact CD1-CG 4.25Å; L78-L82 HydrophobicContact CG-CD1 4.02Å; L78-L82 HydrophobicContact CG-CG 4.45Å; L78-L82 WeakPolarHBondContact O-CG 3.26Å; L78-L82 PolarHBondContact O-N 3.45Å; I79-L82 PolarHBondContact O-N 3.16Å; L82-L85 PolarHBondContact O-N 3.22Å; L82-Y86 WeakPolarHBondContact O-CB 3.46Å; L82-Y86 PolarHBondContact O-N 2.84Å; L82-F148 HydrophobicContact CB-CE1 3.95Å; L82-F148 HydrophobicContact CB-CZ 4.46Å; L82-W151 HydrophobicContact CD1-CH2 3.83Å; L82-W151 HydrophobicContact CD1-CZ3 3.8Å
83M94.4Very high92.4Very high12 Ų1261.1 Ų61.16%0.05933%0.325CS..Hα-helixtrans-63.4-45.1175.3-75.5-175.776.100111.5I79 K80 Q81 L85 Y86 N87 F148 A207I79-M83 HydrophobicContact CG2-CG 4.16Å; I79-M83 HydrophobicContact CG2-SD 3.98Å; I79-M83 WeakPolarHBondContact O-CB 3.34Å; I79-M83 VanDerWaalsContact O-CG 3.25Å; I79-M83 WeakPolarHBondContact O-CG 3.34Å; I79-M83 PolarHBondContact O-N 3.35Å; K80-M83 PolarHBondContact O-N 3.4Å; Q81-M83 VanDerWaalsContact C-N 3.34Å; Q81-M83 PolarHBondContact O-N 3.31Å; M83-L85 VanDerWaalsContact C-N 3.33Å; M83-L85 PolarHBondContact O-N 2.89Å; M83-Y86 PolarHBondContact O-N 2.83Å; M83-N87 VanDerWaalsContact O-CB 3.31Å; M83-N87 WeakPolarHBondContact O-CB 3.27Å; M83-N87 PolarHBondContact O-N 2.87Å; M83-N87 PolarHBondContact O-ND2 3.21Å; M83-F148 HydrophobicContact CE-CB 4.43Å; M83-F148 HydrophobicContact CG-CB 4.08Å; M83-F148 HydrophobicContact CG-CD1 3.64Å; M83-F148 HydrophobicContact CG-CE1 4.24Å; M83-F148 HydrophobicContact CG-CG 3.9Å; M83-F148 HydrophobicContact SD-CB 4.37Å; M83-A207 HydrophobicContact CB-CB 3.96Å
84I95.7Very high93.5Very high68 Ų6858.1 Ų58.135%0.34930%0.304SS..Hα-helixtrans-60.1-47.7178.6-67.7163.2000110K80 Q81 G88 A207 A208K80-I84 HydrophobicContact CG-CD1 4.07Å; K80-I84 VanDerWaalsContact O-CG1 3.27Å; K80-I84 WeakPolarHBondContact O-CG1 3.27Å; K80-I84 PolarHBondContact O-N 2.9Å; Q81-I84 PolarHBondContact O-N 3.41Å; I84-G88 PolarHBondContact O-N 3.12Å; I84-A207 HydrophobicContact CG1-CB 3.77Å; I84-A208 HydrophobicContact CD1-CB 4.27Å; I84-A208 HydrophobicContact CG1-CB 4.47Å
85L97.1Very high94.5Very high108 Ų10853 Ų5357%0.56528%0.282SS*.Hα-helixtrans-60.1-50.7177.4177.161.8000111.5Q81 L82 M83 G88 I89Q81-L85 WeakPolarHBondContact O-CB 3.48Å; Q81-L85 PolarHBondContact O-N 3.37Å; L82-L85 PolarHBondContact O-N 3.22Å; M83-L85 VanDerWaalsContact C-N 3.33Å; M83-L85 PolarHBondContact O-N 2.89Å; L85-G88 PolarHBondContact O-N 3.37Å; L85-I89 HydrophobicContact CD1-CD1 3.94Å; L85-I89 HydrophobicContact CD1-CG1 4.3Å; L85-I89 HydrophobicContact CG-CD1 3.92Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; L85-I89 PolarHBondContact O-N 2.91Å
86Y97.8Very high95.4Very high20 Ų2055.6 Ų55.68%0.07829%0.291CS..Hα-helixtrans-57.9-50.7179.3167.7-97.9000111.9L82 M83 G88 I89 M90 I141 L144 D145 F148 Y200L82-Y86 WeakPolarHBondContact O-CB 3.46Å; L82-Y86 PolarHBondContact O-N 2.84Å; M83-Y86 PolarHBondContact O-N 2.83Å; Y86-G88 VanDerWaalsContact C-N 3.29Å; Y86-G88 PolarHBondContact O-N 3.38Å; Y86-I89 PolarHBondContact O-N 2.8Å; Y86-M90 HydrophobicContact CD1-CG 4.41Å; Y86-M90 HydrophobicContact CD2-CG 4.12Å; Y86-M90 HydrophobicContact CE1-CG 3.99Å; Y86-M90 HydrophobicContact CE2-CG 3.69Å; Y86-M90 HydrophobicContact CE2-SD 4.17Å; Y86-M90 HydrophobicContact CG-CG 4.47Å; Y86-M90 WeakPolarHBondContact O-CB 2.95Å; Y86-M90 VanDerWaalsContact O-CG 3.31Å; Y86-M90 WeakPolarHBondContact O-CG 3.36Å; Y86-M90 PolarHBondContact O-N 2.56Å; Y86-I141 HydrophobicContact CE2-CG2 3.92Å; Y86-L144 HydrophobicContact CE2-CB 4.03Å; Y86-L144 HydrophobicContact CE2-CD1 4.22Å; Y86-D145 WeakPolarHBondContact CE1-OD1 3.5Å; Y86-D145 PolarHBondContact OH-OD1 2.92Å; Y86-F148 AromaticContact CD1-CD2 3.94Å; Y86-F148 HydrophobicContact CD1-CD2 3.94Å; Y86-F148 AromaticContact CD1-CE2 3.66Å; Y86-F148 HydrophobicContact CD1-CE2 3.66Å; Y86-F148 AromaticContact CD2-CE2 3.71Å; Y86-F148 HydrophobicContact CD2-CE2 3.71Å; Y86-F148 HydrophobicContact CD2-CZ 4.42Å; Y86-F148 HydrophobicContact CE1-CD2 4.14Å; Y86-F148 HydrophobicContact CE1-CE2 4.11Å; Y86-F148 HydrophobicContact CE2-CE2 4.14Å; Y86-F148 HydrophobicContact CG-CD2 4.2Å; Y86-F148 AromaticContact CG-CE2 3.43Å; Y86-F148 HydrophobicContact CG-CE2 3.43Å; Y86-F148 VanDerWaalsContact CG-CE2 3.43Å; Y86-F148 HydrophobicContact CG-CZ 4.07Å; Y86-Y200 AromaticContact CE1-CE1 3.98Å; Y86-Y200 HydrophobicContact CE1-CE1 3.98Å
87N97.7Very high96.1Very high5 Ų552.6 Ų52.63%0.02728%0.275CS..Hα-helixtrans-61.3-40.3178.3-75.9-71.1000110.9M83 M90 V91 Y200 Y203M83-N87 VanDerWaalsContact O-CB 3.31Å; M83-N87 WeakPolarHBondContact O-CB 3.27Å; M83-N87 PolarHBondContact O-N 2.87Å; M83-N87 PolarHBondContact O-ND2 3.21Å; N87-M90 PolarHBondContact O-N 3.42Å; N87-V91 VanDerWaalsContact O-CG2 3.32Å; N87-V91 WeakPolarHBondContact O-CG2 3.3Å; N87-V91 PolarHBondContact O-N 3.3Å; N87-Y200 VanDerWaalsContact OD1-CD1 3.28Å; N87-Y200 WeakPolarHBondContact OD1-CD1 3.47Å; N87-Y203 WeakPolarHBondContact OD1-CB 3.46Å
88G97.8Very high96.6Very high32 Ų3248.5 Ų48.533%0.3325%0.253SS..Hα-helixtrans-60.8-45.617500000112.9I84 L85 Y86 V91 I92I84-G88 PolarHBondContact O-N 3.12Å; L85-G88 PolarHBondContact O-N 3.37Å; Y86-G88 VanDerWaalsContact C-N 3.29Å; Y86-G88 PolarHBondContact O-N 3.38Å; G88-V91 PolarHBondContact O-N 3.5Å; G88-I92 WeakPolarHBondContact O-CG1 3.31Å; G88-I92 PolarHBondContact O-N 3.26Å; G88-I92 VanDerWaalsContact O-N 3.12Å
89I98.3Very high96.9Very high92 Ų9251.4 Ų51.447%0.47226%0.262SS..Hα-helixtrans-60.7-46174.7-69.2167.3000110.3L85 Y86 V91 I92 Y93L85-I89 HydrophobicContact CD1-CD1 3.94Å; L85-I89 HydrophobicContact CD1-CG1 4.3Å; L85-I89 HydrophobicContact CG-CD1 3.92Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; L85-I89 PolarHBondContact O-N 2.91Å; Y86-I89 PolarHBondContact O-N 2.8Å; I89-V91 PolarHBondContact O-N 3.22Å; I89-I92 PolarHBondContact O-N 3.34Å; I89-Y93 VanDerWaalsContact O-CB 3.28Å; I89-Y93 WeakPolarHBondContact O-CB 3.48Å; I89-Y93 PolarHBondContact O-N 3.16Å
90M98.3Very high97.2Very high1 Ų153.2 Ų53.21%0.00528%0.275CS..Hα-helixtrans-66.8-34.2-178.6-70.7-56.7-68.700113.2Y86 N87 S94 I141 E142 Y200Y86-M90 HydrophobicContact CD1-CG 4.41Å; Y86-M90 HydrophobicContact CD2-CG 4.12Å; Y86-M90 HydrophobicContact CE1-CG 3.99Å; Y86-M90 HydrophobicContact CE2-CG 3.69Å; Y86-M90 HydrophobicContact CE2-SD 4.17Å; Y86-M90 HydrophobicContact CG-CG 4.47Å; Y86-M90 WeakPolarHBondContact O-CB 2.95Å; Y86-M90 VanDerWaalsContact O-CG 3.31Å; Y86-M90 WeakPolarHBondContact O-CG 3.36Å; Y86-M90 PolarHBondContact O-N 2.56Å; N87-M90 PolarHBondContact O-N 3.42Å; M90-S94 VanDerWaalsContact O-CB 3.24Å; M90-S94 WeakPolarHBondContact O-CB 3.24Å; M90-S94 PolarHBondContact O-N 3.39Å; M90-S94 PolarHBondContact O-OG 3.24Å; M90-I141 HydrophobicContact CE-CG2 4.34Å; M90-I141 HydrophobicContact SD-CB 4.31Å; M90-I141 HydrophobicContact SD-CG2 3.53Å; M90-I141 VanDerWaalsContact SD-CG2 3.53Å; M90-E142 HydrophobicContact CE-CG 3.47Å; M90-E142 VanDerWaalsContact CE-CG 3.47Å; M90-Y200 HydrophobicContact CB-CD1 3.9Å; M90-Y200 HydrophobicContact CB-CD2 3.49Å; M90-Y200 VanDerWaalsContact CB-CD2 3.49Å; M90-Y200 HydrophobicContact CB-CE1 4.15Å; M90-Y200 HydrophobicContact CB-CE2 3.73Å; M90-Y200 HydrophobicContact CB-CG 3.59Å; M90-Y200 HydrophobicContact CE-CD2 4.43Å; M90-Y200 HydrophobicContact CE-CE2 3.58Å; M90-Y200 HydrophobicContact CG-CD1 4.46Å; M90-Y200 HydrophobicContact CG-CD2 4.45Å; M90-Y200 HydrophobicContact CG-CE1 4.29Å; M90-Y200 HydrophobicContact CG-CE2 4.23Å
91V98.6Very high97.5Very high33 Ų3349.1 Ų49.120%0.226%0.257CS..Hα-helixtrans-60.3-52.1170168.20000110.4N87 G88 I89 Y93 S94 A95 V197 T201N87-V91 VanDerWaalsContact O-CG2 3.32Å; N87-V91 WeakPolarHBondContact O-CG2 3.3Å; N87-V91 PolarHBondContact O-N 3.3Å; G88-V91 PolarHBondContact O-N 3.5Å; I89-V91 PolarHBondContact O-N 3.22Å; V91-Y93 VanDerWaalsContact C-N 3.34Å; V91-Y93 PolarHBondContact O-N 2.78Å; V91-S94 PolarHBondContact O-N 2.99Å; V91-A95 VanDerWaalsContact O-CB 3.29Å; V91-A95 WeakPolarHBondContact O-CB 3.49Å; V91-A95 PolarHBondContact O-N 3.16Å; V91-V197 HydrophobicContact CG1-CG1 4.33Å; V91-T201 VanDerWaalsContact CG2-N 3.33Å; V91-T201 WeakPolarHBondContact CG2-OG1 3.41Å
92I98.5Very high97.7Very high106 Ų10647.2 Ų47.254%0.54425%0.25SC..Hα-helixtrans-60.8-46.5-179.4-66.5165.9000110.2G88 I89 A95 I96G88-I92 WeakPolarHBondContact O-CG1 3.31Å; G88-I92 PolarHBondContact O-N 3.26Å; G88-I92 VanDerWaalsContact O-N 3.12Å; I89-I92 PolarHBondContact O-N 3.34Å; I92-A95 PolarHBondContact O-N 3.01Å; I92-I96 HydrophobicContact CG2-CD1 3.76Å; I92-I96 HydrophobicContact CG2-CG1 4.43Å; I92-I96 VanDerWaalsContact O-CG1 3.29Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.22Å
93Y98.5Very high97.8Very high46 Ų4652.1 Ų52.118%0.1826%0.264CS..Hα-helixtrans-63.2-45.4-178.4-164.8-104.5000112I89 V91 A95 I96 I97 F134 S138I89-Y93 VanDerWaalsContact O-CB 3.28Å; I89-Y93 WeakPolarHBondContact O-CB 3.48Å; I89-Y93 PolarHBondContact O-N 3.16Å; V91-Y93 VanDerWaalsContact C-N 3.34Å; V91-Y93 PolarHBondContact O-N 2.78Å; Y93-A95 PolarHBondContact O-N 3.03Å; Y93-I96 PolarHBondContact O-N 3.17Å; Y93-I97 HydrophobicContact CD1-CD1 3.78Å; Y93-I97 HydrophobicContact CE1-CD1 3.54Å; Y93-I97 WeakPolarHBondContact O-CG1 3.45Å; Y93-I97 PolarHBondContact O-N 3.06Å; Y93-I97 VanDerWaalsContact O-N 3.08Å; Y93-F134 WeakPolarHBondContact CE1-O 3.21Å; Y93-F134 WeakPolarHBondContact OH-CA 3.3Å; Y93-F134 WeakPolarHBondContact OH-CD1 3.25Å; Y93-F134 PolarHBondContact OH-O 3.25Å; Y93-S138 VanDerWaalsContact CE1-CB 3.48Å
94S98.5Very high97.9Very high0 Ų051.6 Ų51.60%026%0.262CS..Hα-helixtrans-65.1-39.8176-57.30000111.7M90 V91 I97 S98 C193M90-S94 VanDerWaalsContact O-CB 3.24Å; M90-S94 WeakPolarHBondContact O-CB 3.24Å; M90-S94 PolarHBondContact O-N 3.39Å; M90-S94 PolarHBondContact O-OG 3.24Å; V91-S94 PolarHBondContact O-N 2.99Å; S94-I97 PolarHBondContact O-N 3.45Å; S94-S98 WeakPolarHBondContact O-CB 3.24Å; S94-S98 PolarHBondContact O-N 3.37Å; S94-C193 WeakPolarHBondContact O-CB 3.38Å
95A98.6Very high98Very high24 Ų2448.8 Ų48.820%0.19825%0.249CC..Hα-helixtrans-62.2-46.8176.300000110.9V91 I92 Y93 I97 S98 F99 V197V91-A95 VanDerWaalsContact O-CB 3.29Å; V91-A95 WeakPolarHBondContact O-CB 3.49Å; V91-A95 PolarHBondContact O-N 3.16Å; I92-A95 PolarHBondContact O-N 3.01Å; Y93-A95 PolarHBondContact O-N 3.03Å; A95-I97 PolarHBondContact O-N 3.02Å; A95-S98 PolarHBondContact O-N 3.33Å; A95-F99 HydrophobicContact CB-CD2 4.31Å; A95-F99 HydrophobicContact CB-CE2 4.41Å; A95-F99 WeakPolarHBondContact O-CB 3.29Å; A95-F99 WeakPolarHBondContact O-CD2 3.11Å; A95-F99 PolarHBondContact O-N 2.93Å; A95-V197 HydrophobicContact CB-CG2 3.91Å
96I98.5Very high97.9Very high95 Ų9552.4 Ų52.449%0.48726%0.256SS..Hα-helixtrans-57.1-47.7177.3-70.7166.7000110.9I92 Y93 S98 S100I92-I96 HydrophobicContact CG2-CD1 3.76Å; I92-I96 HydrophobicContact CG2-CG1 4.43Å; I92-I96 VanDerWaalsContact O-CG1 3.29Å; I92-I96 WeakPolarHBondContact O-CG1 3.32Å; I92-I96 PolarHBondContact O-N 3.22Å; Y93-I96 PolarHBondContact O-N 3.17Å; I96-S98 PolarHBondContact O-N 3.46Å; I96-S100 WeakPolarHBondContact O-CB 3.44Å; I96-S100 PolarHBondContact O-N 3.04Å; I96-S100 PolarHBondContact O-OG 3.38Å
97I98.5Very high97.8Very high5 Ų555.9 Ų55.93%0.02628%0.276CS..Hα-helixtrans-61.7-46.2178.7-67.6166.6000110.5Y93 S94 A95 S100 T101 I131 F134 F135 P189 C193Y93-I97 HydrophobicContact CD1-CD1 3.78Å; Y93-I97 HydrophobicContact CE1-CD1 3.54Å; Y93-I97 WeakPolarHBondContact O-CG1 3.45Å; Y93-I97 PolarHBondContact O-N 3.06Å; Y93-I97 VanDerWaalsContact O-N 3.08Å; S94-I97 PolarHBondContact O-N 3.45Å; A95-I97 PolarHBondContact O-N 3.02Å; I97-S100 PolarHBondContact O-N 2.89Å; I97-T101 WeakPolarHBondContact O-CB 3.38Å; I97-T101 PolarHBondContact O-N 2.84Å; I97-T101 PolarHBondContact O-OG1 3.46Å; I97-I131 HydrophobicContact CG2-CG2 4.32Å; I97-F134 HydrophobicContact CD1-CB 4.33Å; I97-F134 HydrophobicContact CG1-CB 4.28Å; I97-F135 HydrophobicContact CG2-CB 4.32Å; I97-F135 HydrophobicContact CG2-CD2 4.41Å; I97-P189 HydrophobicContact CG2-CB 4.34Å; I97-C193 HydrophobicContact CB-CB 4.44Å; I97-C193 HydrophobicContact CG2-CB 4.34Å; I97-C193 VanDerWaalsContact CG2-SG 3.51Å
98S98.1Very high97.7Very high1 Ų157.8 Ų57.81%0.00729%0.286CS..Hα-helixtrans-61.7-51.5-179.7-176.70000112S94 A95 I96 S100 T101 M102 L194S94-S98 WeakPolarHBondContact O-CB 3.24Å; S94-S98 PolarHBondContact O-N 3.37Å; A95-S98 PolarHBondContact O-N 3.33Å; I96-S98 PolarHBondContact O-N 3.46Å; S98-S100 PolarHBondContact O-N 3.37Å; S98-T101 WeakPolarHBondContact O-CB 3.38Å; S98-T101 PolarHBondContact O-N 2.71Å; S98-T101 VanDerWaalsContact O-N 3.17Å; S98-M102 WeakPolarHBondContact O-CG 3.38Å; S98-M102 PolarHBondContact O-N 3.46Å; S98-L194 WeakPolarHBondContact OG-CD2 3.35Å; S98-L194 WeakPolarHBondContact OG-CG 3.43Å
99F98Very high97.6Very high146 Ų14659.5 Ų59.564%0.6430%0.303SS*.Hα-helixtrans-62.3-42.2177.5-80.6-67.5000112A95 T101 M102 W103A95-F99 HydrophobicContact CB-CD2 4.31Å; A95-F99 HydrophobicContact CB-CE2 4.41Å; A95-F99 WeakPolarHBondContact O-CB 3.29Å; A95-F99 WeakPolarHBondContact O-CD2 3.11Å; A95-F99 PolarHBondContact O-N 2.93Å; F99-T101 VanDerWaalsContact C-N 3.28Å; F99-T101 PolarHBondContact O-N 2.93Å; F99-M102 PolarHBondContact O-N 2.87Å; F99-W103 VanDerWaalsContact O-CB 3.27Å; F99-W103 WeakPolarHBondContact O-CB 3.28Å; F99-W103 PolarHBondContact O-N 3.49Å
100S98.2Very high97.4Very high40 Ų4056.9 Ų56.928%0.2829%0.288SS..Hα-helixtrans-62.7-37.8176.2-57.60000111.2I96 I97 S98 W103 A104 I131I96-S100 WeakPolarHBondContact O-CB 3.44Å; I96-S100 PolarHBondContact O-N 3.04Å; I96-S100 PolarHBondContact O-OG 3.38Å; I97-S100 PolarHBondContact O-N 2.89Å; S98-S100 PolarHBondContact O-N 3.37Å; S100-W103 PolarHBondContact O-N 3.25Å; S100-A104 VanDerWaalsContact O-CB 3.25Å; S100-A104 WeakPolarHBondContact O-CB 2.88Å; S100-A104 PolarHBondContact O-N 2.9Å; S100-I131 WeakPolarHBondContact O-CD1 3.27Å
101T97.9Very high97.2Very high1 Ų158.8 Ų58.81%0.00631%0.308CS..Hα-helixtrans-67.6-43.2176-500000111.7I97 S98 F99 A104 A105 I131 F186 P189 L190I97-T101 WeakPolarHBondContact O-CB 3.38Å; I97-T101 PolarHBondContact O-N 2.84Å; I97-T101 PolarHBondContact O-OG1 3.46Å; S98-T101 WeakPolarHBondContact O-CB 3.38Å; S98-T101 PolarHBondContact O-N 2.71Å; S98-T101 VanDerWaalsContact O-N 3.17Å; F99-T101 VanDerWaalsContact C-N 3.28Å; F99-T101 PolarHBondContact O-N 2.93Å; T101-A104 PolarHBondContact O-N 3.02Å; T101-A105 VanDerWaalsContact O-CB 3.22Å; T101-A105 WeakPolarHBondContact O-CB 3.32Å; T101-A105 PolarHBondContact O-N 3.09Å; T101-I131 VanDerWaalsContact OG1-CG2 3.24Å; T101-I131 WeakPolarHBondContact OG1-CG2 3.44Å; T101-F186 HydrophobicContact CG2-CD2 4.11Å; T101-P189 HydrophobicContact CG2-CG 4.46Å; T101-L190 HydrophobicContact CG2-CB 3.77Å
102M97.2Very high96.9Very high95 Ų9563.6 Ų63.647%0.46833%0.332SS..Hα-helixtrans-62.3-44.1174.3-68.1179.462.800111.7S98 F99 A105 Y106 L190S98-M102 WeakPolarHBondContact O-CG 3.38Å; S98-M102 PolarHBondContact O-N 3.46Å; F99-M102 PolarHBondContact O-N 2.87Å; M102-A105 PolarHBondContact O-N 3.03Å; M102-Y106 WeakPolarHBondContact O-CB 3.28Å; M102-Y106 PolarHBondContact O-N 2.96Å; M102-L190 HydrophobicContact CG-CD1 3.34Å; M102-L190 HydrophobicContact CG-CD2 4.35Å; M102-L190 HydrophobicContact CG-CG 4.49Å; M102-L190 HydrophobicContact SD-CD1 4.11Å
103W97.6Very high96.7Very high165 Ų16560.3 Ų60.363%0.62532%0.323SS*.Hα-helixtrans-63.5-46.3178.5-178.5-96.7000111.8F99 S100 Y106 N107F99-W103 VanDerWaalsContact O-CB 3.27Å; F99-W103 WeakPolarHBondContact O-CB 3.28Å; F99-W103 PolarHBondContact O-N 3.49Å; S100-W103 PolarHBondContact O-N 3.25Å; W103-Y106 PolarHBondContact O-N 3.4Å; W103-N107 PolarHBondContact NE1-ND2 3.06Å; W103-N107 PolarHBondContact O-N 3.42Å; W103-N107 PolarHBondContact O-ND2 3.27Å
104A97Very high96.4Very high1 Ų159.7 Ų59.71%0.00833%0.325CS..Hα-helixtrans-60.9-4717500000111.2S100 T101 Y106 N107 L108 I127 L128 I131S100-A104 VanDerWaalsContact O-CB 3.25Å; S100-A104 WeakPolarHBondContact O-CB 2.88Å; S100-A104 PolarHBondContact O-N 2.9Å; T101-A104 PolarHBondContact O-N 3.02Å; A104-Y106 VanDerWaalsContact C-N 3.34Å; A104-Y106 PolarHBondContact O-N 3.23Å; A104-N107 PolarHBondContact O-N 3.02Å; A104-L108 VanDerWaalsContact O-CB 3.29Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 VanDerWaalsContact O-CG 3.28Å; A104-L108 WeakPolarHBondContact O-CG 3.42Å; A104-L108 PolarHBondContact O-N 2.85Å; A104-I127 HydrophobicContact CB-CD1 4.12Å; A104-I127 HydrophobicContact CB-CG1 4.28Å; A104-I127 HydrophobicContact CB-CG2 3.72Å; A104-L128 HydrophobicContact CB-CD2 3.81Å; A104-I131 HydrophobicContact CB-CD1 3.78Å
105A96.5Very high96.3Very high9 Ų960.8 Ų60.87%0.07433%0.332CS..Hα-helixtrans-59.1-43.7178.200000112T101 M102 G109 Y110 F186T101-A105 VanDerWaalsContact O-CB 3.22Å; T101-A105 WeakPolarHBondContact O-CB 3.32Å; T101-A105 PolarHBondContact O-N 3.09Å; M102-A105 PolarHBondContact O-N 3.03Å; A105-G109 PolarHBondContact O-N 3.1Å; A105-G109 VanDerWaalsContact O-N 3.16Å; A105-Y110 WeakPolarHBondContact O-CB 3.47Å; A105-Y110 PolarHBondContact O-N 3.25Å; A105-F186 HydrophobicContact CB-CD2 3.97Å; A105-F186 HydrophobicContact CB-CE2 3.71Å
106Y96.5Very high96Very high183 Ų18364.4 Ų64.472%0.71835%0.345SS*.Hα-helixtrans-62.3-50177.2178.3-100.1000112.2M102 W103 A104 L108 G109M102-Y106 WeakPolarHBondContact O-CB 3.28Å; M102-Y106 PolarHBondContact O-N 2.96Å; W103-Y106 PolarHBondContact O-N 3.4Å; A104-Y106 VanDerWaalsContact C-N 3.34Å; A104-Y106 PolarHBondContact O-N 3.23Å; Y106-L108 VanDerWaalsContact C-N 3.32Å; Y106-L108 PolarHBondContact O-N 2.82Å; Y106-G109 PolarHBondContact O-N 3.42Å; Y106-G109 VanDerWaalsContact O-N 3.17Å
107N95.9Very high95.7Very high93 Ų9362.4 Ų62.450%0.49734%0.335SS..Hα-helixtrans-69.7-29.2-177-72.2-62.7000113.3W103 A104 G109W103-N107 PolarHBondContact NE1-ND2 3.06Å; W103-N107 PolarHBondContact O-N 3.42Å; W103-N107 PolarHBondContact O-ND2 3.27Å; A104-N107 PolarHBondContact O-N 3.02Å; N107-G109 VanDerWaalsContact C-N 3.3Å
108L95.5Very high95.4Very high46 Ų4663.1 Ų63.124%0.24134%0.34CS..THydrogen-bonded Turntrans-86.80.7176-65.5171.8000113A104 Y106 Y110 N124 I127 L128A104-L108 VanDerWaalsContact O-CB 3.29Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 VanDerWaalsContact O-CG 3.28Å; A104-L108 WeakPolarHBondContact O-CG 3.42Å; A104-L108 PolarHBondContact O-N 2.85Å; Y106-L108 VanDerWaalsContact C-N 3.32Å; Y106-L108 PolarHBondContact O-N 2.82Å; L108-Y110 VanDerWaalsContact C-N 3.3Å; L108-Y110 HydrophobicContact CB-CD1 3.61Å; L108-Y110 HydrophobicContact CB-CE1 3.67Å; L108-Y110 HydrophobicContact CD1-CE1 4.21Å; L108-Y110 PolarHBondContact O-N 3.2Å; L108-N124 HydrophobicContact CD2-CB 3.73Å; L108-I127 HydrophobicContact CD1-CG2 4.49Å; L108-L128 HydrophobicContact CD1-CD1 3.54Å; L108-L128 HydrophobicContact CD1-CD2 4.19Å; L108-L128 HydrophobicContact CD1-CG 3.79Å
109G95Very high95Very high67 Ų6767.3 Ų67.369%0.69136%0.362SS*.THydrogen-bonded Turntrans67.727.7-179.800000113.9A105 Y106 N107 G111A105-G109 PolarHBondContact O-N 3.1Å; A105-G109 VanDerWaalsContact O-N 3.16Å; Y106-G109 PolarHBondContact O-N 3.42Å; Y106-G109 VanDerWaalsContact O-N 3.17Å; N107-G109 VanDerWaalsContact C-N 3.3Å; G109-G111 PolarHBondContact O-N 3.14Å
110Y95Very high94.7Very high38 Ų3862.7 Ų62.715%0.14935%0.347CS..  trans-70.9121.8178.1-78.727.3000109.9A105 L108 V115 L128 G183 F186A105-Y110 WeakPolarHBondContact O-CB 3.47Å; A105-Y110 PolarHBondContact O-N 3.25Å; L108-Y110 VanDerWaalsContact C-N 3.3Å; L108-Y110 HydrophobicContact CB-CD1 3.61Å; L108-Y110 HydrophobicContact CB-CE1 3.67Å; L108-Y110 HydrophobicContact CD1-CE1 4.21Å; L108-Y110 PolarHBondContact O-N 3.2Å; Y110-V115 HydrophobicContact CD1-CG1 3.74Å; Y110-V115 HydrophobicContact CD2-CB 4.3Å; Y110-V115 HydrophobicContact CD2-CG1 3.94Å; Y110-V115 HydrophobicContact CD2-CG2 4.15Å; Y110-V115 HydrophobicContact CE1-CG1 3.52Å; Y110-V115 HydrophobicContact CE2-CB 4.31Å; Y110-V115 HydrophobicContact CE2-CG1 3.73Å; Y110-V115 HydrophobicContact CG-CG1 3.94Å; Y110-V115 HydrophobicContact CG-CG2 4.08Å; Y110-V115 VanDerWaalsContact CZ-CG1 3.49Å; Y110-L128 HydrophobicContact CE2-CD1 4.04Å; Y110-L128 VanDerWaalsContact OH-CD1 3.23Å; Y110-L128 WeakPolarHBondContact OH-CD1 3.48Å; Y110-G183 PolarHBondContact OH-N 3.19Å; Y110-F186 HydrophobicContact CD2-CB 4.27Å; Y110-F186 AromaticContact CD2-CD1 3.73Å; Y110-F186 HydrophobicContact CD2-CD1 3.73Å; Y110-F186 HydrophobicContact CD2-CD2 4.16Å; Y110-F186 HydrophobicContact CD2-CE1 4.03Å; Y110-F186 HydrophobicContact CD2-CE2 4.45Å; Y110-F186 AromaticContact CD2-CG 3.77Å; Y110-F186 HydrophobicContact CD2-CG 3.77Å; Y110-F186 HydrophobicContact CD2-CZ 4.38Å; Y110-F186 HydrophobicContact CE2-CB 4.22Å; Y110-F186 HydrophobicContact CE2-CD1 4.23Å; Y110-F186 HydrophobicContact CE2-CG 4.2Å
111G92.6Very high94.3Very high41 Ų4167.5 Ų67.542%0.42337%0.37SS..  trans-87.1-174.7170.200000113.1G109 G113G109-G111 PolarHBondContact O-N 3.14Å; G111-G113 VanDerWaalsContact C-N 3.25Å
112L93Very high94Very high134 Ų13470.4 Ų70.470%0.70239%0.385SS*.SBendtrans-83.3-0170.8-61178.8000113.5M187 H234 Q237L112-M187 HydrophobicContact CD2-CE 3.73Å; L112-H234 PolarHBondContact O-CD2 3.4Å; L112-Q237 PolarHBondContact O-NE2 3.14Å; L112-Q237 PolarHBondContact O-OE1 3.07Å
113G93.3Very high93.8Very high36 Ų3669.3 Ų69.337%0.37139%0.391SS..SBendtrans-84.4-174.3174.300000112G111 V115 Q237G111-G113 VanDerWaalsContact C-N 3.25Å; G113-V115 PolarHBondContact O-N 3.46Å; G113-Q237 VanDerWaalsContact CA-OE1 3.3Å
114C93.9Very high93.6Very high33 Ų3366.9 Ų66.922%0.22339%0.391CS..  trans-66.9129.6173.3-1680000110.6I184 Q237 T243 C245C114-I184 HydrophobicContact CB-CD1 4.11Å; C114-Q237 VanDerWaalsContact N-OE1 3.1Å; C114-T243 HydrophobicContact CB-CG2 3.8Å; C114-C245 HydrophobicContact CB-CB 3.5Å; C114-C245 WeakPolarHBondContact CB-SG 3.5Å; C114-C245 WeakPolarHBondContact SG-CB 3.37Å; C114-C245 CovalentContact SG-SG 2.03Å; C114-C245 PolarHBondContact SG-SG 3.03Å
115V94.6Very high93.4Very high23 Ų2366.9 Ų66.914%0.13939%0.39CS..  trans-115.4132174.8-173.40000108.6Y110 G113 G183 I184Y110-V115 HydrophobicContact CD1-CG1 3.74Å; Y110-V115 HydrophobicContact CD2-CB 4.3Å; Y110-V115 HydrophobicContact CD2-CG1 3.94Å; Y110-V115 HydrophobicContact CD2-CG2 4.15Å; Y110-V115 HydrophobicContact CE1-CG1 3.52Å; Y110-V115 HydrophobicContact CE2-CB 4.31Å; Y110-V115 HydrophobicContact CE2-CG1 3.73Å; Y110-V115 HydrophobicContact CG-CG1 3.94Å; Y110-V115 HydrophobicContact CG-CG2 4.08Å; Y110-V115 VanDerWaalsContact CZ-CG1 3.49Å; G113-V115 PolarHBondContact O-N 3.46Å; V115-G183 CarbonylContact O-C 3.5Å; V115-G183 WeakPolarHBondContact O-CA 2.91Å; V115-I184 PolarHBondContact O-N 2.76Å
116E93.6Very high93.3Very high100 Ų10069.3 Ų69.347%0.46740%0.402SS..PPolyproline II helixtrans-70.6163.6-179.4-58.1-164.2150.700111.9G183 N246E116-G183 WeakPolarHBondContact O-CA 3.22Å; E116-N246 WeakPolarHBondContact OE1-CB 3.41Å; E116-N246 PolarHBondContact OE1-N 3.04Å
117L92.6Very high93.3Very high54 Ų5463.6 Ų63.628%0.28338%0.383SS..PPolyproline II helixtrans-69.3125175.8-175.670.5000108.3A180 P181 Y247L117-A180 VanDerWaalsContact CD1-CA 3.49Å; L117-A180 HydrophobicContact CD1-CB 3.87Å; L117-A180 HydrophobicContact CD2-CB 4.46Å; L117-P181 WeakPolarHBondContact CD1-O 3.42Å; L117-Y247 HydrophobicContact CB-CD2 3.85Å; L117-Y247 HydrophobicContact CB-CE2 3.88Å; L117-Y247 HydrophobicContact CD1-CE2 3.79Å; L117-Y247 HydrophobicContact CG-CE2 4.45Å
118P91.7Very high93.3Very high19 Ų1959.6 Ų59.612%0.12336%0.362CS..PPolyproline II helixtrans-64.9151-179.526.1-34.2000111.8P120 S125 L128P118-P120 WeakPolarHBondContact O-CD 3.27Å; P118-S125 VanDerWaalsContact CB-CB 3.48Å; P118-L128 HydrophobicContact CG-CD1 4.22Å
119D90.3Very high93.3Very high90 Ų9057.5 Ų57.548%0.48135%0.351SS..PPolyproline II helixtrans-63.2126173-172.4-24.6000109.6N121 D122 S125D119-N121 PolarHBondContact O-N 3.12Å; D119-N121 WeakPolarHBondContact OD1-CB 3.29Å; D119-N121 PolarHBondContact OD1-N 2.68Å; D119-N121 PolarHBondContact OD1-ND2 3.49Å; D119-D122 HydrophobicContact CB-CB 4.36Å; D119-D122 PolarHBondContact O-N 3.02Å; D119-S125 PolarHBondContact O-OG 2.9Å
120P90Very high93.4Very high48 Ų4860.2 Ų60.231%0.31234%0.341SS..THydrogen-bonded Turntrans-58.4-17175.6-25.134.9000115.4P18 R19 P118P18-P120 HydrophobicContact CG-CB 4.36Å; R19-P120 WeakPolarHBondContact CD-O 3.21Å; P118-P120 WeakPolarHBondContact O-CD 3.27Å
121N91.2Very high93.6Very high142 Ų14258.9 Ų58.976%0.75934%0.336SS*.THydrogen-bonded Turntrans-89.8-9.1176.4-53.7-69.4000113.2D119 A123D119-N121 PolarHBondContact O-N 3.12Å; D119-N121 WeakPolarHBondContact OD1-CB 3.29Å; D119-N121 PolarHBondContact OD1-N 2.68Å; D119-N121 PolarHBondContact OD1-ND2 3.49Å; N121-A123 PolarHBondContact O-N 3.42Å
122D91.8Very high93.8Very high61 Ų6157.4 Ų57.433%0.32632%0.321SS..  trans-81.8103.5174.6176.920000110.3D119 N124 S125D119-D122 HydrophobicContact CB-CB 4.36Å; D119-D122 PolarHBondContact O-N 3.02Å; D122-N124 PolarHBondContact O-N 3.34Å; D122-N124 VanDerWaalsContact O-N 3.1Å; D122-N124 WeakPolarHBondContact OD1-CB 3.28Å; D122-N124 PolarHBondContact OD1-N 2.78Å; D122-N124 PolarHBondContact OD1-ND2 2.89Å; D122-S125 WeakPolarHBondContact O-CB 3.29Å; D122-S125 PolarHBondContact O-N 2.82Å; D122-S125 PolarHBondContact O-OG 3.42Å
123A92.4Very high94Very high73 Ų7352.1 Ų52.160%0.60329%0.292SS*.G310 helixtrans-57.3-24.7179.400000113.4N121 S125 D126N121-A123 PolarHBondContact O-N 3.42Å; A123-S125 PolarHBondContact O-N 2.91Å; A123-D126 WeakPolarHBondContact O-CB 3.23Å; A123-D126 PolarHBondContact O-N 3.12Å
124N92.6Very high94.2Very high114 Ų11454.7 Ų54.761%0.6129%0.293SS*.G310 helixtrans-65.8-26.4176.5-60.5-60.9000111.9L108 D122 I127L108-N124 HydrophobicContact CD2-CB 3.73Å; D122-N124 PolarHBondContact O-N 3.34Å; D122-N124 VanDerWaalsContact O-N 3.1Å; D122-N124 WeakPolarHBondContact OD1-CB 3.28Å; D122-N124 PolarHBondContact OD1-N 2.78Å; D122-N124 PolarHBondContact OD1-ND2 2.89Å; N124-I127 WeakPolarHBondContact O-CG2 3.3Å
125S93.3Very high94.4Very high1 Ų153.3 Ų53.31%0.00728%0.283CS..G310 helixtrans-85.3-7.5-179.8730000114R19 P118 D119 D122 A123 I127 L128R19-S125 PolarHBondContact NH1-OG 3.46Å; P118-S125 VanDerWaalsContact CB-CB 3.48Å; D119-S125 PolarHBondContact O-OG 2.9Å; D122-S125 WeakPolarHBondContact O-CB 3.29Å; D122-S125 PolarHBondContact O-N 2.82Å; D122-S125 PolarHBondContact O-OG 3.42Å; A123-S125 PolarHBondContact O-N 2.91Å; S125-I127 PolarHBondContact O-N 2.9Å; S125-L128 VanDerWaalsContact O-CB 3.31Å; S125-L128 WeakPolarHBondContact O-CB 3.24Å; S125-L128 PolarHBondContact O-N 2.84Å
126D94.7Very high94.6Very high60 Ų6052.2 Ų52.232%0.32128%0.276SS..Hα-helixtrans-60.3-30.8-179.8-71.1-7.1000112.5R19 A123 L128 V129 W130R19-D126 WeakPolarHBondContact CD-OD1 3.24Å; R19-D126 IonicContact CZ-OD1 3.93Å; R19-D126 IonicContact NE-OD1 2.98Å; R19-D126 IonicContact NH1-OD1 3.3Å; R19-D126 PolarHBondContact NH1-OD1 3.45Å; A123-D126 WeakPolarHBondContact O-CB 3.23Å; A123-D126 PolarHBondContact O-N 3.12Å; D126-L128 PolarHBondContact O-N 2.63Å; D126-V129 WeakPolarHBondContact O-CB 3.4Å; D126-V129 PolarHBondContact O-N 3.28Å; D126-V129 VanDerWaalsContact O-N 3.1Å; D126-W130 PolarHBondContact O-N 3.22Å; D126-W130 VanDerWaalsContact O-N 3.1Å
127I96Very high94.8Very high63 Ų6351.3 Ų51.332%0.32327%0.271SS..Hα-helixtrans-58.2-35.6174.1-169.2169.4000112A104 L108 N124 S125 V129 W130 I131A104-I127 HydrophobicContact CB-CD1 4.12Å; A104-I127 HydrophobicContact CB-CG1 4.28Å; A104-I127 HydrophobicContact CB-CG2 3.72Å; L108-I127 HydrophobicContact CD1-CG2 4.49Å; N124-I127 WeakPolarHBondContact O-CG2 3.3Å; S125-I127 PolarHBondContact O-N 2.9Å; I127-V129 VanDerWaalsContact C-N 3.32Å; I127-V129 PolarHBondContact O-N 3.44Å; I127-W130 PolarHBondContact O-N 2.76Å; I127-I131 HydrophobicContact CG1-CD1 3.89Å; I127-I131 HydrophobicContact CG1-CG1 4.44Å; I127-I131 WeakPolarHBondContact O-CB 3.37Å; I127-I131 WeakPolarHBondContact O-CD1 3.16Å; I127-I131 WeakPolarHBondContact O-CG1 3.42Å; I127-I131 PolarHBondContact O-N 2.92Å
128L96.3Very high95Very high8 Ų848.8 Ų48.84%0.04226%0.258CS..Hα-helixtrans-68.7-33.6178.3-61.5174000111.6A104 L108 Y110 P118 S125 D126 G132A104-L128 HydrophobicContact CB-CD2 3.81Å; L108-L128 HydrophobicContact CD1-CD1 3.54Å; L108-L128 HydrophobicContact CD1-CD2 4.19Å; L108-L128 HydrophobicContact CD1-CG 3.79Å; Y110-L128 HydrophobicContact CE2-CD1 4.04Å; Y110-L128 VanDerWaalsContact OH-CD1 3.23Å; Y110-L128 WeakPolarHBondContact OH-CD1 3.48Å; P118-L128 HydrophobicContact CG-CD1 4.22Å; S125-L128 VanDerWaalsContact O-CB 3.31Å; S125-L128 WeakPolarHBondContact O-CB 3.24Å; S125-L128 PolarHBondContact O-N 2.84Å; D126-L128 PolarHBondContact O-N 2.63Å; L128-G132 PolarHBondContact O-N 2.89Å
129V96.2Very high95.3Very high3 Ų347.9 Ų47.92%0.01825%0.252CS..Hα-helixtrans-65.8-47.9174.7-178.80000110.3R19 L20 D126 I127 I131 G132 Y133 P181R19-V129 HydrophobicContact CB-CG1 4.29Å; R19-V129 HydrophobicContact CB-CG2 4.47Å; L20-V129 HydrophobicContact CD1-CG1 4.07Å; L20-V129 HydrophobicContact CD2-CG1 3.43Å; L20-V129 VanDerWaalsContact CD2-CG1 3.43Å; L20-V129 HydrophobicContact CG-CG1 3.48Å; L20-V129 VanDerWaalsContact CG-CG1 3.48Å; D126-V129 WeakPolarHBondContact O-CB 3.4Å; D126-V129 PolarHBondContact O-N 3.28Å; D126-V129 VanDerWaalsContact O-N 3.1Å; I127-V129 VanDerWaalsContact C-N 3.32Å; I127-V129 PolarHBondContact O-N 3.44Å; V129-I131 PolarHBondContact O-N 2.83Å; V129-G132 PolarHBondContact O-N 2.63Å; V129-Y133 WeakPolarHBondContact O-CB 3.37Å; V129-Y133 PolarHBondContact O-N 3.41Å; V129-P181 HydrophobicContact CG2-CB 4.08Å; V129-P181 HydrophobicContact CG2-CG 3.98Å
130W97Very high95.6Very high124 Ų12444.7 Ų44.747%0.4723%0.234SC..Hα-helixtrans-60.6-45.1175.6-81104.9000112.2F23 D126 I127 G132 Y133 F134F23-W130 HydrophobicContact CD1-CZ3 4.31Å; F23-W130 AromaticContact CE1-CD2 3.78Å; F23-W130 HydrophobicContact CE1-CD2 3.78Å; F23-W130 AromaticContact CE1-CE3 3.45Å; F23-W130 HydrophobicContact CE1-CE3 3.45Å; F23-W130 VanDerWaalsContact CE1-CE3 3.45Å; F23-W130 AromaticContact CE1-CH2 3.74Å; F23-W130 HydrophobicContact CE1-CH2 3.74Å; F23-W130 HydrophobicContact CE1-CZ2 4.05Å; F23-W130 AromaticContact CE1-CZ3 3.42Å; F23-W130 HydrophobicContact CE1-CZ3 3.42Å; F23-W130 VanDerWaalsContact CE1-CZ3 3.42Å; F23-W130 HydrophobicContact CE2-CH2 4.22Å; F23-W130 HydrophobicContact CE2-CZ2 4.06Å; F23-W130 AromaticContact CZ-CD2 3.63Å; F23-W130 HydrophobicContact CZ-CD2 3.63Å; F23-W130 AromaticContact CZ-CE2 3.43Å; F23-W130 VanDerWaalsContact CZ-CE2 3.43Å; F23-W130 AromaticContact CZ-CE3 3.74Å; F23-W130 HydrophobicContact CZ-CE3 3.74Å; F23-W130 HydrophobicContact CZ-CG 4.39Å; F23-W130 AromaticContact CZ-CH2 3.5Å; F23-W130 HydrophobicContact CZ-CH2 3.5Å; F23-W130 AromaticContact CZ-CZ2 3.38Å; F23-W130 HydrophobicContact CZ-CZ2 3.38Å; F23-W130 AromaticContact CZ-CZ3 3.68Å; F23-W130 HydrophobicContact CZ-CZ3 3.68Å; D126-W130 PolarHBondContact O-N 3.22Å; D126-W130 VanDerWaalsContact O-N 3.1Å; I127-W130 PolarHBondContact O-N 2.76Å; W130-G132 PolarHBondContact O-N 3.13Å; W130-Y133 HydrophobicContact CE3-CD1 4.5Å; W130-Y133 PolarHBondContact O-N 2.92Å; W130-F134 HydrophobicContact CB-CD2 4.47Å; W130-F134 HydrophobicContact CB-CE2 4.32Å; W130-F134 HydrophobicContact CD2-CE2 4.46Å; W130-F134 HydrophobicContact CE3-CD2 4.47Å; W130-F134 AromaticContact CE3-CE2 3.65Å; W130-F134 HydrophobicContact CE3-CE2 3.65Å; W130-F134 AromaticContact CE3-CZ 3.81Å; W130-F134 HydrophobicContact CE3-CZ 3.81Å; W130-F134 HydrophobicContact CZ3-CE2 4.41Å; W130-F134 HydrophobicContact CZ3-CZ 4.1Å; W130-F134 WeakPolarHBondContact O-CD2 3.47Å; W130-F134 PolarHBondContact O-N 2.85Å
131I98.1Very high96Very high10 Ų1044.5 Ų44.55%0.05123%0.231CC..Hα-helixtrans-58-48.7174.7-73.5161.9000110.6I97 S100 T101 A104 I127 V129 Y133 F134 F135 P189I97-I131 HydrophobicContact CG2-CG2 4.32Å; S100-I131 WeakPolarHBondContact O-CD1 3.27Å; T101-I131 VanDerWaalsContact OG1-CG2 3.24Å; T101-I131 WeakPolarHBondContact OG1-CG2 3.44Å; A104-I131 HydrophobicContact CB-CD1 3.78Å; I127-I131 HydrophobicContact CG1-CD1 3.89Å; I127-I131 HydrophobicContact CG1-CG1 4.44Å; I127-I131 WeakPolarHBondContact O-CB 3.37Å; I127-I131 WeakPolarHBondContact O-CD1 3.16Å; I127-I131 WeakPolarHBondContact O-CG1 3.42Å; I127-I131 PolarHBondContact O-N 2.92Å; V129-I131 PolarHBondContact O-N 2.83Å; I131-Y133 VanDerWaalsContact C-N 3.3Å; I131-Y133 PolarHBondContact O-N 3.19Å; I131-F134 PolarHBondContact O-N 3.16Å; I131-F135 VanDerWaalsContact O-CB 3.24Å; I131-F135 WeakPolarHBondContact O-CB 3.49Å; I131-F135 PolarHBondContact O-N 2.88Å; I131-P189 HydrophobicContact CG2-CG 4.5Å
132G97.3Very high96.3Very high10 Ų1037.8 Ų37.810%0.10320%0.195CC..Hα-helixtrans-58.3-43.1177.600000111.8L128 V129 W130 F135 Y136 V177L128-G132 PolarHBondContact O-N 2.89Å; V129-G132 PolarHBondContact O-N 2.63Å; W130-G132 PolarHBondContact O-N 3.13Å; G132-F135 PolarHBondContact O-N 2.91Å; G132-Y136 WeakPolarHBondContact O-CB 3.38Å; G132-Y136 PolarHBondContact O-N 3.11Å; G132-V177 WeakPolarHBondContact O-CG2 3.47Å
133Y97.6Very high96.6Very high23 Ų2335.6 Ų35.69%0.0918%0.183CC..Hα-helixtrans-63.8-49.3176.5178-110.7000113F23 P24 M26 V129 W130 I131 F135 Y136 F137F23-Y133 HydrophobicContact CB-CD2 4.27Å; F23-Y133 HydrophobicContact CB-CE2 4.07Å; F23-Y133 AromaticContact CD1-CD1 3.55Å; F23-Y133 HydrophobicContact CD1-CD1 3.55Å; F23-Y133 AromaticContact CD1-CD2 3.59Å; F23-Y133 HydrophobicContact CD1-CD2 3.59Å; F23-Y133 AromaticContact CD1-CE1 3.89Å; F23-Y133 HydrophobicContact CD1-CE1 3.89Å; F23-Y133 AromaticContact CD1-CE2 3.93Å; F23-Y133 HydrophobicContact CD1-CE2 3.93Å; F23-Y133 AromaticContact CD1-CG 3.36Å; F23-Y133 HydrophobicContact CD1-CG 3.36Å; F23-Y133 AromaticContact CE1-CD1 3.8Å; F23-Y133 HydrophobicContact CE1-CD1 3.8Å; F23-Y133 HydrophobicContact CE1-CD2 4.42Å; F23-Y133 HydrophobicContact CE1-CE1 4.44Å; F23-Y133 AromaticContact CE1-CG 3.77Å; F23-Y133 HydrophobicContact CE1-CG 3.77Å; F23-Y133 HydrophobicContact CG-CD2 4.42Å; P24-Y133 WeakPolarHBondContact CD-OH 3.49Å; P24-Y133 WeakPolarHBondContact O-CE2 3.44Å; P24-Y133 PolarHBondContact O-OH 3.34Å; M26-Y133 HydrophobicContact CG-CD2 3.81Å; M26-Y133 HydrophobicContact CG-CE2 3.85Å; M26-Y133 HydrophobicContact SD-CD2 4.26Å; V129-Y133 WeakPolarHBondContact O-CB 3.37Å; V129-Y133 PolarHBondContact O-N 3.41Å; W130-Y133 HydrophobicContact CE3-CD1 4.5Å; W130-Y133 PolarHBondContact O-N 2.92Å; I131-Y133 VanDerWaalsContact C-N 3.3Å; I131-Y133 PolarHBondContact O-N 3.19Å; Y133-F135 PolarHBondContact O-N 3.49Å; Y133-Y136 HydrophobicContact CD2-CD1 4.37Å; Y133-Y136 HydrophobicContact CE2-CD1 4.44Å; Y133-Y136 WeakPolarHBondContact O-CB 3.45Å; Y133-Y136 PolarHBondContact O-N 3.36Å; Y133-F137 PolarHBondContact O-N 3.14Å
134F98.1Very high96.8Very high89 Ų8935.8 Ų35.839%0.3917%0.173SC..Hα-helixtrans-63.2-34178.2-73.5-55.2000112.1Y93 I97 W130 I131 F137 S138Y93-F134 WeakPolarHBondContact CE1-O 3.21Å; Y93-F134 WeakPolarHBondContact OH-CA 3.3Å; Y93-F134 WeakPolarHBondContact OH-CD1 3.25Å; Y93-F134 PolarHBondContact OH-O 3.25Å; I97-F134 HydrophobicContact CD1-CB 4.33Å; I97-F134 HydrophobicContact CG1-CB 4.28Å; W130-F134 HydrophobicContact CB-CD2 4.47Å; W130-F134 HydrophobicContact CB-CE2 4.32Å; W130-F134 HydrophobicContact CD2-CE2 4.46Å; W130-F134 HydrophobicContact CE3-CD2 4.47Å; W130-F134 AromaticContact CE3-CE2 3.65Å; W130-F134 HydrophobicContact CE3-CE2 3.65Å; W130-F134 AromaticContact CE3-CZ 3.81Å; W130-F134 HydrophobicContact CE3-CZ 3.81Å; W130-F134 HydrophobicContact CZ3-CE2 4.41Å; W130-F134 HydrophobicContact CZ3-CZ 4.1Å; W130-F134 WeakPolarHBondContact O-CD2 3.47Å; W130-F134 PolarHBondContact O-N 2.85Å; I131-F134 PolarHBondContact O-N 3.16Å; F134-F137 PolarHBondContact O-N 3.43Å; F134-S138 PolarHBondContact O-N 3.15Å
135F98.3Very high96.9Very high4 Ų430.8 Ų30.82%0.01815%0.146CC..Hα-helixtrans-67.5-44.7172.9-179.8-111.2000112.6I97 I131 G132 Y133 F137 S138 K139 I173 F188 P189 N192I97-F135 HydrophobicContact CG2-CB 4.32Å; I97-F135 HydrophobicContact CG2-CD2 4.41Å; I131-F135 VanDerWaalsContact O-CB 3.24Å; I131-F135 WeakPolarHBondContact O-CB 3.49Å; I131-F135 PolarHBondContact O-N 2.88Å; G132-F135 PolarHBondContact O-N 2.91Å; Y133-F135 PolarHBondContact O-N 3.49Å; F135-F137 VanDerWaalsContact C-N 3.29Å; F135-F137 PolarHBondContact O-N 2.97Å; F135-S138 VanDerWaalsContact O-CB 3.29Å; F135-S138 WeakPolarHBondContact O-CB 3.34Å; F135-S138 PolarHBondContact O-N 3.32Å; F135-S138 VanDerWaalsContact O-N 3.16Å; F135-S138 PolarHBondContact O-OG 3.3Å; F135-K139 VanDerWaalsContact CE2-CE 3.4Å; F135-K139 VanDerWaalsContact CZ-CE 3.44Å; F135-K139 PolarHBondContact O-N 3.44Å; F135-I173 HydrophobicContact CD1-CG1 4.49Å; F135-I173 HydrophobicContact CD1-CG2 3.64Å; F135-I173 HydrophobicContact CE1-CD1 3.99Å; F135-I173 HydrophobicContact CE1-CG1 3.9Å; F135-I173 HydrophobicContact CE1-CG2 3.87Å; F135-F188 AromaticContact CE1-CD1 3.54Å; F135-F188 HydrophobicContact CE1-CD1 3.54Å; F135-F188 AromaticContact CE1-CE1 3.51Å; F135-F188 HydrophobicContact CE1-CE1 3.51Å; F135-F188 AromaticContact CZ-CD1 3.73Å; F135-F188 HydrophobicContact CZ-CD1 3.73Å; F135-F188 AromaticContact CZ-CE1 3.51Å; F135-F188 HydrophobicContact CZ-CE1 3.51Å; F135-P189 HydrophobicContact CB-CB 4.13Å; F135-P189 HydrophobicContact CD1-CB 3.93Å; F135-P189 HydrophobicContact CD2-CB 3.81Å; F135-P189 HydrophobicContact CE1-CB 4.27Å; F135-P189 HydrophobicContact CE2-CB 4.15Å; F135-P189 HydrophobicContact CG-CB 3.68Å; F135-P189 HydrophobicContact CZ-CB 4.37Å; F135-N192 HydrophobicContact CE2-CB 4.11Å; F135-N192 HydrophobicContact CZ-CB 4.13Å
136Y97.8Very high97.1Very high0 Ų030.7 Ų30.70%015%0.146CC..Hα-helixtrans-55.7-46.5171162-105.1000111.3L25 M26 T32 G132 Y133 S138 K139 L140 W174L25-Y136 HydrophobicContact CB-CE1 4.19Å; M26-Y136 HydrophobicContact SD-CD1 4.02Å; M26-Y136 HydrophobicContact SD-CE1 4.12Å; T32-Y136 HydrophobicContact CG2-CE2 3.94Å; T32-Y136 PolarHBondContact OG1-OH 3.18Å; G132-Y136 WeakPolarHBondContact O-CB 3.38Å; G132-Y136 PolarHBondContact O-N 3.11Å; Y133-Y136 HydrophobicContact CD2-CD1 4.37Å; Y133-Y136 HydrophobicContact CE2-CD1 4.44Å; Y133-Y136 WeakPolarHBondContact O-CB 3.45Å; Y133-Y136 PolarHBondContact O-N 3.36Å; Y136-S138 VanDerWaalsContact C-N 3.3Å; Y136-S138 PolarHBondContact O-N 3.29Å; Y136-K139 PolarHBondContact O-N 3.26Å; Y136-K139 VanDerWaalsContact O-N 3.14Å; Y136-L140 HydrophobicContact CE1-CD1 3.8Å; Y136-L140 HydrophobicContact CE2-CD1 4.37Å; Y136-L140 HydrophobicContact CE2-CG 4.4Å; Y136-L140 PolarHBondContact O-N 3.28Å; Y136-W174 HydrophobicContact CD2-CB 4.09Å; Y136-W174 HydrophobicContact CE2-CB 3.83Å; Y136-W174 AromaticContact CE2-CD1 3.74Å; Y136-W174 HydrophobicContact CE2-CG 4.22Å; Y136-W174 AromaticContact CZ-CD1 3.72Å
137F97Very high97.1Very high82 Ų8230.2 Ų30.236%0.3615%0.145SC..Hα-helixtrans-64.9-35.5178.3-162-105000112.1Y133 F134 F135 K139 L140 I141Y133-F137 PolarHBondContact O-N 3.14Å; F134-F137 PolarHBondContact O-N 3.43Å; F135-F137 VanDerWaalsContact C-N 3.29Å; F135-F137 PolarHBondContact O-N 2.97Å; F137-K139 VanDerWaalsContact C-N 3.28Å; F137-K139 PolarHBondContact O-N 3.02Å; F137-L140 HydrophobicContact CD2-CD1 4.2Å; F137-L140 WeakPolarHBondContact O-CB 3.47Å; F137-L140 PolarHBondContact O-N 3.21Å; F137-L140 VanDerWaalsContact O-N 3.15Å; F137-I141 HydrophobicContact CD1-CD1 3.65Å; F137-I141 HydrophobicContact CD1-CG1 4.15Å; F137-I141 HydrophobicContact CE1-CD1 3.68Å; F137-I141 HydrophobicContact CE1-CG1 4.04Å; F137-I141 WeakPolarHBondContact O-CG1 3.36Å; F137-I141 PolarHBondContact O-N 3.42Å; F137-I141 VanDerWaalsContact O-N 3.11Å
138S97.9Very high97Very high0 Ų028.3 Ų28.30%014%0.135CC..Hα-helixtrans-53.1-49.2171.5107.40000110.1Y93 F134 F135 Y136 L140 I141 E142Y93-S138 VanDerWaalsContact CE1-CB 3.48Å; F134-S138 PolarHBondContact O-N 3.15Å; F135-S138 VanDerWaalsContact O-CB 3.29Å; F135-S138 WeakPolarHBondContact O-CB 3.34Å; F135-S138 PolarHBondContact O-N 3.32Å; F135-S138 VanDerWaalsContact O-N 3.16Å; F135-S138 PolarHBondContact O-OG 3.3Å; Y136-S138 VanDerWaalsContact C-N 3.3Å; Y136-S138 PolarHBondContact O-N 3.29Å; S138-L140 PolarHBondContact O-N 3.32Å; S138-I141 WeakPolarHBondContact O-CA 3.49Å; S138-I141 WeakPolarHBondContact O-CB 3.4Å; S138-I141 PolarHBondContact O-N 3.29Å; S138-E142 VanDerWaalsContact O-CG 3.25Å; S138-E142 WeakPolarHBondContact O-CG 3.26Å; S138-E142 PolarHBondContact O-N 3.02Å; S138-E142 PolarHBondContact OG-OE1 2.88Å
139K97.9Very high96.8Very high1 Ų128.6 Ų28.60%0.00414%0.135CC..Hα-helixtrans-63.5-28.1-177.8-59-45177.8-169.10114F135 Y136 F137 E142 P170 I173 N192 H196F135-K139 VanDerWaalsContact CE2-CE 3.4Å; F135-K139 VanDerWaalsContact CZ-CE 3.44Å; F135-K139 PolarHBondContact O-N 3.44Å; Y136-K139 PolarHBondContact O-N 3.26Å; Y136-K139 VanDerWaalsContact O-N 3.14Å; F137-K139 VanDerWaalsContact C-N 3.28Å; F137-K139 PolarHBondContact O-N 3.02Å; K139-E142 WeakPolarHBondContact CD-OE2 3.08Å; K139-E142 IonicContact NZ-OE1 2.88Å; K139-E142 PolarHBondContact NZ-OE1 3.28Å; K139-E142 IonicContact NZ-OE2 3.9Å; K139-E142 PolarHBondContact NZ-OE2 2.89Å; K139-P170 HydrophobicContact CB-CB 4.36Å; K139-P170 HydrophobicContact CB-CG 4.08Å; K139-I173 HydrophobicContact CG-CG1 4.17Å; K139-N192 VanDerWaalsContact CE-OD1 3.32Å; K139-N192 WeakPolarHBondContact CE-OD1 3.44Å; K139-N192 PolarHBondContact NZ-OD1 2.87Å; K139-H196 PolarHBondContact NZ-NE2 3.48Å
140L97.3Very high96.6Very high22 Ų2228.6 Ų28.612%0.11514%0.135CC..Hα-helixtrans-70.9-42.7170.9-64.2176000111.8L25 I35 Y136 F137 S138 E142 L143 P170L25-L140 HydrophobicContact CD1-CD1 3.84Å; I35-L140 HydrophobicContact CD1-CD2 4.46Å; I35-L140 HydrophobicContact CG2-CD2 4.18Å; Y136-L140 HydrophobicContact CE1-CD1 3.8Å; Y136-L140 HydrophobicContact CE2-CD1 4.37Å; Y136-L140 HydrophobicContact CE2-CG 4.4Å; Y136-L140 PolarHBondContact O-N 3.28Å; F137-L140 HydrophobicContact CD2-CD1 4.2Å; F137-L140 WeakPolarHBondContact O-CB 3.47Å; F137-L140 PolarHBondContact O-N 3.21Å; F137-L140 VanDerWaalsContact O-N 3.15Å; S138-L140 PolarHBondContact O-N 3.32Å; L140-E142 VanDerWaalsContact C-N 3.32Å; L140-E142 PolarHBondContact O-N 2.94Å; L140-L143 VanDerWaalsContact O-CB 3.31Å; L140-L143 WeakPolarHBondContact O-CB 3.33Å; L140-L143 VanDerWaalsContact O-CG 3.32Å; L140-L143 WeakPolarHBondContact O-CG 3.13Å; L140-L143 PolarHBondContact O-N 3.26Å; L140-P170 HydrophobicContact CD2-CB 3.74Å; L140-P170 HydrophobicContact CD2-CG 4.29Å; L140-P170 HydrophobicContact CG-CB 4.49Å
141I97.6Very high96.3Very high45 Ų4527.5 Ų27.523%0.23113%0.131CC..Hα-helixtrans-63.7-40177.4-62.1168.6000110.7Y86 M90 F137 S138 L143 L144Y86-I141 HydrophobicContact CE2-CG2 3.92Å; M90-I141 HydrophobicContact CE-CG2 4.34Å; M90-I141 HydrophobicContact SD-CB 4.31Å; M90-I141 HydrophobicContact SD-CG2 3.53Å; M90-I141 VanDerWaalsContact SD-CG2 3.53Å; F137-I141 HydrophobicContact CD1-CD1 3.65Å; F137-I141 HydrophobicContact CD1-CG1 4.15Å; F137-I141 HydrophobicContact CE1-CD1 3.68Å; F137-I141 HydrophobicContact CE1-CG1 4.04Å; F137-I141 WeakPolarHBondContact O-CG1 3.36Å; F137-I141 PolarHBondContact O-N 3.42Å; F137-I141 VanDerWaalsContact O-N 3.11Å; S138-I141 WeakPolarHBondContact O-CA 3.49Å; S138-I141 WeakPolarHBondContact O-CB 3.4Å; S138-I141 PolarHBondContact O-N 3.29Å; I141-L143 PolarHBondContact O-N 3.45Å; I141-L144 HydrophobicContact CG2-CD1 4.36Å; I141-L144 VanDerWaalsContact O-CB 3.24Å; I141-L144 WeakPolarHBondContact O-CB 3.3Å; I141-L144 WeakPolarHBondContact O-CG 3.22Å; I141-L144 PolarHBondContact O-N 3.19Å
142E98Very high95.8Very high1 Ų131.9 Ų31.91%0.00515%0.147CC..THydrogen-bonded Turntrans-59.5-18.5179.6-66.1177.7-165.800113.2M90 S138 K139 L140 L144 D145 H166 H196 Y200M90-E142 HydrophobicContact CE-CG 3.47Å; M90-E142 VanDerWaalsContact CE-CG 3.47Å; S138-E142 VanDerWaalsContact O-CG 3.25Å; S138-E142 WeakPolarHBondContact O-CG 3.26Å; S138-E142 PolarHBondContact O-N 3.02Å; S138-E142 PolarHBondContact OG-OE1 2.88Å; K139-E142 WeakPolarHBondContact CD-OE2 3.08Å; K139-E142 IonicContact NZ-OE1 2.88Å; K139-E142 PolarHBondContact NZ-OE1 3.28Å; K139-E142 IonicContact NZ-OE2 3.9Å; K139-E142 PolarHBondContact NZ-OE2 2.89Å; L140-E142 VanDerWaalsContact C-N 3.32Å; L140-E142 PolarHBondContact O-N 2.94Å; E142-L144 PolarHBondContact O-N 3.14Å; E142-L144 VanDerWaalsContact O-N 3.17Å; E142-D145 VanDerWaalsContact O-CB 3.27Å; E142-D145 WeakPolarHBondContact O-CB 3.39Å; E142-D145 VanDerWaalsContact O-CG 3.3Å; E142-D145 PolarHBondContact O-N 2.84Å; E142-H166 PolarHBondContact O-CE1 3.04Å; E142-H166 PolarHBondContact O-ND1 3.25Å; E142-H196 IonicContact OE1-CD2 3.46Å; E142-H196 PolarHBondContact OE1-CD2 3.35Å; E142-H196 IonicContact OE1-NE2 3.85Å; E142-H196 IonicContact OE2-CD2 3.6Å; E142-H196 IonicContact OE2-NE2 2.78Å; E142-H196 PolarHBondContact OE2-NE2 3Å; E142-Y200 VanDerWaalsContact CG-OH 3.27Å; E142-Y200 WeakPolarHBondContact CG-OH 3.24Å
143L97.2Very high95.2Very high14 Ų1433.5 Ų33.57%0.07316%0.164CC..THydrogen-bonded Turntrans-60-23.2171.5-59.6-180000112.5I35 Y39 L140 I141 D145 T146 H166 P170I35-L143 HydrophobicContact CG2-CD1 3.77Å; Y39-L143 HydrophobicContact CD1-CD2 4.19Å; Y39-L143 HydrophobicContact CD2-CB 4.01Å; Y39-L143 HydrophobicContact CD2-CD2 4Å; Y39-L143 HydrophobicContact CD2-CG 4.41Å; Y39-L143 HydrophobicContact CE1-CD2 4.25Å; Y39-L143 HydrophobicContact CE2-CB 4.2Å; Y39-L143 HydrophobicContact CE2-CD2 4.04Å; Y39-L143 HydrophobicContact CG-CD1 4.49Å; Y39-L143 HydrophobicContact CG-CD2 4.08Å; L140-L143 VanDerWaalsContact O-CB 3.31Å; L140-L143 WeakPolarHBondContact O-CB 3.33Å; L140-L143 VanDerWaalsContact O-CG 3.32Å; L140-L143 WeakPolarHBondContact O-CG 3.13Å; L140-L143 PolarHBondContact O-N 3.26Å; I141-L143 PolarHBondContact O-N 3.45Å; L143-D145 PolarHBondContact O-N 3.49Å; L143-T146 PolarHBondContact O-N 3.37Å; L143-H166 HydrophobicContact CD2-CB 3.9Å; L143-H166 VanDerWaalsContact CD2-O 3.26Å; L143-H166 WeakPolarHBondContact CD2-O 3.32Å; L143-P170 HydrophobicContact CD2-CG 4.34Å
144L96.3Very high94.6Very high78 Ų7834.6 Ų34.641%0.40817%0.169SC..Hα-helixtrans-67.5-19.3175-63.9177.5000112.9Y86 I141 E142 T146 V147 F148Y86-L144 HydrophobicContact CE2-CB 4.03Å; Y86-L144 HydrophobicContact CE2-CD1 4.22Å; I141-L144 HydrophobicContact CG2-CD1 4.36Å; I141-L144 VanDerWaalsContact O-CB 3.24Å; I141-L144 WeakPolarHBondContact O-CB 3.3Å; I141-L144 WeakPolarHBondContact O-CG 3.22Å; I141-L144 PolarHBondContact O-N 3.19Å; E142-L144 PolarHBondContact O-N 3.14Å; E142-L144 VanDerWaalsContact O-N 3.17Å; L144-T146 VanDerWaalsContact C-N 3.26Å; L144-T146 PolarHBondContact O-N 3.43Å; L144-V147 HydrophobicContact CD2-CG2 4.26Å; L144-V147 WeakPolarHBondContact O-CA 3.41Å; L144-V147 WeakPolarHBondContact O-CB 3.37Å; L144-V147 PolarHBondContact O-N 2.66Å; L144-F148 HydrophobicContact CB-CD2 4.4Å; L144-F148 HydrophobicContact CB-CE2 4.16Å; L144-F148 WeakPolarHBondContact O-CD2 3.4Å; L144-F148 PolarHBondContact O-N 3.39Å
145D96.3Very high94.1Very high8 Ų831.3 Ų31.34%0.04316%0.156CC..Hα-helixtrans-54.5-47.4174.7-70.9-16.3000110.6Y86 E142 L143 V147 F148 F149 H166 Y200Y86-D145 WeakPolarHBondContact CE1-OD1 3.5Å; Y86-D145 PolarHBondContact OH-OD1 2.92Å; E142-D145 VanDerWaalsContact O-CB 3.27Å; E142-D145 WeakPolarHBondContact O-CB 3.39Å; E142-D145 VanDerWaalsContact O-CG 3.3Å; E142-D145 PolarHBondContact O-N 2.84Å; L143-D145 PolarHBondContact O-N 3.49Å; D145-V147 VanDerWaalsContact C-N 3.3Å; D145-V147 PolarHBondContact O-N 3.22Å; D145-F148 PolarHBondContact O-N 3.01Å; D145-F149 WeakPolarHBondContact O-CD1 3.18Å; D145-F149 VanDerWaalsContact O-CG 3.27Å; D145-F149 WeakPolarHBondContact O-CG 3.38Å; D145-F149 PolarHBondContact O-N 2.92Å; D145-H166 IonicContact OD2-CE1 3.78Å; D145-Y200 WeakPolarHBondContact OD1-CE1 3.24Å; D145-Y200 PolarHBondContact OD1-OH 3.3Å; D145-Y200 PolarHBondContact OD2-OH 3.29Å
146T96.2Very high93.5Very high0 Ų034.2 Ų34.20%017%0.171CC..Hα-helixtrans-64.6-35.9177.7-45.40000112.1Y39 V43 L143 L144 F149 L150 V158 H162Y39-T146 HydrophobicContact CE2-CG2 4.33Å; Y39-T146 WeakPolarHBondContact CE2-OG1 3.45Å; Y39-T146 PolarHBondContact OH-OG1 3.17Å; V43-T146 HydrophobicContact CB-CG2 4.3Å; V43-T146 HydrophobicContact CG1-CG2 3.74Å; V43-T146 HydrophobicContact CG2-CG2 3.5Å; L143-T146 PolarHBondContact O-N 3.37Å; L144-T146 VanDerWaalsContact C-N 3.26Å; L144-T146 PolarHBondContact O-N 3.43Å; T146-F149 PolarHBondContact O-N 3.23Å; T146-L150 HydrophobicContact CG2-CD1 4.06Å; T146-L150 HydrophobicContact CG2-CG 4.38Å; T146-L150 WeakPolarHBondContact O-CB 3.37Å; T146-L150 VanDerWaalsContact O-CG 3.32Å; T146-L150 WeakPolarHBondContact O-CG 3.37Å; T146-L150 PolarHBondContact O-N 3.43Å; T146-V158 HydrophobicContact CG2-CG1 3.81Å; T146-V158 HydrophobicContact CG2-CG2 4.09Å; T146-H162 PolarHBondContact OG1-CE1 3.46Å; T146-H162 PolarHBondContact OG1-ND1 3.42Å
147V94.2Very high93.1Very high50 Ų5036.4 Ų36.430%0.30318%0.181SC..Hα-helixtrans-62.2-46.9176.2174.80000109.8W46 L144 D145 F149 L150 W151W46-V147 HydrophobicContact CH2-CG1 4.09Å; W46-V147 HydrophobicContact CZ3-CB 4.4Å; W46-V147 HydrophobicContact CZ3-CG1 3.96Å; L144-V147 HydrophobicContact CD2-CG2 4.26Å; L144-V147 WeakPolarHBondContact O-CA 3.41Å; L144-V147 WeakPolarHBondContact O-CB 3.37Å; L144-V147 PolarHBondContact O-N 2.66Å; D145-V147 VanDerWaalsContact C-N 3.3Å; D145-V147 PolarHBondContact O-N 3.22Å; V147-F149 PolarHBondContact O-N 3.12Å; V147-L150 PolarHBondContact O-N 3.22Å; V147-W151 VanDerWaalsContact O-CB 3.24Å; V147-W151 WeakPolarHBondContact O-CB 3.39Å; V147-W151 PolarHBondContact O-N 3.07Å
148F93.9Very high92.9Very high23 Ų2332.5 Ų32.510%0.10117%0.165CC..Hα-helixtrans-64-39.3176.6-72.3-62.4000112.5L82 M83 Y86 L144 D145 W151 R152L82-F148 HydrophobicContact CB-CE1 3.95Å; L82-F148 HydrophobicContact CB-CZ 4.46Å; M83-F148 HydrophobicContact CE-CB 4.43Å; M83-F148 HydrophobicContact CG-CB 4.08Å; M83-F148 HydrophobicContact CG-CD1 3.64Å; M83-F148 HydrophobicContact CG-CE1 4.24Å; M83-F148 HydrophobicContact CG-CG 3.9Å; M83-F148 HydrophobicContact SD-CB 4.37Å; Y86-F148 AromaticContact CD1-CD2 3.94Å; Y86-F148 HydrophobicContact CD1-CD2 3.94Å; Y86-F148 AromaticContact CD1-CE2 3.66Å; Y86-F148 HydrophobicContact CD1-CE2 3.66Å; Y86-F148 AromaticContact CD2-CE2 3.71Å; Y86-F148 HydrophobicContact CD2-CE2 3.71Å; Y86-F148 HydrophobicContact CD2-CZ 4.42Å; Y86-F148 HydrophobicContact CE1-CD2 4.14Å; Y86-F148 HydrophobicContact CE1-CE2 4.11Å; Y86-F148 HydrophobicContact CE2-CE2 4.14Å; Y86-F148 HydrophobicContact CG-CD2 4.2Å; Y86-F148 AromaticContact CG-CE2 3.43Å; Y86-F148 HydrophobicContact CG-CE2 3.43Å; Y86-F148 VanDerWaalsContact CG-CE2 3.43Å; Y86-F148 HydrophobicContact CG-CZ 4.07Å; L144-F148 HydrophobicContact CB-CD2 4.4Å; L144-F148 HydrophobicContact CB-CE2 4.16Å; L144-F148 WeakPolarHBondContact O-CD2 3.4Å; L144-F148 PolarHBondContact O-N 3.39Å; D145-F148 PolarHBondContact O-N 3.01Å; F148-W151 PolarHBondContact O-N 3.12Å; F148-R152 VanDerWaalsContact O-CB 3.3Å; F148-R152 WeakPolarHBondContact O-CB 3.46Å; F148-R152 PolarHBondContact O-N 3.3Å
149F92Very high92.7Very high14 Ų1434.1 Ų34.16%0.06117%0.174CC..Hα-helixtrans-63.4-47.1176.5-64.8-13.1000112.2D145 T146 V147 R152 G153 K154 Q157 V158 H162D145-F149 WeakPolarHBondContact O-CD1 3.18Å; D145-F149 VanDerWaalsContact O-CG 3.27Å; D145-F149 WeakPolarHBondContact O-CG 3.38Å; D145-F149 PolarHBondContact O-N 2.92Å; T146-F149 PolarHBondContact O-N 3.23Å; V147-F149 PolarHBondContact O-N 3.12Å; F149-R152 PolarHBondContact O-N 3.37Å; F149-G153 PolarHBondContact O-N 3.34Å; F149-K154 PolarHBondContact O-N 3.04Å; F149-Q157 HydrophobicContact CB-CB 4.41Å; F149-Q157 HydrophobicContact CD2-CB 3.67Å; F149-Q157 HydrophobicContact CE2-CB 3.98Å; F149-Q157 HydrophobicContact CG-CB 3.99Å; F149-V158 HydrophobicContact CB-CG2 3.92Å; F149-H162 AromaticContact CD2-CE1 3.91Å; F149-H162 AromaticContact CD2-NE2 3.84Å; F149-H162 AromaticContact CE2-CD2 3.98Å; F149-H162 AromaticContact CE2-CE1 3.86Å; F149-H162 AromaticContact CE2-NE2 3.32Å; F149-H162 VanDerWaalsContact CE2-NE2 3.32Å; F149-H162 WeakPolarHBondContact CE2-NE2 3.45Å
150L93Very high92.4Very high3 Ų341.3 Ų41.32%0.01621%0.206CC..Hα-helixtrans-66.1-41.2177.9-70.4171.1000111.9V43 W46 K47 T146 V147 R152 G153 V158V43-L150 HydrophobicContact CB-CD1 4.44Å; V43-L150 HydrophobicContact CG1-CD1 4.29Å; V43-L150 HydrophobicContact CG2-CD1 4.27Å; W46-L150 HydrophobicContact CB-CD1 4.06Å; W46-L150 HydrophobicContact CD2-CB 3.72Å; W46-L150 HydrophobicContact CD2-CD1 3.81Å; W46-L150 HydrophobicContact CD2-CG 4.34Å; W46-L150 HydrophobicContact CE3-CB 3.83Å; W46-L150 HydrophobicContact CE3-CD1 3.56Å; W46-L150 HydrophobicContact CE3-CG 4.35Å; W46-L150 HydrophobicContact CG-CB 4.31Å; W46-L150 HydrophobicContact CG-CD1 4.04Å; W46-L150 HydrophobicContact CH2-CB 4.13Å; W46-L150 HydrophobicContact CZ2-CB 4.02Å; W46-L150 HydrophobicContact CZ3-CB 4.03Å; W46-L150 HydrophobicContact CZ3-CD1 4.29Å; K47-L150 HydrophobicContact CB-CD2 4.26Å; T146-L150 HydrophobicContact CG2-CD1 4.06Å; T146-L150 HydrophobicContact CG2-CG 4.38Å; T146-L150 WeakPolarHBondContact O-CB 3.37Å; T146-L150 VanDerWaalsContact O-CG 3.32Å; T146-L150 WeakPolarHBondContact O-CG 3.37Å; T146-L150 PolarHBondContact O-N 3.43Å; V147-L150 PolarHBondContact O-N 3.22Å; L150-R152 PolarHBondContact O-N 3.5Å; L150-G153 WeakPolarHBondContact O-CA 3.4Å; L150-G153 PolarHBondContact O-N 3.09Å; L150-V158 HydrophobicContact CD2-CG2 3.86Å; L150-V158 HydrophobicContact CG-CG2 3.99Å
151W90Very high92.1Very high101 Ų10141.7 Ų41.738%0.38321%0.208SC..Hα-helixtrans-65.8-38.2178.7-166.45.2000112.2W46 L78 I79 L82 V147 F148 G153W46-W151 HydrophobicContact CH2-CB 4.07Å; W46-W151 HydrophobicContact CZ2-CB 4.14Å; L78-W151 HydrophobicContact CD2-CH2 4.49Å; I79-W151 HydrophobicContact CD1-CB 4.5Å; I79-W151 VanDerWaalsContact CD1-CD1 3.45Å; I79-W151 HydrophobicContact CD1-CD2 3.89Å; I79-W151 HydrophobicContact CD1-CG 3.71Å; I79-W151 HydrophobicContact CD1-CZ2 4.48Å; I79-W151 HydrophobicContact CG1-CD2 3.58Å; I79-W151 VanDerWaalsContact CG1-CE2 3.49Å; I79-W151 HydrophobicContact CG1-CE3 4.03Å; I79-W151 HydrophobicContact CG1-CG 3.94Å; I79-W151 HydrophobicContact CG1-CH2 4.27Å; I79-W151 HydrophobicContact CG1-CZ2 3.86Å; I79-W151 HydrophobicContact CG1-CZ3 4.35Å; L82-W151 HydrophobicContact CD1-CH2 3.83Å; L82-W151 HydrophobicContact CD1-CZ3 3.8Å; V147-W151 VanDerWaalsContact O-CB 3.24Å; V147-W151 WeakPolarHBondContact O-CB 3.39Å; V147-W151 PolarHBondContact O-N 3.07Å; F148-W151 PolarHBondContact O-N 3.12Å; W151-G153 PolarHBondContact O-N 3.49Å
152R87.2Confident91.9Very high101 Ų10140.8 Ų40.838%0.38120%0.203SC..THydrogen-bonded Turntrans-71.7-10172.6-164.6175176.9162.7-2.1113I79 F148 F149 L150 K154I79-R152 HydrophobicContact CG2-CB 4.49Å; F148-R152 VanDerWaalsContact O-CB 3.3Å; F148-R152 WeakPolarHBondContact O-CB 3.46Å; F148-R152 PolarHBondContact O-N 3.3Å; F149-R152 PolarHBondContact O-N 3.37Å; L150-R152 PolarHBondContact O-N 3.5Å; R152-K154 VanDerWaalsContact C-N 3.28Å; R152-K154 HydrophobicContact CB-CG 4.23Å; R152-K154 HydrophobicContact CG-CG 4Å
153G84.6Confident91.9Very high45 Ų4542.1 Ų42.146%0.46421%0.211SC..THydrogen-bonded Turntrans72.519.4-174.400000113.6F149 L150 W151 I155F149-G153 PolarHBondContact O-N 3.34Å; L150-G153 WeakPolarHBondContact O-CA 3.4Å; L150-G153 PolarHBondContact O-N 3.09Å; W151-G153 PolarHBondContact O-N 3.49Å; G153-I155 PolarHBondContact O-N 3.43Å; G153-I155 VanDerWaalsContact O-N 3.1Å
154K85.7Confident91.7Very high45 Ų4544.3 Ų44.320%0.19622%0.22CC..  trans-85.559.6174.1-64-61.8-171.4-174.90110.1F149 R152 D156 Q157 D329F149-K154 PolarHBondContact O-N 3.04Å; R152-K154 VanDerWaalsContact C-N 3.28Å; R152-K154 HydrophobicContact CB-CG 4.23Å; R152-K154 HydrophobicContact CG-CG 4Å; K154-D156 PolarHBondContact O-N 3.43Å; K154-D156 VanDerWaalsContact O-N 3.16Å; K154-Q157 HydrophobicContact CB-CG 4.08Å; K154-Q157 WeakPolarHBondContact O-CB 3.08Å; K154-Q157 PolarHBondContact O-N 3.46Å; K154-D329 HydrophobicContact CD-CB 3.95Å; K154-D329 IonicContact NZ-OD2 2.66Å; K154-D329 PolarHBondContact NZ-OD2 3.13Å
155I88.2Confident91.7Very high21 Ų2141.7 Ų41.711%0.10821%0.205CC..G310 helixtrans-56.3-33.9-177.9-58.2171.3000111.7K47 C50 L51 G153 Q157 V158K47-I155 HydrophobicContact CD-CG2 4.08Å; K47-I155 HydrophobicContact CG-CG2 3.75Å; C50-I155 HydrophobicContact CB-CD1 3.44Å; C50-I155 VanDerWaalsContact CB-CD1 3.44Å; C50-I155 HydrophobicContact CB-CG1 3.93Å; L51-I155 HydrophobicContact CD2-CD1 3.88Å; L51-I155 HydrophobicContact CD2-CG2 4.38Å; L51-I155 HydrophobicContact CG-CD1 4.13Å; G153-I155 PolarHBondContact O-N 3.43Å; G153-I155 VanDerWaalsContact O-N 3.1Å; I155-Q157 VanDerWaalsContact C-N 3.25Å; I155-Q157 PolarHBondContact O-N 2.94Å; I155-V158 WeakPolarHBondContact O-CA 3.24Å; I155-V158 VanDerWaalsContact O-CB 3.3Å; I155-V158 WeakPolarHBondContact O-CB 3.08Å; I155-V158 PolarHBondContact O-N 3.44Å
156D85.2Confident91.7Very high65 Ų6541.9 Ų41.935%0.34821%0.206SC..G310 helixtrans-52.6-37.7174.5-73.2-11.3000113.7K154 V158 T159 H327 M328K154-D156 PolarHBondContact O-N 3.43Å; K154-D156 VanDerWaalsContact O-N 3.16Å; D156-V158 VanDerWaalsContact C-N 3.25Å; D156-V158 PolarHBondContact O-N 3.33Å; D156-T159 WeakPolarHBondContact O-CG2 3.44Å; D156-H327 WeakPolarHBondContact CB-O 3.3Å; D156-H327 WeakPolarHBondContact OD2-CB 3.38Å; D156-M328 HydrophobicContact CB-CB 4.18Å; D156-M328 HydrophobicContact CB-CG 3.86Å; D156-M328 WeakPolarHBondContact O-CE 3.43Å; D156-M328 WeakPolarHBondContact O-CG 3.21Å
157Q89.3Confident91.7Very high45 Ų4542.7 Ų42.721%0.2121%0.213CC..G310 helixtrans-73-20.1175.9-62.4-179-24.800112.2F149 K154 I155 T159 D329F149-Q157 HydrophobicContact CB-CB 4.41Å; F149-Q157 HydrophobicContact CD2-CB 3.67Å; F149-Q157 HydrophobicContact CE2-CB 3.98Å; F149-Q157 HydrophobicContact CG-CB 3.99Å; K154-Q157 HydrophobicContact CB-CG 4.08Å; K154-Q157 WeakPolarHBondContact O-CB 3.08Å; K154-Q157 PolarHBondContact O-N 3.46Å; I155-Q157 VanDerWaalsContact C-N 3.25Å; I155-Q157 PolarHBondContact O-N 2.94Å; Q157-T159 PolarHBondContact O-N 3.44Å; Q157-D329 WeakPolarHBondContact CG-O 3.44Å; Q157-D329 PolarHBondContact NE2-O 3.11Å; Q157-D329 PolarHBondContact NE2-OXT 3.41Å
158V93.5Very high91.7Very high1 Ų141.5 Ų41.51%0.00621%0.206CC..  trans-8466178.2-167.80000110V43 K47 T146 F149 L150 I155 D156 V163V43-V158 HydrophobicContact CG1-CG1 3.65Å; K47-V158 PolarHBondContact NZ-O 3.44Å; T146-V158 HydrophobicContact CG2-CG1 3.81Å; T146-V158 HydrophobicContact CG2-CG2 4.09Å; F149-V158 HydrophobicContact CB-CG2 3.92Å; L150-V158 HydrophobicContact CD2-CG2 3.86Å; L150-V158 HydrophobicContact CG-CG2 3.99Å; I155-V158 WeakPolarHBondContact O-CA 3.24Å; I155-V158 VanDerWaalsContact O-CB 3.3Å; I155-V158 WeakPolarHBondContact O-CB 3.08Å; I155-V158 PolarHBondContact O-N 3.44Å; D156-V158 VanDerWaalsContact C-N 3.25Å; D156-V158 PolarHBondContact O-N 3.33Å; V158-V163 HydrophobicContact CG1-CG2 3.61Å
159T92.5Very high91.8Very high34 Ų3440.8 Ų40.821%0.20920%0.203CC..  trans-78.2165.3179.468.80000112.1D156 Q157 L161 H162 V163 M328D156-T159 WeakPolarHBondContact O-CG2 3.44Å; Q157-T159 PolarHBondContact O-N 3.44Å; T159-L161 VanDerWaalsContact C-N 3.3Å; T159-L161 PolarHBondContact O-N 2.98Å; T159-H162 WeakPolarHBondContact O-CB 3.39Å; T159-H162 PolarHBondContact O-N 2.95Å; T159-H162 WeakPolarHBondContact OG1-CB 3.23Å; T159-H162 PolarHBondContact OG1-N 3.42Å; T159-V163 WeakPolarHBondContact O-CG2 3.29Å; T159-V163 PolarHBondContact O-N 3.24Å; T159-M328 HydrophobicContact CG2-CE 3.24Å; T159-M328 HydrophobicContact CG2-SD 3.79Å
160F91.5Very high92.1Very high152 Ų15240.1 Ų40.167%0.66720%0.2SC*.Hα-helixtrans-56.6-46.1170.6172.1-100.6000111.6H162 V163 F164F160-H162 VanDerWaalsContact C-N 3.31Å; F160-H162 PolarHBondContact O-N 3.31Å; F160-V163 PolarHBondContact O-N 3.44Å; F160-F164 HydrophobicContact CE1-CB 4.38Å; F160-F164 HydrophobicContact CZ-CB 4.29Å; F160-F164 HydrophobicContact CZ-CD2 4.45Å; F160-F164 HydrophobicContact CZ-CG 4.43Å; F160-F164 WeakPolarHBondContact O-CB 3.34Å; F160-F164 PolarHBondContact O-N 3.25Å
161L91.5Very high92.2Very high29 Ų2940.9 Ų40.915%0.15221%0.205CC..Hα-helixtrans-56.6-47.1178-178.7167.4000110.8T159 H165 L265 F266 F269T159-L161 VanDerWaalsContact C-N 3.3Å; T159-L161 PolarHBondContact O-N 2.98Å; L161-H165 VanDerWaalsContact O-CB 3.29Å; L161-H165 WeakPolarHBondContact O-CB 3.44Å; L161-H165 PolarHBondContact O-N 2.95Å; L161-L265 HydrophobicContact CD1-CB 3.68Å; L161-L265 HydrophobicContact CG-CB 4.08Å; L161-F266 HydrophobicContact CD1-CD2 3.99Å; L161-F266 HydrophobicContact CD1-CE2 4.19Å; L161-F266 HydrophobicContact CD1-CG 4.32Å; L161-F266 HydrophobicContact CD2-CD2 4.27Å; L161-F266 HydrophobicContact CD2-CE2 3.65Å; L161-F266 HydrophobicContact CD2-CZ 3.87Å; L161-F266 HydrophobicContact CG-CE2 4.35Å; L161-F269 HydrophobicContact CD1-CB 4.49Å
162H94.6Very high92.4Very high26 Ų2637.5 Ų37.512%0.1220%0.197CC..Hα-helixtrans-59-55.5178.9-172.3-92.4000111.6T146 F149 T159 F160 F164 H165 H166T146-H162 PolarHBondContact OG1-CE1 3.46Å; T146-H162 PolarHBondContact OG1-ND1 3.42Å; F149-H162 AromaticContact CD2-CE1 3.91Å; F149-H162 AromaticContact CD2-NE2 3.84Å; F149-H162 AromaticContact CE2-CD2 3.98Å; F149-H162 AromaticContact CE2-CE1 3.86Å; F149-H162 AromaticContact CE2-NE2 3.32Å; F149-H162 VanDerWaalsContact CE2-NE2 3.32Å; F149-H162 WeakPolarHBondContact CE2-NE2 3.45Å; T159-H162 WeakPolarHBondContact O-CB 3.39Å; T159-H162 PolarHBondContact O-N 2.95Å; T159-H162 WeakPolarHBondContact OG1-CB 3.23Å; T159-H162 PolarHBondContact OG1-N 3.42Å; F160-H162 VanDerWaalsContact C-N 3.31Å; F160-H162 PolarHBondContact O-N 3.31Å; H162-F164 VanDerWaalsContact C-N 3.35Å; H162-F164 PolarHBondContact O-N 2.88Å; H162-H165 PolarHBondContact O-N 3.49Å; H162-H166 AromaticContact CD2-CD2 3.83Å; H162-H166 AromaticContact CD2-NE2 3.82Å; H162-H166 AromaticContact CE1-CD2 3.44Å; H162-H166 PolarHBondContact CE1-CD2 3.19Å; H162-H166 VanDerWaalsContact CE1-CD2 3.44Å; H162-H166 AromaticContact CE1-NE2 3.64Å; H162-H166 AromaticContact CG-CD2 3.97Å; H162-H166 AromaticContact ND1-CD2 3.74Å; H162-H166 AromaticContact NE2-CD2 3.52Å; H162-H166 AromaticContact NE2-NE2 3.3Å; H162-H166 PolarHBondContact NE2-NE2 3.38Å; H162-H166 PolarHBondContact O-CD2 3.39Å; H162-H166 VanDerWaalsContact O-CD2 3.26Å; H162-H166 PolarHBondContact O-N 3.3Å
163V96.1Very high92.8Very high29 Ų2933.5 Ų33.518%0.17618%0.183CC..Hα-helixtrans-64.2-41.5-177.6-179.90000111.1Y39 V43 V158 T159 F160 A167Y39-V163 HydrophobicContact CE1-CG1 4.22Å; V43-V163 HydrophobicContact CG1-CG2 3.85Å; V158-V163 HydrophobicContact CG1-CG2 3.61Å; T159-V163 WeakPolarHBondContact O-CG2 3.29Å; T159-V163 PolarHBondContact O-N 3.24Å; F160-V163 PolarHBondContact O-N 3.44Å; V163-A167 WeakPolarHBondContact O-CB 3.29Å; V163-A167 PolarHBondContact O-N 3.31Å
164F94.6Very high93.4Very high60 Ų6031.7 Ų31.726%0.26316%0.162SC..Hα-helixtrans-60.2-45.3176.2175-105.5000111.9F160 H162 T168 V261 F262 L265F160-F164 HydrophobicContact CE1-CB 4.38Å; F160-F164 HydrophobicContact CZ-CB 4.29Å; F160-F164 HydrophobicContact CZ-CD2 4.45Å; F160-F164 HydrophobicContact CZ-CG 4.43Å; F160-F164 WeakPolarHBondContact O-CB 3.34Å; F160-F164 PolarHBondContact O-N 3.25Å; H162-F164 VanDerWaalsContact C-N 3.35Å; H162-F164 PolarHBondContact O-N 2.88Å; F164-T168 HydrophobicContact CD2-CG2 4Å; F164-T168 HydrophobicContact CE2-CG2 3.73Å; F164-T168 HydrophobicContact CZ-CG2 4.15Å; F164-T168 WeakPolarHBondContact O-CB 3.3Å; F164-T168 VanDerWaalsContact O-CG2 3.3Å; F164-T168 WeakPolarHBondContact O-CG2 3.48Å; F164-T168 PolarHBondContact O-N 3.05Å; F164-T168 VanDerWaalsContact O-N 3.12Å; F164-T168 PolarHBondContact O-OG1 3.48Å; F164-V261 HydrophobicContact CE1-CG1 3.86Å; F164-V261 HydrophobicContact CZ-CG1 4.29Å; F164-F262 AromaticContact CD1-CE1 3.7Å; F164-F262 HydrophobicContact CD1-CE1 3.7Å; F164-F262 HydrophobicContact CD1-CZ 4.45Å; F164-F262 HydrophobicContact CE1-CD1 4.42Å; F164-F262 AromaticContact CE1-CE1 3.7Å; F164-F262 HydrophobicContact CE1-CE1 3.7Å; F164-F262 HydrophobicContact CE1-CZ 4.22Å; F164-L265 HydrophobicContact CD1-CD1 4.13Å; F164-L265 HydrophobicContact CE1-CD1 4.38Å
165H95.2Very high93.8Very high23 Ų2333.5 Ų33.511%0.10617%0.167CC..Hα-helixtrans-59.5-58.9176.3179.673.9000111.4L161 H162 A167 T168 M169 F262L161-H165 VanDerWaalsContact O-CB 3.29Å; L161-H165 WeakPolarHBondContact O-CB 3.44Å; L161-H165 PolarHBondContact O-N 2.95Å; H162-H165 PolarHBondContact O-N 3.49Å; H165-A167 VanDerWaalsContact C-N 3.28Å; H165-A167 PolarHBondContact O-N 3.1Å; H165-T168 PolarHBondContact O-N 3.44Å; H165-T168 VanDerWaalsContact O-N 3.15Å; H165-T168 PolarHBondContact O-OG1 3.37Å; H165-M169 WeakPolarHBondContact CE1-CG 3.32Å; H165-M169 VanDerWaalsContact O-CG 3.25Å; H165-M169 WeakPolarHBondContact O-CG 3.5Å; H165-M169 PolarHBondContact O-N 2.85Å; H165-F262 HydrophobicContact CB-CE1 3.81Å; H165-F262 HydrophobicContact CB-CZ 4.09Å; H165-F262 AromaticContact ND1-CE1 3.58Å; H165-F262 AromaticContact ND1-CE2 3.56Å; H165-F262 AromaticContact ND1-CZ 3.23Å; H165-F262 WeakPolarHBondContact ND1-CZ 3.49Å
166H96.4Very high94.1Very high12 Ų1233.4 Ų33.46%0.05617%0.172CC..Hα-helixtrans-63.6-30.8-177.2-77-82.2000113.2Y39 E142 L143 D145 H162 P170Y39-H166 HydrophobicContact CE1-CB 4.02Å; Y39-H166 WeakPolarHBondContact OH-CB 3.25Å; E142-H166 PolarHBondContact O-CE1 3.04Å; E142-H166 PolarHBondContact O-ND1 3.25Å; L143-H166 HydrophobicContact CD2-CB 3.9Å; L143-H166 VanDerWaalsContact CD2-O 3.26Å; L143-H166 WeakPolarHBondContact CD2-O 3.32Å; D145-H166 IonicContact OD2-CE1 3.78Å; H162-H166 AromaticContact CD2-CD2 3.83Å; H162-H166 AromaticContact CD2-NE2 3.82Å; H162-H166 AromaticContact CE1-CD2 3.44Å; H162-H166 PolarHBondContact CE1-CD2 3.19Å; H162-H166 VanDerWaalsContact CE1-CD2 3.44Å; H162-H166 AromaticContact CE1-NE2 3.64Å; H162-H166 AromaticContact CG-CD2 3.97Å; H162-H166 AromaticContact ND1-CD2 3.74Å; H162-H166 AromaticContact NE2-CD2 3.52Å; H162-H166 AromaticContact NE2-NE2 3.3Å; H162-H166 PolarHBondContact NE2-NE2 3.38Å; H162-H166 PolarHBondContact O-CD2 3.39Å; H162-H166 VanDerWaalsContact O-CD2 3.26Å; H162-H166 PolarHBondContact O-N 3.3Å; H166-P170 WeakPolarHBondContact O-CD 3.41Å
167A96.1Very high94.5Very high18 Ų1830.8 Ų30.815%0.14916%0.158CC..Hα-helixtrans-74.1-31.2176.900000113.4Y39 V40 V163 H165 P171Y39-A167 HydrophobicContact CD1-CB 4.32Å; Y39-A167 HydrophobicContact CE1-CB 4.19Å; V40-A167 HydrophobicContact CG2-CB 3.54Å; V163-A167 WeakPolarHBondContact O-CB 3.29Å; V163-A167 PolarHBondContact O-N 3.31Å; H165-A167 VanDerWaalsContact C-N 3.28Å; H165-A167 PolarHBondContact O-N 3.1Å; A167-P171 WeakPolarHBondContact O-CD 3.48Å
168T95.2Very high94.8Very high25 Ų2529 Ų2915%0.15315%0.15CC..Hα-helixtrans-94.8-26.2-174.555.20000113.3F164 H165 S172 Y258F164-T168 HydrophobicContact CD2-CG2 4Å; F164-T168 HydrophobicContact CE2-CG2 3.73Å; F164-T168 HydrophobicContact CZ-CG2 4.15Å; F164-T168 WeakPolarHBondContact O-CB 3.3Å; F164-T168 VanDerWaalsContact O-CG2 3.3Å; F164-T168 WeakPolarHBondContact O-CG2 3.48Å; F164-T168 PolarHBondContact O-N 3.05Å; F164-T168 VanDerWaalsContact O-N 3.12Å; F164-T168 PolarHBondContact O-OG1 3.48Å; H165-T168 PolarHBondContact O-N 3.44Å; H165-T168 VanDerWaalsContact O-N 3.15Å; H165-T168 PolarHBondContact O-OG1 3.37Å; T168-S172 VanDerWaalsContact O-CB 3.31Å; T168-S172 WeakPolarHBondContact O-CB 3.15Å; T168-S172 PolarHBondContact O-N 2.68Å; T168-S172 PolarHBondContact O-OG 2.85Å; T168-Y258 HydrophobicContact CG2-CE1 4.41Å
169M96.3Very high94.8Very high8 Ų831.3 Ų31.34%0.03916%0.158CC..Hα-helixtrans-61.3-58.9-178.2-70.9-61.990.100113.2H165 S172 I173 F188 Y258 F262H165-M169 WeakPolarHBondContact CE1-CG 3.32Å; H165-M169 VanDerWaalsContact O-CG 3.25Å; H165-M169 WeakPolarHBondContact O-CG 3.5Å; H165-M169 PolarHBondContact O-N 2.85Å; M169-S172 PolarHBondContact O-N 3.22Å; M169-I173 VanDerWaalsContact O-CG1 3.32Å; M169-I173 WeakPolarHBondContact O-CG1 3.43Å; M169-I173 PolarHBondContact O-N 3.41Å; M169-F188 HydrophobicContact SD-CZ 4.35Å; M169-Y258 HydrophobicContact CE-CD1 4.17Å; M169-Y258 HydrophobicContact CE-CG 4.49Å; M169-F262 HydrophobicContact CE-CE2 3.42Å; M169-F262 VanDerWaalsContact CE-CE2 3.42Å; M169-F262 HydrophobicContact CE-CZ 3.68Å; M169-F262 HydrophobicContact SD-CE2 4.13Å
170P96.8Very high94.8Very high0 Ų029.7 Ų29.70%015%0.149CC..Hα-helixtrans-57.8-45.4-174.5-16.526.1000114.1T32 T36 K139 L140 L143 H166 S172 I173 W174T32-P170 HydrophobicContact CG2-CB 4.04Å; T36-P170 HydrophobicContact CG2-CB 4.16Å; T36-P170 HydrophobicContact CG2-CG 4.06Å; K139-P170 HydrophobicContact CB-CB 4.36Å; K139-P170 HydrophobicContact CB-CG 4.08Å; L140-P170 HydrophobicContact CD2-CB 3.74Å; L140-P170 HydrophobicContact CD2-CG 4.29Å; L140-P170 HydrophobicContact CG-CB 4.49Å; L143-P170 HydrophobicContact CD2-CG 4.34Å; H166-P170 WeakPolarHBondContact O-CD 3.41Å; P170-S172 VanDerWaalsContact C-N 3.32Å; P170-S172 PolarHBondContact O-N 3.5Å; P170-I173 PolarHBondContact O-N 2.87Å; P170-W174 WeakPolarHBondContact O-CB 3.44Å; P170-W174 PolarHBondContact O-N 2.96Å
171P95.4Very high94.9Very high19 Ų1922.7 Ų22.712%0.12312%0.118CC..Hα-helixtrans-59.3-41.6175-26.336.4000112.5T32 T36 A167 W174 W175T32-P171 HydrophobicContact CG2-CB 4.46Å; T32-P171 HydrophobicContact CG2-CG 4.18Å; T36-P171 HydrophobicContact CG2-CG 3.65Å; A167-P171 WeakPolarHBondContact O-CD 3.48Å; P171-W174 PolarHBondContact O-N 3.14Å; P171-W175 VanDerWaalsContact O-CD1 3.23Å; P171-W175 PolarHBondContact O-N 2.88Å
172S94.4Very high95Very high29 Ų2921.7 Ų21.720%0.20312%0.115CC..Hα-helixtrans-68.6-39.7-178-55.50000111.8T168 M169 P170 W175 G176 Y258T168-S172 VanDerWaalsContact O-CB 3.31Å; T168-S172 WeakPolarHBondContact O-CB 3.15Å; T168-S172 PolarHBondContact O-N 2.68Å; T168-S172 PolarHBondContact O-OG 2.85Å; M169-S172 PolarHBondContact O-N 3.22Å; P170-S172 VanDerWaalsContact C-N 3.32Å; P170-S172 PolarHBondContact O-N 3.5Å; S172-W175 PolarHBondContact O-N 2.93Å; S172-G176 PolarHBondContact O-N 3.46Å; S172-Y258 PolarHBondContact OG-OH 3.41Å
173I96.3Very high95Very high17 Ų1720.4 Ų20.49%0.08711%0.109CC..Hα-helixtrans-70.5-37.5179.2-57.8-36.4000110.8F135 K139 M169 P170 W175 G176 V177 F188F135-I173 HydrophobicContact CD1-CG1 4.49Å; F135-I173 HydrophobicContact CD1-CG2 3.64Å; F135-I173 HydrophobicContact CE1-CD1 3.99Å; F135-I173 HydrophobicContact CE1-CG1 3.9Å; F135-I173 HydrophobicContact CE1-CG2 3.87Å; K139-I173 HydrophobicContact CG-CG1 4.17Å; M169-I173 VanDerWaalsContact O-CG1 3.32Å; M169-I173 WeakPolarHBondContact O-CG1 3.43Å; M169-I173 PolarHBondContact O-N 3.41Å; P170-I173 PolarHBondContact O-N 2.87Å; I173-W175 VanDerWaalsContact C-N 3.29Å; I173-W175 PolarHBondContact O-N 3.45Å; I173-G176 PolarHBondContact O-N 3.44Å; I173-G176 VanDerWaalsContact O-N 3.14Å; I173-V177 HydrophobicContact CG2-CG2 3.77Å; I173-V177 VanDerWaalsContact O-CG2 3.31Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 2.85Å; I173-F188 HydrophobicContact CD1-CD1 3.96Å; I173-F188 HydrophobicContact CD1-CE1 3.27Å; I173-F188 HydrophobicContact CD1-CZ 4.03Å; I173-F188 HydrophobicContact CG1-CE1 4.3Å
174W96.6Very high94.9Very high8 Ų819 Ų193%0.0310%0.101CC..Hα-helixtrans-53.3-47.2176-171.393.6000112L25 S28 W29 T32 Y136 P170 P171 V177 K178 Y179L25-W174 PolarHBondContact O-NE1 3.46Å; S28-W174 WeakPolarHBondContact O-CZ2 3.31Å; S28-W174 PolarHBondContact O-NE1 3.31Å; W29-W174 HydrophobicContact CB-CD2 4.11Å; W29-W174 HydrophobicContact CB-CE3 3.76Å; W29-W174 HydrophobicContact CB-CH2 3.84Å; W29-W174 HydrophobicContact CB-CZ2 4.17Å; W29-W174 HydrophobicContact CB-CZ3 3.62Å; W29-W174 AromaticContact CD1-CE3 3.74Å; W29-W174 HydrophobicContact CG-CD2 4.49Å; W29-W174 HydrophobicContact CG-CE3 4.11Å; W29-W174 HydrophobicContact CG-CZ3 4.35Å; W29-W174 VanDerWaalsContact N-CZ2 3.27Å; T32-W174 HydrophobicContact CG2-CB 4.43Å; Y136-W174 HydrophobicContact CD2-CB 4.09Å; Y136-W174 HydrophobicContact CE2-CB 3.83Å; Y136-W174 AromaticContact CE2-CD1 3.74Å; Y136-W174 HydrophobicContact CE2-CG 4.22Å; Y136-W174 AromaticContact CZ-CD1 3.72Å; P170-W174 WeakPolarHBondContact O-CB 3.44Å; P170-W174 PolarHBondContact O-N 2.96Å; P171-W174 PolarHBondContact O-N 3.14Å; W174-V177 PolarHBondContact O-N 3.08Å; W174-K178 HydrophobicContact CE3-CB 4.33Å; W174-K178 HydrophobicContact CH2-CB 4.18Å; W174-K178 HydrophobicContact CH2-CG 3.8Å; W174-K178 HydrophobicContact CZ2-CB 4.4Å; W174-K178 HydrophobicContact CZ2-CG 4.13Å; W174-K178 HydrophobicContact CZ3-CB 4.14Å; W174-K178 HydrophobicContact CZ3-CG 4.17Å; W174-K178 VanDerWaalsContact O-CB 3.25Å; W174-K178 WeakPolarHBondContact O-CB 3.46Å; W174-K178 PolarHBondContact O-N 3.17Å; W174-Y179 HydrophobicContact CZ3-CE2 4.03Å
175W94Very high95Very high82 Ų8217.1 Ų17.131%0.3119%0.094SC..Hα-helixtrans-63.9-43.5177.8-78.4102.3000112.5L12 W29 P171 S172 I173 Y179L12-W175 HydrophobicContact CD1-CE3 4.3Å; L12-W175 HydrophobicContact CD1-CZ3 3.8Å; L12-W175 HydrophobicContact CD2-CE3 4.29Å; W29-W175 AromaticContact CD1-CD1 4Å; W29-W175 AromaticContact CD1-NE1 3.46Å; W29-W175 AromaticContact CE2-NE1 3.89Å; W29-W175 HydrophobicContact CG-CZ2 4.36Å; W29-W175 AromaticContact CG-NE1 3.83Å; W29-W175 AromaticContact NE1-CD1 4Å; W29-W175 AromaticContact NE1-NE1 3.48Å; P171-W175 VanDerWaalsContact O-CD1 3.23Å; P171-W175 PolarHBondContact O-N 2.88Å; S172-W175 PolarHBondContact O-N 2.93Å; I173-W175 VanDerWaalsContact C-N 3.29Å; I173-W175 PolarHBondContact O-N 3.45Å; W175-Y179 HydrophobicContact CD2-CE2 4.31Å; W175-Y179 AromaticContact CE3-CD2 3.52Å; W175-Y179 HydrophobicContact CE3-CD2 3.52Å; W175-Y179 AromaticContact CE3-CE2 3.21Å; W175-Y179 HydrophobicContact CE3-CE2 3.21Å; W175-Y179 HydrophobicContact CH2-CE2 4.26Å; W175-Y179 AromaticContact CZ3-CD2 3.94Å; W175-Y179 HydrophobicContact CZ3-CD2 3.94Å; W175-Y179 AromaticContact CZ3-CE2 3.18Å; W175-Y179 HydrophobicContact CZ3-CE2 3.18Å; W175-Y179 AromaticContact CZ3-CZ 3.56Å; W175-Y179 WeakPolarHBondContact O-CB 3.17Å; W175-Y179 WeakPolarHBondContact O-CD2 3.49Å; W175-Y179 PolarHBondContact O-N 3.05Å
176G93.6Very high95Very high19 Ų1916.5 Ų16.520%0.1969%0.091CC..Hα-helixtrans-61-49.9177.300000111.9S172 I173 A180S172-G176 PolarHBondContact O-N 3.46Å; I173-G176 PolarHBondContact O-N 3.44Å; I173-G176 VanDerWaalsContact O-N 3.14Å; G176-A180 CarbonylContact O-C 3.11Å; G176-A180 WeakPolarHBondContact O-CA 3.38Å; G176-A180 PolarHBondContact O-N 3.39Å
177V95.3Very high95Very high10 Ų1016.5 Ų16.56%0.0619%0.091CC..Hα-helixtrans-66-43.3-1781790000111.3L20 M26 G132 I173 W174 Y179 P181L20-V177 HydrophobicContact CD1-CG1 3.8Å; L20-V177 WeakPolarHBondContact CD1-O 3.45Å; L20-V177 HydrophobicContact CD2-CG1 4.26Å; M26-V177 HydrophobicContact CE-CB 3.99Å; M26-V177 HydrophobicContact CE-CG1 3.64Å; G132-V177 WeakPolarHBondContact O-CG2 3.47Å; I173-V177 HydrophobicContact CG2-CG2 3.77Å; I173-V177 VanDerWaalsContact O-CG2 3.31Å; I173-V177 WeakPolarHBondContact O-CG2 3.34Å; I173-V177 PolarHBondContact O-N 2.85Å; W174-V177 PolarHBondContact O-N 3.08Å; V177-Y179 PolarHBondContact O-N 3.38Å; V177-P181 WeakPolarHBondContact O-CD 3.43Å
178K94.7Very high95Very high8 Ų816.9 Ų16.94%0.0359%0.09CC..Hα-helixtrans-68.4-31.4-176.3-175.256.8172168.60113.9P16 D17 L20 D21 M26 W174P16-K178 HydrophobicContact CB-CD 4Å; P16-K178 HydrophobicContact CB-CG 3.96Å; D17-K178 PolarHBondContact N-O 2.72Å; L20-K178 HydrophobicContact CB-CD 4.26Å; L20-K178 HydrophobicContact CD1-CD 4.47Å; D21-K178 IonicContact OD1-NZ 2.76Å; D21-K178 PolarHBondContact OD1-NZ 3.43Å; M26-K178 HydrophobicContact CE-CB 3.99Å; M26-K178 HydrophobicContact CE-CD 4.44Å; M26-K178 WeakPolarHBondContact O-CD 3.36Å; M26-K178 WeakPolarHBondContact O-CE 3.24Å; M26-K178 PolarHBondContact O-NZ 3.08Å; W174-K178 HydrophobicContact CE3-CB 4.33Å; W174-K178 HydrophobicContact CH2-CB 4.18Å; W174-K178 HydrophobicContact CH2-CG 3.8Å; W174-K178 HydrophobicContact CZ2-CB 4.4Å; W174-K178 HydrophobicContact CZ2-CG 4.13Å; W174-K178 HydrophobicContact CZ3-CB 4.14Å; W174-K178 HydrophobicContact CZ3-CG 4.17Å; W174-K178 VanDerWaalsContact O-CB 3.25Å; W174-K178 WeakPolarHBondContact O-CB 3.46Å; W174-K178 PolarHBondContact O-N 3.17Å
179Y93Very high95.1Very high49 Ų4916.3 Ų16.319%0.1929%0.087CC..Hα-helixtrans-114.5-24.2-169.6-74.5-86.3000114.4P13 P16 W174 W175 V177 F251P13-Y179 HydrophobicContact CG-CD1 4.08Å; P13-Y179 HydrophobicContact CG-CG 4.39Å; P13-Y179 VanDerWaalsContact CG-O 3.28Å; P13-Y179 WeakPolarHBondContact CG-O 3.18Å; P16-Y179 HydrophobicContact CB-CD1 4.18Å; P16-Y179 HydrophobicContact CB-CE1 3.95Å; W174-Y179 HydrophobicContact CZ3-CE2 4.03Å; W175-Y179 HydrophobicContact CD2-CE2 4.31Å; W175-Y179 AromaticContact CE3-CD2 3.52Å; W175-Y179 HydrophobicContact CE3-CD2 3.52Å; W175-Y179 AromaticContact CE3-CE2 3.21Å; W175-Y179 HydrophobicContact CE3-CE2 3.21Å; W175-Y179 HydrophobicContact CH2-CE2 4.26Å; W175-Y179 AromaticContact CZ3-CD2 3.94Å; W175-Y179 HydrophobicContact CZ3-CD2 3.94Å; W175-Y179 AromaticContact CZ3-CE2 3.18Å; W175-Y179 HydrophobicContact CZ3-CE2 3.18Å; W175-Y179 AromaticContact CZ3-CZ 3.56Å; W175-Y179 WeakPolarHBondContact O-CB 3.17Å; W175-Y179 WeakPolarHBondContact O-CD2 3.49Å; W175-Y179 PolarHBondContact O-N 3.05Å; V177-Y179 PolarHBondContact O-N 3.38Å; Y179-F251 HydrophobicContact CG-CZ 4.45Å
180A92.7Very high95.2Very high0 Ų017 Ų170%09%0.09CC..  trans-150.163-177.300000110.8L117 G176 G182 Y247 F251L117-A180 VanDerWaalsContact CD1-CA 3.49Å; L117-A180 HydrophobicContact CD1-CB 3.87Å; L117-A180 HydrophobicContact CD2-CB 4.46Å; G176-A180 CarbonylContact O-C 3.11Å; G176-A180 WeakPolarHBondContact O-CA 3.38Å; G176-A180 PolarHBondContact O-N 3.39Å; A180-G182 PolarHBondContact O-N 3.35Å; A180-Y247 HydrophobicContact CB-CE1 4.27Å; A180-Y247 VanDerWaalsContact CB-OH 3.29Å; A180-Y247 WeakPolarHBondContact CB-OH 3.32Å; A180-Y247 PolarHBondContact O-OH 3.46Å; A180-F251 HydrophobicContact CB-CD2 3.53Å; A180-F251 HydrophobicContact CB-CE2 3.42Å; A180-F251 VanDerWaalsContact CB-CE2 3.42Å; A180-F251 HydrophobicContact CB-CG 4.26Å; A180-F251 HydrophobicContact CB-CZ 4.07Å
181P93.3Very high95.2Very high5 Ų517.7 Ų17.73%0.03210%0.095CC..  trans-69.7127.5176.129.2-31.8000110.3D17 L117 V129 V177D17-P181 HydrophobicContact CB-CG 3.98Å; D17-P181 WeakPolarHBondContact OD2-CG 3.31Å; L117-P181 WeakPolarHBondContact CD1-O 3.42Å; V129-P181 HydrophobicContact CG2-CB 4.08Å; V129-P181 HydrophobicContact CG2-CG 3.98Å; V177-P181 WeakPolarHBondContact O-CD 3.43Å
182G93.7Very high95.3Very high8 Ų817 Ų178%0.0829%0.089CC..SBendtrans89.7-149.5176.500000114.3A180 T185 Y247A180-G182 PolarHBondContact O-N 3.35Å; G182-T185 PolarHBondContact O-N 2.88Å; G182-T185 PolarHBondContact O-OG1 3.25Å; G182-Y247 PolarHBondContact O-OH 3.46Å
183G94.7Very high95.5Very high0 Ų015.6 Ų15.60%08%0.08CC..G310 helixtrans53.1-149.1-170.700000112.2Y110 V115 E116 T185 F186Y110-G183 PolarHBondContact OH-N 3.19Å; V115-G183 CarbonylContact O-C 3.5Å; V115-G183 WeakPolarHBondContact O-CA 2.91Å; E116-G183 WeakPolarHBondContact O-CA 3.22Å; G183-T185 PolarHBondContact O-N 3.34Å; G183-F186 WeakPolarHBondContact O-CB 3.42Å; G183-F186 WeakPolarHBondContact O-CD1 3.2Å; G183-F186 PolarHBondContact O-N 2.86Å
184I95.7Very high95.6Very high0 Ų018.9 Ų18.90%010%0.097CC..G310 helixtrans-54-24-177.1-164.1179000113.9C114 V115 F186 H234 Q235 L238 Y247 P252C114-I184 HydrophobicContact CB-CD1 4.11Å; V115-I184 PolarHBondContact O-N 2.76Å; I184-F186 PolarHBondContact O-N 2.88Å; I184-H234 WeakPolarHBondContact CD1-O 3.22Å; I184-H234 VanDerWaalsContact CG1-CE1 3.47Å; I184-H234 WeakPolarHBondContact CG1-CE1 3.29Å; I184-H234 PolarHBondContact O-CE1 2.79Å; I184-H234 VanDerWaalsContact O-CE1 3.23Å; I184-Q235 PolarHBondContact O-NE2 3.23Å; I184-L238 HydrophobicContact CD1-CB 4.39Å; I184-Y247 HydrophobicContact CG2-CD1 3.89Å; I184-Y247 HydrophobicContact CG2-CD2 4.04Å; I184-Y247 HydrophobicContact CG2-CE1 4.14Å; I184-Y247 HydrophobicContact CG2-CE2 4.27Å; I184-Y247 HydrophobicContact CG2-CG 3.85Å; I184-P252 HydrophobicContact CG2-CG 3.91Å
185T95.8Very high95.7Very high19 Ų1919.5 Ų19.512%0.11710%0.101CC..G310 helixtrans-75.5-9.918069.80000113.5G182 G183 M187 F188 P189 Y247 F251 P252 I255G182-T185 PolarHBondContact O-N 2.88Å; G182-T185 PolarHBondContact O-OG1 3.25Å; G183-T185 PolarHBondContact O-N 3.34Å; T185-M187 PolarHBondContact O-N 3.41Å; T185-M187 VanDerWaalsContact O-N 3.08Å; T185-F188 VanDerWaalsContact O-CB 3.24Å; T185-F188 WeakPolarHBondContact O-CB 3.39Å; T185-F188 PolarHBondContact O-N 3.48Å; T185-P189 VanDerWaalsContact O-CD 3.29Å; T185-P189 WeakPolarHBondContact O-CD 3.42Å; T185-Y247 HydrophobicContact CG2-CE1 3.76Å; T185-Y247 WeakPolarHBondContact CG2-OH 3.48Å; T185-Y247 PolarHBondContact OG1-OH 3.19Å; T185-Y247 VanDerWaalsContact OG1-OH 3.09Å; T185-F251 HydrophobicContact CG2-CB 4.33Å; T185-P252 HydrophobicContact CG2-CG 4.47Å; T185-I255 HydrophobicContact CG2-CD1 3.83Å
186F95.9Very high95.9Very high10 Ų1015.9 Ų15.94%0.0449%0.087CC..G310 helixtrans-54.5-29.517688.4-76.2000113.5T101 A105 Y110 G183 I184 F188 P189 L190T101-F186 HydrophobicContact CG2-CD2 4.11Å; A105-F186 HydrophobicContact CB-CD2 3.97Å; A105-F186 HydrophobicContact CB-CE2 3.71Å; Y110-F186 HydrophobicContact CD2-CB 4.27Å; Y110-F186 AromaticContact CD2-CD1 3.73Å; Y110-F186 HydrophobicContact CD2-CD1 3.73Å; Y110-F186 HydrophobicContact CD2-CD2 4.16Å; Y110-F186 HydrophobicContact CD2-CE1 4.03Å; Y110-F186 HydrophobicContact CD2-CE2 4.45Å; Y110-F186 AromaticContact CD2-CG 3.77Å; Y110-F186 HydrophobicContact CD2-CG 3.77Å; Y110-F186 HydrophobicContact CD2-CZ 4.38Å; Y110-F186 HydrophobicContact CE2-CB 4.22Å; Y110-F186 HydrophobicContact CE2-CD1 4.23Å; Y110-F186 HydrophobicContact CE2-CG 4.2Å; G183-F186 WeakPolarHBondContact O-CB 3.42Å; G183-F186 WeakPolarHBondContact O-CD1 3.2Å; G183-F186 PolarHBondContact O-N 2.86Å; I184-F186 PolarHBondContact O-N 2.88Å; F186-F188 PolarHBondContact O-N 3.34Å; F186-P189 WeakPolarHBondContact O-CD 3.14Å; F186-P189 VanDerWaalsContact O-CG 3.29Å; F186-P189 WeakPolarHBondContact O-CG 3.27Å; F186-L190 HydrophobicContact CE2-CD2 4.25Å; F186-L190 PolarHBondContact O-N 3.03Å
187M95.7Very high96.1Very high13 Ų1316.8 Ų16.86%0.0649%0.089CC..Hα-helixtrans-62.4-26.7178.3-168.259.969.600111.8L112 T185 L190 V191 I230 H234L112-M187 HydrophobicContact CD2-CE 3.73Å; T185-M187 PolarHBondContact O-N 3.41Å; T185-M187 VanDerWaalsContact O-N 3.08Å; M187-L190 HydrophobicContact SD-CD2 4.06Å; M187-V191 HydrophobicContact CG-CG2 4.02Å; M187-V191 WeakPolarHBondContact O-CG2 3.39Å; M187-V191 PolarHBondContact O-N 3.4Å; M187-V191 HydrophobicContact SD-CG2 3.59Å; M187-V191 VanDerWaalsContact SD-CG2 3.59Å; M187-I230 HydrophobicContact CG-CG2 4.39Å; M187-H234 WeakPolarHBondContact CE-NE2 3.46Å; M187-H234 HydrophobicContact CG-CB 4.42Å
188F96.1Very high96.2Very high25 Ų2518.3 Ų18.311%0.1110%0.102CC..Hα-helixtrans-65.6-60.6-179-170.1-101.7000113F135 M169 I173 T185 F186 L190 N192 F231 I255F135-F188 AromaticContact CE1-CD1 3.54Å; F135-F188 HydrophobicContact CE1-CD1 3.54Å; F135-F188 AromaticContact CE1-CE1 3.51Å; F135-F188 HydrophobicContact CE1-CE1 3.51Å; F135-F188 AromaticContact CZ-CD1 3.73Å; F135-F188 HydrophobicContact CZ-CD1 3.73Å; F135-F188 AromaticContact CZ-CE1 3.51Å; F135-F188 HydrophobicContact CZ-CE1 3.51Å; M169-F188 HydrophobicContact SD-CZ 4.35Å; I173-F188 HydrophobicContact CD1-CD1 3.96Å; I173-F188 HydrophobicContact CD1-CE1 3.27Å; I173-F188 HydrophobicContact CD1-CZ 4.03Å; I173-F188 HydrophobicContact CG1-CE1 4.3Å; T185-F188 VanDerWaalsContact O-CB 3.24Å; T185-F188 WeakPolarHBondContact O-CB 3.39Å; T185-F188 PolarHBondContact O-N 3.48Å; F186-F188 PolarHBondContact O-N 3.34Å; F188-L190 VanDerWaalsContact C-N 3.27Å; F188-L190 PolarHBondContact O-N 3.44Å; F188-N192 WeakPolarHBondContact O-CB 3.41Å; F188-N192 PolarHBondContact O-N 2.91Å; F188-F231 HydrophobicContact CB-CE1 4.46Å; F188-F231 HydrophobicContact CD2-CD1 4.21Å; F188-F231 AromaticContact CD2-CD2 3.84Å; F188-F231 HydrophobicContact CD2-CD2 3.84Å; F188-F231 AromaticContact CD2-CE1 3.88Å; F188-F231 HydrophobicContact CD2-CE1 3.88Å; F188-F231 AromaticContact CD2-CE2 3.49Å; F188-F231 HydrophobicContact CD2-CE2 3.49Å; F188-F231 VanDerWaalsContact CD2-CE2 3.49Å; F188-F231 HydrophobicContact CD2-CG 4.2Å; F188-F231 AromaticContact CD2-CZ 3.52Å; F188-F231 HydrophobicContact CD2-CZ 3.52Å; F188-F231 AromaticContact CE2-CD2 3.86Å; F188-F231 HydrophobicContact CE2-CD2 3.86Å; F188-F231 AromaticContact CE2-CE2 3.45Å; F188-F231 HydrophobicContact CE2-CE2 3.45Å; F188-F231 VanDerWaalsContact CE2-CE2 3.45Å; F188-F231 AromaticContact CE2-CZ 3.9Å; F188-F231 HydrophobicContact CE2-CZ 3.9Å; F188-F231 HydrophobicContact CG-CZ 4.33Å; F188-I255 HydrophobicContact CD2-CG2 4.13Å
189P97.3Very high96.3Very high14 Ų1418.7 Ų18.79%0.09111%0.105CC..Hα-helixtrans-59.1-38.5174.722.7-32.7000112.1I97 T101 I131 F135 T185 F186 C193I97-P189 HydrophobicContact CG2-CB 4.34Å; T101-P189 HydrophobicContact CG2-CG 4.46Å; I131-P189 HydrophobicContact CG2-CG 4.5Å; F135-P189 HydrophobicContact CB-CB 4.13Å; F135-P189 HydrophobicContact CD1-CB 3.93Å; F135-P189 HydrophobicContact CD2-CB 3.81Å; F135-P189 HydrophobicContact CE1-CB 4.27Å; F135-P189 HydrophobicContact CE2-CB 4.15Å; F135-P189 HydrophobicContact CG-CB 3.68Å; F135-P189 HydrophobicContact CZ-CB 4.37Å; T185-P189 VanDerWaalsContact O-CD 3.29Å; T185-P189 WeakPolarHBondContact O-CD 3.42Å; F186-P189 WeakPolarHBondContact O-CD 3.14Å; F186-P189 VanDerWaalsContact O-CG 3.29Å; F186-P189 WeakPolarHBondContact O-CG 3.27Å; P189-C193 WeakPolarHBondContact O-CB 3.5Å; P189-C193 PolarHBondContact O-N 2.88Å; P189-C193 PolarHBondContact O-SG 2.98Å; P189-C193 VanDerWaalsContact O-SG 3.38Å
190L97.9Very high96.6Very high21 Ų2116.4 Ų16.411%0.1110%0.096CC..Hα-helixtrans-55.9-63.5179.9174.554.3000112.6T101 M102 F186 M187 F188 L194T101-L190 HydrophobicContact CG2-CB 3.77Å; M102-L190 HydrophobicContact CG-CD1 3.34Å; M102-L190 HydrophobicContact CG-CD2 4.35Å; M102-L190 HydrophobicContact CG-CG 4.49Å; M102-L190 HydrophobicContact SD-CD1 4.11Å; F186-L190 HydrophobicContact CE2-CD2 4.25Å; F186-L190 PolarHBondContact O-N 3.03Å; M187-L190 HydrophobicContact SD-CD2 4.06Å; F188-L190 VanDerWaalsContact C-N 3.27Å; F188-L190 PolarHBondContact O-N 3.44Å; L190-L194 HydrophobicContact CD1-CD1 4.21Å; L190-L194 WeakPolarHBondContact O-CG 3.29Å; L190-L194 PolarHBondContact O-N 3.23Å; L190-L194 VanDerWaalsContact O-N 3.12Å
191V97.6Very high96.8Very high16 Ų1619.1 Ų19.110%0.09711%0.112CC..Hα-helixtrans-72.2-37.3-173.6178.30000110.6M187 C193 L194 I195 Q227 I230 F231M187-V191 HydrophobicContact CG-CG2 4.02Å; M187-V191 WeakPolarHBondContact O-CG2 3.39Å; M187-V191 PolarHBondContact O-N 3.4Å; M187-V191 HydrophobicContact SD-CG2 3.59Å; M187-V191 VanDerWaalsContact SD-CG2 3.59Å; V191-C193 PolarHBondContact O-N 2.75Å; V191-L194 PolarHBondContact O-N 2.71Å; V191-I195 WeakPolarHBondContact O-CG1 3.5Å; V191-I195 PolarHBondContact O-N 3.39Å; V191-Q227 HydrophobicContact CG1-CB 4.01Å; V191-I230 HydrophobicContact CG1-CD1 4.47Å; V191-I230 HydrophobicContact CG2-CG2 4.29Å; V191-F231 HydrophobicContact CB-CE1 3.74Å; V191-F231 HydrophobicContact CB-CZ 4.05Å; V191-F231 HydrophobicContact CG1-CE1 4.22Å; V191-F231 HydrophobicContact CG1-CZ 4.33Å; V191-F231 HydrophobicContact CG2-CE1 4.35Å
192N97.7Very high96.9Very high3 Ų319.9 Ų19.92%0.01612%0.115CC..Hα-helixtrans-60.2-48.2178.1-174.9-86.2000110.6F135 K139 F188 L194 I195 H196 F231F135-N192 HydrophobicContact CE2-CB 4.11Å; F135-N192 HydrophobicContact CZ-CB 4.13Å; K139-N192 VanDerWaalsContact CE-OD1 3.32Å; K139-N192 WeakPolarHBondContact CE-OD1 3.44Å; K139-N192 PolarHBondContact NZ-OD1 2.87Å; F188-N192 WeakPolarHBondContact O-CB 3.41Å; F188-N192 PolarHBondContact O-N 2.91Å; N192-L194 PolarHBondContact O-N 3.15Å; N192-I195 PolarHBondContact O-N 3.12Å; N192-H196 PolarHBondContact O-N 2.84Å; N192-H196 PolarHBondContact O-ND1 3.14Å; N192-H196 PolarHBondContact OD1-CE1 3.16Å; N192-H196 PolarHBondContact OD1-ND1 3.29Å; N192-F231 HydrophobicContact CB-CZ 4.22Å
193C98.4Very high96.9Very high0 Ų022.6 Ų22.60%012%0.123CC..Hα-helixtrans-66.3-34.7178.3-74.20000113S94 I97 P189 V191 I195 H196 V197S94-C193 WeakPolarHBondContact O-CB 3.38Å; I97-C193 HydrophobicContact CB-CB 4.44Å; I97-C193 HydrophobicContact CG2-CB 4.34Å; I97-C193 VanDerWaalsContact CG2-SG 3.51Å; P189-C193 WeakPolarHBondContact O-CB 3.5Å; P189-C193 PolarHBondContact O-N 2.88Å; P189-C193 PolarHBondContact O-SG 2.98Å; P189-C193 VanDerWaalsContact O-SG 3.38Å; V191-C193 PolarHBondContact O-N 2.75Å; C193-I195 VanDerWaalsContact C-N 3.32Å; C193-I195 PolarHBondContact O-N 3.04Å; C193-H196 PolarHBondContact O-N 2.93Å; C193-H196 VanDerWaalsContact O-N 3.14Å; C193-V197 WeakPolarHBondContact O-CG2 3.42Å; C193-V197 PolarHBondContact O-N 3.4Å
194L97.8Very high96.9Very high86 Ų8623.3 Ų23.345%0.4513%0.13SC..Hα-helixtrans-58.8-44.2172.1-74.9172.3000112S98 L190 V191 N192 H196 V197 A198S98-L194 WeakPolarHBondContact OG-CD2 3.35Å; S98-L194 WeakPolarHBondContact OG-CG 3.43Å; L190-L194 HydrophobicContact CD1-CD1 4.21Å; L190-L194 WeakPolarHBondContact O-CG 3.29Å; L190-L194 PolarHBondContact O-N 3.23Å; L190-L194 VanDerWaalsContact O-N 3.12Å; V191-L194 PolarHBondContact O-N 2.71Å; N192-L194 PolarHBondContact O-N 3.15Å; L194-H196 VanDerWaalsContact C-N 3.32Å; L194-V197 PolarHBondContact O-N 2.67Å; L194-A198 PolarHBondContact O-N 3.21Å
195I98.2Very high96.8Very high21 Ų2125.4 Ų25.411%0.10814%0.141CC..Hα-helixtrans-66.4-36.8175.6-64.3-61.9000111.2V191 N192 C193 A198 M199 A223 Q224 Q227V191-I195 WeakPolarHBondContact O-CG1 3.5Å; V191-I195 PolarHBondContact O-N 3.39Å; N192-I195 PolarHBondContact O-N 3.12Å; C193-I195 VanDerWaalsContact C-N 3.32Å; C193-I195 PolarHBondContact O-N 3.04Å; I195-A198 PolarHBondContact O-N 3.44Å; I195-M199 HydrophobicContact CG2-CG 4.29Å; I195-M199 WeakPolarHBondContact O-CG 3.34Å; I195-M199 PolarHBondContact O-N 3.18Å; I195-A223 HydrophobicContact CD1-CB 3.81Å; I195-Q224 HydrophobicContact CG2-CG 3.62Å; I195-Q227 HydrophobicContact CD1-CB 4.37Å; I195-Q227 HydrophobicContact CG1-CB 3.85Å
196H97.8Very high96.6Very high7 Ų725.5 Ų25.53%0.03214%0.144CC..Hα-helixtrans-70.2-33178.7-75.161.4000112.6K139 E142 N192 C193 L194 A198 M199 Y200K139-H196 PolarHBondContact NZ-NE2 3.48Å; E142-H196 IonicContact OE1-CD2 3.46Å; E142-H196 PolarHBondContact OE1-CD2 3.35Å; E142-H196 IonicContact OE1-NE2 3.85Å; E142-H196 IonicContact OE2-CD2 3.6Å; E142-H196 IonicContact OE2-NE2 2.78Å; E142-H196 PolarHBondContact OE2-NE2 3Å; N192-H196 PolarHBondContact O-N 2.84Å; N192-H196 PolarHBondContact O-ND1 3.14Å; N192-H196 PolarHBondContact OD1-CE1 3.16Å; N192-H196 PolarHBondContact OD1-ND1 3.29Å; C193-H196 PolarHBondContact O-N 2.93Å; C193-H196 VanDerWaalsContact O-N 3.14Å; L194-H196 VanDerWaalsContact C-N 3.32Å; H196-A198 VanDerWaalsContact C-N 3.31Å; H196-A198 PolarHBondContact O-N 3.27Å; H196-M199 PolarHBondContact O-N 3.07Å; H196-Y200 HydrophobicContact CB-CD2 4.05Å; H196-Y200 HydrophobicContact CB-CE2 4.09Å; H196-Y200 AromaticContact CD2-CE2 3.77Å; H196-Y200 WeakPolarHBondContact O-CB 3.2Å; H196-Y200 VanDerWaalsContact O-CD2 3.23Å; H196-Y200 WeakPolarHBondContact O-CD2 3.25Å; H196-Y200 PolarHBondContact O-N 3.41Å
197V98.5Very high96.4Very high38 Ų3825.2 Ų25.223%0.2314%0.144CC..Hα-helixtrans-55.5-49.2168.7168.30000110.1V91 A95 C193 L194 T201V91-V197 HydrophobicContact CG1-CG1 4.33Å; A95-V197 HydrophobicContact CB-CG2 3.91Å; C193-V197 WeakPolarHBondContact O-CG2 3.42Å; C193-V197 PolarHBondContact O-N 3.4Å; L194-V197 PolarHBondContact O-N 2.67Å; V197-T201 VanDerWaalsContact O-CB 3.28Å; V197-T201 WeakPolarHBondContact O-CB 3.38Å; V197-T201 PolarHBondContact O-N 2.97Å; V197-T201 PolarHBondContact O-OG1 3.01Å
198A97.7Very high96.2Very high41 Ų4126.8 Ų26.834%0.33916%0.159SC..Hα-helixtrans-66.3-41.9178.800000112.5L194 I195 H196 Y202 L220L194-A198 PolarHBondContact O-N 3.21Å; I195-A198 PolarHBondContact O-N 3.44Å; H196-A198 VanDerWaalsContact C-N 3.31Å; H196-A198 PolarHBondContact O-N 3.27Å; A198-Y202 PolarHBondContact O-N 3.37Å; A198-L220 HydrophobicContact CB-CD1 3.65Å
199M97.1Very high95.8Very high17 Ų1727.3 Ų27.38%0.08417%0.171CC..Hα-helixtrans-62.1-53.1177.9-78.3-117.8-66.500112.5I195 H196 T201 Y202 Y203 L220 Q224I195-M199 HydrophobicContact CG2-CG 4.29Å; I195-M199 WeakPolarHBondContact O-CG 3.34Å; I195-M199 PolarHBondContact O-N 3.18Å; H196-M199 PolarHBondContact O-N 3.07Å; M199-T201 VanDerWaalsContact C-N 3.29Å; M199-T201 PolarHBondContact O-N 3Å; M199-Y202 WeakPolarHBondContact O-CB 3.19Å; M199-Y202 PolarHBondContact O-N 2.88Å; M199-Y202 VanDerWaalsContact O-N 3.12Å; M199-Y203 HydrophobicContact CB-CE2 4.23Å; M199-Y203 HydrophobicContact CE-CE2 4.04Å; M199-Y203 WeakPolarHBondContact O-CD2 3.36Å; M199-Y203 PolarHBondContact O-N 3.29Å; M199-Y203 HydrophobicContact SD-CE2 4.07Å; M199-L220 HydrophobicContact CB-CD2 4.47Å; M199-L220 HydrophobicContact CG-CD1 4.1Å; M199-L220 HydrophobicContact CG-CD2 3.98Å; M199-L220 HydrophobicContact CG-CG 4.19Å; M199-L220 HydrophobicContact SD-CD2 4.26Å; M199-Q224 PolarHBondContact SD-NE2 3.01Å
200Y98.1Very high95.3Very high1 Ų127.6 Ų27.60%0.00417%0.174CC..Hα-helixtrans-68.9-30.1-178.2-73.4-57.6000112.1Y86 N87 M90 E142 D145 H196 Y203 G204Y86-Y200 AromaticContact CE1-CE1 3.98Å; Y86-Y200 HydrophobicContact CE1-CE1 3.98Å; N87-Y200 VanDerWaalsContact OD1-CD1 3.28Å; N87-Y200 WeakPolarHBondContact OD1-CD1 3.47Å; M90-Y200 HydrophobicContact CB-CD1 3.9Å; M90-Y200 HydrophobicContact CB-CD2 3.49Å; M90-Y200 VanDerWaalsContact CB-CD2 3.49Å; M90-Y200 HydrophobicContact CB-CE1 4.15Å; M90-Y200 HydrophobicContact CB-CE2 3.73Å; M90-Y200 HydrophobicContact CB-CG 3.59Å; M90-Y200 HydrophobicContact CE-CD2 4.43Å; M90-Y200 HydrophobicContact CE-CE2 3.58Å; M90-Y200 HydrophobicContact CG-CD1 4.46Å; M90-Y200 HydrophobicContact CG-CD2 4.45Å; M90-Y200 HydrophobicContact CG-CE1 4.29Å; M90-Y200 HydrophobicContact CG-CE2 4.23Å; E142-Y200 VanDerWaalsContact CG-OH 3.27Å; E142-Y200 WeakPolarHBondContact CG-OH 3.24Å; D145-Y200 WeakPolarHBondContact OD1-CE1 3.24Å; D145-Y200 PolarHBondContact OD1-OH 3.3Å; D145-Y200 PolarHBondContact OD2-OH 3.29Å; H196-Y200 HydrophobicContact CB-CD2 4.05Å; H196-Y200 HydrophobicContact CB-CE2 4.09Å; H196-Y200 AromaticContact CD2-CE2 3.77Å; H196-Y200 WeakPolarHBondContact O-CB 3.2Å; H196-Y200 VanDerWaalsContact O-CD2 3.23Å; H196-Y200 WeakPolarHBondContact O-CD2 3.25Å; H196-Y200 PolarHBondContact O-N 3.41Å; Y200-Y203 HydrophobicContact CD1-CD2 4.15Å; Y200-Y203 HydrophobicContact CE1-CD2 4.45Å; Y200-Y203 PolarHBondContact O-N 3.47Å; Y200-G204 PolarHBondContact O-N 2.95Å
201T97.2Very high94.7Very high56 Ų5632.5 Ų32.534%0.34420%0.197SC..Hα-helixtrans-61.6-46.8169.6-59.30000110.6V91 V197 M199 Y203 G204 L205V91-T201 VanDerWaalsContact CG2-N 3.33Å; V91-T201 WeakPolarHBondContact CG2-OG1 3.41Å; V197-T201 VanDerWaalsContact O-CB 3.28Å; V197-T201 WeakPolarHBondContact O-CB 3.38Å; V197-T201 PolarHBondContact O-N 2.97Å; V197-T201 PolarHBondContact O-OG1 3.01Å; M199-T201 VanDerWaalsContact C-N 3.29Å; M199-T201 PolarHBondContact O-N 3Å; T201-Y203 PolarHBondContact O-N 3.49Å; T201-G204 PolarHBondContact O-N 3.37Å; T201-L205 HydrophobicContact CG2-CD1 4.18Å; T201-L205 WeakPolarHBondContact O-CB 3.33Å; T201-L205 VanDerWaalsContact O-CG 3.28Å; T201-L205 WeakPolarHBondContact O-CG 3.33Å; T201-L205 PolarHBondContact O-N 3.26Å
202Y95.9Very high94Very high22 Ų2239 Ų399%0.08623%0.225CC..Hα-helixtrans-60.9-45.7176.9178.5-84.4000112A198 M199 L205 A206 L214 W216 K217 L220A198-Y202 PolarHBondContact O-N 3.37Å; M199-Y202 WeakPolarHBondContact O-CB 3.19Å; M199-Y202 PolarHBondContact O-N 2.88Å; M199-Y202 VanDerWaalsContact O-N 3.12Å; Y202-L205 PolarHBondContact O-N 3.08Å; Y202-A206 WeakPolarHBondContact O-CB 3.35Å; Y202-A206 PolarHBondContact O-N 3.43Å; Y202-L214 HydrophobicContact CD2-CD2 3.87Å; Y202-L214 HydrophobicContact CE1-CD2 4.4Å; Y202-L214 HydrophobicContact CE2-CB 3.73Å; Y202-L214 HydrophobicContact CE2-CD2 3.65Å; Y202-L214 HydrophobicContact CE2-CG 4.23Å; Y202-L214 HydrophobicContact CG-CD2 4.35Å; Y202-W216 AromaticContact CD2-CD1 3.96Å; Y202-W216 AromaticContact CD2-NE1 3.62Å; Y202-K217 HydrophobicContact CE1-CG 4.26Å; Y202-K217 HydrophobicContact CE2-CB 3.74Å; Y202-K217 HydrophobicContact CE2-CG 4.15Å; Y202-K217 WeakPolarHBondContact OH-CB 3.32Å; Y202-K217 WeakPolarHBondContact OH-CD 3.18Å; Y202-K217 WeakPolarHBondContact OH-CG 3.04Å; Y202-L220 HydrophobicContact CD1-CD2 4.49Å; Y202-L220 HydrophobicContact CG-CD2 4.21Å
203Y93.6Very high93.5Very high64 Ų6441.7 Ų41.725%0.25124%0.24SC..Hα-helixtrans-67.9-37.1178.8-64.1-33.7000112.9N87 M199 Y200 T201 A206 A207N87-Y203 WeakPolarHBondContact OD1-CB 3.46Å; M199-Y203 HydrophobicContact CB-CE2 4.23Å; M199-Y203 HydrophobicContact CE-CE2 4.04Å; M199-Y203 WeakPolarHBondContact O-CD2 3.36Å; M199-Y203 PolarHBondContact O-N 3.29Å; M199-Y203 HydrophobicContact SD-CE2 4.07Å; Y200-Y203 HydrophobicContact CD1-CD2 4.15Å; Y200-Y203 HydrophobicContact CE1-CD2 4.45Å; Y200-Y203 PolarHBondContact O-N 3.47Å; T201-Y203 PolarHBondContact O-N 3.49Å; Y203-A206 PolarHBondContact O-N 2.98Å; Y203-A207 WeakPolarHBondContact O-CB 3.01Å; Y203-A207 PolarHBondContact O-N 2.95Å
204G94.4Very high93Very high15 Ų1542.9 Ų42.916%0.15525%0.246CC..Hα-helixtrans-61.9-45.5173.100000112.1Y200 T201 A207 A208Y200-G204 PolarHBondContact O-N 2.95Å; T201-G204 PolarHBondContact O-N 3.37Å; G204-A207 PolarHBondContact O-N 2.81Å; G204-A208 WeakPolarHBondContact O-CB 3.33Å; G204-A208 PolarHBondContact O-N 3.39Å
205L94.4Very high92.7Very high44 Ų4447.2 Ų47.223%0.2326%0.256CS..Hα-helixtrans-63.7-40.8175-69.7173.5000112.1T201 Y202 A207 A208 G209 A210 L213 L214 W216T201-L205 HydrophobicContact CG2-CD1 4.18Å; T201-L205 WeakPolarHBondContact O-CB 3.33Å; T201-L205 VanDerWaalsContact O-CG 3.28Å; T201-L205 WeakPolarHBondContact O-CG 3.33Å; T201-L205 PolarHBondContact O-N 3.26Å; Y202-L205 PolarHBondContact O-N 3.08Å; L205-A207 VanDerWaalsContact C-N 3.32Å; L205-A207 PolarHBondContact O-N 3.2Å; L205-A208 PolarHBondContact O-N 3.44Å; L205-G209 PolarHBondContact O-N 3.02Å; L205-G209 VanDerWaalsContact O-N 3.15Å; L205-A210 HydrophobicContact CB-CB 4.44Å; L205-A210 HydrophobicContact CD2-CB 4.27Å; L205-A210 PolarHBondContact O-N 3.06Å; L205-L213 HydrophobicContact CD1-CB 4.49Å; L205-L213 HydrophobicContact CD1-CD1 4.5Å; L205-L213 HydrophobicContact CD2-CD1 4.28Å; L205-L214 HydrophobicContact CB-CD2 4.05Å; L205-W216 HydrophobicContact CD1-CH2 4.03Å; L205-W216 HydrophobicContact CD1-CZ2 3.75Å
206A92.1Very high92.3Very high22 Ų2249.5 Ų49.518%0.18226%0.264CS..Hα-helixtrans-65.4-36175.700000112.2Y202 Y203 L214Y202-A206 WeakPolarHBondContact O-CB 3.35Å; Y202-A206 PolarHBondContact O-N 3.43Å; Y203-A206 PolarHBondContact O-N 2.98Å; A206-L214 HydrophobicContact CB-CD1 3.8Å; A206-L214 HydrophobicContact CB-CD2 4.03Å
207A90.9Very high92Very high4 Ų452.9 Ų52.93%0.03328%0.278CS..Hα-helixtrans-70.3-37.7173.200000111.7K80 M83 I84 Y203 G204 L205 G209K80-A207 WeakPolarHBondContact CE-O 3.43Å; K80-A207 WeakPolarHBondContact CG-O 3.02Å; M83-A207 HydrophobicContact CB-CB 3.96Å; I84-A207 HydrophobicContact CG1-CB 3.77Å; Y203-A207 WeakPolarHBondContact O-CB 3.01Å; Y203-A207 PolarHBondContact O-N 2.95Å; G204-A207 PolarHBondContact O-N 2.81Å; L205-A207 VanDerWaalsContact C-N 3.32Å; L205-A207 PolarHBondContact O-N 3.2Å; A207-G209 PolarHBondContact O-N 3.41Å
208A91.2Very high91.7Very high46 Ų4652.5 Ų52.538%0.3828%0.275SS..Hα-helixtrans-64.9-25.8176.400000113.2K80 I84 G204 L205K80-A208 WeakPolarHBondContact CE-O 3.44Å; K80-A208 PolarHBondContact NZ-O 3.44Å; I84-A208 HydrophobicContact CD1-CB 4.27Å; I84-A208 HydrophobicContact CG1-CB 4.47Å; G204-A208 WeakPolarHBondContact O-CB 3.33Å; G204-A208 PolarHBondContact O-N 3.39Å; L205-A208 PolarHBondContact O-N 3.44Å
209G87.3Confident91.5Very high36 Ų3657.6 Ų57.637%0.37129%0.286SS..THydrogen-bonded Turntrans94.615.1-175.500000113.1L205 A207 H211L205-G209 PolarHBondContact O-N 3.02Å; L205-G209 VanDerWaalsContact O-N 3.15Å; A207-G209 PolarHBondContact O-N 3.41Å; G209-H211 PolarHBondContact O-CD2 3.34Å; G209-H211 VanDerWaalsContact O-CD2 3.3Å; G209-H211 PolarHBondContact O-N 3.46Å
210A88Confident91.4Very high19 Ų1957.4 Ų57.416%0.15729%0.286CS..  trans-78.353.9177.100000111.5L205 H212 L213L205-A210 HydrophobicContact CB-CB 4.44Å; L205-A210 HydrophobicContact CD2-CB 4.27Å; L205-A210 PolarHBondContact O-N 3.06Å; A210-H212 PolarHBondContact O-N 3.43Å; A210-H212 VanDerWaalsContact O-N 3.14Å; A210-L213 HydrophobicContact CB-CD1 4.2Å; A210-L213 PolarHBondContact O-N 3.46Å
211H84.9Confident91.2Very high125 Ų12557.7 Ų57.758%0.57929%0.287SS*.G310 helixtrans-60-28.6-171.6-66.1-72000114G209 L213 L214G209-H211 PolarHBondContact O-CD2 3.34Å; G209-H211 VanDerWaalsContact O-CD2 3.3Å; G209-H211 PolarHBondContact O-N 3.46Å; H211-L213 PolarHBondContact O-N 2.83Å; H211-L214 HydrophobicContact CB-CD1 4.42Å; H211-L214 PolarHBondContact O-N 3.41Å; H211-L214 VanDerWaalsContact O-N 3.14Å
212H83Confident91.1Very high151 Ų15157.4 Ų57.470%0.69928%0.283SS*.G310 helixtrans-63.3-23.9176.966.5-83.5000113.3A210A210-H212 PolarHBondContact O-N 3.43Å; A210-H212 VanDerWaalsContact O-N 3.14Å
213L86.3Confident91.2Very high61 Ų6157.9 Ų57.932%0.31929%0.292SS..G310 helixtrans-88-6.1177.7-58.8179.2000113L205 A210 H211 W215 W216L205-L213 HydrophobicContact CD1-CB 4.49Å; L205-L213 HydrophobicContact CD1-CD1 4.5Å; L205-L213 HydrophobicContact CD2-CD1 4.28Å; A210-L213 HydrophobicContact CB-CD1 4.2Å; A210-L213 PolarHBondContact O-N 3.46Å; H211-L213 PolarHBondContact O-N 2.83Å; L213-W215 PolarHBondContact O-N 3.29Å; L213-W215 VanDerWaalsContact O-N 3.1Å; L213-W216 HydrophobicContact CB-CH2 3.87Å; L213-W216 HydrophobicContact CB-CZ3 4.18Å; L213-W216 WeakPolarHBondContact O-CH2 3.42Å; L213-W216 WeakPolarHBondContact O-CZ3 3.4Å
214L89.4Confident91.3Very high25 Ų2555.7 Ų55.713%0.13128%0.284CS..G310 helixtrans-84.317.8-171.3-57.2178000114.2Y202 L205 A206 H211 W216Y202-L214 HydrophobicContact CD2-CD2 3.87Å; Y202-L214 HydrophobicContact CE1-CD2 4.4Å; Y202-L214 HydrophobicContact CE2-CB 3.73Å; Y202-L214 HydrophobicContact CE2-CD2 3.65Å; Y202-L214 HydrophobicContact CE2-CG 4.23Å; Y202-L214 HydrophobicContact CG-CD2 4.35Å; L205-L214 HydrophobicContact CB-CD2 4.05Å; A206-L214 HydrophobicContact CB-CD1 3.8Å; A206-L214 HydrophobicContact CB-CD2 4.03Å; H211-L214 HydrophobicContact CB-CD1 4.42Å; H211-L214 PolarHBondContact O-N 3.41Å; H211-L214 VanDerWaalsContact O-N 3.14Å; L214-W216 PolarHBondContact O-N 2.91Å
215W90.2Very high91.5Very high177 Ų17756.2 Ų56.267%0.6728%0.283SS*.G310 helixtrans-66.9-21.7-175.759.5-93.3000113.3L213 K217 Y219L213-W215 PolarHBondContact O-N 3.29Å; L213-W215 VanDerWaalsContact O-N 3.1Å; W215-K217 PolarHBondContact O-N 3.17Å; W215-Y219 HydrophobicContact CE3-CE2 4.29Å; W215-Y219 HydrophobicContact CZ3-CD2 4.29Å; W215-Y219 AromaticContact CZ3-CE2 3.96Å; W215-Y219 HydrophobicContact CZ3-CE2 3.96Å
216W91.2Very high91.6Very high69 Ų6958.2 Ų58.226%0.26129%0.293SS..G310 helixtrans-89.813.2-176.563.376.7000115.7Y202 L205 L213 L214 N218 Y219 L220Y202-W216 AromaticContact CD2-CD1 3.96Å; Y202-W216 AromaticContact CD2-NE1 3.62Å; L205-W216 HydrophobicContact CD1-CH2 4.03Å; L205-W216 HydrophobicContact CD1-CZ2 3.75Å; L213-W216 HydrophobicContact CB-CH2 3.87Å; L213-W216 HydrophobicContact CB-CZ3 4.18Å; L213-W216 WeakPolarHBondContact O-CH2 3.42Å; L213-W216 WeakPolarHBondContact O-CZ3 3.4Å; L214-W216 PolarHBondContact O-N 2.91Å; W216-N218 PolarHBondContact O-N 3.23Å; W216-Y219 HydrophobicContact CB-CD2 4.04Å; W216-Y219 PolarHBondContact O-N 3.29Å; W216-Y219 VanDerWaalsContact O-N 3.1Å; W216-L220 PolarHBondContact O-N 3.12Å
217K91Very high91.9Very high77 Ų7757.5 Ų57.534%0.33529%0.285SS..Hα-helixtrans-52.7-40.5177.9-165.8-172-178.5169.40112.8Y202 W215 L220 T221 Y274Y202-K217 HydrophobicContact CE1-CG 4.26Å; Y202-K217 HydrophobicContact CE2-CB 3.74Å; Y202-K217 HydrophobicContact CE2-CG 4.15Å; Y202-K217 WeakPolarHBondContact OH-CB 3.32Å; Y202-K217 WeakPolarHBondContact OH-CD 3.18Å; Y202-K217 WeakPolarHBondContact OH-CG 3.04Å; W215-K217 PolarHBondContact O-N 3.17Å; K217-L220 WeakPolarHBondContact O-CB 3.04Å; K217-L220 PolarHBondContact O-N 3.46Å; K217-T221 PolarHBondContact O-N 3.47Å; K217-T221 PolarHBondContact O-OG1 3.07Å; K217-Y274 WeakPolarHBondContact CG-OH 3.36Å
218N91.1Very high92.3Very high31 Ų3157.7 Ų57.717%0.16629%0.286CS..Hα-helixtrans-63.6-45.6179.5-170.237.7000111.8W216 L220 T221 I222 Y270 Y274W216-N218 PolarHBondContact O-N 3.23Å; N218-L220 VanDerWaalsContact C-N 3.26Å; N218-L220 PolarHBondContact O-N 3.15Å; N218-T221 PolarHBondContact O-N 2.96Å; N218-I222 WeakPolarHBondContact O-CG1 3.44Å; N218-I222 PolarHBondContact O-N 3.35Å; N218-I222 VanDerWaalsContact O-N 3.08Å; N218-Y270 PolarHBondContact ND2-OH 3.37Å; N218-Y270 WeakPolarHBondContact OD1-CE2 3.43Å; N218-Y270 PolarHBondContact OD1-OH 3.27Å; N218-Y274 HydrophobicContact CB-CD1 4.2Å; N218-Y274 HydrophobicContact CB-CE1 3.92Å; N218-Y274 VanDerWaalsContact OD1-CD2 3.31Å; N218-Y274 WeakPolarHBondContact OD1-CD2 3.32Å; N218-Y274 VanDerWaalsContact OD1-CG 3.29Å
219Y94.4Very high92.6Very high147 Ų14759.1 Ų59.158%0.57629%0.286SS*.Hα-helixtrans-63.9-32.8177.4-61-71000112.1W215 W216 I222 A223W215-Y219 HydrophobicContact CE3-CE2 4.29Å; W215-Y219 HydrophobicContact CZ3-CD2 4.29Å; W215-Y219 AromaticContact CZ3-CE2 3.96Å; W215-Y219 HydrophobicContact CZ3-CE2 3.96Å; W216-Y219 HydrophobicContact CB-CD2 4.04Å; W216-Y219 PolarHBondContact O-N 3.29Å; W216-Y219 VanDerWaalsContact O-N 3.1Å; Y219-I222 HydrophobicContact CD1-CD1 4.45Å; Y219-I222 PolarHBondContact O-N 3.46Å; Y219-A223 WeakPolarHBondContact O-CB 3.36Å; Y219-A223 PolarHBondContact O-N 3.13Å
220L94.8Very high93.1Very high14 Ų1460.5 Ų60.57%0.07328%0.284CS..Hα-helixtrans-62.3-44.4174.3-170.369.8000111.6A198 M199 Y202 W216 K217 N218 I222 A223 Q224A198-L220 HydrophobicContact CB-CD1 3.65Å; M199-L220 HydrophobicContact CB-CD2 4.47Å; M199-L220 HydrophobicContact CG-CD1 4.1Å; M199-L220 HydrophobicContact CG-CD2 3.98Å; M199-L220 HydrophobicContact CG-CG 4.19Å; M199-L220 HydrophobicContact SD-CD2 4.26Å; Y202-L220 HydrophobicContact CD1-CD2 4.49Å; Y202-L220 HydrophobicContact CG-CD2 4.21Å; W216-L220 PolarHBondContact O-N 3.12Å; K217-L220 WeakPolarHBondContact O-CB 3.04Å; K217-L220 PolarHBondContact O-N 3.46Å; N218-L220 VanDerWaalsContact C-N 3.26Å; N218-L220 PolarHBondContact O-N 3.15Å; L220-I222 VanDerWaalsContact C-N 3.32Å; L220-I222 PolarHBondContact O-N 3.48Å; L220-A223 PolarHBondContact O-N 3Å; L220-Q224 WeakPolarHBondContact O-CG 3.41Å; L220-Q224 PolarHBondContact O-N 2.94Å
221T94.3Very high93.6Very high6 Ų659.7 Ų59.74%0.03728%0.277CS..Hα-helixtrans-64.2-37.8175.3-50.60000111.7K217 N218 Q224 M225 F266 F269 Y270K217-T221 PolarHBondContact O-N 3.47Å; K217-T221 PolarHBondContact O-OG1 3.07Å; N218-T221 PolarHBondContact O-N 2.96Å; T221-Q224 WeakPolarHBondContact O-CB 3.31Å; T221-Q224 PolarHBondContact O-N 3.46Å; T221-M225 PolarHBondContact O-N 2.94Å; T221-M225 VanDerWaalsContact O-N 3.13Å; T221-F266 HydrophobicContact CG2-CD1 4.25Å; T221-F269 HydrophobicContact CG2-CD1 4.11Å; T221-F269 HydrophobicContact CG2-CE1 4.22Å; T221-Y270 HydrophobicContact CG2-CD2 3.87Å
222I95.3Very high94.2Very high50 Ų5055.8 Ų55.826%0.25626%0.26SS..Hα-helixtrans-64.1-45.3174.3-63.2169.8000110.6N218 Y219 L220 Q224 M225 I226 Y270N218-I222 WeakPolarHBondContact O-CG1 3.44Å; N218-I222 PolarHBondContact O-N 3.35Å; N218-I222 VanDerWaalsContact O-N 3.08Å; Y219-I222 HydrophobicContact CD1-CD1 4.45Å; Y219-I222 PolarHBondContact O-N 3.46Å; L220-I222 VanDerWaalsContact C-N 3.32Å; L220-I222 PolarHBondContact O-N 3.48Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.43Å; I222-M225 HydrophobicContact CB-CE 4.5Å; I222-M225 HydrophobicContact CG1-CE 4.2Å; I222-M225 PolarHBondContact O-N 2.87Å; I222-I226 HydrophobicContact CG2-CD1 3.89Å; I222-I226 HydrophobicContact CG2-CG1 4.37Å; I222-I226 WeakPolarHBondContact O-CG1 3.43Å; I222-I226 PolarHBondContact O-N 2.98Å; I222-Y270 HydrophobicContact CD1-CE2 4.08Å; I222-Y270 HydrophobicContact CG1-CD2 4.42Å; I222-Y270 HydrophobicContact CG1-CE2 3.58Å
223A97.2Very high94.9Very high32 Ų3254.4 Ų54.426%0.26426%0.258SS..Hα-helixtrans-59.1-39.8177.100000111.4I195 Y219 L220 M225 I226 Q227I195-A223 HydrophobicContact CD1-CB 3.81Å; Y219-A223 WeakPolarHBondContact O-CB 3.36Å; Y219-A223 PolarHBondContact O-N 3.13Å; L220-A223 PolarHBondContact O-N 3Å; A223-M225 PolarHBondContact O-N 2.84Å; A223-I226 PolarHBondContact O-N 2.72Å; A223-Q227 PolarHBondContact O-N 2.81Å
224Q96.9Very high95.4Very high19 Ų1952.1 Ų52.19%0.08925%0.245CC..Hα-helixtrans-61.6-40173.3-73.5177.6-52.600112.8I195 M199 L220 T221 I222 Q227 F228 F266I195-Q224 HydrophobicContact CG2-CG 3.62Å; M199-Q224 PolarHBondContact SD-NE2 3.01Å; L220-Q224 WeakPolarHBondContact O-CG 3.41Å; L220-Q224 PolarHBondContact O-N 2.94Å; T221-Q224 WeakPolarHBondContact O-CB 3.31Å; T221-Q224 PolarHBondContact O-N 3.46Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.43Å; Q224-Q227 VanDerWaalsContact O-CB 3.32Å; Q224-Q227 WeakPolarHBondContact O-CB 3.03Å; Q224-Q227 WeakPolarHBondContact O-CG 3.48Å; Q224-Q227 PolarHBondContact O-N 3.28Å; Q224-Q227 PolarHBondContact O-NE2 2.97Å; Q224-F228 WeakPolarHBondContact O-CD2 3.44Å; Q224-F228 WeakPolarHBondContact O-CE2 3.42Å; Q224-F228 PolarHBondContact O-N 3.41Å; Q224-F266 HydrophobicContact CB-CD1 4.39Å; Q224-F266 HydrophobicContact CB-CE1 4.28Å
225M97.2Very high95.8Very high25 Ų2550.9 Ų50.912%0.12324%0.239CC..Hα-helixtrans-68.4-41.1176.2-67.6-174-63.200111.8T221 I222 A223 Q227 F228 I229 L263 F266 Y270T221-M225 PolarHBondContact O-N 2.94Å; T221-M225 VanDerWaalsContact O-N 3.13Å; I222-M225 HydrophobicContact CB-CE 4.5Å; I222-M225 HydrophobicContact CG1-CE 4.2Å; I222-M225 PolarHBondContact O-N 2.87Å; A223-M225 PolarHBondContact O-N 2.84Å; M225-Q227 VanDerWaalsContact C-N 3.25Å; M225-Q227 PolarHBondContact O-N 3.25Å; M225-F228 PolarHBondContact O-N 3.15Å; M225-F228 VanDerWaalsContact O-N 3.11Å; M225-I229 WeakPolarHBondContact O-CG1 3.25Å; M225-I229 PolarHBondContact O-N 2.67Å; M225-I229 VanDerWaalsContact O-N 3.15Å; M225-L263 HydrophobicContact CB-CD1 3.92Å; M225-L263 HydrophobicContact CG-CD1 4.22Å; M225-F266 HydrophobicContact CG-CB 3.96Å; M225-Y270 HydrophobicContact CE-CD1 4.46Å; M225-Y270 HydrophobicContact CE-CD2 3.86Å; M225-Y270 HydrophobicContact CE-CE2 4.28Å; M225-Y270 HydrophobicContact CE-CG 3.96Å
226I97.9Very high96.1Very high87 Ų8743.5 Ų43.545%0.44622%0.217SC..Hα-helixtrans-58.8-40.1174.2-68.5169.8000110.5I222 A223 F228 I229 I230I222-I226 HydrophobicContact CG2-CD1 3.89Å; I222-I226 HydrophobicContact CG2-CG1 4.37Å; I222-I226 WeakPolarHBondContact O-CG1 3.43Å; I222-I226 PolarHBondContact O-N 2.98Å; A223-I226 PolarHBondContact O-N 2.72Å; I226-F228 VanDerWaalsContact C-N 3.27Å; I226-F228 PolarHBondContact O-N 3.04Å; I226-I229 PolarHBondContact O-N 3.35Å; I226-I229 VanDerWaalsContact O-N 3.16Å; I226-I230 HydrophobicContact CG2-CD1 3.88Å; I226-I230 HydrophobicContact CG2-CG1 4.32Å; I226-I230 WeakPolarHBondContact O-CG1 3.28Å; I226-I230 PolarHBondContact O-N 2.99Å
227Q98Very high96.3Very high6 Ų642.6 Ų42.63%0.02822%0.216CC..Hα-helixtrans-53.3-43.8174.8115.5-171.3-86.300112V191 I195 A223 Q224 M225 I230 F231V191-Q227 HydrophobicContact CG1-CB 4.01Å; I195-Q227 HydrophobicContact CD1-CB 4.37Å; I195-Q227 HydrophobicContact CG1-CB 3.85Å; A223-Q227 PolarHBondContact O-N 2.81Å; Q224-Q227 VanDerWaalsContact O-CB 3.32Å; Q224-Q227 WeakPolarHBondContact O-CB 3.03Å; Q224-Q227 WeakPolarHBondContact O-CG 3.48Å; Q224-Q227 PolarHBondContact O-N 3.28Å; Q224-Q227 PolarHBondContact O-NE2 2.97Å; M225-Q227 VanDerWaalsContact C-N 3.25Å; M225-Q227 PolarHBondContact O-N 3.25Å; Q227-I230 PolarHBondContact O-N 3.34Å; Q227-F231 HydrophobicContact CG-CD2 4.45Å; Q227-F231 HydrophobicContact CG-CE2 3.96Å; Q227-F231 HydrophobicContact CG-CZ 4.48Å; Q227-F231 WeakPolarHBondContact O-CD2 3.25Å; Q227-F231 WeakPolarHBondContact O-CG 3.39Å; Q227-F231 PolarHBondContact O-N 3Å
228F97.9Very high96.4Very high8 Ų839.2 Ų39.24%0.03520%0.201CC..Hα-helixtrans-72.9-35.5-178-59.7-49.6000111.2Q224 M225 I226 F231 I232 A259 F262 L263 F266Q224-F228 WeakPolarHBondContact O-CD2 3.44Å; Q224-F228 WeakPolarHBondContact O-CE2 3.42Å; Q224-F228 PolarHBondContact O-N 3.41Å; M225-F228 PolarHBondContact O-N 3.15Å; M225-F228 VanDerWaalsContact O-N 3.11Å; I226-F228 VanDerWaalsContact C-N 3.27Å; I226-F228 PolarHBondContact O-N 3.04Å; F228-F231 HydrophobicContact CD1-CD2 4.24Å; F228-F231 PolarHBondContact O-N 3.19Å; F228-I232 VanDerWaalsContact O-CG1 3.29Å; F228-I232 WeakPolarHBondContact O-CG1 3.43Å; F228-I232 PolarHBondContact O-N 3.28Å; F228-A259 HydrophobicContact CB-CB 4.2Å; F228-A259 HydrophobicContact CD1-CB 4.37Å; F228-F262 HydrophobicContact CD1-CB 4.13Å; F228-F262 HydrophobicContact CD2-CB 4.09Å; F228-F262 HydrophobicContact CE1-CB 3.76Å; F228-F262 AromaticContact CE1-CD2 3.97Å; F228-F262 HydrophobicContact CE1-CD2 3.97Å; F228-F262 HydrophobicContact CE1-CG 4.22Å; F228-F262 HydrophobicContact CE2-CB 3.74Å; F228-F262 HydrophobicContact CG-CB 4.31Å; F228-F262 HydrophobicContact CZ-CB 3.56Å; F228-F262 HydrophobicContact CZ-CD2 4.31Å; F228-F262 HydrophobicContact CZ-CG 4.15Å; F228-L263 HydrophobicContact CB-CB 4.13Å; F228-L263 HydrophobicContact CB-CD1 4.48Å; F228-L263 HydrophobicContact CD2-CB 4.48Å; F228-F266 HydrophobicContact CE2-CB 4.47Å; F228-F266 AromaticContact CE2-CD2 3.54Å; F228-F266 HydrophobicContact CE2-CD2 3.54Å; F228-F266 AromaticContact CE2-CE2 3.86Å; F228-F266 HydrophobicContact CE2-CE2 3.86Å; F228-F266 AromaticContact CE2-CG 4Å; F228-F266 HydrophobicContact CE2-CG 4Å; F228-F266 HydrophobicContact CZ-CD2 4.06Å; F228-F266 AromaticContact CZ-CE2 3.93Å; F228-F266 HydrophobicContact CZ-CE2 3.93Å
229I98.3Very high96.5Very high76 Ų7642.3 Ų42.339%0.3921%0.213SC..Hα-helixtrans-62.9-44.6173.1-64.2168.2000110.2M225 I226 F231 I232 L233 L263M225-I229 WeakPolarHBondContact O-CG1 3.25Å; M225-I229 PolarHBondContact O-N 2.67Å; M225-I229 VanDerWaalsContact O-N 3.15Å; I226-I229 PolarHBondContact O-N 3.35Å; I226-I229 VanDerWaalsContact O-N 3.16Å; I229-F231 VanDerWaalsContact C-N 3.3Å; I229-F231 PolarHBondContact O-N 3.1Å; I229-I232 PolarHBondContact O-N 2.94Å; I229-L233 HydrophobicContact CG2-CD1 3.87Å; I229-L233 HydrophobicContact CG2-CG 4.28Å; I229-L233 WeakPolarHBondContact O-CG 3.45Å; I229-L233 PolarHBondContact O-N 2.9Å; I229-L263 HydrophobicContact CG1-CD1 4.3Å; I229-L263 HydrophobicContact CG1-CD2 4.06Å
230I98.1Very high96.4Very high66 Ų6639.6 Ų39.634%0.33821%0.209SC..Hα-helixtrans-57.4-45.8174.9-68.4166.6000110.2M187 V191 I226 Q227 L233 H234M187-I230 HydrophobicContact CG-CG2 4.39Å; V191-I230 HydrophobicContact CG1-CD1 4.47Å; V191-I230 HydrophobicContact CG2-CG2 4.29Å; I226-I230 HydrophobicContact CG2-CD1 3.88Å; I226-I230 HydrophobicContact CG2-CG1 4.32Å; I226-I230 WeakPolarHBondContact O-CG1 3.28Å; I226-I230 PolarHBondContact O-N 2.99Å; Q227-I230 PolarHBondContact O-N 3.34Å; I230-L233 PolarHBondContact O-N 3.38Å; I230-H234 WeakPolarHBondContact O-CB 3.29Å; I230-H234 PolarHBondContact O-N 3.49Å
231F98.2Very high96Very high1 Ų145.6 Ų45.60%0.00425%0.248CC..Hα-helixtrans-61.2-45.6176.7-64.3-24.9000112.8F188 V191 N192 Q227 F228 I229 L233 Q235 I255 A259F188-F231 HydrophobicContact CB-CE1 4.46Å; F188-F231 HydrophobicContact CD2-CD1 4.21Å; F188-F231 AromaticContact CD2-CD2 3.84Å; F188-F231 HydrophobicContact CD2-CD2 3.84Å; F188-F231 AromaticContact CD2-CE1 3.88Å; F188-F231 HydrophobicContact CD2-CE1 3.88Å; F188-F231 AromaticContact CD2-CE2 3.49Å; F188-F231 HydrophobicContact CD2-CE2 3.49Å; F188-F231 VanDerWaalsContact CD2-CE2 3.49Å; F188-F231 HydrophobicContact CD2-CG 4.2Å; F188-F231 AromaticContact CD2-CZ 3.52Å; F188-F231 HydrophobicContact CD2-CZ 3.52Å; F188-F231 AromaticContact CE2-CD2 3.86Å; F188-F231 HydrophobicContact CE2-CD2 3.86Å; F188-F231 AromaticContact CE2-CE2 3.45Å; F188-F231 HydrophobicContact CE2-CE2 3.45Å; F188-F231 VanDerWaalsContact CE2-CE2 3.45Å; F188-F231 AromaticContact CE2-CZ 3.9Å; F188-F231 HydrophobicContact CE2-CZ 3.9Å; F188-F231 HydrophobicContact CG-CZ 4.33Å; V191-F231 HydrophobicContact CB-CE1 3.74Å; V191-F231 HydrophobicContact CB-CZ 4.05Å; V191-F231 HydrophobicContact CG1-CE1 4.22Å; V191-F231 HydrophobicContact CG1-CZ 4.33Å; V191-F231 HydrophobicContact CG2-CE1 4.35Å; N192-F231 HydrophobicContact CB-CZ 4.22Å; Q227-F231 HydrophobicContact CG-CD2 4.45Å; Q227-F231 HydrophobicContact CG-CE2 3.96Å; Q227-F231 HydrophobicContact CG-CZ 4.48Å; Q227-F231 WeakPolarHBondContact O-CD2 3.25Å; Q227-F231 WeakPolarHBondContact O-CG 3.39Å; Q227-F231 PolarHBondContact O-N 3Å; F228-F231 HydrophobicContact CD1-CD2 4.24Å; F228-F231 PolarHBondContact O-N 3.19Å; I229-F231 VanDerWaalsContact C-N 3.3Å; I229-F231 PolarHBondContact O-N 3.1Å; F231-L233 PolarHBondContact O-N 3.1Å; F231-Q235 WeakPolarHBondContact O-CB 3.11Å; F231-Q235 WeakPolarHBondContact O-CG 3.47Å; F231-Q235 PolarHBondContact O-N 2.88Å; F231-I255 HydrophobicContact CB-CG2 4.04Å; F231-I255 HydrophobicContact CG-CG2 4.42Å; F231-A259 HydrophobicContact CB-CB 4.02Å
232I98.3Very high95.6Very high43 Ų4350.1 Ų50.122%0.22128%0.28CS..Hα-helixtrans-60.6-47.2178.9-68.5163.2000110.7F228 I229 G236 A259 L263F228-I232 VanDerWaalsContact O-CG1 3.29Å; F228-I232 WeakPolarHBondContact O-CG1 3.43Å; F228-I232 PolarHBondContact O-N 3.28Å; I229-I232 PolarHBondContact O-N 2.94Å; I232-G236 VanDerWaalsContact O-CA 3.29Å; I232-G236 WeakPolarHBondContact O-CA 3.32Å; I232-G236 PolarHBondContact O-N 3.36Å; I232-A259 HydrophobicContact CD1-CB 4.28Å; I232-A259 HydrophobicContact CG1-CB 3.79Å; I232-L263 HydrophobicContact CD1-CD2 4.08Å
233L97.5Very high95.2Very high123 Ų12349.7 Ų49.764%0.64428%0.28SS*.Hα-helixtrans-69.6-48-177.9-66.5177.3000112I229 I230 F231 G236 Q237I229-L233 HydrophobicContact CG2-CD1 3.87Å; I229-L233 HydrophobicContact CG2-CG 4.28Å; I229-L233 WeakPolarHBondContact O-CG 3.45Å; I229-L233 PolarHBondContact O-N 2.9Å; I230-L233 PolarHBondContact O-N 3.38Å; F231-L233 PolarHBondContact O-N 3.1Å; L233-G236 PolarHBondContact O-N 3.2Å; L233-Q237 PolarHBondContact O-N 2.88Å
234H97.2Very high94.7Very high12 Ų1254.9 Ų54.96%0.05631%0.308CS..Hα-helixtrans-65.3-50.3-177.5-174.5-86.4000111.3L112 I184 M187 I230 G236 Q237L112-H234 PolarHBondContact O-CD2 3.4Å; I184-H234 WeakPolarHBondContact CD1-O 3.22Å; I184-H234 VanDerWaalsContact CG1-CE1 3.47Å; I184-H234 WeakPolarHBondContact CG1-CE1 3.29Å; I184-H234 PolarHBondContact O-CE1 2.79Å; I184-H234 VanDerWaalsContact O-CE1 3.23Å; M187-H234 WeakPolarHBondContact CE-NE2 3.46Å; M187-H234 HydrophobicContact CG-CB 4.42Å; I230-H234 WeakPolarHBondContact O-CB 3.29Å; I230-H234 PolarHBondContact O-N 3.49Å; H234-G236 VanDerWaalsContact C-N 3.28Å; H234-G236 PolarHBondContact O-N 3.27Å; H234-Q237 WeakPolarHBondContact O-CB 3.21Å; H234-Q237 WeakPolarHBondContact O-CG 3.12Å; H234-Q237 PolarHBondContact O-N 3.5Å
235Q96.7Very high94.3Very high0 Ų054.9 Ų54.90%031%0.311CS..Hα-helixtrans-71-27.4178.8-57.1-52.4-48.500111.9I184 F231 Q237 L238 P252 I255 I256I184-Q235 PolarHBondContact O-NE2 3.23Å; F231-Q235 WeakPolarHBondContact O-CB 3.11Å; F231-Q235 WeakPolarHBondContact O-CG 3.47Å; F231-Q235 PolarHBondContact O-N 2.88Å; Q235-Q237 PolarHBondContact O-N 3.14Å; Q235-L238 PolarHBondContact O-N 3.33Å; Q235-P252 HydrophobicContact CB-CB 4.03Å; Q235-I255 HydrophobicContact CG-CB 4.12Å; Q235-I255 HydrophobicContact CG-CD1 4.3Å; Q235-I255 HydrophobicContact CG-CG2 3.72Å; Q235-I256 HydrophobicContact CB-CD1 4.16Å; Q235-I256 HydrophobicContact CB-CG1 3.85Å
236G96.1Very high93.9Very high21 Ų2159.9 Ų59.922%0.21634%0.338CS..Hα-helixtrans-62.5-24.8176.300000114I232 L233 H234 L238 F239I232-G236 VanDerWaalsContact O-CA 3.29Å; I232-G236 WeakPolarHBondContact O-CA 3.32Å; I232-G236 PolarHBondContact O-N 3.36Å; L233-G236 PolarHBondContact O-N 3.2Å; H234-G236 VanDerWaalsContact C-N 3.28Å; H234-G236 PolarHBondContact O-N 3.27Å; G236-L238 PolarHBondContact O-N 2.87Å; G236-F239 PolarHBondContact O-N 3.5Å
237Q95Very high93.6Very high51 Ų5156 Ų5624%0.23832%0.318CS..G310 helixtrans-54.9-37178.7-66.5174.2-3.500112.5L112 G113 C114 L233 H234 Q235 F239 L240 T243L112-Q237 PolarHBondContact O-NE2 3.14Å; L112-Q237 PolarHBondContact O-OE1 3.07Å; G113-Q237 VanDerWaalsContact CA-OE1 3.3Å; C114-Q237 VanDerWaalsContact N-OE1 3.1Å; L233-Q237 PolarHBondContact O-N 2.88Å; H234-Q237 WeakPolarHBondContact O-CB 3.21Å; H234-Q237 WeakPolarHBondContact O-CG 3.12Å; H234-Q237 PolarHBondContact O-N 3.5Å; Q235-Q237 PolarHBondContact O-N 3.14Å; Q237-F239 PolarHBondContact O-N 3.31Å; Q237-F239 VanDerWaalsContact O-N 3.16Å; Q237-L240 WeakPolarHBondContact O-CB 3.32Å; Q237-L240 PolarHBondContact O-N 3.38Å; Q237-L240 VanDerWaalsContact O-N 3.1Å; Q237-T243 WeakPolarHBondContact O-CB 3.21Å; Q237-T243 PolarHBondContact O-OG1 2.93Å
238L93.2Very high93.3Very high5 Ų557.3 Ų57.33%0.02633%0.326CS..G310 helixtrans-63.5-19.2179.5-173.464.4000113.5I184 Q235 G236 C245 Y247 K249 P252I184-L238 HydrophobicContact CD1-CB 4.39Å; Q235-L238 PolarHBondContact O-N 3.33Å; G236-L238 PolarHBondContact O-N 2.87Å; L238-C245 HydrophobicContact CD1-CB 4Å; L238-C245 WeakPolarHBondContact CD1-O 3.49Å; L238-Y247 HydrophobicContact CD2-CD1 4.39Å; L238-K249 HydrophobicContact CD2-CB 4.36Å; L238-K249 HydrophobicContact CD2-CG 3.91Å; L238-K249 HydrophobicContact CG-CG 4.21Å; L238-P252 HydrophobicContact CD2-CB 4.01Å; L238-P252 HydrophobicContact CD2-CG 3.62Å
239F93.4Very high93Very high96 Ų9663 Ų6342%0.42135%0.351SS..G310 helixtrans-98.3-2.4179.2-58.4-82.2000113.1G236 Q237 K249 P252 A253 I256G236-F239 PolarHBondContact O-N 3.5Å; Q237-F239 PolarHBondContact O-N 3.31Å; Q237-F239 VanDerWaalsContact O-N 3.16Å; F239-K249 HydrophobicContact CE1-CB 4.08Å; F239-K249 HydrophobicContact CE1-CD 4.38Å; F239-K249 HydrophobicContact CE1-CG 4.5Å; F239-K249 HydrophobicContact CZ-CB 4.25Å; F239-P252 HydrophobicContact CE2-CB 4.06Å; F239-P252 HydrophobicContact CZ-CB 4.45Å; F239-A253 HydrophobicContact CE1-CB 4.46Å; F239-A253 HydrophobicContact CZ-CB 3.77Å; F239-I256 HydrophobicContact CD2-CD1 3.78Å; F239-I256 HydrophobicContact CE2-CD1 3.55Å
240L92.8Very high92.7Very high91 Ų9161.6 Ų61.648%0.47634%0.344SS..SBendtrans-75.3135.6173.8-62.2175.5000110.2Q237 S242 T243Q237-L240 WeakPolarHBondContact O-CB 3.32Å; Q237-L240 PolarHBondContact O-N 3.38Å; Q237-L240 VanDerWaalsContact O-N 3.1Å; L240-S242 PolarHBondContact O-N 2.95Å; L240-S242 VanDerWaalsContact O-N 3.13Å; L240-T243 PolarHBondContact O-N 2.84Å; L240-T243 VanDerWaalsContact O-N 3.1Å
241P87.1Confident92.5Very high139 Ų13959.3 Ų59.390%0.90333%0.332SS*.THydrogen-bonded Turntrans-58.4-26.7178.9-25.734.1000114.4T243P241-T243 VanDerWaalsContact C-N 3.3Å; P241-T243 PolarHBondContact O-N 3.43Å
242S86.1Confident92.3Very high101 Ų10159.2 Ų59.271%0.70633%0.331SS*.THydrogen-bonded Turntrans-77.8-10-179.750.10000114.2L240L240-S242 PolarHBondContact O-N 2.95Å; L240-S242 VanDerWaalsContact O-N 3.13Å
243T86.1Confident92.2Very high41 Ų4158.9 Ų58.925%0.25234%0.335SS..  trans-92.1110.4-171.8-58.30000111.4C114 Q237 L240 P241 C245C114-T243 HydrophobicContact CB-CG2 3.8Å; Q237-T243 WeakPolarHBondContact O-CB 3.21Å; Q237-T243 PolarHBondContact O-OG1 2.93Å; L240-T243 PolarHBondContact O-N 2.84Å; L240-T243 VanDerWaalsContact O-N 3.1Å; P241-T243 VanDerWaalsContact C-N 3.3Å; P241-T243 PolarHBondContact O-N 3.43Å; T243-C245 HydrophobicContact CG2-CB 3.66Å; T243-C245 PolarHBondContact O-N 3.26Å
244T85.9Confident92.1Very high141 Ų14154.7 Ų54.787%0.86532%0.318SS*.  trans-9070.8174.456.20000110.5
245C89.2Confident92Very high20 Ų2055.3 Ų55.314%0.13532%0.321CS..  trans-129.6122.3-176.4-174.30000110.8C114 L238 T243 Y247C114-C245 HydrophobicContact CB-CB 3.5Å; C114-C245 WeakPolarHBondContact CB-SG 3.5Å; C114-C245 WeakPolarHBondContact SG-CB 3.37Å; C114-C245 CovalentContact SG-SG 2.03Å; C114-C245 PolarHBondContact SG-SG 3.03Å; L238-C245 HydrophobicContact CD1-CB 4Å; L238-C245 WeakPolarHBondContact CD1-O 3.49Å; T243-C245 HydrophobicContact CG2-CB 3.66Å; T243-C245 PolarHBondContact O-N 3.26Å; C245-Y247 PolarHBondContact O-N 3.33Å
246N88.7Confident92.1Very high129 Ų12957 Ų5769%0.6933%0.33SS*.  trans-92.881.1-179.4-167.618.8000111.5E116E116-N246 WeakPolarHBondContact OE1-CB 3.41Å; E116-N246 PolarHBondContact OE1-N 3.04Å
247Y91.4Very high92.1Very high6 Ų661.4 Ų61.42%0.02435%0.348CS..  trans-124.6142.2173.3-165.2-83.4000110.5L117 A180 G182 I184 T185 L238 C245 K249 F251 P252L117-Y247 HydrophobicContact CB-CD2 3.85Å; L117-Y247 HydrophobicContact CB-CE2 3.88Å; L117-Y247 HydrophobicContact CD1-CE2 3.79Å; L117-Y247 HydrophobicContact CG-CE2 4.45Å; A180-Y247 HydrophobicContact CB-CE1 4.27Å; A180-Y247 VanDerWaalsContact CB-OH 3.29Å; A180-Y247 WeakPolarHBondContact CB-OH 3.32Å; A180-Y247 PolarHBondContact O-OH 3.46Å; G182-Y247 PolarHBondContact O-OH 3.46Å; I184-Y247 HydrophobicContact CG2-CD1 3.89Å; I184-Y247 HydrophobicContact CG2-CD2 4.04Å; I184-Y247 HydrophobicContact CG2-CE1 4.14Å; I184-Y247 HydrophobicContact CG2-CE2 4.27Å; I184-Y247 HydrophobicContact CG2-CG 3.85Å; T185-Y247 HydrophobicContact CG2-CE1 3.76Å; T185-Y247 WeakPolarHBondContact CG2-OH 3.48Å; T185-Y247 PolarHBondContact OG1-OH 3.19Å; T185-Y247 VanDerWaalsContact OG1-OH 3.09Å; L238-Y247 HydrophobicContact CD2-CD1 4.39Å; C245-Y247 PolarHBondContact O-N 3.33Å; Y247-K249 PolarHBondContact O-N 3.5Å; Y247-F251 HydrophobicContact CE1-CB 4.35Å; Y247-F251 HydrophobicContact CE1-CD2 4.2Å; Y247-P252 HydrophobicContact CD1-CG 3.84Å; Y247-P252 HydrophobicContact CE1-CG 4.03Å
248P91.5Very high92.2Very high33 Ų3362.3 Ų62.321%0.21435%0.35CS..  trans-58.8111177.2-22.331.7000112.1P13 I250 F251 P252P13-P248 HydrophobicContact CG-CG 4.46Å; P248-I250 PolarHBondContact O-N 3.49Å; P248-I250 VanDerWaalsContact O-N 3.09Å; P248-F251 HydrophobicContact CB-CD2 3.92Å; P248-F251 HydrophobicContact CB-CE2 3.84Å; P248-F251 HydrophobicContact CG-CE2 4.39Å; P248-F251 PolarHBondContact O-N 3.2Å; P248-P252 WeakPolarHBondContact O-CD 3.23Å
249K91.6Very high92.4Very high127 Ų12762.2 Ų62.255%0.55235%0.349SS*.THydrogen-bonded Turntrans-63.7-20.3-169.7-63.4-176179.5-176.50114.5L238 F239 Y247 F251 P252 A253L238-K249 HydrophobicContact CD2-CB 4.36Å; L238-K249 HydrophobicContact CD2-CG 3.91Å; L238-K249 HydrophobicContact CG-CG 4.21Å; F239-K249 HydrophobicContact CE1-CB 4.08Å; F239-K249 HydrophobicContact CE1-CD 4.38Å; F239-K249 HydrophobicContact CE1-CG 4.5Å; F239-K249 HydrophobicContact CZ-CB 4.25Å; Y247-K249 PolarHBondContact O-N 3.5Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 2.66Å; K249-P252 WeakPolarHBondContact O-CD 3.29Å; K249-A253 VanDerWaalsContact O-CB 3.25Å; K249-A253 WeakPolarHBondContact O-CB 3.39Å; K249-A253 PolarHBondContact O-N 3.46Å
250I92Very high92.6Very high48 Ų4860.2 Ų60.225%0.24635%0.345CS..Hα-helixtrans-62.1-38.8-178.1-169.954.8000112.7L11 L12 P248 A253 A254L11-I250 HydrophobicContact CD1-CD1 3.98Å; L11-I250 HydrophobicContact CD2-CD1 3.61Å; L11-I250 HydrophobicContact CD2-CG1 3.88Å; L11-I250 HydrophobicContact CG-CB 4.1Å; L11-I250 HydrophobicContact CG-CD1 3.63Å; L11-I250 HydrophobicContact CG-CG1 3.74Å; L11-I250 VanDerWaalsContact O-CB 3.29Å; L11-I250 WeakPolarHBondContact O-CB 3.31Å; L11-I250 WeakPolarHBondContact O-CG2 3.48Å; L12-I250 HydrophobicContact CD2-CG2 4.23Å; P248-I250 PolarHBondContact O-N 3.49Å; P248-I250 VanDerWaalsContact O-N 3.09Å; I250-A253 PolarHBondContact O-N 2.92Å; I250-A254 WeakPolarHBondContact O-CB 3.24Å; I250-A254 PolarHBondContact O-N 2.93Å
251F93.9Very high92.8Very high17 Ų1758.3 Ų58.38%0.07534%0.337CS..Hα-helixtrans-73.3-47.4-175.6-50-79.9000111.2L12 P13 Y179 A180 T185 Y247 P248 K249 A253 A254 I255L12-F251 HydrophobicContact CD2-CE1 4.08Å; L12-F251 HydrophobicContact CD2-CZ 3.78Å; P13-F251 HydrophobicContact CG-CE2 4.17Å; P13-F251 HydrophobicContact CG-CZ 4.34Å; Y179-F251 HydrophobicContact CG-CZ 4.45Å; A180-F251 HydrophobicContact CB-CD2 3.53Å; A180-F251 HydrophobicContact CB-CE2 3.42Å; A180-F251 VanDerWaalsContact CB-CE2 3.42Å; A180-F251 HydrophobicContact CB-CG 4.26Å; A180-F251 HydrophobicContact CB-CZ 4.07Å; T185-F251 HydrophobicContact CG2-CB 4.33Å; Y247-F251 HydrophobicContact CE1-CB 4.35Å; Y247-F251 HydrophobicContact CE1-CD2 4.2Å; P248-F251 HydrophobicContact CB-CD2 3.92Å; P248-F251 HydrophobicContact CB-CE2 3.84Å; P248-F251 HydrophobicContact CG-CE2 4.39Å; P248-F251 PolarHBondContact O-N 3.2Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 2.66Å; F251-A253 VanDerWaalsContact C-N 3.31Å; F251-A253 PolarHBondContact O-N 2.82Å; F251-A254 PolarHBondContact O-N 3.06Å; F251-I255 WeakPolarHBondContact O-CG1 3.15Å; F251-I255 PolarHBondContact O-N 2.91Å
252P94.7Very high93.2Very high0 Ų051.9 Ų51.90%030%0.295CS..Hα-helixtrans-60.6-39172.2-29.743000112.4I184 T185 Q235 L238 F239 Y247 P248 K249 A254 I255 I256I184-P252 HydrophobicContact CG2-CG 3.91Å; T185-P252 HydrophobicContact CG2-CG 4.47Å; Q235-P252 HydrophobicContact CB-CB 4.03Å; L238-P252 HydrophobicContact CD2-CB 4.01Å; L238-P252 HydrophobicContact CD2-CG 3.62Å; F239-P252 HydrophobicContact CE2-CB 4.06Å; F239-P252 HydrophobicContact CZ-CB 4.45Å; Y247-P252 HydrophobicContact CD1-CG 3.84Å; Y247-P252 HydrophobicContact CE1-CG 4.03Å; P248-P252 WeakPolarHBondContact O-CD 3.23Å; K249-P252 WeakPolarHBondContact O-CD 3.29Å; P252-A254 PolarHBondContact O-N 3.4Å; P252-I255 PolarHBondContact O-N 3.47Å; P252-I256 VanDerWaalsContact O-CG1 3.24Å; P252-I256 WeakPolarHBondContact O-CG1 3.16Å; P252-I256 PolarHBondContact O-N 2.89Å
253A95.3Very high93.7Very high36 Ų3648.9 Ų48.930%0.29827%0.271SS..Hα-helixtrans-60.1-45173.900000112.2F239 K249 I250 F251 I256 L257F239-A253 HydrophobicContact CE1-CB 4.46Å; F239-A253 HydrophobicContact CZ-CB 3.77Å; K249-A253 VanDerWaalsContact O-CB 3.25Å; K249-A253 WeakPolarHBondContact O-CB 3.39Å; K249-A253 PolarHBondContact O-N 3.46Å; I250-A253 PolarHBondContact O-N 2.92Å; F251-A253 VanDerWaalsContact C-N 3.31Å; F251-A253 PolarHBondContact O-N 2.82Å; A253-I256 PolarHBondContact O-N 3.5Å; A253-L257 WeakPolarHBondContact O-CB 3.34Å; A253-L257 PolarHBondContact O-N 3.41Å
254A95.3Very high94.2Very high34 Ų3452.1 Ų52.128%0.28129%0.286SS..Hα-helixtrans-63.2-44.3176.700000111.3I250 F251 P252 I256 L257 Y258I250-A254 WeakPolarHBondContact O-CB 3.24Å; I250-A254 PolarHBondContact O-N 2.93Å; F251-A254 PolarHBondContact O-N 3.06Å; P252-A254 PolarHBondContact O-N 3.4Å; A254-I256 VanDerWaalsContact C-N 3.34Å; A254-I256 PolarHBondContact O-N 3.37Å; A254-L257 WeakPolarHBondContact O-CB 3.18Å; A254-L257 PolarHBondContact O-N 3.39Å; A254-Y258 WeakPolarHBondContact O-CD2 3.2Å; A254-Y258 PolarHBondContact O-N 3.33Å
255I96.5Very high94.6Very high25 Ų2547.5 Ų47.513%0.12826%0.255CS..Hα-helixtrans-59.9-44.6176.7-65.7164.9000110.7T185 F188 F231 Q235 F251 P252 L257 Y258 A259T185-I255 HydrophobicContact CG2-CD1 3.83Å; F188-I255 HydrophobicContact CD2-CG2 4.13Å; F231-I255 HydrophobicContact CB-CG2 4.04Å; F231-I255 HydrophobicContact CG-CG2 4.42Å; Q235-I255 HydrophobicContact CG-CB 4.12Å; Q235-I255 HydrophobicContact CG-CD1 4.3Å; Q235-I255 HydrophobicContact CG-CG2 3.72Å; F251-I255 WeakPolarHBondContact O-CG1 3.15Å; F251-I255 PolarHBondContact O-N 2.91Å; P252-I255 PolarHBondContact O-N 3.47Å; I255-L257 PolarHBondContact O-N 3.05Å; I255-Y258 PolarHBondContact O-N 2.94Å; I255-A259 WeakPolarHBondContact O-CB 3.33Å; I255-A259 PolarHBondContact O-N 3.22Å
256I97.7Very high94.8Very high36 Ų3647.6 Ų47.619%0.18525%0.253CS..Hα-helixtrans-60.7-45.1176.5-68.1164.6000110.9Q235 F239 P252 A253 A254 A259 T260Q235-I256 HydrophobicContact CB-CD1 4.16Å; Q235-I256 HydrophobicContact CB-CG1 3.85Å; F239-I256 HydrophobicContact CD2-CD1 3.78Å; F239-I256 HydrophobicContact CE2-CD1 3.55Å; P252-I256 VanDerWaalsContact O-CG1 3.24Å; P252-I256 WeakPolarHBondContact O-CG1 3.16Å; P252-I256 PolarHBondContact O-N 2.89Å; A253-I256 PolarHBondContact O-N 3.5Å; A254-I256 VanDerWaalsContact C-N 3.34Å; A254-I256 PolarHBondContact O-N 3.37Å; I256-A259 PolarHBondContact O-N 3.05Å; I256-T260 WeakPolarHBondContact O-CB 3.34Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 3.15Å
257L96.9Very high95Very high114 Ų11443.9 Ų43.960%0.59724%0.235SC*.Hα-helixtrans-60-52.2178.4177.466.3000111.1A253 A254 I255 T260 V261A253-L257 WeakPolarHBondContact O-CB 3.34Å; A253-L257 PolarHBondContact O-N 3.41Å; A254-L257 WeakPolarHBondContact O-CB 3.18Å; A254-L257 PolarHBondContact O-N 3.39Å; I255-L257 PolarHBondContact O-N 3.05Å; L257-T260 PolarHBondContact O-N 3.11Å; L257-V261 WeakPolarHBondContact O-CG2 3.42Å; L257-V261 PolarHBondContact O-N 3.37Å
258Y96.1Very high95.1Very high70 Ų7047.1 Ų47.128%0.27525%0.253SS..Hα-helixtrans-62.4-44178.7-82.6-72000111.9T168 M169 S172 A254 I255 T260 V261 F262T168-Y258 HydrophobicContact CG2-CE1 4.41Å; M169-Y258 HydrophobicContact CE-CD1 4.17Å; M169-Y258 HydrophobicContact CE-CG 4.49Å; S172-Y258 PolarHBondContact OG-OH 3.41Å; A254-Y258 WeakPolarHBondContact O-CD2 3.2Å; A254-Y258 PolarHBondContact O-N 3.33Å; I255-Y258 PolarHBondContact O-N 2.94Å; Y258-T260 VanDerWaalsContact C-N 3.31Å; Y258-T260 PolarHBondContact O-N 3.43Å; Y258-V261 PolarHBondContact O-N 3.08Å; Y258-F262 HydrophobicContact CD1-CE2 4.26Å; Y258-F262 HydrophobicContact CD1-CZ 4.42Å; Y258-F262 WeakPolarHBondContact O-CD2 3.43Å; Y258-F262 WeakPolarHBondContact O-CG 3.28Å; Y258-F262 PolarHBondContact O-N 2.89Å
259A97.5Very high95.1Very high2 Ų248.6 Ų48.62%0.01726%0.257CS..Hα-helixtrans-61.5-39.5177.100000111.7F228 F231 I232 I255 I256 L263F228-A259 HydrophobicContact CB-CB 4.2Å; F228-A259 HydrophobicContact CD1-CB 4.37Å; F231-A259 HydrophobicContact CB-CB 4.02Å; I232-A259 HydrophobicContact CD1-CB 4.28Å; I232-A259 HydrophobicContact CG1-CB 3.79Å; I255-A259 WeakPolarHBondContact O-CB 3.33Å; I255-A259 PolarHBondContact O-N 3.22Å; I256-A259 PolarHBondContact O-N 3.05Å; A259-L263 WeakPolarHBondContact O-CB 3.5Å; A259-L263 PolarHBondContact O-N 3.03Å
260T97.8Very high95Very high54 Ų5445.1 Ų45.133%0.33124%0.24SC..Hα-helixtrans-65.1-47.5175.9-57.50000111.3I256 L257 Y258 F262 L263 I264I256-T260 WeakPolarHBondContact O-CB 3.34Å; I256-T260 PolarHBondContact O-N 3.37Å; I256-T260 PolarHBondContact O-OG1 3.15Å; L257-T260 PolarHBondContact O-N 3.11Å; Y258-T260 VanDerWaalsContact C-N 3.31Å; Y258-T260 PolarHBondContact O-N 3.43Å; T260-F262 PolarHBondContact O-N 3.4Å; T260-L263 PolarHBondContact O-N 3.26Å; T260-I264 HydrophobicContact CG2-CD1 4.16Å; T260-I264 WeakPolarHBondContact O-CG1 3.39Å; T260-I264 PolarHBondContact O-N 3.34Å
261V96.7Very high95Very high51 Ų5145.5 Ų45.531%0.30924%0.242SC..Hα-helixtrans-59.4-47.8176.9171.60000110.6F164 L257 Y258 I264 L265F164-V261 HydrophobicContact CE1-CG1 3.86Å; F164-V261 HydrophobicContact CZ-CG1 4.29Å; L257-V261 WeakPolarHBondContact O-CG2 3.42Å; L257-V261 PolarHBondContact O-N 3.37Å; Y258-V261 PolarHBondContact O-N 3.08Å; V261-I264 PolarHBondContact O-N 2.96Å; V261-L265 HydrophobicContact CG1-CD1 3.96Å; V261-L265 HydrophobicContact CG1-CG 4.49Å; V261-L265 WeakPolarHBondContact O-CG 3.48Å; V261-L265 PolarHBondContact O-N 2.66Å
262F95.6Very high94.7Very high5 Ų551 Ų512%0.02227%0.266CS..Hα-helixtrans-66-39.8178.1-69.3-44.6000112.6F164 H165 M169 F228 Y258 T260 I264 L265 F266F164-F262 AromaticContact CD1-CE1 3.7Å; F164-F262 HydrophobicContact CD1-CE1 3.7Å; F164-F262 HydrophobicContact CD1-CZ 4.45Å; F164-F262 HydrophobicContact CE1-CD1 4.42Å; F164-F262 AromaticContact CE1-CE1 3.7Å; F164-F262 HydrophobicContact CE1-CE1 3.7Å; F164-F262 HydrophobicContact CE1-CZ 4.22Å; H165-F262 HydrophobicContact CB-CE1 3.81Å; H165-F262 HydrophobicContact CB-CZ 4.09Å; H165-F262 AromaticContact ND1-CE1 3.58Å; H165-F262 AromaticContact ND1-CE2 3.56Å; H165-F262 AromaticContact ND1-CZ 3.23Å; H165-F262 WeakPolarHBondContact ND1-CZ 3.49Å; M169-F262 HydrophobicContact CE-CE2 3.42Å; M169-F262 VanDerWaalsContact CE-CE2 3.42Å; M169-F262 HydrophobicContact CE-CZ 3.68Å; M169-F262 HydrophobicContact SD-CE2 4.13Å; F228-F262 HydrophobicContact CD1-CB 4.13Å; F228-F262 HydrophobicContact CD2-CB 4.09Å; F228-F262 HydrophobicContact CE1-CB 3.76Å; F228-F262 AromaticContact CE1-CD2 3.97Å; F228-F262 HydrophobicContact CE1-CD2 3.97Å; F228-F262 HydrophobicContact CE1-CG 4.22Å; F228-F262 HydrophobicContact CE2-CB 3.74Å; F228-F262 HydrophobicContact CG-CB 4.31Å; F228-F262 HydrophobicContact CZ-CB 3.56Å; F228-F262 HydrophobicContact CZ-CD2 4.31Å; F228-F262 HydrophobicContact CZ-CG 4.15Å; Y258-F262 HydrophobicContact CD1-CE2 4.26Å; Y258-F262 HydrophobicContact CD1-CZ 4.42Å; Y258-F262 WeakPolarHBondContact O-CD2 3.43Å; Y258-F262 WeakPolarHBondContact O-CG 3.28Å; Y258-F262 PolarHBondContact O-N 2.89Å; T260-F262 PolarHBondContact O-N 3.4Å; F262-I264 VanDerWaalsContact C-N 3.29Å; F262-I264 PolarHBondContact O-N 3.05Å; F262-L265 PolarHBondContact O-N 3.1Å; F262-F266 HydrophobicContact CB-CD2 4.31Å; F262-F266 WeakPolarHBondContact O-CB 3.36Å; F262-F266 WeakPolarHBondContact O-CD2 3.48Å; F262-F266 PolarHBondContact O-N 2.92Å
263L97Very high94.3Very high37 Ų3752.7 Ų52.719%0.19428%0.28CS..Hα-helixtrans-58-44.3176.5-177.961.1000111.1M225 F228 I229 I232 A259 T260 T267M225-L263 HydrophobicContact CB-CD1 3.92Å; M225-L263 HydrophobicContact CG-CD1 4.22Å; F228-L263 HydrophobicContact CB-CB 4.13Å; F228-L263 HydrophobicContact CB-CD1 4.48Å; F228-L263 HydrophobicContact CD2-CB 4.48Å; I229-L263 HydrophobicContact CG1-CD1 4.3Å; I229-L263 HydrophobicContact CG1-CD2 4.06Å; I232-L263 HydrophobicContact CD1-CD2 4.08Å; A259-L263 WeakPolarHBondContact O-CB 3.5Å; A259-L263 PolarHBondContact O-N 3.03Å; T260-L263 PolarHBondContact O-N 3.26Å; L263-T267 WeakPolarHBondContact O-CB 3.34Å; L263-T267 PolarHBondContact O-N 3.29Å; L263-T267 PolarHBondContact O-OG1 2.94Å
264I96.3Very high93.8Very high110 Ų11052.6 Ų52.656%0.56427%0.272SS*.Hα-helixtrans-62.2-48.2176.2-66.7165.8000110.8T260 V261 F262 T267 N268T260-I264 HydrophobicContact CG2-CD1 4.16Å; T260-I264 WeakPolarHBondContact O-CG1 3.39Å; T260-I264 PolarHBondContact O-N 3.34Å; V261-I264 PolarHBondContact O-N 2.96Å; F262-I264 VanDerWaalsContact C-N 3.29Å; F262-I264 PolarHBondContact O-N 3.05Å; I264-T267 PolarHBondContact O-N 2.87Å; I264-N268 WeakPolarHBondContact O-CB 3.47Å; I264-N268 PolarHBondContact O-N 3.42Å
265L94.1Very high93Very high44 Ų4456.4 Ų56.423%0.2328%0.279CS..Hα-helixtrans-64.9-43-178.3-69.4175.8000112.4L161 F164 V261 F262 N268 F269L161-L265 HydrophobicContact CD1-CB 3.68Å; L161-L265 HydrophobicContact CG-CB 4.08Å; F164-L265 HydrophobicContact CD1-CD1 4.13Å; F164-L265 HydrophobicContact CE1-CD1 4.38Å; V261-L265 HydrophobicContact CG1-CD1 3.96Å; V261-L265 HydrophobicContact CG1-CG 4.49Å; V261-L265 WeakPolarHBondContact O-CG 3.48Å; V261-L265 PolarHBondContact O-N 2.66Å; F262-L265 PolarHBondContact O-N 3.1Å; L265-N268 PolarHBondContact O-N 3.28Å; L265-F269 PolarHBondContact O-N 2.81Å
266F93.3Very high92.2Very high21 Ų2160 Ų609%0.09230%0.295CS..Hα-helixtrans-68.8-37.5176.7-90.1-91.6000112.1L161 T221 Q224 M225 F228 F262 N268 F269 Y270L161-F266 HydrophobicContact CD1-CD2 3.99Å; L161-F266 HydrophobicContact CD1-CE2 4.19Å; L161-F266 HydrophobicContact CD1-CG 4.32Å; L161-F266 HydrophobicContact CD2-CD2 4.27Å; L161-F266 HydrophobicContact CD2-CE2 3.65Å; L161-F266 HydrophobicContact CD2-CZ 3.87Å; L161-F266 HydrophobicContact CG-CE2 4.35Å; T221-F266 HydrophobicContact CG2-CD1 4.25Å; Q224-F266 HydrophobicContact CB-CD1 4.39Å; Q224-F266 HydrophobicContact CB-CE1 4.28Å; M225-F266 HydrophobicContact CG-CB 3.96Å; F228-F266 HydrophobicContact CE2-CB 4.47Å; F228-F266 AromaticContact CE2-CD2 3.54Å; F228-F266 HydrophobicContact CE2-CD2 3.54Å; F228-F266 AromaticContact CE2-CE2 3.86Å; F228-F266 HydrophobicContact CE2-CE2 3.86Å; F228-F266 AromaticContact CE2-CG 4Å; F228-F266 HydrophobicContact CE2-CG 4Å; F228-F266 HydrophobicContact CZ-CD2 4.06Å; F228-F266 AromaticContact CZ-CE2 3.93Å; F228-F266 HydrophobicContact CZ-CE2 3.93Å; F262-F266 HydrophobicContact CB-CD2 4.31Å; F262-F266 WeakPolarHBondContact O-CB 3.36Å; F262-F266 WeakPolarHBondContact O-CD2 3.48Å; F262-F266 PolarHBondContact O-N 2.92Å; F266-N268 VanDerWaalsContact C-N 3.35Å; F266-F269 PolarHBondContact O-N 3.46Å; F266-Y270 VanDerWaalsContact O-CB 3.29Å; F266-Y270 WeakPolarHBondContact O-CB 3.14Å; F266-Y270 PolarHBondContact O-N 3.36Å
267T94.3Very high91.4Very high51 Ų5165.8 Ų65.831%0.31332%0.319SS..Hα-helixtrans-63-43.4174.4-59.80000110.8L263 I264 Y270 I271L263-T267 WeakPolarHBondContact O-CB 3.34Å; L263-T267 PolarHBondContact O-N 3.29Å; L263-T267 PolarHBondContact O-OG1 2.94Å; I264-T267 PolarHBondContact O-N 2.87Å; T267-Y270 PolarHBondContact O-N 3.05Å; T267-I271 HydrophobicContact CG2-CD1 3.88Å; T267-I271 HydrophobicContact CG2-CG1 4.48Å; T267-I271 WeakPolarHBondContact O-CB 3.16Å; T267-I271 VanDerWaalsContact O-CG1 3.32Å; T267-I271 WeakPolarHBondContact O-CG1 3.37Å; T267-I271 PolarHBondContact O-N 3.47Å
268N93.5Very high90.6Very high74 Ų7464.8 Ų64.840%0.39631%0.311SS..Hα-helixtrans-60.3-46.7175.4-172-33.3000111.4I264 L265 F266 K272I264-N268 WeakPolarHBondContact O-CB 3.47Å; I264-N268 PolarHBondContact O-N 3.42Å; L265-N268 PolarHBondContact O-N 3.28Å; F266-N268 VanDerWaalsContact C-N 3.35Å; N268-K272 WeakPolarHBondContact O-CG 3.29Å; N268-K272 PolarHBondContact O-N 2.88Å; N268-K272 VanDerWaalsContact O-N 3.15Å; N268-K272 WeakPolarHBondContact OD1-CD 3.1Å; N268-K272 WeakPolarHBondContact OD1-CE 3.46Å; N268-K272 PolarHBondContact OD1-NZ 3.3Å
269F90.5Very high89.5Confident65 Ų6568 Ų6829%0.28532%0.323SS..Hα-helixtrans-58.5-47.8174.1170.6-99000112L161 T221 L265 F266 I271 K272 A273 Y274L161-F269 HydrophobicContact CD1-CB 4.49Å; T221-F269 HydrophobicContact CG2-CD1 4.11Å; T221-F269 HydrophobicContact CG2-CE1 4.22Å; L265-F269 PolarHBondContact O-N 2.81Å; F266-F269 PolarHBondContact O-N 3.46Å; F269-I271 PolarHBondContact O-N 2.87Å; F269-K272 PolarHBondContact O-N 2.82Å; F269-A273 HydrophobicContact CE1-CB 4.35Å; F269-A273 HydrophobicContact CE2-CB 4.25Å; F269-A273 HydrophobicContact CZ-CB 4.1Å; F269-A273 VanDerWaalsContact O-CB 3.3Å; F269-A273 WeakPolarHBondContact O-CB 3.19Å; F269-A273 PolarHBondContact O-N 2.7Å; F269-Y274 HydrophobicContact CE1-CE2 4.4Å
270Y91.1Very high88.6Confident54 Ų5471.1 Ų71.121%0.21234%0.339CS..Hα-helixtrans-60.4-46.3-178.6-178-88.4000112.2N218 T221 I222 M225 F266 T267 K272 A273 Y274 W275N218-Y270 PolarHBondContact ND2-OH 3.37Å; N218-Y270 WeakPolarHBondContact OD1-CE2 3.43Å; N218-Y270 PolarHBondContact OD1-OH 3.27Å; T221-Y270 HydrophobicContact CG2-CD2 3.87Å; I222-Y270 HydrophobicContact CD1-CE2 4.08Å; I222-Y270 HydrophobicContact CG1-CD2 4.42Å; I222-Y270 HydrophobicContact CG1-CE2 3.58Å; M225-Y270 HydrophobicContact CE-CD1 4.46Å; M225-Y270 HydrophobicContact CE-CD2 3.86Å; M225-Y270 HydrophobicContact CE-CE2 4.28Å; M225-Y270 HydrophobicContact CE-CG 3.96Å; F266-Y270 VanDerWaalsContact O-CB 3.29Å; F266-Y270 WeakPolarHBondContact O-CB 3.14Å; F266-Y270 PolarHBondContact O-N 3.36Å; T267-Y270 PolarHBondContact O-N 3.05Å; Y270-K272 VanDerWaalsContact C-N 3.32Å; Y270-K272 PolarHBondContact O-N 3.31Å; Y270-A273 PolarHBondContact O-N 2.78Å; Y270-Y274 AromaticContact CD2-CD2 3.61Å; Y270-Y274 HydrophobicContact CD2-CD2 3.61Å; Y270-Y274 HydrophobicContact CD2-CE2 4.11Å; Y270-Y274 AromaticContact CE2-CD2 3.88Å; Y270-Y274 HydrophobicContact CE2-CD2 3.88Å; Y270-Y274 HydrophobicContact CE2-CE2 4.45Å; Y270-Y274 HydrophobicContact CE2-CG 4.46Å; Y270-Y274 HydrophobicContact CG-CD2 4.15Å; Y270-Y274 PolarHBondContact O-N 3.38Å; Y270-W275 PolarHBondContact O-N 3.3Å
271I91.1Very high87.8Confident55 Ų5570.6 Ų70.628%0.28234%0.34SS..Iπ-helixtrans-58-46.4177.1-74.1168.4000110.7T267 F269 W275 H276T267-I271 HydrophobicContact CG2-CD1 3.88Å; T267-I271 HydrophobicContact CG2-CG1 4.48Å; T267-I271 WeakPolarHBondContact O-CB 3.16Å; T267-I271 VanDerWaalsContact O-CG1 3.32Å; T267-I271 WeakPolarHBondContact O-CG1 3.37Å; T267-I271 PolarHBondContact O-N 3.47Å; F269-I271 PolarHBondContact O-N 2.87Å; I271-W275 HydrophobicContact CB-CE3 4.42Å; I271-W275 HydrophobicContact CG1-CE3 4.05Å; I271-W275 HydrophobicContact CG2-CE3 3.88Å; I271-W275 WeakPolarHBondContact O-CB 3.36Å; I271-W275 PolarHBondContact O-N 2.98Å; I271-W275 VanDerWaalsContact O-N 3.15Å; I271-H276 PolarHBondContact O-N 3.05Å
272K88.3Confident87.1Confident134 Ų13474.8 Ų74.858%0.58335%0.354SS*.Iπ-helixtrans-68.2-46.7-179.8-72.8174.5176.6165.10112.9N268 F269 Y270N268-K272 WeakPolarHBondContact O-CG 3.29Å; N268-K272 PolarHBondContact O-N 2.88Å; N268-K272 VanDerWaalsContact O-N 3.15Å; N268-K272 WeakPolarHBondContact OD1-CD 3.1Å; N268-K272 WeakPolarHBondContact OD1-CE 3.46Å; N268-K272 PolarHBondContact OD1-NZ 3.3Å; F269-K272 PolarHBondContact O-N 2.82Å; Y270-K272 VanDerWaalsContact C-N 3.32Å; Y270-K272 PolarHBondContact O-N 3.31Å
273A84.5Confident86.2Confident34 Ų3476.9 Ų76.928%0.28137%0.37SS..Iπ-helixtrans-74.7-40.4-17300000112.9F269 Y270 K277F269-A273 HydrophobicContact CE1-CB 4.35Å; F269-A273 HydrophobicContact CE2-CB 4.25Å; F269-A273 HydrophobicContact CZ-CB 4.1Å; F269-A273 VanDerWaalsContact O-CB 3.3Å; F269-A273 WeakPolarHBondContact O-CB 3.19Å; F269-A273 PolarHBondContact O-N 2.7Å; Y270-A273 PolarHBondContact O-N 2.78Å; A273-K277 WeakPolarHBondContact O-CB 3.18Å
274Y86.7Confident85.5Confident35 Ų3578.1 Ų78.114%0.13738%0.376CS..Iπ-helixtrans-111.4-47.3-170.9-59.5-72.7000112.5K217 N218 F269 Y270 Q278K217-Y274 WeakPolarHBondContact CG-OH 3.36Å; N218-Y274 HydrophobicContact CB-CD1 4.2Å; N218-Y274 HydrophobicContact CB-CE1 3.92Å; N218-Y274 VanDerWaalsContact OD1-CD2 3.31Å; N218-Y274 WeakPolarHBondContact OD1-CD2 3.32Å; N218-Y274 VanDerWaalsContact OD1-CG 3.29Å; F269-Y274 HydrophobicContact CE1-CE2 4.4Å; Y270-Y274 AromaticContact CD2-CD2 3.61Å; Y270-Y274 HydrophobicContact CD2-CD2 3.61Å; Y270-Y274 HydrophobicContact CD2-CE2 4.11Å; Y270-Y274 AromaticContact CE2-CD2 3.88Å; Y270-Y274 HydrophobicContact CE2-CD2 3.88Å; Y270-Y274 HydrophobicContact CE2-CE2 4.45Å; Y270-Y274 HydrophobicContact CE2-CG 4.46Å; Y270-Y274 HydrophobicContact CG-CD2 4.15Å; Y270-Y274 PolarHBondContact O-N 3.38Å; Y274-Q278 WeakPolarHBondContact O-CB 3.44Å; Y274-Q278 WeakPolarHBondContact O-CG 3.29Å; Y274-Q278 PolarHBondContact O-N 2.76Å
275W78.2Confident84.8Confident114 Ų11478.6 Ų78.643%0.43238%0.376SS..Iπ-helixtrans-73.7-47-170.6-165.234.3000113Y270 I271 K277 Q278 R279Y270-W275 PolarHBondContact O-N 3.3Å; I271-W275 HydrophobicContact CB-CE3 4.42Å; I271-W275 HydrophobicContact CG1-CE3 4.05Å; I271-W275 HydrophobicContact CG2-CE3 3.88Å; I271-W275 WeakPolarHBondContact O-CB 3.36Å; I271-W275 PolarHBondContact O-N 2.98Å; I271-W275 VanDerWaalsContact O-N 3.15Å; W275-K277 VanDerWaalsContact C-N 3.32Å; W275-K277 PolarHBondContact O-N 3.43Å; W275-Q278 PolarHBondContact O-N 2.79Å; W275-R279 PolarHBondContact O-N 2.89Å
276H78.9Confident84Confident101 Ų10182.8 Ų82.847%0.46839%0.392SS..Hα-helixtrans-64.6-37.6175.7-70.4-40.3000112.2I271 R279 L280I271-H276 PolarHBondContact O-N 3.05Å; H276-R279 PolarHBondContact O-N 3.48Å; H276-L280 WeakPolarHBondContact O-CB 3.17Å; H276-L280 PolarHBondContact O-N 3.44Å
277K80.4Confident83.1Confident156 Ų15687.7 Ų87.768%0.67842%0.415SS*.Hα-helixtrans-64.8-43177.2-166.4175.4-177.4-179.40112.3A273 W275 L280 A281A273-K277 WeakPolarHBondContact O-CB 3.18Å; W275-K277 VanDerWaalsContact C-N 3.32Å; W275-K277 PolarHBondContact O-N 3.43Å; K277-L280 PolarHBondContact O-N 3.09Å; K277-A281 WeakPolarHBondContact O-CB 3.48Å; K277-A281 PolarHBondContact O-N 2.89Å
278Q79.7Confident82.1Confident93 Ų9390.9 Ų90.944%0.43543%0.427SS..Hα-helixtrans-66.6-39.4176-74175.220.500112.5Y274 W275 A281 K282Y274-Q278 WeakPolarHBondContact O-CB 3.44Å; Y274-Q278 WeakPolarHBondContact O-CG 3.29Å; Y274-Q278 PolarHBondContact O-N 2.76Å; W275-Q278 PolarHBondContact O-N 2.79Å; Q278-A281 PolarHBondContact O-N 3.32Å; Q278-K282 WeakPolarHBondContact O-CG 3.24Å; Q278-K282 PolarHBondContact O-N 2.9Å
279R74.3Confident80.6Confident138 Ų13893.5 Ų93.552%0.52144%0.436SS..Hα-helixtrans-64.5-41.5175.6-77.5-176.7172.2-161.3-4.4111.9W275 H276 K282 S283W275-R279 PolarHBondContact O-N 2.89Å; H276-R279 PolarHBondContact O-N 3.48Å; R279-K282 PolarHBondContact O-N 3.08Å; R279-S283 PolarHBondContact O-N 3.35Å; R279-S283 PolarHBondContact O-OG 3.17Å
280L77.6Confident78.7Confident68 Ų6897.9 Ų97.936%0.35645%0.452SS..Hα-helixtrans-64.5-42.9176.7-176.761.6000111.6H276 K277 K282 S283 L284 M318H276-L280 WeakPolarHBondContact O-CB 3.17Å; H276-L280 PolarHBondContact O-N 3.44Å; K277-L280 PolarHBondContact O-N 3.09Å; L280-K282 PolarHBondContact O-N 3.31Å; L280-S283 WeakPolarHBondContact CA-OG 3.46Å; L280-S283 PolarHBondContact O-N 2.9Å; L280-S283 PolarHBondContact O-OG 3.44Å; L280-L284 HydrophobicContact CD1-CD1 4.41Å; L280-L284 HydrophobicContact CD1-CG 4.43Å; L280-L284 HydrophobicContact CG-CD1 4.11Å; L280-L284 WeakPolarHBondContact O-CB 3.34Å; L280-L284 VanDerWaalsContact O-CG 3.24Å; L280-L284 WeakPolarHBondContact O-CG 3.45Å; L280-L284 PolarHBondContact O-N 3.22Å; L280-M318 HydrophobicContact CD2-CE 3.86Å
281A82.2Confident77.2Confident43 Ų4399.4 Ų99.436%0.35546%0.461SS..Hα-helixtrans-58.7-47.9174.300000111.4K277 Q278 S283 L284 E285K277-A281 WeakPolarHBondContact O-CB 3.48Å; K277-A281 PolarHBondContact O-N 2.89Å; Q278-A281 PolarHBondContact O-N 3.32Å; A281-S283 PolarHBondContact O-N 2.98Å; A281-L284 PolarHBondContact O-N 2.86Å; A281-E285 WeakPolarHBondContact O-CG 2.95Å; A281-E285 PolarHBondContact O-N 3.41Å
282K80.6Confident75.5Confident138 Ų138104.4 Ų104.460%0.648%0.482SS*.Hα-helixtrans-63-37.7176.9-72.3177.6179.4-174.80113.4Q278 R279 L280 K286Q278-K282 WeakPolarHBondContact O-CG 3.24Å; Q278-K282 PolarHBondContact O-N 2.9Å; R279-K282 PolarHBondContact O-N 3.08Å; L280-K282 PolarHBondContact O-N 3.31Å; K282-K286 WeakPolarHBondContact O-CB 3.15Å; K282-K286 PolarHBondContact O-N 3.29Å
283S77.6Confident73.7Confident50 Ų50105.1 Ų105.135%0.3549%0.488SS..Hα-helixtrans-69.6-36.9176.862.10000112R279 L280 A281 K286 H287R279-S283 PolarHBondContact O-N 3.35Å; R279-S283 PolarHBondContact O-OG 3.17Å; L280-S283 WeakPolarHBondContact CA-OG 3.46Å; L280-S283 PolarHBondContact O-N 2.9Å; L280-S283 PolarHBondContact O-OG 3.44Å; A281-S283 PolarHBondContact O-N 2.98Å; S283-K286 PolarHBondContact O-N 2.89Å; S283-H287 PolarHBondContact O-CD2 3.41Å; S283-H287 VanDerWaalsContact O-CD2 3.29Å; S283-H287 PolarHBondContact O-N 2.82Å
284L82.1Confident72Confident62 Ų62109.9 Ų109.933%0.32551%0.508SS..Hα-helixtrans-65.5-43.8175.1-71.9167.6000111.1L280 A281 K286 H287 Q288 M314L280-L284 HydrophobicContact CD1-CD1 4.41Å; L280-L284 HydrophobicContact CD1-CG 4.43Å; L280-L284 HydrophobicContact CG-CD1 4.11Å; L280-L284 WeakPolarHBondContact O-CB 3.34Å; L280-L284 VanDerWaalsContact O-CG 3.24Å; L280-L284 WeakPolarHBondContact O-CG 3.45Å; L280-L284 PolarHBondContact O-N 3.22Å; A281-L284 PolarHBondContact O-N 2.86Å; L284-K286 VanDerWaalsContact C-N 3.35Å; L284-K286 PolarHBondContact O-N 3.16Å; L284-H287 PolarHBondContact O-N 3.42Å; L284-Q288 WeakPolarHBondContact O-CG 3.29Å; L284-Q288 PolarHBondContact O-N 3.29Å; L284-M314 HydrophobicContact CD2-SD 3.96Å
285E82.1Confident70Confident120 Ų120111.9 Ų111.956%0.56152%0.519SS*.Hα-helixtrans-59.1-44.9173.7-73.7169.7-177.400111.5A281 H287 Q288 H289A281-E285 WeakPolarHBondContact O-CG 2.95Å; A281-E285 PolarHBondContact O-N 3.41Å; E285-H287 PolarHBondContact O-N 3.16Å; E285-Q288 PolarHBondContact O-N 2.85Å; E285-H289 PolarHBondContact O-N 2.93Å
286K77.2Confident68.1Low133 Ų133109.3 Ų109.358%0.57853%0.528SS*.Hα-helixtrans-63-42.9177.2-170.5176.1179.2-179.30112K282 S283 L284 H289 Y290K282-K286 WeakPolarHBondContact O-CB 3.15Å; K282-K286 PolarHBondContact O-N 3.29Å; S283-K286 PolarHBondContact O-N 2.89Å; L284-K286 VanDerWaalsContact C-N 3.35Å; L284-K286 PolarHBondContact O-N 3.16Å; K286-H289 PolarHBondContact O-N 3.23Å; K286-Y290 HydrophobicContact CG-CD2 4.06Å; K286-Y290 HydrophobicContact CG-CE2 4.14Å; K286-Y290 WeakPolarHBondContact O-CD2 3.25Å; K286-Y290 PolarHBondContact O-N 3.41Å
287H74.2Confident66.2Low123 Ų123112.6 Ų112.657%0.56954%0.543SS*.Hα-helixtrans-64.9-39.1176.8-88.1-64.6000112.7S283 L284 E285 H289 Y290 H291S283-H287 PolarHBondContact O-CD2 3.41Å; S283-H287 VanDerWaalsContact O-CD2 3.29Å; S283-H287 PolarHBondContact O-N 2.82Å; L284-H287 PolarHBondContact O-N 3.42Å; E285-H287 PolarHBondContact O-N 3.16Å; H287-H289 VanDerWaalsContact C-N 3.33Å; H287-Y290 PolarHBondContact O-N 3.23Å; H287-H291 PolarHBondContact O-N 3.48Å; H287-H291 VanDerWaalsContact O-N 3.11Å
288Q72.5Confident64.1Low119 Ų119112.4 Ų112.456%0.55654%0.544SS*.Hα-helixtrans-62.9-41.2173.8-74.5177.6-3300111.5L284 E285 H291 H292L284-Q288 WeakPolarHBondContact O-CG 3.29Å; L284-Q288 PolarHBondContact O-N 3.29Å; E285-Q288 PolarHBondContact O-N 2.85Å; Q288-H291 PolarHBondContact O-N 3.42Å; Q288-H292 PolarHBondContact O-N 2.94Å; Q288-H292 VanDerWaalsContact O-N 3.09Å
289H61.7Low62.2Low129 Ų129112.7 Ų112.760%0.59756%0.557SS**Hα-helixtrans-68.2-34.6178.6-152.1-65.4000113E285 K286 H287 H292 H293E285-H289 PolarHBondContact O-N 2.93Å; K286-H289 PolarHBondContact O-N 3.23Å; H287-H289 VanDerWaalsContact C-N 3.33Å; H289-H292 PolarHBondContact O-N 3.42Å; H289-H293 PolarHBondContact O-N 2.81Å
290Y52.3Low60.6Low156 Ų156114.6 Ų114.661%0.61257%0.571SS**Hα-helixtrans-66.2-46173.5-97.9-86.5000112.1K286 H287 H292 H293 D294K286-Y290 HydrophobicContact CG-CD2 4.06Å; K286-Y290 HydrophobicContact CG-CE2 4.14Å; K286-Y290 WeakPolarHBondContact O-CD2 3.25Å; K286-Y290 PolarHBondContact O-N 3.41Å; H287-Y290 PolarHBondContact O-N 3.23Å; Y290-H292 VanDerWaalsContact C-N 3.26Å; Y290-H292 PolarHBondContact O-N 2.89Å; Y290-H293 PolarHBondContact O-N 2.96Å; Y290-D294 PolarHBondContact O-N 3.47Å; Y290-D294 VanDerWaalsContact O-N 3.07Å
291H58.2Low58.9Low86 Ų86119.8 Ų119.840%0.39859%0.593SS.*Hα-helixtrans-62.8-33176.9-97.2-73.8000112.7H287 Q288 H293 H295H287-H291 PolarHBondContact O-N 3.48Å; H287-H291 VanDerWaalsContact O-N 3.11Å; Q288-H291 PolarHBondContact O-N 3.42Å; H291-H293 VanDerWaalsContact C-N 3.33Å; H291-H295 AromaticContact ND1-NE2 3.44Å; H291-H295 PolarHBondContact ND1-NE2 3.28Å; H291-H295 PolarHBondContact O-CD2 2.91Å; H291-H295 VanDerWaalsContact O-CG 3.26Å; H291-H295 PolarHBondContact O-N 2.93Å
292H55.2Low56.9Low160 Ų160125.9 Ų125.974%0.74162%0.615SS**Hα-helixtrans-72.8-26.3177.9-139.1-58.4000113.2Q288 H289 Y290Q288-H292 PolarHBondContact O-N 2.94Å; Q288-H292 VanDerWaalsContact O-N 3.09Å; H289-H292 PolarHBondContact O-N 3.42Å; Y290-H292 VanDerWaalsContact C-N 3.26Å; Y290-H292 PolarHBondContact O-N 2.89Å
293H51.3Low54.8Low150 Ų150122.1 Ų122.169%0.69460%0.599SS**Hα-helixtrans-84.9-34.4178.4-119.2-69.5000113H289 Y290 H291 H295 G296H289-H293 PolarHBondContact O-N 2.81Å; Y290-H293 PolarHBondContact O-N 2.96Å; H291-H293 VanDerWaalsContact C-N 3.33Å; H293-H295 VanDerWaalsContact C-N 3.27Å; H293-H295 PolarHBondContact O-N 2.97Å; H293-G296 PolarHBondContact O-N 3.19Å
294D49.5Very low52.9Low133 Ų133127.2 Ų127.271%0.71162%0.617SS**Hα-helixtrans-77.7-16-179.3-147.222.3000112.5Y290 G296Y290-D294 PolarHBondContact O-N 3.47Å; Y290-D294 VanDerWaalsContact O-N 3.07Å; D294-G296 VanDerWaalsContact C-N 3.27Å; D294-G296 PolarHBondContact O-N 3.19Å
295H43.6Very low50.7Low77 Ų77131.6 Ų131.636%0.35664%0.636SS.*THydrogen-bonded Turntrans-87.510.9176-66.7-28.3000114.5H291 H293 H297 Q303H291-H295 AromaticContact ND1-NE2 3.44Å; H291-H295 PolarHBondContact ND1-NE2 3.28Å; H291-H295 PolarHBondContact O-CD2 2.91Å; H291-H295 VanDerWaalsContact O-CG 3.26Å; H291-H295 PolarHBondContact O-N 2.93Å; H293-H295 VanDerWaalsContact C-N 3.27Å; H293-H295 PolarHBondContact O-N 2.97Å; H295-H297 PolarHBondContact O-N 3.06Å; H295-Q303 PolarHBondContact CD2-OE1 3.48Å; H295-Q303 VanDerWaalsContact CE1-CG 3.43Å; H295-Q303 WeakPolarHBondContact CE1-CG 3.11Å; H295-Q303 PolarHBondContact CE1-NE2 2.92Å; H295-Q303 PolarHBondContact ND1-NE2 3.38Å; H295-Q303 VanDerWaalsContact NE2-CD 3.26Å; H295-Q303 WeakPolarHBondContact NE2-CG 3.42Å
296G39.8Very low48.5Very low61 Ų61131.2 Ų131.263%0.62964%0.638SS**THydrogen-bonded Turntrans-67.3-15.8167.400000114.6H293 D294H293-G296 PolarHBondContact O-N 3.19Å; D294-G296 VanDerWaalsContact C-N 3.27Å; D294-G296 PolarHBondContact O-N 3.19Å
297H38.2Very low46.5Very low170 Ų170126.8 Ų126.879%0.78763%0.63SS**SBendtrans-144.476.8177.9-93.8-79.9000111.5H295H295-H297 PolarHBondContact O-N 3.06Å
298H36.6Very low44.8Very low151 Ų151129.8 Ų129.870%0.69964%0.636SS**SBendtrans160.3115.1135.1-90.5-65.5000112.1Q303H298-Q303 PolarHBondContact O-NE2 2.95Å
299S39.8Very low43.1Very low100 Ų100130.4 Ų130.470%0.69964%0.639SS**  trans54.9102.7142-51.20000118.7H301S299-H301 VanDerWaalsContact C-N 3.32Å; S299-H301 PolarHBondContact O-N 3.4Å
300H39.6Very low41.9Very low177 Ų177128.9 Ų128.982%0.81963%0.632SS**THydrogen-bonded Turntrans-6315.4-167.3-114.6-75.5000120.1
301H42.9Very low41.3Very low178 Ų178127.8 Ų127.882%0.82463%0.631SS**THydrogen-bonded Turntrans-121.5-16.8-173.1-88.9-65.7000117.7S299S299-H301 VanDerWaalsContact C-N 3.32Å; S299-H301 PolarHBondContact O-N 3.4Å
302Q38.9Very low40.3Very low171 Ų171130.8 Ų130.880%0.79965%0.645SS**SBendtrans-96.9-15.9178.1-83178.4-11.700114.6Q304Q302-Q304 PolarHBondContact O-N 3Å
303Q37.5Very low39.8Very low58 Ų58128.4 Ų128.427%0.27164%0.641SS.*Hα-helixtrans-69.7-29.3-176.6-78.8166.321.500114.6H295 H298 Q305 G307H295-Q303 PolarHBondContact CD2-OE1 3.48Å; H295-Q303 VanDerWaalsContact CE1-CG 3.43Å; H295-Q303 WeakPolarHBondContact CE1-CG 3.11Å; H295-Q303 PolarHBondContact CE1-NE2 2.92Å; H295-Q303 PolarHBondContact ND1-NE2 3.38Å; H295-Q303 VanDerWaalsContact NE2-CD 3.26Å; H295-Q303 WeakPolarHBondContact NE2-CG 3.42Å; H298-Q303 PolarHBondContact O-NE2 2.95Å; Q303-Q305 PolarHBondContact O-N 3.47Å; Q303-G307 PolarHBondContact O-N 2.74Å
304Q38.3Very low39.4Very low158 Ų158125.2 Ų125.274%0.73863%0.628SS**Hα-helixtrans-68.6-24.9-174.7-126.4176.814.900113.1Q302Q302-Q304 PolarHBondContact O-N 3Å
305Q36Very low38.9Very low153 Ų153122.9 Ų122.972%0.71562%0.615SS**Hα-helixtrans-85-42.7179.4-72.7-173.6-5.800112.7Q303 R308 Q309Q303-Q305 PolarHBondContact O-N 3.47Å; Q305-R308 PolarHBondContact O-N 2.88Å; Q305-Q309 PolarHBondContact O-N 2.88Å; Q305-Q309 VanDerWaalsContact O-N 3.11Å
306N34.5Very low38.6Very low112 Ų112120.7 Ų120.760%0.59961%0.614SS**Hα-helixtrans-67.4-38178.4-89.8-0000112.6R308 Q309 Q310N306-R308 VanDerWaalsContact C-N 3.32Å; N306-R308 PolarHBondContact O-N 3.4Å; N306-Q309 PolarHBondContact O-N 3.39Å; N306-Q310 PolarHBondContact O-N 3.01Å
307G36.8Very low38.5Very low40 Ų40120.7 Ų120.741%0.41260%0.604SS.*Hα-helixtrans-61.4-38.617500000112.7Q303 F311Q303-G307 PolarHBondContact O-N 2.74Å; G307-F311 WeakPolarHBondContact O-CB 3.5Å; G307-F311 PolarHBondContact O-N 3.28Å; G307-F311 VanDerWaalsContact O-N 3.07Å
308R37.6Very low38.4Very low187 Ų187116.8 Ų116.871%0.70659%0.587SS**Hα-helixtrans-69.6-37.7175.8-83.9-174.4-178.8-1803113Q305 N306 F311 H312Q305-R308 PolarHBondContact O-N 2.88Å; N306-R308 VanDerWaalsContact C-N 3.32Å; N306-R308 PolarHBondContact O-N 3.4Å; R308-F311 PolarHBondContact O-N 3.43Å; R308-H312 WeakPolarHBondContact O-CB 3.24Å; R308-H312 PolarHBondContact O-N 3.09Å
309Q35.8Very low38.3Very low131 Ų131117 Ų11761%0.61259%0.586SS**Hα-helixtrans-68.1-43.6177.6-77.9-174.3-3.500111.9Q305 N306 F311 H312 V313Q305-Q309 PolarHBondContact O-N 2.88Å; Q305-Q309 VanDerWaalsContact O-N 3.11Å; N306-Q309 PolarHBondContact O-N 3.39Å; Q309-F311 VanDerWaalsContact C-N 3.34Å; Q309-F311 PolarHBondContact O-N 2.97Å; Q309-H312 PolarHBondContact O-N 2.65Å; Q309-H312 VanDerWaalsContact O-N 3.16Å; Q309-V313 WeakPolarHBondContact O-CG2 3.31Å; Q309-V313 PolarHBondContact O-N 3.31Å
310Q38.6Very low37.9Very low98 Ų98119.2 Ų119.246%0.45859%0.585SS.*Hα-helixtrans-63.4-39.5174.3-84-173.5-7.900112.2N306 H312 V313 M314N306-Q310 PolarHBondContact O-N 3.01Å; Q310-H312 VanDerWaalsContact C-N 3.29Å; Q310-H312 PolarHBondContact O-N 2.85Å; Q310-V313 PolarHBondContact O-N 2.81Å; Q310-M314 HydrophobicContact CB-CE 4Å; Q310-M314 VanDerWaalsContact O-CB 3.27Å; Q310-M314 WeakPolarHBondContact O-CB 3.44Å; Q310-M314 WeakPolarHBondContact O-CG 3.26Å; Q310-M314 PolarHBondContact O-N 3.02Å
311F38Very low37.7Very low132 Ų132117 Ų11758%0.57958%0.577SS**Hα-helixtrans-62.2-36.6174.2-129.6-88.7000112G307 R308 Q309 N315G307-F311 WeakPolarHBondContact O-CB 3.5Å; G307-F311 PolarHBondContact O-N 3.28Å; G307-F311 VanDerWaalsContact O-N 3.07Å; R308-F311 PolarHBondContact O-N 3.43Å; Q309-F311 VanDerWaalsContact C-N 3.34Å; Q309-F311 PolarHBondContact O-N 2.97Å; F311-N315 WeakPolarHBondContact O-CB 3.48Å; F311-N315 PolarHBondContact O-N 3.43Å
312H38.5Very low37.2Very low150 Ų150110.8 Ų110.869%0.69455%0.55SS*.Hα-helixtrans-72.4-42.6177.9-110.5-80.1000113.3R308 Q309 Q310 M314 N315 G316R308-H312 WeakPolarHBondContact O-CB 3.24Å; R308-H312 PolarHBondContact O-N 3.09Å; Q309-H312 PolarHBondContact O-N 2.65Å; Q309-H312 VanDerWaalsContact O-N 3.16Å; Q310-H312 VanDerWaalsContact C-N 3.29Å; Q310-H312 PolarHBondContact O-N 2.85Å; H312-M314 VanDerWaalsContact C-N 3.31Å; H312-N315 PolarHBondContact O-N 2.83Å; H312-G316 PolarHBondContact O-N 3.21Å
313V45Very low36.8Very low110 Ų110105.6 Ų105.667%0.66754%0.542SS*.Hα-helixtrans-63.6-40.5174.4176.50000110Q309 Q310 G316 S317Q309-V313 WeakPolarHBondContact O-CG2 3.31Å; Q309-V313 PolarHBondContact O-N 3.31Å; Q310-V313 PolarHBondContact O-N 2.81Å; V313-G316 CarbonylContact O-C 3.6Å; V313-G316 WeakPolarHBondContact O-CA 3.46Å; V313-G316 PolarHBondContact O-N 3.07Å; V313-S317 PolarHBondContact O-N 2.03Å
314M42.3Very low36.4Very low83 Ų83113.4 Ų113.441%0.40957%0.571SS.*Hα-helixtrans-71.4-38.1176.7-76.9-166.5-106.300113.3L284 Q310 H312 G316 S317 M318L284-M314 HydrophobicContact CD2-SD 3.96Å; Q310-M314 HydrophobicContact CB-CE 4Å; Q310-M314 VanDerWaalsContact O-CB 3.27Å; Q310-M314 WeakPolarHBondContact O-CB 3.44Å; Q310-M314 WeakPolarHBondContact O-CG 3.26Å; Q310-M314 PolarHBondContact O-N 3.02Å; H312-M314 VanDerWaalsContact C-N 3.31Å; M314-G316 PolarHBondContact O-N 3.22Å; M314-S317 CarbonylContact O-C 3.58Å; M314-S317 PolarHBondContact O-N 3.35Å; M314-S317 VanDerWaalsContact O-N 3.12Å; M314-M318 WeakPolarHBondContact O-CB 3.18Å; M314-M318 PolarHBondContact O-N 3.38Å
315N38.8Very low36.1Very low83 Ų83108.7 Ų108.744%0.44457%0.565SS.*Hα-helixtrans-61.9-33170-116-11.8000111.1F311 H312 K319F311-N315 WeakPolarHBondContact O-CB 3.48Å; F311-N315 PolarHBondContact O-N 3.43Å; H312-N315 PolarHBondContact O-N 2.83Å; N315-K319 WeakPolarHBondContact O-CB 3.1Å; N315-K319 WeakPolarHBondContact O-CG 3.36Å; N315-K319 PolarHBondContact O-N 3.29Å
316G36.5Very low35.8Very low32 Ų32104.3 Ų104.333%0.3355%0.548SS..Hα-helixtrans-64-45.4170.500000112.5H312 V313 M314 K319 Q320H312-G316 PolarHBondContact O-N 3.21Å; V313-G316 CarbonylContact O-C 3.6Å; V313-G316 WeakPolarHBondContact O-CA 3.46Å; V313-G316 PolarHBondContact O-N 3.07Å; M314-G316 PolarHBondContact O-N 3.22Å; G316-K319 CarbonylContact O-C 3.53Å; G316-K319 PolarHBondContact O-N 3.39Å; G316-Q320 PolarHBondContact O-N 3.47Å
317S39.1Very low35.5Very low60 Ų60104.9 Ų104.942%0.4255%0.547SS..Hα-helixtrans-67.9-37.8177.1-160.20000112.3V313 M314 K319 Q320 M321V313-S317 PolarHBondContact O-N 2.03Å; M314-S317 CarbonylContact O-C 3.58Å; M314-S317 PolarHBondContact O-N 3.35Å; M314-S317 VanDerWaalsContact O-N 3.12Å; S317-K319 VanDerWaalsContact C-N 3.34Å; S317-K319 PolarHBondContact O-N 2.9Å; S317-Q320 PolarHBondContact O-N 3.37Å; S317-M321 WeakPolarHBondContact O-CG 2.88Å; S317-M321 PolarHBondContact O-N 3.42Å
318M34.5Very low35.2Very low88 Ų88107.2 Ų107.243%0.43355%0.548SS..Hα-helixtrans-65.2-37.9172.4-139.9177.8-151.100111L280 M314 N322L280-M318 HydrophobicContact CD2-CE 3.86Å; M314-M318 WeakPolarHBondContact O-CB 3.18Å; M314-M318 PolarHBondContact O-N 3.38Å; M318-N322 WeakPolarHBondContact O-CB 3.45Å; M318-N322 PolarHBondContact O-N 3.39Å; M318-N322 PolarHBondContact O-OD1 3.19Å; M318-N322 VanDerWaalsContact O-OD1 3.13Å
319K35.7Very low35Very low157 Ų157104.6 Ų104.668%0.68355%0.549SS*.Hα-helixtrans-69.5-32.9170.8-81-177.4177.4-177.60113.3N315 G316 S317 N322 G323N315-K319 WeakPolarHBondContact O-CB 3.1Å; N315-K319 WeakPolarHBondContact O-CG 3.36Å; N315-K319 PolarHBondContact O-N 3.29Å; G316-K319 CarbonylContact O-C 3.53Å; G316-K319 PolarHBondContact O-N 3.39Å; S317-K319 VanDerWaalsContact C-N 3.34Å; S317-K319 PolarHBondContact O-N 2.9Å; K319-N322 PolarHBondContact O-N 3.43Å; K319-G323 PolarHBondContact O-N 2.87Å
320Q31.9Very low34.9Very low146 Ų146103.3 Ų103.368%0.68255%0.545SS*.Hα-helixtrans-73.3-37.2175.1-83.3-174.8-13.900112.2G316 S317 N322 G323 Y324G316-Q320 PolarHBondContact O-N 3.47Å; S317-Q320 PolarHBondContact O-N 3.37Å; Q320-N322 VanDerWaalsContact C-N 3.33Å; Q320-G323 PolarHBondContact O-N 3.31Å; Q320-Y324 PolarHBondContact O-N 3.01Å
321M33.9Very low34.8Very low130 Ų130103.6 Ų103.664%0.6455%0.55SS*.Hα-helixtrans-68.3-33.6170.4-70.1-175.187.700111.6S317S317-M321 WeakPolarHBondContact O-CG 2.88Å; S317-M321 PolarHBondContact O-N 3.42Å
322N32.5Very low34.6Very low48 Ų48102 Ų10226%0.25755%0.548SS..Hα-helixtrans-68.7-36.3169.7-72.210.3000112.2M318 K319 Q320 Y324 G325 T326 H327M318-N322 WeakPolarHBondContact O-CB 3.45Å; M318-N322 PolarHBondContact O-N 3.39Å; M318-N322 PolarHBondContact O-OD1 3.19Å; M318-N322 VanDerWaalsContact O-OD1 3.13Å; K319-N322 PolarHBondContact O-N 3.43Å; Q320-N322 VanDerWaalsContact C-N 3.33Å; N322-Y324 PolarHBondContact O-N 2.69Å; N322-Y324 VanDerWaalsContact O-N 3.16Å; N322-G325 PolarHBondContact O-N 3.1Å; N322-T326 VanDerWaalsContact CA-OG1 3.3Å; N322-T326 WeakPolarHBondContact CA-OG1 3.29Å; N322-T326 VanDerWaalsContact CB-OG1 3.26Å; N322-T326 WeakPolarHBondContact CB-OG1 3.4Å; N322-T326 PolarHBondContact ND2-OG1 2.97Å; N322-T326 PolarHBondContact O-N 3.16Å; N322-T326 PolarHBondContact OD1-OG1 3.27Å; N322-H327 PolarHBondContact ND2-CE1 3.5Å; N322-H327 PolarHBondContact ND2-NE2 3.1Å
323G30.3Very low34.3Very low62 Ų6299.2 Ų99.264%0.63954%0.54SS*.Hα-helixtrans-61.7-22.4177.200000114.4K319 Q320K319-G323 PolarHBondContact O-N 2.87Å; Q320-G323 PolarHBondContact O-N 3.31Å
324Y30.2Very low33.7Very low222 Ų22298.5 Ų98.587%0.87153%0.532SS*.THydrogen-bonded Turntrans-10810.3178.1-85.6-77.9000115.4Q320 N322Q320-Y324 PolarHBondContact O-N 3.01Å; N322-Y324 PolarHBondContact O-N 2.69Å; N322-Y324 VanDerWaalsContact O-N 3.16Å
325G30.9Very low33.1Very low59 Ų5999.5 Ų99.561%0.60854%0.54SS*.THydrogen-bonded Turntrans164.419.7169.600000117.9N322N322-G325 PolarHBondContact O-N 3.1Å
326T30.2Very low32.7Very low61 Ų61100.7 Ų100.737%0.37455%0.547SS..  trans-136.5120.9174.795.20000110.2N322N322-T326 VanDerWaalsContact CA-OG1 3.3Å; N322-T326 WeakPolarHBondContact CA-OG1 3.29Å; N322-T326 VanDerWaalsContact CB-OG1 3.26Å; N322-T326 WeakPolarHBondContact CB-OG1 3.4Å; N322-T326 PolarHBondContact ND2-OG1 2.97Å; N322-T326 PolarHBondContact O-N 3.16Å; N322-T326 PolarHBondContact OD1-OG1 3.27Å
327H27.9Very low32.4Very low123 Ų123106 Ų10657%0.56956%0.564SS**  -141.7143.1105.9-85.6-80.5000103.4D156 N322D156-H327 WeakPolarHBondContact CB-O 3.3Å; D156-H327 WeakPolarHBondContact OD2-CB 3.38Å; N322-H327 PolarHBondContact ND2-CE1 3.5Å; N322-H327 PolarHBondContact ND2-NE2 3.1Å
328M31Very low31.8Very low90 Ų90109.8 Ų109.844%0.44358%0.576SS.*  trans-154.989.4172-63.2-161.3-17300106.6D156 T159D156-M328 HydrophobicContact CB-CB 4.18Å; D156-M328 HydrophobicContact CB-CG 3.86Å; D156-M328 WeakPolarHBondContact O-CE 3.43Å; D156-M328 WeakPolarHBondContact O-CG 3.21Å; T159-M328 HydrophobicContact CG2-CE 3.24Å; T159-M328 HydrophobicContact CG2-SD 3.79Å
329D33.3Very low31.6Very low132 Ų132111.8 Ų111.871%0.70659%0.588SS**  trans-76.70150.7-81.8-17.6000109K154 Q157K154-D329 HydrophobicContact CD-CB 3.95Å; K154-D329 IonicContact NZ-OD2 2.66Å; K154-D329 PolarHBondContact NZ-OD2 3.13Å; Q157-D329 WeakPolarHBondContact CG-O 3.44Å; Q157-D329 PolarHBondContact NE2-O 3.11Å; Q157-D329 PolarHBondContact NE2-OXT 3.41Å

Retrieved 329 of 329 residues in 516.6 ms (Link to these results)

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