A0A067XG57_HUMAN Loading...

ATPase phospholipid transporting 11C

AlphaFold DB , UniProt , Accession A0A067XG57, Species HUMAN (Homo sapiens, Human), Gene ATP11C, Length 172 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
1T53.3Low61.1Low145 Ų145138.8 Ų138.889%0.8971%0.709SS**  0150.30290000107.8T3 S4T1-T3 PolarHBondContact O-N 3.22Å; T1-S4 WeakPolarHBondContact O-CB 3.49Å; T1-S4 PolarHBondContact O-N 3.27Å; T1-S4 PolarHBondContact O-OG 3.01Å
2L57.5Low60.9Low156 Ų156136.6 Ų136.682%0.81770%0.698SS**G310 helixtrans-44.2-22.9-165.3-82.2146.6000117.5S4L2-S4 VanDerWaalsContact C-N 3.28Å; L2-S4 PolarHBondContact O-N 2.91Å
3T65.3Low60.4Low130 Ų130131.4 Ų131.480%0.79868%0.681SS**G310 helixtrans-67.6-17.4170.536.10000115.2T1T1-T3 PolarHBondContact O-N 3.22Å
4S68.3Low60.1Low100 Ų100125.9 Ų125.970%0.69967%0.673SS**G310 helixtrans-80.4-14.8-177.1630000114.2T1 L2T1-S4 WeakPolarHBondContact O-CB 3.49Å; T1-S4 PolarHBondContact O-N 3.27Å; T1-S4 PolarHBondContact O-OG 3.01Å; L2-S4 VanDerWaalsContact C-N 3.28Å; L2-S4 PolarHBondContact O-N 2.91Å
5D66.2Low60.1Low70 Ų70125.3 Ų125.337%0.37467%0.67SS.*  trans-142.986176.6-170.9-4.7000111.5R7 L8D5-R7 PolarHBondContact O-N 3.23Å; D5-R7 WeakPolarHBondContact OD1-CB 3.47Å; D5-R7 PolarHBondContact OD1-N 2.96Å; D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 PolarHBondContact O-N 3.37Å; D5-L8 WeakPolarHBondContact OD2-CD1 3.38Å
6P65.2Low60.1Low95 Ų95119.9 Ų119.962%0.61765%0.648SS**THydrogen-bonded Turntrans-66.8-16.1-17723.7-31.1000113.8L8 Y9 M10P6-L8 VanDerWaalsContact C-N 3.27Å; P6-L8 PolarHBondContact O-N 3.27Å; P6-Y9 PolarHBondContact O-N 3.15Å; P6-M10 PolarHBondContact O-N 2.92Å
7R61.6Low60.2Low204 Ų204122.7 Ų122.777%0.7766%0.658SS**Hα-helixtrans-68.1-27.4179.5-64.8-178174.4-173-0.6112.4D5 K11D5-R7 PolarHBondContact O-N 3.23Å; D5-R7 WeakPolarHBondContact OD1-CB 3.47Å; D5-R7 PolarHBondContact OD1-N 2.96Å; R7-K11 PolarHBondContact O-N 2.85Å
8L61.7Low60.4Low109 Ų109123.8 Ų123.857%0.57166%0.663SS**Hα-helixtrans-67.2-34.4174.4-88.8148.8000112.7D5 P6D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 PolarHBondContact O-N 3.37Å; D5-L8 WeakPolarHBondContact OD2-CD1 3.38Å; P6-L8 VanDerWaalsContact C-N 3.27Å; P6-L8 PolarHBondContact O-N 3.27Å
9Y58.8Low61.3Low176 Ų176123.1 Ų123.169%0.6966%0.656SS**Hα-helixtrans-76.1-40.4177-174.2-96.7000111.7P6 K11 I12 S13P6-Y9 PolarHBondContact O-N 3.15Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.34Å; Y9-I12 WeakPolarHBondContact O-CA 3.43Å; Y9-I12 PolarHBondContact O-N 3.37Å; Y9-S13 PolarHBondContact O-N 3.38Å
10M59.7Low62.2Low149 Ų149123 Ų12373%0.73465%0.654SS**Hα-helixtrans-63.6-33.8-175.8-144.8149.5102.300112.4P6 I12 S13P6-M10 PolarHBondContact O-N 2.92Å; M10-I12 VanDerWaalsContact C-N 3.27Å; M10-I12 PolarHBondContact O-N 2.76Å; M10-S13 PolarHBondContact O-N 2.77Å; M10-S13 PolarHBondContact O-OG 3.37Å
11K54.5Low63.2Low193 Ų193119.4 Ų119.484%0.83965%0.647SS**THydrogen-bonded Turntrans-67.2-20.5171.8-102.2-177.7177.9177.70114.7R7 Y9R7-K11 PolarHBondContact O-N 2.85Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.34Å
12I58.4Low64.5Low112 Ų112114.6 Ų114.657%0.57462%0.618SS**THydrogen-bonded Turntrans-96.3-21.4178.6-61.8171.9000110.9Y9 M10 G14Y9-I12 WeakPolarHBondContact O-CA 3.43Å; Y9-I12 PolarHBondContact O-N 3.37Å; M10-I12 VanDerWaalsContact C-N 3.27Å; M10-I12 PolarHBondContact O-N 2.76Å; I12-G14 VanDerWaalsContact C-N 3.29Å; I12-G14 PolarHBondContact O-N 3.2Å; I12-G14 VanDerWaalsContact O-N 3.15Å
13S54.3Low65.8Low69 Ų69113.2 Ų113.248%0.48361%0.606SS.*  trans-73.91.1-170.675.90000117.2Y9 M10 N15Y9-S13 PolarHBondContact O-N 3.38Å; M10-S13 PolarHBondContact O-N 2.77Å; M10-S13 PolarHBondContact O-OG 3.37Å; S13-N15 PolarHBondContact O-N 3.45Å
14G56.8Low66.8Low55 Ų55110.6 Ų110.657%0.56759%0.586SS**SBendtrans-94.341.2-173.500000116.1I12 A16I12-G14 VanDerWaalsContact C-N 3.29Å; I12-G14 PolarHBondContact O-N 3.2Å; I12-G14 VanDerWaalsContact O-N 3.15Å; G14-A16 PolarHBondContact O-N 3.13Å
15N60.2Low67.7Low117 Ų117109.6 Ų109.663%0.62657%0.568SS**SBendtrans55.215.2-175.9-142.122.9000114.8S13 M17 L18 Q19S13-N15 PolarHBondContact O-N 3.45Å; N15-M17 PolarHBondContact O-N 3.45Å; N15-M17 VanDerWaalsContact O-N 3.13Å; N15-L18 PolarHBondContact O-N 3.33Å; N15-L18 VanDerWaalsContact O-N 3.16Å; N15-Q19 PolarHBondContact O-N 3.16Å
16A60.2Low68.6Low39 Ų39111.5 Ų111.532%0.32257%0.57SS.*THydrogen-bonded Turntrans-64.9-21.2-172.800000113.1G14 P22G14-A16 PolarHBondContact O-N 3.13Å; A16-P22 WeakPolarHBondContact O-CG 3.48Å
17M60.6Low69.8Low167 Ų167110.1 Ų110.182%0.82356%0.559SS**THydrogen-bonded Turntrans-77.8-22.5-179.5-148168.9176.900112.9N15N15-M17 PolarHBondContact O-N 3.45Å; N15-M17 VanDerWaalsContact O-N 3.13Å
18L63.8Low71.1Confident142 Ų142107.6 Ų107.674%0.74355%0.554SS**SBendtrans-113.29.4179.9-71.1169.4000113N15N15-L18 PolarHBondContact O-N 3.33Å; N15-L18 VanDerWaalsContact O-N 3.16Å
19Q77.7Confident72.4Confident111 Ų111103 Ų10352%0.51953%0.53SS..SBendtrans-60.9150.9171.5-81.1178.4-37.100110.7N15 G21 P22 F23N15-Q19 PolarHBondContact O-N 3.16Å; Q19-G21 PolarHBondContact O-N 3.21Å; Q19-G21 VanDerWaalsContact O-N 3.11Å; Q19-P22 VanDerWaalsContact O-CD 3.26Å; Q19-P22 WeakPolarHBondContact O-CD 3.32Å; Q19-F23 PolarHBondContact O-N 3.24Å
20L80.1Confident73.9Confident121 Ų12197.2 Ų97.263%0.63452%0.519SS*.Hα-helixtrans-56.5-30.7179.9-169.270.5000112.4F23 L24L20-F23 HydrophobicContact CD1-CD1 4.24Å; L20-F23 PolarHBondContact O-N 3.23Å; L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CD2-CD1 4.2Å; L20-L24 HydrophobicContact CG-CD1 3.85Å; L20-L24 HydrophobicContact CG-CG 4.15Å; L20-L24 WeakPolarHBondContact O-CB 3.26Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 2.84Å
21G82.2Confident75.4Confident48 Ų4892.7 Ų92.750%0.49551%0.506SS..Hα-helixtrans-59.4-63.5178.400000113.2Q19 F23 L24 Y25Q19-G21 PolarHBondContact O-N 3.21Å; Q19-G21 VanDerWaalsContact O-N 3.11Å; G21-F23 VanDerWaalsContact C-N 3.27Å; G21-F23 PolarHBondContact O-N 3.09Å; G21-L24 PolarHBondContact O-N 2.95Å; G21-Y25 WeakPolarHBondContact O-CB 3.36Å; G21-Y25 PolarHBondContact O-N 3.48Å
22P81.6Confident77.1Confident44 Ų4488.3 Ų88.329%0.28649%0.486SS..Hα-helixtrans-55.2-40.9174.1-29.335.7000113.3A16 Q19 Y25 W26A16-P22 WeakPolarHBondContact O-CG 3.48Å; Q19-P22 VanDerWaalsContact O-CD 3.26Å; Q19-P22 WeakPolarHBondContact O-CD 3.32Å; P22-Y25 WeakPolarHBondContact O-CB 3.48Å; P22-Y25 PolarHBondContact O-N 3.04Å; P22-W26 PolarHBondContact O-N 3.18Å
23F83.6Confident78.6Confident127 Ų12783.6 Ų83.656%0.55746%0.462SS*.Hα-helixtrans-59.4-49.7177.9174.2-97.9000112.7Q19 L20 G21 Y25 W26 T27Q19-F23 PolarHBondContact O-N 3.24Å; L20-F23 HydrophobicContact CD1-CD1 4.24Å; L20-F23 PolarHBondContact O-N 3.23Å; G21-F23 VanDerWaalsContact C-N 3.27Å; G21-F23 PolarHBondContact O-N 3.09Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.2Å; F23-W26 PolarHBondContact O-N 3.47Å; F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.36Å; F23-T27 PolarHBondContact O-OG1 3.36Å
24L88.1Confident80.4Confident75 Ų7582 Ų8239%0.39346%0.457SS..Hα-helixtrans-61.6-41.9176.8-76.7170.9000110.8L20 G21 T27 F28L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CD2-CD1 4.2Å; L20-L24 HydrophobicContact CG-CD1 3.85Å; L20-L24 HydrophobicContact CG-CG 4.15Å; L20-L24 WeakPolarHBondContact O-CB 3.26Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 2.84Å; G21-L24 PolarHBondContact O-N 2.95Å; L24-T27 WeakPolarHBondContact O-CB 3.33Å; L24-T27 PolarHBondContact O-N 3.47Å; L24-F28 WeakPolarHBondContact O-CD2 3.22Å; L24-F28 PolarHBondContact O-N 2.87Å
25Y85.3Confident82.1Confident79 Ų7982.8 Ų82.831%0.3145%0.45SS..Hα-helixtrans-60.3-46.8177.3166.8-94.2000112.7G21 P22 F23 T27 F28 L29 L151G21-Y25 WeakPolarHBondContact O-CB 3.36Å; G21-Y25 PolarHBondContact O-N 3.48Å; P22-Y25 WeakPolarHBondContact O-CB 3.48Å; P22-Y25 PolarHBondContact O-N 3.04Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.2Å; Y25-T27 VanDerWaalsContact C-N 3.28Å; Y25-T27 PolarHBondContact O-N 2.93Å; Y25-F28 PolarHBondContact O-N 3.34Å; Y25-L29 WeakPolarHBondContact O-CB 3.46Å; Y25-L29 PolarHBondContact O-N 3.43Å; Y25-L151 HydrophobicContact CE2-CD1 4.11Å; Y25-L151 HydrophobicContact CE2-CD2 4.39Å; Y25-L151 WeakPolarHBondContact OH-CD1 3.22Å; Y25-L151 VanDerWaalsContact OH-CD2 3.28Å; Y25-L151 WeakPolarHBondContact OH-CD2 3.4Å; Y25-L151 VanDerWaalsContact OH-CG 3.32Å; Y25-L151 WeakPolarHBondContact OH-CG 3.42Å
26W86.1Confident83.6Confident110 Ų11078.2 Ų78.242%0.41743%0.427SS..Hα-helixtrans-64-35.5175.3-72.1114000111.9P22 F23 L29 A30P22-W26 PolarHBondContact O-N 3.18Å; F23-W26 PolarHBondContact O-N 3.47Å; W26-L29 HydrophobicContact CE3-CD2 4.02Å; W26-L29 HydrophobicContact CZ3-CD2 4.08Å; W26-L29 PolarHBondContact O-N 3.24Å; W26-A30 WeakPolarHBondContact O-CB 3.44Å; W26-A30 PolarHBondContact O-N 3.35Å
27T90.2Very high85Confident65 Ų6576.9 Ų76.940%0.39941%0.414SS..Hα-helixtrans-65.3-46.1175.6-56.80000111.9F23 L24 Y25 L29 A30 A31F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.36Å; F23-T27 PolarHBondContact O-OG1 3.36Å; L24-T27 WeakPolarHBondContact O-CB 3.33Å; L24-T27 PolarHBondContact O-N 3.47Å; Y25-T27 VanDerWaalsContact C-N 3.28Å; Y25-T27 PolarHBondContact O-N 2.93Å; T27-L29 VanDerWaalsContact C-N 3.32Å; T27-L29 PolarHBondContact O-N 3.28Å; T27-A30 PolarHBondContact O-N 3.11Å; T27-A31 WeakPolarHBondContact O-CB 3.48Å; T27-A31 PolarHBondContact O-N 3.32Å
28F90.1Very high86.4Confident151 Ų15174.1 Ų74.166%0.66240%0.397SS*.Hα-helixtrans-63.3-38.9175.5-84.3-69.4000111.9L24 Y25 A31 F32L24-F28 WeakPolarHBondContact O-CD2 3.22Å; L24-F28 PolarHBondContact O-N 2.87Å; Y25-F28 PolarHBondContact O-N 3.34Å; F28-A31 PolarHBondContact O-N 2.96Å; F28-F32 WeakPolarHBondContact O-CB 3.42Å; F28-F32 PolarHBondContact O-N 3.25Å
29L88.2Confident87.6Confident13 Ų1372.2 Ų72.27%0.06838%0.383CS..Hα-helixtrans-62.3-48.1175-174.265.1000110.8Y25 W26 T27 A31 F32 E33 P147Y25-L29 WeakPolarHBondContact O-CB 3.46Å; Y25-L29 PolarHBondContact O-N 3.43Å; W26-L29 HydrophobicContact CE3-CD2 4.02Å; W26-L29 HydrophobicContact CZ3-CD2 4.08Å; W26-L29 PolarHBondContact O-N 3.24Å; T27-L29 VanDerWaalsContact C-N 3.32Å; T27-L29 PolarHBondContact O-N 3.28Å; L29-A31 VanDerWaalsContact C-N 3.31Å; L29-A31 PolarHBondContact O-N 3.33Å; L29-F32 WeakPolarHBondContact O-CB 3.41Å; L29-F32 PolarHBondContact O-N 3.4Å; L29-F32 VanDerWaalsContact O-N 3.16Å; L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.38Å; L29-E33 PolarHBondContact O-N 3.02Å; L29-P147 HydrophobicContact CD1-CB 4.15Å; L29-P147 HydrophobicContact CD1-CG 4.02Å
30A89.4Confident88.1Confident55 Ų5567.9 Ų67.946%0.45537%0.368SS..Hα-helixtrans-61.3-38.4176.300000112.4W26 T27 E33 G34W26-A30 WeakPolarHBondContact O-CB 3.44Å; W26-A30 PolarHBondContact O-N 3.35Å; T27-A30 PolarHBondContact O-N 3.11Å; A30-E33 PolarHBondContact O-N 3.41Å; A30-G34 PolarHBondContact O-N 2.95Å
31A92.2Very high88.3Confident54 Ų5462.1 Ų62.145%0.44634%0.338SS..Hα-helixtrans-65-39.7175.100000112T27 F28 L29 T35T27-A31 WeakPolarHBondContact O-CB 3.48Å; T27-A31 PolarHBondContact O-N 3.32Å; F28-A31 PolarHBondContact O-N 2.96Å; L29-A31 VanDerWaalsContact C-N 3.31Å; L29-A31 PolarHBondContact O-N 3.33Å; A31-T35 WeakPolarHBondContact O-CB 3.5Å; A31-T35 PolarHBondContact O-N 3.19Å; A31-T35 PolarHBondContact O-OG1 3.48Å
32F90.6Very high88.5Confident100 Ų10065 Ų6544%0.43933%0.334SS..Hα-helixtrans-63.5-49.6173.9174.8-97.1000111.4F28 L29 G34 T35 V36 P147F28-F32 WeakPolarHBondContact O-CB 3.42Å; F28-F32 PolarHBondContact O-N 3.25Å; L29-F32 WeakPolarHBondContact O-CB 3.41Å; L29-F32 PolarHBondContact O-N 3.4Å; L29-F32 VanDerWaalsContact O-N 3.16Å; F32-G34 PolarHBondContact O-N 3.06Å; F32-T35 WeakPolarHBondContact O-CB 3.33Å; F32-T35 PolarHBondContact O-N 3.25Å; F32-T35 VanDerWaalsContact O-N 3.15Å; F32-V36 HydrophobicContact CD1-CG2 4.24Å; F32-V36 HydrophobicContact CE1-CG2 3.78Å; F32-V36 HydrophobicContact CE2-CG2 4.08Å; F32-V36 HydrophobicContact CZ-CG2 3.7Å; F32-V36 WeakPolarHBondContact O-CG2 3.49Å; F32-V36 PolarHBondContact O-N 3.16Å; F32-P147 HydrophobicContact CD1-CG 4.19Å; F32-P147 HydrophobicContact CE1-CG 3.91Å
33E90.4Very high88.7Confident13 Ų1369.5 Ų69.56%0.06135%0.35CS..Hα-helixtrans-57.8-47.1177.2-66.2174.5176.700111.1L29 A30 T35 V36 F37 K77 S144L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.38Å; L29-E33 PolarHBondContact O-N 3.02Å; A30-E33 PolarHBondContact O-N 3.41Å; E33-T35 VanDerWaalsContact C-N 3.32Å; E33-T35 PolarHBondContact O-N 3.3Å; E33-V36 PolarHBondContact O-N 3.31Å; E33-V36 VanDerWaalsContact O-N 3.16Å; E33-F37 HydrophobicContact CB-CE2 4.06Å; E33-F37 HydrophobicContact CB-CZ 3.98Å; E33-F37 WeakPolarHBondContact O-CD1 3.35Å; E33-F37 VanDerWaalsContact O-CD2 3.27Å; E33-F37 WeakPolarHBondContact O-CD2 3.43Å; E33-F37 WeakPolarHBondContact O-CG 3.18Å; E33-F37 PolarHBondContact O-N 2.96Å; E33-K77 IonicContact OE1-NZ 2.69Å; E33-K77 PolarHBondContact OE1-NZ 3.01Å; E33-K77 IonicContact OE2-NZ 3.8Å; E33-S144 WeakPolarHBondContact CG-OG 3.34Å
34G91.3Very high88.5Confident36 Ų3664.3 Ų64.337%0.37133%0.328SS..Hα-helixtrans-59.9-39.6175.600000113.4A30 F32 F37 F38A30-G34 PolarHBondContact O-N 2.95Å; F32-G34 PolarHBondContact O-N 3.06Å; G34-F37 PolarHBondContact O-N 3Å; G34-F38 PolarHBondContact O-N 3.18Å; G34-F38 VanDerWaalsContact O-N 3.08Å
35T91.9Very high88Confident71 Ų7163.2 Ų63.244%0.43632%0.32SS..Hα-helixtrans-63.6-45.7174.7-58.40000110.6A31 F32 E33 F37 F38 F39A31-T35 WeakPolarHBondContact O-CB 3.5Å; A31-T35 PolarHBondContact O-N 3.19Å; A31-T35 PolarHBondContact O-OG1 3.48Å; F32-T35 WeakPolarHBondContact O-CB 3.33Å; F32-T35 PolarHBondContact O-N 3.25Å; F32-T35 VanDerWaalsContact O-N 3.15Å; E33-T35 VanDerWaalsContact C-N 3.32Å; E33-T35 PolarHBondContact O-N 3.3Å; T35-F37 PolarHBondContact O-N 2.76Å; T35-F38 PolarHBondContact O-N 3.48Å; T35-F39 HydrophobicContact CG2-CD2 3.48Å; T35-F39 VanDerWaalsContact CG2-CD2 3.48Å; T35-F39 HydrophobicContact CG2-CE2 3.75Å; T35-F39 WeakPolarHBondContact O-CB 3.23Å; T35-F39 WeakPolarHBondContact O-CD2 3.29Å; T35-F39 PolarHBondContact O-N 3.06Å
36V91.1Very high87.6Confident22 Ų2265 Ų6513%0.13333%0.331CS..Hα-helixtrans-61.6-42.7177.4170.70000111.3F32 E33 G40 L140 I143F32-V36 HydrophobicContact CD1-CG2 4.24Å; F32-V36 HydrophobicContact CE1-CG2 3.78Å; F32-V36 HydrophobicContact CE2-CG2 4.08Å; F32-V36 HydrophobicContact CZ-CG2 3.7Å; F32-V36 WeakPolarHBondContact O-CG2 3.49Å; F32-V36 PolarHBondContact O-N 3.16Å; E33-V36 PolarHBondContact O-N 3.31Å; E33-V36 VanDerWaalsContact O-N 3.16Å; V36-G40 VanDerWaalsContact O-CA 3.26Å; V36-G40 WeakPolarHBondContact O-CA 3.44Å; V36-G40 PolarHBondContact O-N 3.08Å; V36-L140 HydrophobicContact CG1-CD2 4.28Å; V36-I143 HydrophobicContact CG1-CG2 3.97Å
37F90.8Very high86.7Confident10 Ų1063.7 Ų63.74%0.04434%0.336CS..Hα-helixtrans-62-46.4177.7-56.8-29.3000111.8E33 G34 T35 T41 V66 V69 L70 T73 S144E33-F37 HydrophobicContact CB-CE2 4.06Å; E33-F37 HydrophobicContact CB-CZ 3.98Å; E33-F37 WeakPolarHBondContact O-CD1 3.35Å; E33-F37 VanDerWaalsContact O-CD2 3.27Å; E33-F37 WeakPolarHBondContact O-CD2 3.43Å; E33-F37 WeakPolarHBondContact O-CG 3.18Å; E33-F37 PolarHBondContact O-N 2.96Å; G34-F37 PolarHBondContact O-N 3Å; T35-F37 PolarHBondContact O-N 2.76Å; F37-T41 WeakPolarHBondContact O-CB 3.46Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.49Å; F37-T41 PolarHBondContact O-N 2.96Å; F37-T41 VanDerWaalsContact O-N 3.15Å; F37-T41 PolarHBondContact O-OG1 2.97Å; F37-V66 HydrophobicContact CB-CG1 4.35Å; F37-V69 HydrophobicContact CD1-CB 4.44Å; F37-V69 HydrophobicContact CD1-CG1 3.41Å; F37-V69 VanDerWaalsContact CD1-CG1 3.41Å; F37-V69 HydrophobicContact CE1-CG1 3.63Å; F37-V69 HydrophobicContact CG-CG1 4.23Å; F37-L70 HydrophobicContact CD2-CB 4.41Å; F37-L70 HydrophobicContact CE2-CB 4.37Å; F37-L70 HydrophobicContact CE2-CG 4.41Å; F37-T73 HydrophobicContact CE1-CG2 4.11Å; F37-T73 HydrophobicContact CZ-CG2 3.69Å; F37-S144 VanDerWaalsContact CE1-OG 3.25Å; F37-S144 WeakPolarHBondContact CE1-OG 3.36Å; F37-S144 WeakPolarHBondContact CZ-OG 3.43Å
38F89.2Confident84.9Confident109 Ų10965.2 Ų65.248%0.47836%0.355SS..Hα-helixtrans-69.4-53.1-178.3-176.3-97.2000112.4G34 T35 T41 Y42 F62G34-F38 PolarHBondContact O-N 3.18Å; G34-F38 VanDerWaalsContact O-N 3.08Å; T35-F38 PolarHBondContact O-N 3.48Å; F38-T41 PolarHBondContact O-OG1 2.99Å; F38-Y42 VanDerWaalsContact O-CB 3.32Å; F38-Y42 WeakPolarHBondContact O-CB 3.42Å; F38-Y42 PolarHBondContact O-N 3.36Å; F38-F62 HydrophobicContact CD2-CE1 4.19Å; F38-F62 HydrophobicContact CD2-CZ 4.1Å; F38-F62 HydrophobicContact CE2-CE1 4.01Å; F38-F62 HydrophobicContact CE2-CZ 4.03Å
39F89.9Confident83.3Confident103 Ų10362.5 Ų62.545%0.45236%0.355SS..Hα-helixtrans-69.3-36.3-179.1-78.8-80000111.9T35 Y42 F43T35-F39 HydrophobicContact CG2-CD2 3.48Å; T35-F39 VanDerWaalsContact CG2-CD2 3.48Å; T35-F39 HydrophobicContact CG2-CE2 3.75Å; T35-F39 WeakPolarHBondContact O-CB 3.23Å; T35-F39 WeakPolarHBondContact O-CD2 3.29Å; T35-F39 PolarHBondContact O-N 3.06Å; F39-Y42 WeakPolarHBondContact O-CB 3.22Å; F39-Y42 PolarHBondContact O-N 3.48Å; F39-F43 HydrophobicContact CB-CE2 4.25Å; F39-F43 WeakPolarHBondContact O-CD2 3.4Å; F39-F43 PolarHBondContact O-N 3.08Å
40G87.1Confident81.8Confident19 Ų1962.8 Ų62.820%0.19636%0.356CS..Hα-helixtrans-62-45.5177.700000112.9V36 L44V36-G40 VanDerWaalsContact O-CA 3.26Å; V36-G40 WeakPolarHBondContact O-CA 3.44Å; V36-G40 PolarHBondContact O-N 3.08Å; G40-L44 PolarHBondContact O-N 3.49Å
41T86.1Confident80.2Confident0 Ų061 Ų610%034%0.339CS..Hα-helixtrans-70.1-32.9173.353.50000112.3F37 F38 L44 F45 F62 I65 V66 L140F37-T41 WeakPolarHBondContact O-CB 3.46Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.49Å; F37-T41 PolarHBondContact O-N 2.96Å; F37-T41 VanDerWaalsContact O-N 3.15Å; F37-T41 PolarHBondContact O-OG1 2.97Å; F38-T41 PolarHBondContact O-OG1 2.99Å; T41-L44 WeakPolarHBondContact O-CB 2.99Å; T41-L44 PolarHBondContact O-N 3.12Å; T41-F45 VanDerWaalsContact O-CD2 3.28Å; T41-F45 WeakPolarHBondContact O-CD2 3.16Å; T41-F45 PolarHBondContact O-N 3.39Å; T41-F45 VanDerWaalsContact O-N 3.09Å; T41-F62 WeakPolarHBondContact OG1-CE2 3.16Å; T41-F62 VanDerWaalsContact OG1-CZ 3.31Å; T41-F62 WeakPolarHBondContact OG1-CZ 3.17Å; T41-I65 HydrophobicContact CG2-CB 4.42Å; T41-I65 HydrophobicContact CG2-CG2 3.59Å; T41-V66 HydrophobicContact CG2-CG2 3.69Å; T41-V66 WeakPolarHBondContact OG1-CG2 3.3Å; T41-L140 HydrophobicContact CG2-CD1 3.93Å
42Y85.9Confident78.3Confident108 Ų10868.3 Ų68.342%0.42436%0.363SS..Hα-helixtrans-62-46.4174.3177.9-97.8000112F38 F39 L44 F45 Q46F38-Y42 VanDerWaalsContact O-CB 3.32Å; F38-Y42 WeakPolarHBondContact O-CB 3.42Å; F38-Y42 PolarHBondContact O-N 3.36Å; F39-Y42 WeakPolarHBondContact O-CB 3.22Å; F39-Y42 PolarHBondContact O-N 3.48Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 2.95Å; Y42-F45 PolarHBondContact O-N 3.4Å; Y42-F45 VanDerWaalsContact O-N 3.14Å; Y42-Q46 HydrophobicContact CE1-CG 4.18Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.28Å; Y42-Q46 PolarHBondContact O-N 3.45Å; Y42-Q46 PolarHBondContact OH-NE2 3.39Å; Y42-Q46 VanDerWaalsContact OH-NE2 3.1Å
43F85.1Confident76.7Confident139 Ų13969.3 Ų69.361%0.6137%0.373SS*.Hα-helixtrans-62.1-37.2175.2-73.2-58.8000112.2F39 F45 Q46F39-F43 HydrophobicContact CB-CE2 4.25Å; F39-F43 WeakPolarHBondContact O-CD2 3.4Å; F39-F43 PolarHBondContact O-N 3.08Å; F43-F45 VanDerWaalsContact C-N 3.27Å; F43-F45 PolarHBondContact O-N 3.45Å; F43-Q46 WeakPolarHBondContact O-CB 3.47Å; F43-Q46 PolarHBondContact O-N 3.25Å
44L80.1Confident75.1Confident19 Ų1971.4 Ų71.410%0.09940%0.399CS..Hα-helixtrans-60.6-36.6174.9-174.165.1000112.1G40 T41 Y42 T47 L50 A136G40-L44 PolarHBondContact O-N 3.49Å; T41-L44 WeakPolarHBondContact O-CB 2.99Å; T41-L44 PolarHBondContact O-N 3.12Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 2.95Å; L44-T47 PolarHBondContact O-N 3.28Å; L44-T47 PolarHBondContact O-OG1 3.2Å; L44-L50 HydrophobicContact CD1-CD1 3.89Å; L44-L50 HydrophobicContact CD1-CD2 3.64Å; L44-L50 HydrophobicContact CD1-CG 4.41Å; L44-L50 HydrophobicContact CD2-CD1 4.22Å; L44-L50 HydrophobicContact CG-CD1 3.6Å; L44-L50 HydrophobicContact CG-CD2 4.29Å; L44-L50 WeakPolarHBondContact O-CD1 3.37Å; L44-A136 HydrophobicContact CD1-CB 3.46Å; L44-A136 VanDerWaalsContact CD1-CB 3.46Å; L44-A136 HydrophobicContact CD2-CB 3.58Å; L44-A136 HydrophobicContact CG-CB 4.09Å
45F77.9Confident73.7Confident52 Ų5275.5 Ų75.523%0.22841%0.406CS..Hα-helixtrans-76.7-21.9178.3-88.4-117.2000113.8T41 Y42 F43 T47 Y57 F62 I65T41-F45 VanDerWaalsContact O-CD2 3.28Å; T41-F45 WeakPolarHBondContact O-CD2 3.16Å; T41-F45 PolarHBondContact O-N 3.39Å; T41-F45 VanDerWaalsContact O-N 3.09Å; Y42-F45 PolarHBondContact O-N 3.4Å; Y42-F45 VanDerWaalsContact O-N 3.14Å; F43-F45 VanDerWaalsContact C-N 3.27Å; F43-F45 PolarHBondContact O-N 3.45Å; F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.37Å; F45-Y57 HydrophobicContact CE1-CG 4.3Å; F45-Y57 HydrophobicContact CZ-CG 4.24Å; F45-F62 HydrophobicContact CD1-CD2 4.23Å; F45-F62 AromaticContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CE2 4.41Å; F45-F62 HydrophobicContact CE1-CB 3.8Å; F45-F62 HydrophobicContact CE1-CD2 4.23Å; F45-F62 HydrophobicContact CE2-CB 4.09Å; F45-F62 AromaticContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CG 4.39Å; F45-F62 AromaticContact CG-CD2 3.98Å; F45-F62 HydrophobicContact CG-CD2 3.98Å; F45-F62 VanDerWaalsContact CZ-CA 3.41Å; F45-F62 HydrophobicContact CZ-CB 3.57Å; F45-F62 HydrophobicContact CZ-CD2 4Å; F45-F62 HydrophobicContact CZ-CG 4.3Å; F45-I65 HydrophobicContact CE2-CD1 3.65Å; F45-I65 HydrophobicContact CZ-CD1 4.04Å
46Q76.4Confident72.4Confident115 Ų11578.8 Ų78.854%0.53743%0.426SS..Hα-helixtrans-68.9-28.4174.3-68.4-65.9-24.800112Y42 F43 A48Y42-Q46 HydrophobicContact CE1-CG 4.18Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.28Å; Y42-Q46 PolarHBondContact O-N 3.45Å; Y42-Q46 PolarHBondContact OH-NE2 3.39Å; Y42-Q46 VanDerWaalsContact OH-NE2 3.1Å; F43-Q46 WeakPolarHBondContact O-CB 3.47Å; F43-Q46 PolarHBondContact O-N 3.25Å; Q46-A48 VanDerWaalsContact C-N 3.33Å; Q46-A48 PolarHBondContact O-N 3.11Å
47T67.3Low71.3Confident83 Ų8378.9 Ų78.951%0.50942%0.424SS..SBendtrans-76.485168.836.50000109.9L44 F45 S49L44-T47 PolarHBondContact O-N 3.28Å; L44-T47 PolarHBondContact O-OG1 3.2Å; F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.37Å; T47-S49 PolarHBondContact O-N 3.14Å
48A52.5Low70.5Confident97 Ų9780.1 Ų80.180%0.80244%0.439SS*.SBendtrans-60.716.1-16700000118Q46Q46-A48 VanDerWaalsContact C-N 3.33Å; Q46-A48 PolarHBondContact O-N 3.11Å
49S55.9Low70Confident95 Ų9581.9 Ų81.966%0.66445%0.454SS*.  trans-149.151.9-175.2690000113.7T47 E51T47-S49 PolarHBondContact O-N 3.14Å; S49-E51 PolarHBondContact O-N 3.37Å
50L55.8Low69.6Low18 Ų1882.4 Ų82.49%0.09445%0.453CS..SBendtrans-77-8.7177.7-42.2160.4000113.1L44 Y57 S130 S132L44-L50 HydrophobicContact CD1-CD1 3.89Å; L44-L50 HydrophobicContact CD1-CD2 3.64Å; L44-L50 HydrophobicContact CD1-CG 4.41Å; L44-L50 HydrophobicContact CD2-CD1 4.22Å; L44-L50 HydrophobicContact CG-CD1 3.6Å; L44-L50 HydrophobicContact CG-CD2 4.29Å; L44-L50 WeakPolarHBondContact O-CD1 3.37Å; L50-Y57 HydrophobicContact CB-CE2 3.73Å; L50-Y57 HydrophobicContact CD1-CD2 4.27Å; L50-Y57 HydrophobicContact CD1-CE2 3.93Å; L50-Y57 HydrophobicContact CG-CE2 4.25Å; L50-S130 WeakPolarHBondContact O-CB 3.39Å; L50-S130 PolarHBondContact O-OG 3.2Å; L50-S132 WeakPolarHBondContact CD2-OG 3.41Å
51E56.6Low69.2Low19 Ų1981.8 Ų81.89%0.08945%0.445CS..SBendtrans-110.2131.7172.7-119.9-175.8161.900109.5S49 N53 G54 K55 Q126S49-E51 PolarHBondContact O-N 3.37Å; E51-N53 PolarHBondContact O-N 3.23Å; E51-G54 PolarHBondContact O-N 3.42Å; E51-K55 WeakPolarHBondContact OE2-CB 3.45Å; E51-Q126 VanDerWaalsContact CD-NE2 3.34Å; E51-Q126 WeakPolarHBondContact OE1-CG 3.41Å; E51-Q126 PolarHBondContact OE1-NE2 3.16Å; E51-Q126 PolarHBondContact OE2-NE2 2.89Å
52E52.1Low69.1Low206 Ų20683.8 Ų83.896%0.96345%0.454SS*.THydrogen-bonded Turntrans-57.2-18.7175.2-67.6-175.6161.900112.6
53N56.7Low69Low121 Ų12180.4 Ų80.465%0.64745%0.452SS*.THydrogen-bonded Turntrans-91.90.9-179.3-65.2-29.5000114.5E51 K55E51-N53 PolarHBondContact O-N 3.23Å; N53-K55 HydrophobicContact CB-CG 4.44Å; N53-K55 PolarHBondContact O-N 3.09Å
54G57.3Low69.1Low58 Ų5875 Ų7560%0.59843%0.43SS*.  trans65.317.9176.200000115.5E51E51-G54 PolarHBondContact O-N 3.42Å
55K62.4Low69.4Low122 Ų12274 Ų7453%0.5343%0.425SS..PPolyproline II helixtrans-77.1140.1177-58.9176.51771730110.2E51 N53E51-K55 WeakPolarHBondContact OE2-CB 3.45Å; N53-K55 HydrophobicContact CB-CG 4.44Å; N53-K55 PolarHBondContact O-N 3.09Å
56V63.7Low70Confident139 Ų13973 Ų7384%0.84242%0.423SS*.PPolyproline II helixtrans-79.8126.3179.3-173.10000109.2G58V56-G58 PolarHBondContact O-N 2.89Å
57Y69.2Low70.6Confident24 Ų2472.9 Ų72.99%0.09442%0.421CS..PPolyproline II helixtrans-68.9128.6172.5-71.1-72.2000110.7F45 L50 T61 S130F45-Y57 HydrophobicContact CE1-CG 4.3Å; F45-Y57 HydrophobicContact CZ-CG 4.24Å; L50-Y57 HydrophobicContact CB-CE2 3.73Å; L50-Y57 HydrophobicContact CD1-CD2 4.27Å; L50-Y57 HydrophobicContact CD1-CE2 3.93Å; L50-Y57 HydrophobicContact CG-CE2 4.25Å; Y57-T61 HydrophobicContact CD1-CG2 3.27Å; Y57-T61 HydrophobicContact CE1-CG2 3.82Å; Y57-T61 HydrophobicContact CG-CG2 4.18Å; Y57-S130 WeakPolarHBondContact OH-CB 3.39Å
58G72.9Confident71.7Confident36 Ų3669.1 Ų69.137%0.37140%0.398SS..PPolyproline II helixtrans-80.2167.8175.400000112.7V56 W60 T61 F62V56-G58 PolarHBondContact O-N 2.89Å; G58-W60 PolarHBondContact O-N 3.19Å; G58-W60 VanDerWaalsContact O-N 3.11Å; G58-T61 WeakPolarHBondContact O-CB 3.41Å; G58-T61 PolarHBondContact O-N 2.95Å; G58-F62 PolarHBondContact O-N 2.83Å
59N79.3Confident73.6Confident146 Ų14664.5 Ų64.578%0.78136%0.36SS*.Hα-helixtrans-56.1-29.5177.3-62.4-13.9000113.3F62 G63N59-F62 WeakPolarHBondContact O-CB 3.27Å; N59-F62 PolarHBondContact O-N 3.32Å; N59-G63 PolarHBondContact O-N 3.47Å; N59-G63 VanDerWaalsContact O-N 3.15Å
60W80.6Confident75.3Confident115 Ų11563.1 Ų63.144%0.43635%0.345SS..Hα-helixtrans-71.4-34.1176.3-65.4109.8000112.9G58 G63 T64 R119 M120G58-W60 PolarHBondContact O-N 3.19Å; G58-W60 VanDerWaalsContact O-N 3.11Å; W60-G63 PolarHBondContact O-N 3.43Å; W60-T64 WeakPolarHBondContact O-CB 3.46Å; W60-T64 PolarHBondContact O-N 2.92Å; W60-T64 PolarHBondContact O-OG1 3.41Å; W60-R119 HydrophobicContact CZ2-CB 4.48Å; W60-M120 HydrophobicContact CB-CG 4.22Å; W60-M120 HydrophobicContact CD2-CE 4.08Å; W60-M120 HydrophobicContact CD2-CG 4.16Å; W60-M120 HydrophobicContact CE3-CE 3.17Å; W60-M120 HydrophobicContact CE3-CG 4.16Å; W60-M120 HydrophobicContact CE3-SD 4.48Å; W60-M120 HydrophobicContact CG-CG 4.23Å; W60-M120 HydrophobicContact CH2-CE 4.19Å; W60-M120 HydrophobicContact CZ3-CE 3.23Å
61T79.6Confident77Confident6 Ų663.3 Ų63.34%0.03735%0.347CS..Hα-helixtrans-67.1-41.4173.9-42.20000110.7Y57 G58 G63 T64 I65 V123 M127Y57-T61 HydrophobicContact CD1-CG2 3.27Å; Y57-T61 HydrophobicContact CE1-CG2 3.82Å; Y57-T61 HydrophobicContact CG-CG2 4.18Å; G58-T61 WeakPolarHBondContact O-CB 3.41Å; G58-T61 PolarHBondContact O-N 2.95Å; T61-G63 PolarHBondContact O-N 3.37Å; T61-T64 PolarHBondContact O-N 3.45Å; T61-I65 HydrophobicContact CG2-CD1 4.04Å; T61-I65 WeakPolarHBondContact O-CG1 3.33Å; T61-I65 PolarHBondContact O-N 3.48Å; T61-V123 HydrophobicContact CG2-CG1 3.99Å; T61-V123 WeakPolarHBondContact OG1-CG1 3.33Å; T61-M127 HydrophobicContact CG2-CB 4.37Å
62F83.9Confident78.7Confident42 Ų4264.7 Ų64.718%0.18435%0.352CS..Hα-helixtrans-54.8-51.8173.5-179.5-91.2000111.4F38 T41 F45 G58 N59 T64 I65 V66F38-F62 HydrophobicContact CD2-CE1 4.19Å; F38-F62 HydrophobicContact CD2-CZ 4.1Å; F38-F62 HydrophobicContact CE2-CE1 4.01Å; F38-F62 HydrophobicContact CE2-CZ 4.03Å; T41-F62 WeakPolarHBondContact OG1-CE2 3.16Å; T41-F62 VanDerWaalsContact OG1-CZ 3.31Å; T41-F62 WeakPolarHBondContact OG1-CZ 3.17Å; F45-F62 HydrophobicContact CD1-CD2 4.23Å; F45-F62 AromaticContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CE2 4.41Å; F45-F62 HydrophobicContact CE1-CB 3.8Å; F45-F62 HydrophobicContact CE1-CD2 4.23Å; F45-F62 HydrophobicContact CE2-CB 4.09Å; F45-F62 AromaticContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CG 4.39Å; F45-F62 AromaticContact CG-CD2 3.98Å; F45-F62 HydrophobicContact CG-CD2 3.98Å; F45-F62 VanDerWaalsContact CZ-CA 3.41Å; F45-F62 HydrophobicContact CZ-CB 3.57Å; F45-F62 HydrophobicContact CZ-CD2 4Å; F45-F62 HydrophobicContact CZ-CG 4.3Å; G58-F62 PolarHBondContact O-N 2.83Å; N59-F62 WeakPolarHBondContact O-CB 3.27Å; N59-F62 PolarHBondContact O-N 3.32Å; F62-T64 VanDerWaalsContact C-N 3.28Å; F62-T64 PolarHBondContact O-N 2.83Å; F62-I65 PolarHBondContact O-N 2.8Å; F62-V66 HydrophobicContact CD1-CG2 4.27Å; F62-V66 HydrophobicContact CE1-CG2 3.87Å; F62-V66 HydrophobicContact CZ-CG2 4.07Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.92Å
63G84.7Confident80.6Confident36 Ų3654.9 Ų54.937%0.37131%0.306SS..Hα-helixtrans-59.7-38.217800000113.1N59 W60 T61 F67N59-G63 PolarHBondContact O-N 3.47Å; N59-G63 VanDerWaalsContact O-N 3.15Å; W60-G63 PolarHBondContact O-N 3.43Å; T61-G63 PolarHBondContact O-N 3.37Å; G63-F67 VanDerWaalsContact O-CB 3.27Å; G63-F67 WeakPolarHBondContact O-CB 3.47Å; G63-F67 PolarHBondContact O-N 3.49Å
64T85.6Confident82.2Confident25 Ų2552.2 Ų52.215%0.15330%0.295CS..Hα-helixtrans-70.1-36.6-179.9-55.20000112W60 T61 F62 F67 T68 F124 M127W60-T64 WeakPolarHBondContact O-CB 3.46Å; W60-T64 PolarHBondContact O-N 2.92Å; W60-T64 PolarHBondContact O-OG1 3.41Å; T61-T64 PolarHBondContact O-N 3.45Å; F62-T64 VanDerWaalsContact C-N 3.28Å; F62-T64 PolarHBondContact O-N 2.83Å; T64-F67 PolarHBondContact O-N 3.36Å; T64-T68 WeakPolarHBondContact O-CB 3.36Å; T64-T68 PolarHBondContact O-N 2.92Å; T64-T68 PolarHBondContact O-OG1 2.89Å; T64-F124 HydrophobicContact CG2-CD2 3.73Å; T64-F124 HydrophobicContact CG2-CE2 4.44Å; T64-M127 HydrophobicContact CG2-SD 3.97Å
65I87.1Confident83.9Confident0 Ų050.3 Ų50.30%027%0.271CS..Hα-helixtrans-66-50.3174.8-67.3163.7000109.8T41 F45 T61 F62 F67 T68 V69 M127 T133 I137T41-I65 HydrophobicContact CG2-CB 4.42Å; T41-I65 HydrophobicContact CG2-CG2 3.59Å; F45-I65 HydrophobicContact CE2-CD1 3.65Å; F45-I65 HydrophobicContact CZ-CD1 4.04Å; T61-I65 HydrophobicContact CG2-CD1 4.04Å; T61-I65 WeakPolarHBondContact O-CG1 3.33Å; T61-I65 PolarHBondContact O-N 3.48Å; F62-I65 PolarHBondContact O-N 2.8Å; I65-F67 VanDerWaalsContact C-N 3.27Å; I65-F67 PolarHBondContact O-N 3.03Å; I65-T68 PolarHBondContact O-N 3.49Å; I65-T68 VanDerWaalsContact O-N 3.16Å; I65-V69 HydrophobicContact CG2-CG2 4.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.17Å; I65-V69 PolarHBondContact O-N 2.68Å; I65-M127 HydrophobicContact CB-SD 4.29Å; I65-M127 HydrophobicContact CD1-CG 4.21Å; I65-M127 HydrophobicContact CG1-CG 3.63Å; I65-M127 HydrophobicContact CG1-SD 3.41Å; I65-M127 WeakPolarHBondContact CG1-SD 3.24Å; I65-T133 HydrophobicContact CD1-CG2 3.87Å; I65-T133 HydrophobicContact CG1-CG2 4.02Å; I65-I137 HydrophobicContact CG2-CG1 4.31Å
66V90.1Very high85.2Confident31 Ų3147 Ų4719%0.18826%0.259CS..Hα-helixtrans-56-45.3176.8174.90000110.7F37 T41 F62 T68 V69 L70F37-V66 HydrophobicContact CB-CG1 4.35Å; T41-V66 HydrophobicContact CG2-CG2 3.69Å; T41-V66 WeakPolarHBondContact OG1-CG2 3.3Å; F62-V66 HydrophobicContact CD1-CG2 4.27Å; F62-V66 HydrophobicContact CE1-CG2 3.87Å; F62-V66 HydrophobicContact CZ-CG2 4.07Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.92Å; V66-T68 PolarHBondContact O-N 3.43Å; V66-V69 PolarHBondContact O-N 3.4Å; V66-L70 WeakPolarHBondContact O-CB 3.23Å; V66-L70 PolarHBondContact O-N 3.03Å
67F89.9Confident86.4Confident111 Ų11141.9 Ų41.949%0.48723%0.225SC..Hα-helixtrans-64.7-40.4179.5-165.1-96000112.3G63 T64 I65 L70 V71 Y100G63-F67 VanDerWaalsContact O-CB 3.27Å; G63-F67 WeakPolarHBondContact O-CB 3.47Å; G63-F67 PolarHBondContact O-N 3.49Å; T64-F67 PolarHBondContact O-N 3.36Å; I65-F67 VanDerWaalsContact C-N 3.27Å; I65-F67 PolarHBondContact O-N 3.03Å; F67-L70 PolarHBondContact O-N 3.28Å; F67-V71 HydrophobicContact CD1-CG2 3.9Å; F67-V71 HydrophobicContact CE1-CG2 3.57Å; F67-V71 HydrophobicContact CZ-CG2 4.05Å; F67-V71 WeakPolarHBondContact O-CG2 3.38Å; F67-V71 PolarHBondContact O-N 3.3Å; F67-Y100 AromaticContact CD1-CE2 3.57Å; F67-Y100 HydrophobicContact CD1-CE2 3.57Å; F67-Y100 AromaticContact CD1-CZ 3.93Å; F67-Y100 HydrophobicContact CE1-CD2 4.13Å; F67-Y100 AromaticContact CE1-CE2 3.49Å; F67-Y100 HydrophobicContact CE1-CE2 3.49Å; F67-Y100 VanDerWaalsContact CE1-CE2 3.49Å
68T89.9Confident87.3Confident4 Ų445.6 Ų45.63%0.02525%0.246CC..Hα-helixtrans-63.1-48.7176.5-59.90000111.2T64 I65 V66 L70 V71 F72 Y100 M127 I137T64-T68 WeakPolarHBondContact O-CB 3.36Å; T64-T68 PolarHBondContact O-N 2.92Å; T64-T68 PolarHBondContact O-OG1 2.89Å; I65-T68 PolarHBondContact O-N 3.49Å; I65-T68 VanDerWaalsContact O-N 3.16Å; V66-T68 PolarHBondContact O-N 3.43Å; T68-L70 VanDerWaalsContact C-N 3.27Å; T68-L70 PolarHBondContact O-N 3.37Å; T68-V71 PolarHBondContact O-N 3.35Å; T68-F72 HydrophobicContact CG2-CD2 3.94Å; T68-F72 HydrophobicContact CG2-CE2 3.96Å; T68-F72 VanDerWaalsContact O-CD2 3.27Å; T68-F72 WeakPolarHBondContact O-CD2 3.04Å; T68-F72 PolarHBondContact O-N 3.37Å; T68-Y100 WeakPolarHBondContact CA-OH 3.38Å; T68-Y100 HydrophobicContact CG2-CE1 4.25Å; T68-Y100 PolarHBondContact OG1-OH 3.46Å; T68-M127 HydrophobicContact CG2-CE 4.36Å; T68-I137 HydrophobicContact CG2-CD1 4.33Å
69V91.5Very high88Confident0 Ų044.6 Ų44.60%024%0.235CC..Hα-helixtrans-58.6-42.4176.7177.30000110.6F37 I65 V66 T73 I137 L140 I141F37-V69 HydrophobicContact CD1-CB 4.44Å; F37-V69 HydrophobicContact CD1-CG1 3.41Å; F37-V69 VanDerWaalsContact CD1-CG1 3.41Å; F37-V69 HydrophobicContact CE1-CG1 3.63Å; F37-V69 HydrophobicContact CG-CG1 4.23Å; I65-V69 HydrophobicContact CG2-CG2 4.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.17Å; I65-V69 PolarHBondContact O-N 2.68Å; V66-V69 PolarHBondContact O-N 3.4Å; V69-T73 VanDerWaalsContact O-CB 3.27Å; V69-T73 WeakPolarHBondContact O-CB 3.47Å; V69-T73 PolarHBondContact O-N 3.19Å; V69-T73 PolarHBondContact O-OG1 2.88Å; V69-I137 HydrophobicContact CG2-CB 4.21Å; V69-I137 HydrophobicContact CG2-CG1 3.86Å; V69-I137 HydrophobicContact CG2-CG2 4.07Å; V69-L140 HydrophobicContact CG1-CB 3.88Å; V69-L140 HydrophobicContact CG2-CB 4.42Å; V69-L140 HydrophobicContact CG2-CD1 4.14Å; V69-I141 HydrophobicContact CG1-CG1 4.3Å
70L92.3Very high88.3Confident67 Ų6741.7 Ų41.735%0.35122%0.219SC..Hα-helixtrans-60.5-55.4177.7-174.9162.4000111.3F37 V66 F67 T68 F72 T73 V74F37-L70 HydrophobicContact CD2-CB 4.41Å; F37-L70 HydrophobicContact CE2-CB 4.37Å; F37-L70 HydrophobicContact CE2-CG 4.41Å; V66-L70 WeakPolarHBondContact O-CB 3.23Å; V66-L70 PolarHBondContact O-N 3.03Å; F67-L70 PolarHBondContact O-N 3.28Å; T68-L70 VanDerWaalsContact C-N 3.27Å; T68-L70 PolarHBondContact O-N 3.37Å; L70-F72 VanDerWaalsContact C-N 3.3Å; L70-F72 PolarHBondContact O-N 2.86Å; L70-T73 PolarHBondContact O-N 2.92Å; L70-T73 VanDerWaalsContact O-N 3.13Å; L70-V74 HydrophobicContact CD2-CG1 4.04Å; L70-V74 HydrophobicContact CD2-CG2 4.27Å; L70-V74 HydrophobicContact CG-CG1 4.46Å; L70-V74 WeakPolarHBondContact O-CG1 3.31Å; L70-V74 WeakPolarHBondContact O-CG2 3.34Å; L70-V74 PolarHBondContact O-N 3.13Å
71V92.3Very high88.4Confident22 Ų2239.8 Ų39.813%0.13322%0.217CC..Hα-helixtrans-57.9-43.8-177.3170.60000111.3F67 T68 V74 T75 Y100F67-V71 HydrophobicContact CD1-CG2 3.9Å; F67-V71 HydrophobicContact CE1-CG2 3.57Å; F67-V71 HydrophobicContact CZ-CG2 4.05Å; F67-V71 WeakPolarHBondContact O-CG2 3.38Å; F67-V71 PolarHBondContact O-N 3.3Å; T68-V71 PolarHBondContact O-N 3.35Å; V71-V74 WeakPolarHBondContact O-CG2 3.46Å; V71-T75 VanDerWaalsContact O-CB 3.27Å; V71-T75 WeakPolarHBondContact O-CB 3.44Å; V71-T75 PolarHBondContact O-N 3.37Å; V71-T75 PolarHBondContact O-OG1 2.91Å; V71-Y100 HydrophobicContact CB-CD1 4.46Å; V71-Y100 HydrophobicContact CB-CE1 4.49Å; V71-Y100 HydrophobicContact CG1-CD1 3.96Å; V71-Y100 HydrophobicContact CG1-CD2 4.34Å; V71-Y100 HydrophobicContact CG1-CE1 4.47Å; V71-Y100 HydrophobicContact CG1-CG 3.88Å; V71-Y100 HydrophobicContact CG2-CD2 4.27Å; V71-Y100 HydrophobicContact CG2-CE2 4.22Å
72F91.5Very high88.8Confident47 Ų4741 Ų4121%0.20623%0.225CC..Hα-helixtrans-65.1-46.2176.4-86.2-104000111.7T68 L70 T75 L76 L97 Y100 I141T68-F72 HydrophobicContact CG2-CD2 3.94Å; T68-F72 HydrophobicContact CG2-CE2 3.96Å; T68-F72 VanDerWaalsContact O-CD2 3.27Å; T68-F72 WeakPolarHBondContact O-CD2 3.04Å; T68-F72 PolarHBondContact O-N 3.37Å; L70-F72 VanDerWaalsContact C-N 3.3Å; L70-F72 PolarHBondContact O-N 2.86Å; F72-T75 PolarHBondContact O-N 3.4Å; F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 VanDerWaalsContact O-CG 3.24Å; F72-L76 WeakPolarHBondContact O-CG 3.32Å; F72-L76 PolarHBondContact O-N 2.82Å; F72-L97 HydrophobicContact CD1-CD2 3.57Å; F72-L97 HydrophobicContact CD2-CD2 3.97Å; F72-L97 HydrophobicContact CE1-CD2 3.47Å; F72-L97 VanDerWaalsContact CE1-CD2 3.47Å; F72-L97 HydrophobicContact CE2-CD2 3.9Å; F72-L97 HydrophobicContact CG-CD2 3.83Å; F72-L97 HydrophobicContact CZ-CD2 3.65Å; F72-Y100 HydrophobicContact CE2-CD1 4.39Å; F72-Y100 HydrophobicContact CE2-CE1 4.37Å; F72-I141 HydrophobicContact CB-CD1 3.59Å; F72-I141 HydrophobicContact CB-CG1 4.22Å; F72-I141 HydrophobicContact CD1-CD1 4.31Å; F72-I141 HydrophobicContact CG-CD1 4.18Å
73T91.6Very high88.5Confident0 Ų048 Ų480%025%0.25CC..Hα-helixtrans-64.1-47.8-177.1-55.50000111.9F37 V69 L70 T75 L76 K77 L145F37-T73 HydrophobicContact CE1-CG2 4.11Å; F37-T73 HydrophobicContact CZ-CG2 3.69Å; V69-T73 VanDerWaalsContact O-CB 3.27Å; V69-T73 WeakPolarHBondContact O-CB 3.47Å; V69-T73 PolarHBondContact O-N 3.19Å; V69-T73 PolarHBondContact O-OG1 2.88Å; L70-T73 PolarHBondContact O-N 2.92Å; L70-T73 VanDerWaalsContact O-N 3.13Å; T73-T75 VanDerWaalsContact C-N 3.28Å; T73-T75 PolarHBondContact O-N 3.47Å; T73-L76 PolarHBondContact O-N 3.29Å; T73-K77 WeakPolarHBondContact O-CB 3.38Å; T73-K77 PolarHBondContact O-N 3.22Å; T73-L145 HydrophobicContact CG2-CD2 3.89Å; T73-L145 HydrophobicContact CG2-CG 4.16Å
74V91.6Very high88.5Confident66 Ų6653.6 Ų53.640%0.426%0.264SS..Hα-helixtrans-65.7-33.8-179.8-590000112.1L70 V71 L78L70-V74 HydrophobicContact CD2-CG1 4.04Å; L70-V74 HydrophobicContact CD2-CG2 4.27Å; L70-V74 HydrophobicContact CG-CG1 4.46Å; L70-V74 WeakPolarHBondContact O-CG1 3.31Å; L70-V74 WeakPolarHBondContact O-CG2 3.34Å; L70-V74 PolarHBondContact O-N 3.13Å; V71-V74 WeakPolarHBondContact O-CG2 3.46Å; V74-L78 WeakPolarHBondContact O-CB 3.36Å; V74-L78 PolarHBondContact O-N 2.69Å
75T92.5Very high88.4Confident17 Ų1758.8 Ų58.810%0.10428%0.281CS..Hα-helixtrans-73.7-42.2178.5-53.80000111.3V71 F72 T73 L78 A79 I93 L97V71-T75 VanDerWaalsContact O-CB 3.27Å; V71-T75 WeakPolarHBondContact O-CB 3.44Å; V71-T75 PolarHBondContact O-N 3.37Å; V71-T75 PolarHBondContact O-OG1 2.91Å; F72-T75 PolarHBondContact O-N 3.4Å; T73-T75 VanDerWaalsContact C-N 3.28Å; T73-T75 PolarHBondContact O-N 3.47Å; T75-L78 PolarHBondContact O-N 3.07Å; T75-A79 WeakPolarHBondContact O-CB 3.43Å; T75-A79 PolarHBondContact O-N 2.97Å; T75-I93 HydrophobicContact CG2-CG2 3.73Å; T75-L97 HydrophobicContact CG2-CD1 3.47Å; T75-L97 VanDerWaalsContact CG2-CD1 3.47Å; T75-L97 HydrophobicContact CG2-CG 3.91Å
76L89.8Confident88.7Confident54 Ų5461.8 Ų61.828%0.28330%0.3SS..Hα-helixtrans-67-38.9174.9-71.8171.1000111.8F72 T73 L78 A79 L80 I141 L145F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 VanDerWaalsContact O-CG 3.24Å; F72-L76 WeakPolarHBondContact O-CG 3.32Å; F72-L76 PolarHBondContact O-N 2.82Å; T73-L76 PolarHBondContact O-N 3.29Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.7Å; L76-A79 WeakPolarHBondContact O-CB 3.31Å; L76-A79 PolarHBondContact O-N 2.85Å; L76-A79 VanDerWaalsContact O-N 3.13Å; L76-L80 WeakPolarHBondContact O-CG 2.77Å; L76-L80 PolarHBondContact O-N 2.98Å; L76-I141 HydrophobicContact CD1-CG2 3.57Å; L76-L145 HydrophobicContact CB-CD1 3.93Å; L76-L145 HydrophobicContact CD1-CD1 4.28Å
77K88.1Confident88.7Confident30 Ų3070.4 Ų70.413%0.1333%0.329CS..Hα-helixtrans-54.6-50171173.2174.6-157.497.20111.1E33 T73 A79 L80 D81 L145 E148E33-K77 IonicContact OE1-NZ 2.69Å; E33-K77 PolarHBondContact OE1-NZ 3.01Å; E33-K77 IonicContact OE2-NZ 3.8Å; T73-K77 WeakPolarHBondContact O-CB 3.38Å; T73-K77 PolarHBondContact O-N 3.22Å; K77-A79 VanDerWaalsContact C-N 3.32Å; K77-A79 PolarHBondContact O-N 3.42Å; K77-L80 PolarHBondContact O-N 3.39Å; K77-D81 PolarHBondContact O-N 2.86Å; K77-L145 HydrophobicContact CB-CD2 4.08Å; K77-E148 WeakPolarHBondContact CE-OE1 3.46Å; K77-E148 WeakPolarHBondContact CE-OE2 3.27Å; K77-E148 VanDerWaalsContact CG-OE2 3.23Å; K77-E148 WeakPolarHBondContact CG-OE2 3.09Å; K77-E148 IonicContact NZ-OE1 2.81Å; K77-E148 PolarHBondContact NZ-OE1 3.34Å; K77-E148 IonicContact NZ-OE2 2.7Å; K77-E148 PolarHBondContact NZ-OE2 3.25Å
78L88.8Confident88.7Confident102 Ų10270.7 Ų70.753%0.53434%0.335SS..Hα-helixtrans-61.5-39.8175.3-175.966.8000112.4V74 T75 L76 L80 D81 T82V74-L78 WeakPolarHBondContact O-CB 3.36Å; V74-L78 PolarHBondContact O-N 2.69Å; T75-L78 PolarHBondContact O-N 3.07Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.7Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.81Å; L78-D81 PolarHBondContact O-N 3.15Å; L78-T82 PolarHBondContact O-N 3.4Å; L78-T82 PolarHBondContact O-OG1 2.91Å
79A87.9Confident88.7Confident15 Ų1573.5 Ų73.512%0.12435%0.349CS..Hα-helixtrans-64.4-36.6177.300000112.5T75 L76 K77 W85 I93T75-A79 WeakPolarHBondContact O-CB 3.43Å; T75-A79 PolarHBondContact O-N 2.97Å; L76-A79 WeakPolarHBondContact O-CB 3.31Å; L76-A79 PolarHBondContact O-N 2.85Å; L76-A79 VanDerWaalsContact O-N 3.13Å; K77-A79 VanDerWaalsContact C-N 3.32Å; K77-A79 PolarHBondContact O-N 3.42Å; A79-W85 HydrophobicContact CB-CZ2 4.21Å; A79-I93 HydrophobicContact CB-CD1 4.24Å; A79-I93 HydrophobicContact CB-CG2 4.15Å
80L85.1Confident88.6Confident86 Ų8677 Ų7745%0.4537%0.365SS..Hα-helixtrans-71.7-36.8175.3-70.9172.8000112.5L76 K77 L78 T82 L145 I149L76-L80 WeakPolarHBondContact O-CG 2.77Å; L76-L80 PolarHBondContact O-N 2.98Å; K77-L80 PolarHBondContact O-N 3.39Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.81Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.35Å; L80-L145 HydrophobicContact CD1-CD1 4.32Å; L80-L145 HydrophobicContact CD1-CD2 4.34Å; L80-I149 HydrophobicContact CD1-CD1 4.45Å; L80-I149 HydrophobicContact CD1-CG1 4.17Å
81D83.1Confident88.6Confident74 Ų7480.6 Ų80.640%0.39638%0.378SS..Hα-helixtrans-73.7-21.6177.5-88.3-18.1000113.2K77 L78 R83K77-D81 PolarHBondContact O-N 2.86Å; L78-D81 PolarHBondContact O-N 3.15Å; D81-R83 PolarHBondContact O-N 2.92Å; D81-R83 VanDerWaalsContact O-N 3.08Å
82T86.4Confident88.5Confident33 Ų3383.8 Ų83.820%0.20240%0.398CS..  trans-70.2104.9-179.9-62.50000111.2L78 L80 F84L78-T82 PolarHBondContact O-N 3.4Å; L78-T82 PolarHBondContact O-OG1 2.91Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.35Å; T82-F84 WeakPolarHBondContact CG2-O 3.37Å
83R79.6Confident88.5Confident187 Ų18782.2 Ų82.271%0.70639%0.392SS*.SBendtrans-74.1-25.5178.5-64.8-179.7-176.8-93.5-11114.3D81D81-R83 PolarHBondContact O-N 2.92Å; D81-R83 VanDerWaalsContact O-N 3.08Å
84F82.6Confident88.5Confident155 Ų15588.4 Ų88.468%0.6842%0.415SS*.SBendtrans-120104.3-176.8-66.1-74.9000110.2T82 T86 N89T82-F84 WeakPolarHBondContact CG2-O 3.37Å; F84-T86 PolarHBondContact O-N 3.25Å; F84-T86 VanDerWaalsContact O-N 3.16Å; F84-N89 PolarHBondContact O-ND2 2.91Å
85W85.5Confident88.5Confident133 Ų13386.7 Ų86.750%0.50441%0.411SS..  trans-81.592.7175.4-86.766.3000110.1A79 H90 W94A79-W85 HydrophobicContact CB-CZ2 4.21Å; W85-H90 AromaticContact CE3-ND1 3.48Å; W85-H90 AromaticContact CZ3-CE1 3.67Å; W85-H90 AromaticContact CZ3-ND1 2.99Å; W85-H90 WeakPolarHBondContact CZ3-ND1 3.44Å; W85-W94 AromaticContact CH2-NE1 3.95Å; W85-W94 AromaticContact CZ3-NE1 4Å
86T91.8Very high88.5Confident64 Ų6488.4 Ų88.439%0.39342%0.424SS..  trans-91.1157.7168.367.80000109.7F84 I88 N89 H90F84-T86 PolarHBondContact O-N 3.25Å; F84-T86 VanDerWaalsContact O-N 3.16Å; T86-I88 PolarHBondContact O-N 3.49Å; T86-N89 PolarHBondContact O-N 2.89Å; T86-N89 WeakPolarHBondContact OG1-CB 3.48Å; T86-N89 PolarHBondContact OG1-N 3.45Å; T86-N89 PolarHBondContact OG1-ND2 2.92Å; T86-H90 PolarHBondContact O-N 3.38Å
87W90.7Very high88.5Confident211 Ų21186.5 Ų86.580%0.79941%0.414SS*.Hα-helixtrans-55.1-37.8174.8178.8-97.9000112.5H90 F91W87-H90 WeakPolarHBondContact O-CB 3.29Å; W87-H90 PolarHBondContact O-N 3.47Å; W87-F91 WeakPolarHBondContact O-CB 3.27Å; W87-F91 PolarHBondContact O-N 2.85Å
88I90.8Very high88.6Confident118 Ų11887.9 Ų87.961%0.60543%0.431SS*.Hα-helixtrans-66.8-46.3179.1-61.7151.4000110.7T86 H90 F91 V92T86-I88 PolarHBondContact O-N 3.49Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.12Å; I88-F91 PolarHBondContact O-N 2.9Å; I88-V92 HydrophobicContact CG2-CG2 4.41Å; I88-V92 WeakPolarHBondContact O-CG2 3.32Å; I88-V92 PolarHBondContact O-N 2.91Å
89N88.9Confident88.8Confident62 Ų6289.5 Ų89.533%0.33243%0.434SS..Hα-helixtrans-61.4-41177.4-70.4-13.5000111F84 T86 V92 I93F84-N89 PolarHBondContact O-ND2 2.91Å; T86-N89 PolarHBondContact O-N 2.89Å; T86-N89 WeakPolarHBondContact OG1-CB 3.48Å; T86-N89 PolarHBondContact OG1-N 3.45Å; T86-N89 PolarHBondContact OG1-ND2 2.92Å; N89-V92 PolarHBondContact O-N 3.3Å; N89-I93 WeakPolarHBondContact O-CB 3.49Å; N89-I93 WeakPolarHBondContact O-CD1 3.45Å; N89-I93 WeakPolarHBondContact O-CG1 3.36Å; N89-I93 PolarHBondContact O-N 3.16Å
90H88.7Confident88.9Confident73 Ų7389.9 Ų89.934%0.33843%0.432SS..Hα-helixtrans-58.5-53.6174.4-166.583.8000111.1W85 T86 W87 I88 V92 I93 W94W85-H90 AromaticContact CE3-ND1 3.48Å; W85-H90 AromaticContact CZ3-CE1 3.67Å; W85-H90 AromaticContact CZ3-ND1 2.99Å; W85-H90 WeakPolarHBondContact CZ3-ND1 3.44Å; T86-H90 PolarHBondContact O-N 3.38Å; W87-H90 WeakPolarHBondContact O-CB 3.29Å; W87-H90 PolarHBondContact O-N 3.47Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.12Å; H90-V92 VanDerWaalsContact C-N 3.32Å; H90-V92 PolarHBondContact O-N 2.97Å; H90-I93 PolarHBondContact O-N 3.36Å; H90-W94 AromaticContact CD2-CD1 3.53Å; H90-W94 AromaticContact CE1-CD1 3.32Å; H90-W94 AromaticContact CE1-NE1 3.03Å; H90-W94 PolarHBondContact CE1-NE1 3.43Å; H90-W94 AromaticContact CG-CD1 3.6Å; H90-W94 AromaticContact CG-NE1 3.92Å; H90-W94 AromaticContact ND1-CD1 3.46Å; H90-W94 AromaticContact ND1-NE1 3.28Å; H90-W94 PolarHBondContact ND1-NE1 3.28Å; H90-W94 AromaticContact NE2-CD1 3.35Å; H90-W94 AromaticContact NE2-NE1 3.55Å; H90-W94 PolarHBondContact O-N 2.96Å
91F92.8Very high89Confident143 Ų14388.1 Ų88.163%0.62743%0.425SS*.Hα-helixtrans-58.7-41.9-178.7-179.9-99.9000112.7W87 I88 G95W87-F91 WeakPolarHBondContact O-CB 3.27Å; W87-F91 PolarHBondContact O-N 2.85Å; I88-F91 PolarHBondContact O-N 2.9Å; F91-G95 WeakPolarHBondContact O-CA 3.36Å; F91-G95 PolarHBondContact O-N 2.92Å
92V91.5Very high89.2Confident90 Ų9091.1 Ų91.155%0.54544%0.435SS..Hα-helixtrans-70.4-42.9-178.7174.20000112I88 N89 H90 S96I88-V92 HydrophobicContact CG2-CG2 4.41Å; I88-V92 WeakPolarHBondContact O-CG2 3.32Å; I88-V92 PolarHBondContact O-N 2.91Å; N89-V92 PolarHBondContact O-N 3.3Å; H90-V92 VanDerWaalsContact C-N 3.32Å; H90-V92 PolarHBondContact O-N 2.97Å; V92-S96 WeakPolarHBondContact O-CB 3.24Å; V92-S96 PolarHBondContact O-N 3.5Å; V92-S96 PolarHBondContact O-OG 3.29Å
93I90.9Very high89.2Confident14 Ų1494.1 Ų94.17%0.07245%0.445CS..Hα-helixtrans-66.5-49.9-179.3-68.8170.1000110.7T75 A79 N89 H90 S96 L97T75-I93 HydrophobicContact CG2-CG2 3.73Å; A79-I93 HydrophobicContact CB-CD1 4.24Å; A79-I93 HydrophobicContact CB-CG2 4.15Å; N89-I93 WeakPolarHBondContact O-CB 3.49Å; N89-I93 WeakPolarHBondContact O-CD1 3.45Å; N89-I93 WeakPolarHBondContact O-CG1 3.36Å; N89-I93 PolarHBondContact O-N 3.16Å; H90-I93 PolarHBondContact O-N 3.36Å; I93-S96 PolarHBondContact O-OG 3.34Å; I93-L97 PolarHBondContact O-N 3.49Å
94W91.1Very high89.4Confident129 Ų12986.1 Ų86.149%0.48942%0.418SS..Hα-helixtrans-73.6-33.5179.5-64.7106.6000111.9W85 H90 L97 A98W85-W94 AromaticContact CH2-NE1 3.95Å; W85-W94 AromaticContact CZ3-NE1 4Å; H90-W94 AromaticContact CD2-CD1 3.53Å; H90-W94 AromaticContact CE1-CD1 3.32Å; H90-W94 AromaticContact CE1-NE1 3.03Å; H90-W94 PolarHBondContact CE1-NE1 3.43Å; H90-W94 AromaticContact CG-CD1 3.6Å; H90-W94 AromaticContact CG-NE1 3.92Å; H90-W94 AromaticContact ND1-CD1 3.46Å; H90-W94 AromaticContact ND1-NE1 3.28Å; H90-W94 PolarHBondContact ND1-NE1 3.28Å; H90-W94 AromaticContact NE2-CD1 3.35Å; H90-W94 AromaticContact NE2-NE1 3.55Å; H90-W94 PolarHBondContact O-N 2.96Å; W94-L97 HydrophobicContact CE3-CD1 4.29Å; W94-L97 PolarHBondContact O-N 3.48Å; W94-A98 WeakPolarHBondContact O-CB 3.27Å; W94-A98 PolarHBondContact O-N 2.84Å
95G91.3Very high89.4Confident31 Ų3183.4 Ų83.432%0.3241%0.406SS..Hα-helixtrans-63.5-38.2175.800000112.7F91 A98 F99F91-G95 WeakPolarHBondContact O-CA 3.36Å; F91-G95 PolarHBondContact O-N 2.92Å; G95-A98 PolarHBondContact O-N 3.42Å; G95-F99 WeakPolarHBondContact O-CB 3.31Å; G95-F99 PolarHBondContact O-N 3.16Å
96S93Very high89.2Confident53 Ų5381.1 Ų81.137%0.37140%0.4SS..Hα-helixtrans-68.7-39.9176.466.80000112.4V92 I93 F99 Y100V92-S96 WeakPolarHBondContact O-CB 3.24Å; V92-S96 PolarHBondContact O-N 3.5Å; V92-S96 PolarHBondContact O-OG 3.29Å; I93-S96 PolarHBondContact O-OG 3.34Å; S96-F99 PolarHBondContact O-N 2.92Å; S96-Y100 WeakPolarHBondContact O-CB 3.27Å; S96-Y100 PolarHBondContact O-N 2.9Å
97L90.6Very high88.5Confident13 Ų1382.5 Ų82.57%0.06840%0.398CS..Hα-helixtrans-61.1-48.4172-88.7147000111.7F72 T75 I93 W94 F99 Y100 V101F72-L97 HydrophobicContact CD1-CD2 3.57Å; F72-L97 HydrophobicContact CD2-CD2 3.97Å; F72-L97 HydrophobicContact CE1-CD2 3.47Å; F72-L97 VanDerWaalsContact CE1-CD2 3.47Å; F72-L97 HydrophobicContact CE2-CD2 3.9Å; F72-L97 HydrophobicContact CG-CD2 3.83Å; F72-L97 HydrophobicContact CZ-CD2 3.65Å; T75-L97 HydrophobicContact CG2-CD1 3.47Å; T75-L97 VanDerWaalsContact CG2-CD1 3.47Å; T75-L97 HydrophobicContact CG2-CG 3.91Å; I93-L97 PolarHBondContact O-N 3.49Å; W94-L97 HydrophobicContact CE3-CD1 4.29Å; W94-L97 PolarHBondContact O-N 3.48Å; L97-F99 VanDerWaalsContact C-N 3.35Å; L97-F99 PolarHBondContact O-N 2.9Å; L97-Y100 WeakPolarHBondContact O-CB 3.44Å; L97-Y100 PolarHBondContact O-N 2.87Å; L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.05Å; L97-V101 VanDerWaalsContact O-N 3.12Å
98A90.1Very high87.6Confident60 Ų6072.9 Ų72.950%0.49636%0.364SS..Hα-helixtrans-63.4-4217800000111.6W94 G95 Y100 V101 F102W94-A98 WeakPolarHBondContact O-CB 3.27Å; W94-A98 PolarHBondContact O-N 2.84Å; G95-A98 PolarHBondContact O-N 3.42Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; A98-Y100 PolarHBondContact O-N 3.46Å; A98-V101 PolarHBondContact O-N 3.16Å; A98-F102 WeakPolarHBondContact O-CB 3.39Å; A98-F102 PolarHBondContact O-N 2.73Å
99F91.9Very high86.6Confident136 Ų13668.9 Ų68.960%0.59635%0.352SS*.Hα-helixtrans-61-43.3175.8-179.7-98.7000111.7G95 S96 L97 V101 F102 F103G95-F99 WeakPolarHBondContact O-CB 3.31Å; G95-F99 PolarHBondContact O-N 3.16Å; S96-F99 PolarHBondContact O-N 2.92Å; L97-F99 VanDerWaalsContact C-N 3.35Å; L97-F99 PolarHBondContact O-N 2.9Å; F99-V101 PolarHBondContact O-N 3.38Å; F99-F102 PolarHBondContact O-N 3.28Å; F99-F103 HydrophobicContact CE1-CB 4.48Å; F99-F103 WeakPolarHBondContact O-CB 3.25Å; F99-F103 PolarHBondContact O-N 3.06Å
100Y90.1Very high85.6Confident23 Ų2371 Ų719%0.0936%0.362CS..Hα-helixtrans-58.2-48.7175.6168.1-109000112.1F67 T68 V71 F72 S96 L97 A98 S104F67-Y100 AromaticContact CD1-CE2 3.57Å; F67-Y100 HydrophobicContact CD1-CE2 3.57Å; F67-Y100 AromaticContact CD1-CZ 3.93Å; F67-Y100 HydrophobicContact CE1-CD2 4.13Å; F67-Y100 AromaticContact CE1-CE2 3.49Å; F67-Y100 HydrophobicContact CE1-CE2 3.49Å; F67-Y100 VanDerWaalsContact CE1-CE2 3.49Å; T68-Y100 WeakPolarHBondContact CA-OH 3.38Å; T68-Y100 HydrophobicContact CG2-CE1 4.25Å; T68-Y100 PolarHBondContact OG1-OH 3.46Å; V71-Y100 HydrophobicContact CB-CD1 4.46Å; V71-Y100 HydrophobicContact CB-CE1 4.49Å; V71-Y100 HydrophobicContact CG1-CD1 3.96Å; V71-Y100 HydrophobicContact CG1-CD2 4.34Å; V71-Y100 HydrophobicContact CG1-CE1 4.47Å; V71-Y100 HydrophobicContact CG1-CG 3.88Å; V71-Y100 HydrophobicContact CG2-CD2 4.27Å; V71-Y100 HydrophobicContact CG2-CE2 4.22Å; F72-Y100 HydrophobicContact CE2-CD1 4.39Å; F72-Y100 HydrophobicContact CE2-CE1 4.37Å; S96-Y100 WeakPolarHBondContact O-CB 3.27Å; S96-Y100 PolarHBondContact O-N 2.9Å; L97-Y100 WeakPolarHBondContact O-CB 3.44Å; L97-Y100 PolarHBondContact O-N 2.87Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; A98-Y100 PolarHBondContact O-N 3.46Å; Y100-S104 WeakPolarHBondContact CE2-OG 3.43Å; Y100-S104 VanDerWaalsContact O-CB 3.29Å; Y100-S104 WeakPolarHBondContact O-CB 3.27Å; Y100-S104 PolarHBondContact O-N 2.76Å; Y100-S104 PolarHBondContact O-OG 3.07Å
101V87.3Confident84.6Confident49 Ų4969.2 Ų69.230%0.29736%0.355SS..Hα-helixtrans-63-49179.3175.50000110.4L97 A98 F99 F103 S104 F105 F124L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.05Å; L97-V101 VanDerWaalsContact O-N 3.12Å; A98-V101 PolarHBondContact O-N 3.16Å; F99-V101 PolarHBondContact O-N 3.38Å; V101-F103 PolarHBondContact O-N 3.14Å; V101-S104 PolarHBondContact O-N 3.34Å; V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.75Å; V101-F105 VanDerWaalsContact O-CD2 3.28Å; V101-F105 WeakPolarHBondContact O-CD2 3.13Å; V101-F105 PolarHBondContact O-N 2.92Å; V101-F124 HydrophobicContact CG1-CE1 4.42Å
102F87.4Confident83Confident136 Ų13662.9 Ų62.960%0.59633%0.327SS*.Hα-helixtrans-59.9-48.1179.9179-97.5000112.2A98 F99 S104 F105 F106A98-F102 WeakPolarHBondContact O-CB 3.39Å; A98-F102 PolarHBondContact O-N 2.73Å; F99-F102 PolarHBondContact O-N 3.28Å; F102-S104 VanDerWaalsContact C-N 3.32Å; F102-S104 PolarHBondContact O-N 2.96Å; F102-F105 PolarHBondContact O-N 3.12Å; F102-F106 PolarHBondContact O-N 2.92Å
103F86Confident81.8Confident96 Ų9663.6 Ų63.642%0.42133%0.333SS..Hα-helixtrans-61.8-40.8178.4-178.3-99.3000111.7F99 V101 F105 F106 W107F99-F103 HydrophobicContact CE1-CB 4.48Å; F99-F103 WeakPolarHBondContact O-CB 3.25Å; F99-F103 PolarHBondContact O-N 3.06Å; V101-F103 PolarHBondContact O-N 3.14Å; F103-F105 VanDerWaalsContact C-N 3.35Å; F103-F105 PolarHBondContact O-N 3.5Å; F103-F106 PolarHBondContact O-N 3.32Å; F103-W107 HydrophobicContact CZ-CE3 4.06Å; F103-W107 VanDerWaalsContact O-CB 3.31Å; F103-W107 WeakPolarHBondContact O-CB 3.32Å; F103-W107 PolarHBondContact O-N 3.5Å
104S84.3Confident80.5Confident19 Ų1971.6 Ų71.613%0.13337%0.368CS..Hα-helixtrans-64.6-37.6178.3-59.80000112.3Y100 V101 F102 G108Y100-S104 WeakPolarHBondContact CE2-OG 3.43Å; Y100-S104 VanDerWaalsContact O-CB 3.29Å; Y100-S104 WeakPolarHBondContact O-CB 3.27Å; Y100-S104 PolarHBondContact O-N 2.76Å; Y100-S104 PolarHBondContact O-OG 3.07Å; V101-S104 PolarHBondContact O-N 3.34Å; F102-S104 VanDerWaalsContact C-N 3.32Å; F102-S104 PolarHBondContact O-N 2.96Å; S104-G108 PolarHBondContact O-N 3.36Å
105F82Confident79.2Confident98 Ų9868.7 Ų68.743%0.4336%0.362SS..Hα-helixtrans-67.5-44.8172.2-87.4-73.2000112.6V101 F102 F103 G108 G109 F124 A125 L128V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.75Å; V101-F105 VanDerWaalsContact O-CD2 3.28Å; V101-F105 WeakPolarHBondContact O-CD2 3.13Å; V101-F105 PolarHBondContact O-N 2.92Å; F102-F105 PolarHBondContact O-N 3.12Å; F103-F105 VanDerWaalsContact C-N 3.35Å; F103-F105 PolarHBondContact O-N 3.5Å; F105-G108 PolarHBondContact O-N 3.16Å; F105-G109 PolarHBondContact O-N 2.9Å; F105-F124 HydrophobicContact CD1-CD1 4.26Å; F105-F124 HydrophobicContact CD2-CD1 4.01Å; F105-F124 AromaticContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CE1-CD1 4.34Å; F105-F124 HydrophobicContact CE2-CD1 4.08Å; F105-F124 AromaticContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CG-CD1 4.1Å; F105-F124 HydrophobicContact CG-CE1 4.21Å; F105-F124 HydrophobicContact CZ-CD1 4.27Å; F105-F124 HydrophobicContact CZ-CE1 4.21Å; F105-A125 HydrophobicContact CE1-CB 4.43Å; F105-L128 HydrophobicContact CE1-CD1 4.06Å; F105-L128 HydrophobicContact CE2-CD1 3.48Å; F105-L128 VanDerWaalsContact CE2-CD1 3.48Å; F105-L128 HydrophobicContact CZ-CD1 3.16Å
106F82.4Confident77.6Confident85 Ų8578 Ų7837%0.37339%0.393SS..Hα-helixtrans-63.2-44.4-179.7-168.3-97.1000111.5F102 F103 G109 I110 I111F102-F106 PolarHBondContact O-N 2.92Å; F103-F106 PolarHBondContact O-N 3.32Å; F106-G109 PolarHBondContact O-N 3.33Å; F106-I110 HydrophobicContact CD2-CB 4.38Å; F106-I110 HydrophobicContact CD2-CD1 3.55Å; F106-I110 HydrophobicContact CD2-CG1 4.5Å; F106-I110 HydrophobicContact CE2-CB 4.17Å; F106-I110 HydrophobicContact CE2-CD1 3.55Å; F106-I110 HydrophobicContact CE2-CG1 4.46Å; F106-I110 HydrophobicContact CE2-CG2 4.06Å; F106-I110 HydrophobicContact CZ-CB 4.37Å; F106-I110 HydrophobicContact CZ-CG2 4.01Å; F106-I110 PolarHBondContact O-N 3.13Å; F106-I111 HydrophobicContact CD1-CD1 3.72Å; F106-I111 HydrophobicContact CD1-CG1 3.94Å; F106-I111 HydrophobicContact CE1-CD1 3.8Å; F106-I111 HydrophobicContact CE1-CG1 3.76Å
107W76.3Confident75.7Confident94 Ų9481.3 Ų81.336%0.35640%0.403SS..Hα-helixtrans-65.3-42.6174.1-170.3-90000112.2F103 G109 I111 W112 L115F103-W107 HydrophobicContact CZ-CE3 4.06Å; F103-W107 VanDerWaalsContact O-CB 3.31Å; F103-W107 WeakPolarHBondContact O-CB 3.32Å; F103-W107 PolarHBondContact O-N 3.5Å; W107-G109 VanDerWaalsContact C-N 3.3Å; W107-G109 PolarHBondContact O-N 2.96Å; W107-I111 HydrophobicContact CD2-CD1 4.25Å; W107-I111 HydrophobicContact CE3-CD1 3.44Å; W107-I111 VanDerWaalsContact CE3-CD1 3.44Å; W107-I111 HydrophobicContact CZ3-CD1 3.9Å; W107-I111 HydrophobicContact CZ3-CG2 4.38Å; W107-W112 PolarHBondContact O-NE1 3.44Å; W107-L115 HydrophobicContact CH2-CD1 3.91Å; W107-L115 HydrophobicContact CZ2-CD1 3.79Å
108G72.1Confident74.1Confident9 Ų986.1 Ų86.19%0.09343%0.425CS..Hα-helixtrans-70.2-18.1179.800000115.2S104 F105 W112 F122S104-G108 PolarHBondContact O-N 3.36Å; F105-G108 PolarHBondContact O-N 3.16Å; G108-W112 PolarHBondContact O-NE1 2.9Å; G108-F122 PolarHBondContact O-N 2.96Å
109G70.1Confident72.5Confident34 Ų3490.8 Ų90.835%0.35143%0.43SS..Hα-helixtrans-118.1-46.2-175.600000116.8F105 F106 W107F105-G109 PolarHBondContact O-N 2.9Å; F106-G109 PolarHBondContact O-N 3.33Å; W107-G109 VanDerWaalsContact C-N 3.3Å; W107-G109 PolarHBondContact O-N 2.96Å
110I67.8Low70.9Confident105 Ų10587.3 Ų87.354%0.53842%0.416SS..THydrogen-bonded Turntrans-104.5-31-160.2-66.7164.4000113.9F106 W112 P113F106-I110 HydrophobicContact CD2-CB 4.38Å; F106-I110 HydrophobicContact CD2-CD1 3.55Å; F106-I110 HydrophobicContact CD2-CG1 4.5Å; F106-I110 HydrophobicContact CE2-CB 4.17Å; F106-I110 HydrophobicContact CE2-CD1 3.55Å; F106-I110 HydrophobicContact CE2-CG1 4.46Å; F106-I110 HydrophobicContact CE2-CG2 4.06Å; F106-I110 HydrophobicContact CZ-CB 4.37Å; F106-I110 HydrophobicContact CZ-CG2 4.01Å; F106-I110 PolarHBondContact O-N 3.13Å; I110-W112 VanDerWaalsContact C-N 3.28Å; I110-W112 PolarHBondContact O-N 3.35Å; I110-P113 WeakPolarHBondContact O-CD 3.31Å
111I66.6Low69.4Low37 Ų3792.4 Ų92.419%0.1944%0.436CS..SBendtrans-77.8-12.2-168.4-62.4-179.5000113.4F106 W107 F114 L115F106-I111 HydrophobicContact CD1-CD1 3.72Å; F106-I111 HydrophobicContact CD1-CG1 3.94Å; F106-I111 HydrophobicContact CE1-CD1 3.8Å; F106-I111 HydrophobicContact CE1-CG1 3.76Å; W107-I111 HydrophobicContact CD2-CD1 4.25Å; W107-I111 HydrophobicContact CE3-CD1 3.44Å; W107-I111 VanDerWaalsContact CE3-CD1 3.44Å; W107-I111 HydrophobicContact CZ3-CD1 3.9Å; W107-I111 HydrophobicContact CZ3-CG2 4.38Å; I111-F114 PolarHBondContact O-N 2.95Å; I111-F114 VanDerWaalsContact O-N 3.16Å; I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 HydrophobicContact CG2-CG 4.01Å
112W60.5Low68.3Low9 Ų995.7 Ų95.73%0.03445%0.446CS..G310 helixtrans-63.3-27-170.7-58.598.5000118.3W107 G108 I110 F114 L115 Q117 Q118 M120 Y121W107-W112 PolarHBondContact O-NE1 3.44Å; G108-W112 PolarHBondContact O-NE1 2.9Å; I110-W112 VanDerWaalsContact C-N 3.28Å; I110-W112 PolarHBondContact O-N 3.35Å; W112-F114 PolarHBondContact O-N 2.92Å; W112-F114 VanDerWaalsContact O-N 3.16Å; W112-L115 PolarHBondContact O-N 2.94Å; W112-Q117 WeakPolarHBondContact CZ3-O 3.36Å; W112-Q118 HydrophobicContact CB-CG 4.39Å; W112-Q118 VanDerWaalsContact CE3-CA 3.49Å; W112-Q118 HydrophobicContact CE3-CB 3.88Å; W112-Q118 HydrophobicContact CE3-CG 3.85Å; W112-Q118 VanDerWaalsContact CZ3-CA 3.41Å; W112-Q118 HydrophobicContact CZ3-CB 4.28Å; W112-Q118 PolarHBondContact O-NE2 2.69Å; W112-M120 VanDerWaalsContact CH2-C 3.47Å; W112-M120 HydrophobicContact CH2-CB 3.57Å; W112-M120 HydrophobicContact CH2-CG 4.33Å; W112-M120 VanDerWaalsContact CH2-N 3.27Å; W112-M120 HydrophobicContact CZ2-CB 3.84Å; W112-M120 WeakPolarHBondContact CZ2-O 3.21Å; W112-Y121 HydrophobicContact CB-CD2 4.25Å; W112-Y121 AromaticContact CD1-CD2 3.38Å; W112-Y121 AromaticContact CD1-CE2 3.9Å; W112-Y121 HydrophobicContact CD2-CD2 4.08Å; W112-Y121 AromaticContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CE2 4.33Å; W112-Y121 AromaticContact NE1-CD2 3.56Å
113P65.7Low67.3Low105 Ų10589.9 Ų89.968%0.68242%0.422SS*.G310 helixtrans-62.4-19174-21.132.9000113.3I110I110-P113 WeakPolarHBondContact O-CD 3.31Å
114F64Low66.6Low182 Ų18285.9 Ų85.980%0.79841%0.405SS*.G310 helixtrans-107-7.8-173.9-56.8-77000114I111 W112I111-F114 PolarHBondContact O-N 2.95Å; I111-F114 VanDerWaalsContact O-N 3.16Å; W112-F114 PolarHBondContact O-N 2.92Å; W112-F114 VanDerWaalsContact O-N 3.16Å
115L63.6Low66Low69 Ų6986 Ų8636%0.36141%0.407SS..  trans-109.5130.9-177.9-69.8173.9000111.4W107 I111 W112 Q117W107-L115 HydrophobicContact CH2-CD1 3.91Å; W107-L115 HydrophobicContact CZ2-CD1 3.79Å; I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 HydrophobicContact CG2-CG 4.01Å; W112-L115 PolarHBondContact O-N 2.94Å; L115-Q117 PolarHBondContact O-N 3.14Å; L115-Q117 VanDerWaalsContact O-N 3.14Å
116K56.8Low65.4Low227 Ų22783.3 Ų83.399%0.98740%0.396SS*.SBendtrans-67.7-9.4-178-69-171.9176.8-175.50114.9
117Q54.2Low65Low122 Ų12279.3 Ų79.357%0.5738%0.378SS*.  trans-133.893.6-171.4-165.8142.8-17.500112.1W112 L115 R119W112-Q117 WeakPolarHBondContact CZ3-O 3.36Å; L115-Q117 PolarHBondContact O-N 3.14Å; L115-Q117 VanDerWaalsContact O-N 3.14Å; Q117-R119 VanDerWaalsContact C-N 3.29Å; Q117-R119 HydrophobicContact CG-CG 3.85Å; Q117-R119 PolarHBondContact O-N 3.32Å
118Q56.3Low64.9Low114 Ų11476.4 Ų76.453%0.53337%0.37SS..  trans-8446.3-173.5-59.7-159.9-18.300115.3W112W112-Q118 HydrophobicContact CB-CG 4.39Å; W112-Q118 VanDerWaalsContact CE3-CA 3.49Å; W112-Q118 HydrophobicContact CE3-CB 3.88Å; W112-Q118 HydrophobicContact CE3-CG 3.85Å; W112-Q118 VanDerWaalsContact CZ3-CA 3.41Å; W112-Q118 HydrophobicContact CZ3-CB 4.28Å; W112-Q118 PolarHBondContact O-NE2 2.69Å
119R56.6Low65Low158 Ų15880.4 Ų80.460%0.59640%0.396SS*.THydrogen-bonded Turntrans-86.4-12.2-170.7-66.1-163.9179.3-158.3-2.2116.4W60 Q117W60-R119 HydrophobicContact CZ2-CB 4.48Å; Q117-R119 VanDerWaalsContact C-N 3.29Å; Q117-R119 HydrophobicContact CG-CG 3.85Å; Q117-R119 PolarHBondContact O-N 3.32Å
120M58.5Low65.4Low62 Ų6279 Ų7931%0.30538%0.381SS..THydrogen-bonded Turntrans-114.714.2176.5-46.9170.2170.700113.2W60 W112 F122 V123W60-M120 HydrophobicContact CB-CG 4.22Å; W60-M120 HydrophobicContact CD2-CE 4.08Å; W60-M120 HydrophobicContact CD2-CG 4.16Å; W60-M120 HydrophobicContact CE3-CE 3.17Å; W60-M120 HydrophobicContact CE3-CG 4.16Å; W60-M120 HydrophobicContact CE3-SD 4.48Å; W60-M120 HydrophobicContact CG-CG 4.23Å; W60-M120 HydrophobicContact CH2-CE 4.19Å; W60-M120 HydrophobicContact CZ3-CE 3.23Å; W112-M120 VanDerWaalsContact CH2-C 3.47Å; W112-M120 HydrophobicContact CH2-CB 3.57Å; W112-M120 HydrophobicContact CH2-CG 4.33Å; W112-M120 VanDerWaalsContact CH2-N 3.27Å; W112-M120 HydrophobicContact CZ2-CB 3.84Å; W112-M120 WeakPolarHBondContact CZ2-O 3.21Å; M120-F122 PolarHBondContact O-N 3.39Å; M120-V123 HydrophobicContact CB-CG2 4.5Å; M120-V123 PolarHBondContact O-N 2.98Å
121Y58.9Low66Low131 Ų13179.1 Ų79.151%0.51439%0.386SS..THydrogen-bonded Turntrans-57.9124.4-178.4-177.7-102.3000110.2W112 V123W112-Y121 HydrophobicContact CB-CD2 4.25Å; W112-Y121 AromaticContact CD1-CD2 3.38Å; W112-Y121 AromaticContact CD1-CE2 3.9Å; W112-Y121 HydrophobicContact CD2-CD2 4.08Å; W112-Y121 AromaticContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CE2 4.33Å; W112-Y121 AromaticContact NE1-CD2 3.56Å; Y121-V123 PolarHBondContact O-N 3.37Å
122F64.5Low66.7Low117 Ų11779.9 Ų79.951%0.51340%0.395SS..THydrogen-bonded Turntrans61.54.1179-146-104.8000116.8G108 M120 F124 A125 Q126G108-F122 PolarHBondContact O-N 2.96Å; M120-F122 PolarHBondContact O-N 3.39Å; F122-F124 VanDerWaalsContact C-N 3.33Å; F122-F124 PolarHBondContact O-N 3.3Å; F122-A125 HydrophobicContact CD1-CB 3.97Å; F122-A125 HydrophobicContact CD2-CB 3.92Å; F122-A125 HydrophobicContact CE1-CB 3.79Å; F122-A125 HydrophobicContact CE2-CB 3.73Å; F122-A125 HydrophobicContact CG-CB 4.04Å; F122-A125 HydrophobicContact CZ-CB 3.67Å; F122-A125 PolarHBondContact O-N 3.44Å; F122-Q126 WeakPolarHBondContact O-CB 3.42Å; F122-Q126 PolarHBondContact O-N 3.42Å
123V67Low67.6Low15 Ų1579.4 Ų79.49%0.09139%0.393CS..Hα-helixtrans-61.9-40.2-178.1169.20000112T61 M120 Y121 M127T61-V123 HydrophobicContact CG2-CG1 3.99Å; T61-V123 WeakPolarHBondContact OG1-CG1 3.33Å; M120-V123 HydrophobicContact CB-CG2 4.5Å; M120-V123 PolarHBondContact O-N 2.98Å; Y121-V123 PolarHBondContact O-N 3.37Å; V123-M127 WeakPolarHBondContact O-CB 3.1Å; V123-M127 PolarHBondContact O-N 3.37Å
124F69.6Low68.5Low11 Ų1179 Ų795%0.04838%0.378CS..Hα-helixtrans-67-42.9177.9-168.7-108.8000111.7T64 V101 F105 F122 Q126 M127 L128T64-F124 HydrophobicContact CG2-CD2 3.73Å; T64-F124 HydrophobicContact CG2-CE2 4.44Å; V101-F124 HydrophobicContact CG1-CE1 4.42Å; F105-F124 HydrophobicContact CD1-CD1 4.26Å; F105-F124 HydrophobicContact CD2-CD1 4.01Å; F105-F124 AromaticContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CE1-CD1 4.34Å; F105-F124 HydrophobicContact CE2-CD1 4.08Å; F105-F124 AromaticContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CG-CD1 4.1Å; F105-F124 HydrophobicContact CG-CE1 4.21Å; F105-F124 HydrophobicContact CZ-CD1 4.27Å; F105-F124 HydrophobicContact CZ-CE1 4.21Å; F122-F124 VanDerWaalsContact C-N 3.33Å; F122-F124 PolarHBondContact O-N 3.3Å; F124-Q126 PolarHBondContact O-N 3.47Å; F124-M127 HydrophobicContact CD2-CE 3.86Å; F124-M127 HydrophobicContact CE2-CE 3.73Å; F124-M127 WeakPolarHBondContact O-CB 3.13Å; F124-M127 PolarHBondContact O-N 2.96Å; F124-L128 HydrophobicContact CD1-CD1 3.69Å; F124-L128 HydrophobicContact CD1-CG 4.4Å; F124-L128 HydrophobicContact CE1-CD1 3.42Å; F124-L128 VanDerWaalsContact CE1-CD1 3.42Å; F124-L128 HydrophobicContact CE1-CG 4.26Å; F124-L128 HydrophobicContact CG-CD1 4.47Å; F124-L128 HydrophobicContact CZ-CD1 3.99Å; F124-L128 HydrophobicContact CZ-CD2 4.32Å; F124-L128 HydrophobicContact CZ-CG 4.45Å; F124-L128 VanDerWaalsContact O-CG 3.27Å; F124-L128 WeakPolarHBondContact O-CG 3.37Å; F124-L128 PolarHBondContact O-N 3.08Å
125A71.6Confident69.5Low23 Ų2375.8 Ų75.819%0.1937%0.369CS..Hα-helixtrans-65.1-40.6177.500000111.9F105 F122 L128 S129F105-A125 HydrophobicContact CE1-CB 4.43Å; F122-A125 HydrophobicContact CD1-CB 3.97Å; F122-A125 HydrophobicContact CD2-CB 3.92Å; F122-A125 HydrophobicContact CE1-CB 3.79Å; F122-A125 HydrophobicContact CE2-CB 3.73Å; F122-A125 HydrophobicContact CG-CB 4.04Å; F122-A125 HydrophobicContact CZ-CB 3.67Å; F122-A125 PolarHBondContact O-N 3.44Å; A125-L128 PolarHBondContact O-N 2.89Å; A125-S129 PolarHBondContact O-N 2.71Å
126Q71.3Confident70.5Confident40 Ų4073.2 Ų73.219%0.18736%0.357CS..Hα-helixtrans-64.3-42.5176.4-164173.7-13.200111.9E51 F122 F124 L128 S129E51-Q126 VanDerWaalsContact CD-NE2 3.34Å; E51-Q126 WeakPolarHBondContact OE1-CG 3.41Å; E51-Q126 PolarHBondContact OE1-NE2 3.16Å; E51-Q126 PolarHBondContact OE2-NE2 2.89Å; F122-Q126 WeakPolarHBondContact O-CB 3.42Å; F122-Q126 PolarHBondContact O-N 3.42Å; F124-Q126 PolarHBondContact O-N 3.47Å; Q126-L128 PolarHBondContact O-N 3.43Å; Q126-S129 WeakPolarHBondContact O-CB 3.37Å; Q126-S129 PolarHBondContact O-N 2.97Å
127M73.4Confident72Confident1 Ų162.7 Ų62.71%0.00531%0.312CS..Hα-helixtrans-58.6-46.1173.7-176.6-16580.300111.9T61 T64 I65 T68 V123 F124 S129 S130 T133T61-M127 HydrophobicContact CG2-CB 4.37Å; T64-M127 HydrophobicContact CG2-SD 3.97Å; I65-M127 HydrophobicContact CB-SD 4.29Å; I65-M127 HydrophobicContact CD1-CG 4.21Å; I65-M127 HydrophobicContact CG1-CG 3.63Å; I65-M127 HydrophobicContact CG1-SD 3.41Å; I65-M127 WeakPolarHBondContact CG1-SD 3.24Å; T68-M127 HydrophobicContact CG2-CE 4.36Å; V123-M127 WeakPolarHBondContact O-CB 3.1Å; V123-M127 PolarHBondContact O-N 3.37Å; F124-M127 HydrophobicContact CD2-CE 3.86Å; F124-M127 HydrophobicContact CE2-CE 3.73Å; F124-M127 WeakPolarHBondContact O-CB 3.13Å; F124-M127 PolarHBondContact O-N 2.96Å; M127-S129 VanDerWaalsContact C-N 3.25Å; M127-S129 PolarHBondContact O-N 3.3Å; M127-S130 PolarHBondContact O-N 3.15Å; M127-T133 HydrophobicContact CG-CG2 3.79Å
128L73.1Confident73.6Confident34 Ų3461.8 Ų61.818%0.17831%0.31CS..Hα-helixtrans-71.1-20-179.4-62.1172.7000113.2F105 F124 A125 Q126 S130 W134F105-L128 HydrophobicContact CE1-CD1 4.06Å; F105-L128 HydrophobicContact CE2-CD1 3.48Å; F105-L128 VanDerWaalsContact CE2-CD1 3.48Å; F105-L128 HydrophobicContact CZ-CD1 3.16Å; F124-L128 HydrophobicContact CD1-CD1 3.69Å; F124-L128 HydrophobicContact CD1-CG 4.4Å; F124-L128 HydrophobicContact CE1-CD1 3.42Å; F124-L128 VanDerWaalsContact CE1-CD1 3.42Å; F124-L128 HydrophobicContact CE1-CG 4.26Å; F124-L128 HydrophobicContact CG-CD1 4.47Å; F124-L128 HydrophobicContact CZ-CD1 3.99Å; F124-L128 HydrophobicContact CZ-CD2 4.32Å; F124-L128 HydrophobicContact CZ-CG 4.45Å; F124-L128 VanDerWaalsContact O-CG 3.27Å; F124-L128 WeakPolarHBondContact O-CG 3.37Å; F124-L128 PolarHBondContact O-N 3.08Å; A125-L128 PolarHBondContact O-N 2.89Å; Q126-L128 PolarHBondContact O-N 3.43Å; L128-S130 VanDerWaalsContact C-N 3.28Å; L128-W134 HydrophobicContact CB-CZ2 4.26Å; L128-W134 HydrophobicContact CD2-CH2 3.65Å; L128-W134 HydrophobicContact CD2-CZ2 3.12Å; L128-W134 HydrophobicContact CG-CZ2 4.18Å; L128-W134 PolarHBondContact O-NE1 3.25Å
129S76Confident75.2Confident92 Ų9261.3 Ų61.364%0.64331%0.31SS*.Hα-helixtrans-73.3-21.1176.9-167.40000112.8A125 Q126 M127A125-S129 PolarHBondContact O-N 2.71Å; Q126-S129 WeakPolarHBondContact O-CB 3.37Å; Q126-S129 PolarHBondContact O-N 2.97Å; M127-S129 VanDerWaalsContact C-N 3.25Å; M127-S129 PolarHBondContact O-N 3.3Å
130S78.5Confident76.7Confident5 Ų554.4 Ų54.44%0.03529%0.285CS..  trans-89.6111.4-178.5171.10000111.5L50 Y57 M127 L128 S132 T133 W134L50-S130 WeakPolarHBondContact O-CB 3.39Å; L50-S130 PolarHBondContact O-OG 3.2Å; Y57-S130 WeakPolarHBondContact OH-CB 3.39Å; M127-S130 PolarHBondContact O-N 3.15Å; L128-S130 VanDerWaalsContact C-N 3.28Å; S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.89Å; S130-T133 VanDerWaalsContact CB-OG1 3.31Å; S130-T133 WeakPolarHBondContact CB-OG1 3.48Å; S130-T133 WeakPolarHBondContact O-CB 3.28Å; S130-T133 PolarHBondContact O-N 3.07Å; S130-T133 VanDerWaalsContact O-N 3.16Å; S130-T133 PolarHBondContact OG-N 3.36Å; S130-T133 PolarHBondContact OG-OG1 3.23Å; S130-W134 PolarHBondContact O-N 2.76Å
131V80.1Confident78.3Confident107 Ų10752.2 Ų52.265%0.64827%0.274SS*.Hα-helixtrans-60.6-37.7175.6178.60000111.7T133 W134 L135V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.99Å; V131-W134 WeakPolarHBondContact O-CB 3.36Å; V131-W134 PolarHBondContact O-N 2.95Å; V131-L135 HydrophobicContact CG1-CD1 4.36Å; V131-L135 HydrophobicContact CG1-CG 4.48Å; V131-L135 PolarHBondContact O-N 3.18Å
132S79.6Confident79.7Confident53 Ų5352.1 Ų52.137%0.37128%0.277SS..Hα-helixtrans-59.7-40176.9-173.70000111.7L50 S130 W134 L135 A136L50-S132 WeakPolarHBondContact CD2-OG 3.41Å; S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.89Å; S132-W134 PolarHBondContact O-N 3.45Å; S132-L135 PolarHBondContact O-N 3.32Å; S132-A136 WeakPolarHBondContact O-CB 3.46Å; S132-A136 PolarHBondContact O-N 3.45Å
133T80.5Confident80.9Confident0 Ų050 Ų500%027%0.27CS..Hα-helixtrans-65-40.8177.3-550000111.6I65 M127 S130 V131 A136 I137I65-T133 HydrophobicContact CD1-CG2 3.87Å; I65-T133 HydrophobicContact CG1-CG2 4.02Å; M127-T133 HydrophobicContact CG-CG2 3.79Å; S130-T133 VanDerWaalsContact CB-OG1 3.31Å; S130-T133 WeakPolarHBondContact CB-OG1 3.48Å; S130-T133 WeakPolarHBondContact O-CB 3.28Å; S130-T133 PolarHBondContact O-N 3.07Å; S130-T133 VanDerWaalsContact O-N 3.16Å; S130-T133 PolarHBondContact OG-N 3.36Å; S130-T133 PolarHBondContact OG-OG1 3.23Å; V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.99Å; T133-A136 PolarHBondContact O-N 3.06Å; T133-I137 HydrophobicContact CG2-CD1 3.99Å; T133-I137 WeakPolarHBondContact O-CG1 3.22Å; T133-I137 PolarHBondContact O-N 3.32Å
134W83.5Confident81.9Confident97 Ų9749.3 Ų49.337%0.36727%0.266SS..Hα-helixtrans-63.4-44.7174.8-79.2103.9000113.4L128 S130 V131 S132 A136 I137 I138L128-W134 HydrophobicContact CB-CZ2 4.26Å; L128-W134 HydrophobicContact CD2-CH2 3.65Å; L128-W134 HydrophobicContact CD2-CZ2 3.12Å; L128-W134 HydrophobicContact CG-CZ2 4.18Å; L128-W134 PolarHBondContact O-NE1 3.25Å; S130-W134 PolarHBondContact O-N 2.76Å; V131-W134 WeakPolarHBondContact O-CB 3.36Å; V131-W134 PolarHBondContact O-N 2.95Å; S132-W134 PolarHBondContact O-N 3.45Å; W134-A136 VanDerWaalsContact C-N 3.29Å; W134-A136 PolarHBondContact O-N 2.76Å; W134-I137 PolarHBondContact O-N 3.02Å; W134-I138 WeakPolarHBondContact O-CG1 3.34Å; W134-I138 PolarHBondContact O-N 2.95Å
135L85.6Confident82.8Confident114 Ų11449.4 Ų49.460%0.59727%0.267SS*.Hα-helixtrans-60.6-42.3176.6-69.8175.5000111V131 S132 I138 L139V131-L135 HydrophobicContact CG1-CD1 4.36Å; V131-L135 HydrophobicContact CG1-CG 4.48Å; V131-L135 PolarHBondContact O-N 3.18Å; S132-L135 PolarHBondContact O-N 3.32Å; L135-I138 PolarHBondContact O-N 2.96Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.45Å
136A85.3Confident83.6Confident15 Ų1553.6 Ų53.612%0.12428%0.281CS..Hα-helixtrans-63.9-43.3175.100000112.1L44 S132 T133 W134 I138 L139 L140L44-A136 HydrophobicContact CD1-CB 3.46Å; L44-A136 VanDerWaalsContact CD1-CB 3.46Å; L44-A136 HydrophobicContact CD2-CB 3.58Å; L44-A136 HydrophobicContact CG-CB 4.09Å; S132-A136 WeakPolarHBondContact O-CB 3.46Å; S132-A136 PolarHBondContact O-N 3.45Å; T133-A136 PolarHBondContact O-N 3.06Å; W134-A136 VanDerWaalsContact C-N 3.29Å; W134-A136 PolarHBondContact O-N 2.76Å; A136-I138 PolarHBondContact O-N 2.99Å; A136-L139 PolarHBondContact O-N 3.46Å; A136-L140 WeakPolarHBondContact O-CB 3.36Å; A136-L140 WeakPolarHBondContact O-CG 3.37Å; A136-L140 PolarHBondContact O-N 3.21Å
137I87.3Confident84.3Confident5 Ų553 Ų533%0.02628%0.281CS..Hα-helixtrans-58.6-49.6175.7-71.6164.2000110.6I65 T68 V69 T133 W134 L139 L140 I141I65-I137 HydrophobicContact CG2-CG1 4.31Å; T68-I137 HydrophobicContact CG2-CD1 4.33Å; V69-I137 HydrophobicContact CG2-CB 4.21Å; V69-I137 HydrophobicContact CG2-CG1 3.86Å; V69-I137 HydrophobicContact CG2-CG2 4.07Å; T133-I137 HydrophobicContact CG2-CD1 3.99Å; T133-I137 WeakPolarHBondContact O-CG1 3.22Å; T133-I137 PolarHBondContact O-N 3.32Å; W134-I137 PolarHBondContact O-N 3.02Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 2.92Å; I137-L140 PolarHBondContact O-N 3.42Å; I137-I141 HydrophobicContact CG2-CD1 3.74Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 VanDerWaalsContact O-CG1 3.24Å; I137-I141 WeakPolarHBondContact O-CG1 3.46Å; I137-I141 PolarHBondContact O-N 3.15Å
138I88.7Confident84.8Confident104 Ų10453.2 Ų53.253%0.53328%0.282SS..Hα-helixtrans-61.1-44.3179.3-68.2161.1000110.7W134 L135 A136 I141 F142W134-I138 WeakPolarHBondContact O-CG1 3.34Å; W134-I138 PolarHBondContact O-N 2.95Å; L135-I138 PolarHBondContact O-N 2.96Å; A136-I138 PolarHBondContact O-N 2.99Å; I138-I141 PolarHBondContact O-N 3.48Å; I138-F142 PolarHBondContact O-N 2.72Å
139L88.9Confident85.4Confident103 Ų10354.8 Ų54.854%0.53929%0.289SS..Hα-helixtrans-62-44.6177.8-177.267.7000111.5L135 A136 I137 F142 I143L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.45Å; A136-L139 PolarHBondContact O-N 3.46Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 2.92Å; L139-F142 PolarHBondContact O-N 3.15Å; L139-I143 HydrophobicContact CD1-CD1 4.14Å; L139-I143 HydrophobicContact CD1-CG1 4.45Å; L139-I143 HydrophobicContact CD2-CD1 4.41Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.48Å; L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.24Å; L139-I143 PolarHBondContact O-N 3.29Å
140L89.4Confident86Confident13 Ų1354.4 Ų54.47%0.06828%0.28CS..Hα-helixtrans-64.5-41.6178.8-71.6175.4000112.1V36 T41 V69 A136 I137 F142 I143 S144V36-L140 HydrophobicContact CG1-CD2 4.28Å; T41-L140 HydrophobicContact CG2-CD1 3.93Å; V69-L140 HydrophobicContact CG1-CB 3.88Å; V69-L140 HydrophobicContact CG2-CB 4.42Å; V69-L140 HydrophobicContact CG2-CD1 4.14Å; A136-L140 WeakPolarHBondContact O-CB 3.36Å; A136-L140 WeakPolarHBondContact O-CG 3.37Å; A136-L140 PolarHBondContact O-N 3.21Å; I137-L140 PolarHBondContact O-N 3.42Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 2.91Å; L140-I143 PolarHBondContact O-N 3.11Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 3.4Å
141I90.6Very high86.2Confident16 Ų1656.5 Ų56.58%0.08229%0.29CS..Hα-helixtrans-58.1-46.9172.9-68.6162.7000109.7V69 F72 L76 I137 I138 S144 L145V69-I141 HydrophobicContact CG1-CG1 4.3Å; F72-I141 HydrophobicContact CB-CD1 3.59Å; F72-I141 HydrophobicContact CB-CG1 4.22Å; F72-I141 HydrophobicContact CD1-CD1 4.31Å; F72-I141 HydrophobicContact CG-CD1 4.18Å; L76-I141 HydrophobicContact CD1-CG2 3.57Å; I137-I141 HydrophobicContact CG2-CD1 3.74Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 VanDerWaalsContact O-CG1 3.24Å; I137-I141 WeakPolarHBondContact O-CG1 3.46Å; I137-I141 PolarHBondContact O-N 3.15Å; I138-I141 PolarHBondContact O-N 3.48Å; I141-S144 PolarHBondContact O-N 3.22Å; I141-L145 HydrophobicContact CG2-CD1 3.71Å; I141-L145 HydrophobicContact CG2-CG 4.37Å; I141-L145 WeakPolarHBondContact O-CB 3.28Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.42Å; I141-L145 PolarHBondContact O-N 2.99Å
142F89.6Confident86.4Confident130 Ų13054 Ų5457%0.5727%0.273SS*.Hα-helixtrans-64.2-46.8-178.7-168.6-93.2000112.4I138 L139 L140 S144 L145 F146I138-F142 PolarHBondContact O-N 2.72Å; L139-F142 PolarHBondContact O-N 3.15Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 2.91Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 3.46Å; F142-L145 PolarHBondContact O-N 2.9Å; F142-F146 HydrophobicContact CE1-CD2 4.42Å; F142-F146 WeakPolarHBondContact O-CB 3.31Å; F142-F146 PolarHBondContact O-N 2.9Å
143I89.5Confident86.8Confident72 Ų7255 Ų5537%0.36928%0.277SS..Hα-helixtrans-60.9-40.2177-67.7169000110.5V36 L139 L140 P147V36-I143 HydrophobicContact CG1-CG2 3.97Å; L139-I143 HydrophobicContact CD1-CD1 4.14Å; L139-I143 HydrophobicContact CD1-CG1 4.45Å; L139-I143 HydrophobicContact CD2-CD1 4.41Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.48Å; L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.24Å; L139-I143 PolarHBondContact O-N 3.29Å; L140-I143 PolarHBondContact O-N 3.11Å; I143-P147 WeakPolarHBondContact O-CD 3.26Å
144S88.6Confident87Confident0 Ų059.8 Ų59.80%030%0.301CS..Hα-helixtrans-69-37.6179.5-169.40000112.9E33 F37 L140 I141 F142 P147E33-S144 WeakPolarHBondContact CG-OG 3.34Å; F37-S144 VanDerWaalsContact CE1-OG 3.25Å; F37-S144 WeakPolarHBondContact CE1-OG 3.36Å; F37-S144 WeakPolarHBondContact CZ-OG 3.43Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 3.4Å; I141-S144 PolarHBondContact O-N 3.22Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 3.46Å; S144-P147 WeakPolarHBondContact O-CD 3.35Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å
145L88.1Confident87Confident13 Ų1359.8 Ų59.87%0.06830%0.304CS..Hα-helixtrans-82.1-20.3179.3-67.8175.6000113.1T73 L76 K77 L80 I141 F142 E148 I149T73-L145 HydrophobicContact CG2-CD2 3.89Å; T73-L145 HydrophobicContact CG2-CG 4.16Å; L76-L145 HydrophobicContact CB-CD1 3.93Å; L76-L145 HydrophobicContact CD1-CD1 4.28Å; K77-L145 HydrophobicContact CB-CD2 4.08Å; L80-L145 HydrophobicContact CD1-CD1 4.32Å; L80-L145 HydrophobicContact CD1-CD2 4.34Å; I141-L145 HydrophobicContact CG2-CD1 3.71Å; I141-L145 HydrophobicContact CG2-CG 4.37Å; I141-L145 WeakPolarHBondContact O-CB 3.28Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.42Å; I141-L145 PolarHBondContact O-N 2.99Å; F142-L145 PolarHBondContact O-N 2.9Å; L145-E148 PolarHBondContact O-N 2.95Å; L145-E148 VanDerWaalsContact O-N 3.14Å; L145-I149 HydrophobicContact CB-CD1 4.16Å; L145-I149 WeakPolarHBondContact O-CG1 3.42Å; L145-I149 PolarHBondContact O-N 2.82Å
146F88.1Confident86.9Confident111 Ų11158 Ų5849%0.48730%0.295SS..Hα-helixtrans-50.4-51.7180-173.9-99.4000114.8F142 E148 I149 L150F142-F146 HydrophobicContact CE1-CD2 4.42Å; F142-F146 WeakPolarHBondContact O-CB 3.31Å; F142-F146 PolarHBondContact O-N 2.9Å; F146-E148 VanDerWaalsContact C-N 3.25Å; F146-E148 PolarHBondContact O-N 3.35Å; F146-I149 PolarHBondContact O-N 2.81Å; F146-L150 WeakPolarHBondContact O-CB 3.49Å; F146-L150 PolarHBondContact O-N 2.94Å
147P85.3Confident86.9Confident28 Ų2861.6 Ų61.618%0.18232%0.315CS..Hα-helixtrans-58.6-40.4179.123.2-35.1000111.6L29 F32 I143 S144 L150 L151L29-P147 HydrophobicContact CD1-CB 4.15Å; L29-P147 HydrophobicContact CD1-CG 4.02Å; F32-P147 HydrophobicContact CD1-CG 4.19Å; F32-P147 HydrophobicContact CE1-CG 3.91Å; I143-P147 WeakPolarHBondContact O-CD 3.26Å; S144-P147 WeakPolarHBondContact O-CD 3.35Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å; P147-L150 PolarHBondContact O-N 3.47Å; P147-L151 WeakPolarHBondContact O-CB 3.5Å; P147-L151 WeakPolarHBondContact O-CD1 3.32Å; P147-L151 WeakPolarHBondContact O-CG 3.44Å; P147-L151 PolarHBondContact O-N 3.04Å
148E84.6Confident86.6Confident6 Ų670.9 Ų70.93%0.02835%0.35CS..Hα-helixtrans-69-44.9-178.8-176.5159.1-130.400112.7K77 L145 F146 L150 L151 I152K77-E148 WeakPolarHBondContact CE-OE1 3.46Å; K77-E148 WeakPolarHBondContact CE-OE2 3.27Å; K77-E148 VanDerWaalsContact CG-OE2 3.23Å; K77-E148 WeakPolarHBondContact CG-OE2 3.09Å; K77-E148 IonicContact NZ-OE1 2.81Å; K77-E148 PolarHBondContact NZ-OE1 3.34Å; K77-E148 IonicContact NZ-OE2 2.7Å; K77-E148 PolarHBondContact NZ-OE2 3.25Å; L145-E148 PolarHBondContact O-N 2.95Å; L145-E148 VanDerWaalsContact O-N 3.14Å; F146-E148 VanDerWaalsContact C-N 3.25Å; F146-E148 PolarHBondContact O-N 3.35Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.07Å; E148-L151 PolarHBondContact O-N 3.24Å; E148-L151 VanDerWaalsContact O-N 3.15Å; E148-I152 HydrophobicContact CG-CD1 4.01Å; E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.37Å
149I86.5Confident86Confident66 Ų6672 Ų7234%0.33835%0.348SS..Hα-helixtrans-58.3-45.7174.4-66.6168.4000109.9L80 L145 F146 L151 I152 V153L80-I149 HydrophobicContact CD1-CD1 4.45Å; L80-I149 HydrophobicContact CD1-CG1 4.17Å; L145-I149 HydrophobicContact CB-CD1 4.16Å; L145-I149 WeakPolarHBondContact O-CG1 3.42Å; L145-I149 PolarHBondContact O-N 2.82Å; F146-I149 PolarHBondContact O-N 2.81Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 3.37Å; I149-I152 PolarHBondContact O-N 2.97Å; I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 VanDerWaalsContact O-CG2 3.31Å; I149-V153 WeakPolarHBondContact O-CG2 3.28Å; I149-V153 PolarHBondContact O-N 3.34Å
150L87.3Confident85.4Confident84 Ų8476 Ų7644%0.4436%0.356SS..Hα-helixtrans-58.9-43.8177.3-17369.4000111.2F146 P147 E148 V153 L154F146-L150 WeakPolarHBondContact O-CB 3.49Å; F146-L150 PolarHBondContact O-N 2.94Å; P147-L150 PolarHBondContact O-N 3.47Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.07Å; L150-V153 PolarHBondContact O-N 3.02Å; L150-L154 HydrophobicContact CG-CD1 4.02Å; L150-L154 HydrophobicContact CG-CG 4.46Å; L150-L154 WeakPolarHBondContact O-CB 3.37Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.34Å; L150-L154 PolarHBondContact O-N 3.38Å
151L83.8Confident84.9Confident49 Ų4978.5 Ų78.526%0.25737%0.374SS..Hα-helixtrans-66.5-38.8178.9-73.1155.9000112.3Y25 P147 E148 I149 K155Y25-L151 HydrophobicContact CE2-CD1 4.11Å; Y25-L151 HydrophobicContact CE2-CD2 4.39Å; Y25-L151 WeakPolarHBondContact OH-CD1 3.22Å; Y25-L151 VanDerWaalsContact OH-CD2 3.28Å; Y25-L151 WeakPolarHBondContact OH-CD2 3.4Å; Y25-L151 VanDerWaalsContact OH-CG 3.32Å; Y25-L151 WeakPolarHBondContact OH-CG 3.42Å; P147-L151 WeakPolarHBondContact O-CB 3.5Å; P147-L151 WeakPolarHBondContact O-CD1 3.32Å; P147-L151 WeakPolarHBondContact O-CG 3.44Å; P147-L151 PolarHBondContact O-N 3.04Å; E148-L151 PolarHBondContact O-N 3.24Å; E148-L151 VanDerWaalsContact O-N 3.15Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 3.37Å; L151-K155 VanDerWaalsContact O-CB 3.29Å; L151-K155 WeakPolarHBondContact O-CB 3.44Å; L151-K155 VanDerWaalsContact O-CG 3.23Å; L151-K155 WeakPolarHBondContact O-CG 3Å; L151-K155 PolarHBondContact O-N 3.23Å
152I84.6Confident84.1Confident54 Ų5480.7 Ų80.728%0.27740%0.395SS..Hα-helixtrans-63-47.5173.8-69.5165.3000110.2E148 I149 K155 N156E148-I152 HydrophobicContact CG-CD1 4.01Å; E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.37Å; I149-I152 PolarHBondContact O-N 2.97Å; I152-K155 PolarHBondContact O-N 3.44Å; I152-N156 WeakPolarHBondContact O-CB 3.49Å; I152-N156 PolarHBondContact O-N 3.49Å; I152-N156 PolarHBondContact O-ND2 2.89Å
153V86.8Confident83.3Confident76 Ų7682.7 Ų82.746%0.46140%0.398SS..Hα-helixtrans-62.3-49.8179172.30000110.9I149 L150 K155 N156 V157I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 VanDerWaalsContact O-CG2 3.31Å; I149-V153 WeakPolarHBondContact O-CG2 3.28Å; I149-V153 PolarHBondContact O-N 3.34Å; L150-V153 PolarHBondContact O-N 3.02Å; V153-K155 VanDerWaalsContact C-N 3.34Å; V153-K155 PolarHBondContact O-N 2.91Å; V153-N156 PolarHBondContact O-N 3.5Å; V153-N156 VanDerWaalsContact O-N 3.12Å; V153-V157 HydrophobicContact CG1-CG2 4.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.27Å; V153-V157 PolarHBondContact O-N 2.85Å
154L85.9Confident82.5Confident99 Ų9982.8 Ų82.852%0.51840%0.402SS..Hα-helixtrans-59.4-43.6178.5-73.1172.9000111.9L150 N156 V157 R158L150-L154 HydrophobicContact CG-CD1 4.02Å; L150-L154 HydrophobicContact CG-CG 4.46Å; L150-L154 WeakPolarHBondContact O-CB 3.37Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.34Å; L150-L154 PolarHBondContact O-N 3.38Å; L154-N156 VanDerWaalsContact C-N 3.35Å; L154-N156 PolarHBondContact O-N 3.28Å; L154-V157 PolarHBondContact O-N 3.33Å; L154-R158 VanDerWaalsContact O-CB 3.31Å; L154-R158 WeakPolarHBondContact O-CB 3.37Å; L154-R158 PolarHBondContact O-N 3.49Å
155K82.4Confident81.6Confident98 Ų9889.1 Ų89.143%0.42643%0.431SS..Hα-helixtrans-62.7-41.5175.4-77.2173.1-179170.50111.4L151 I152 V153 R159L151-K155 VanDerWaalsContact O-CB 3.29Å; L151-K155 WeakPolarHBondContact O-CB 3.44Å; L151-K155 VanDerWaalsContact O-CG 3.23Å; L151-K155 WeakPolarHBondContact O-CG 3Å; L151-K155 PolarHBondContact O-N 3.23Å; I152-K155 PolarHBondContact O-N 3.44Å; V153-K155 VanDerWaalsContact C-N 3.34Å; V153-K155 PolarHBondContact O-N 2.91Å; K155-R159 WeakPolarHBondContact O-CB 2.95Å; K155-R159 WeakPolarHBondContact O-CG 3.37Å; K155-R159 PolarHBondContact O-N 3.19Å
156N83.4Confident80.7Confident76 Ų7694.3 Ų94.341%0.40646%0.455SS..Hα-helixtrans-67.6-43179-73.3-21.3000112.2I152 V153 L154 R159 R160I152-N156 WeakPolarHBondContact O-CB 3.49Å; I152-N156 PolarHBondContact O-N 3.49Å; I152-N156 PolarHBondContact O-ND2 2.89Å; V153-N156 PolarHBondContact O-N 3.5Å; V153-N156 VanDerWaalsContact O-N 3.12Å; L154-N156 VanDerWaalsContact C-N 3.35Å; L154-N156 PolarHBondContact O-N 3.28Å; N156-R159 PolarHBondContact O-N 2.99Å; N156-R160 WeakPolarHBondContact O-CB 3.44Å; N156-R160 PolarHBondContact O-N 3.09Å
157V85.6Confident80Confident90 Ų9094.8 Ų94.855%0.54546%0.462SS..Hα-helixtrans-62.4-48.1175.5172.60000110.5V153 L154 R159 R160 S161V153-V157 HydrophobicContact CG1-CG2 4.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.27Å; V153-V157 PolarHBondContact O-N 2.85Å; L154-V157 PolarHBondContact O-N 3.33Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.91Å; V157-R160 WeakPolarHBondContact O-CB 3.48Å; V157-R160 PolarHBondContact O-N 3.38Å; V157-R160 VanDerWaalsContact O-N 3.08Å; V157-S161 PolarHBondContact O-N 3.28Å
158R81.4Confident79.5Confident200 Ų20098.3 Ų98.376%0.75548%0.478SS*.Hα-helixtrans-59.8-42.8177.4-172.6175.9-178.5179.91.2112L154 R160 S161 A162L154-R158 VanDerWaalsContact O-CB 3.31Å; L154-R158 WeakPolarHBondContact O-CB 3.37Å; L154-R158 PolarHBondContact O-N 3.49Å; R158-R160 VanDerWaalsContact C-N 3.31Å; R158-R160 PolarHBondContact O-N 3.14Å; R158-S161 PolarHBondContact O-N 3.37Å; R158-A162 WeakPolarHBondContact O-CB 3.31Å; R158-A162 PolarHBondContact O-N 3.17Å
159R75.4Confident78.8Confident128 Ų128101.9 Ų101.948%0.48350%0.504SS..Hα-helixtrans-63.7-34.5175.1-75.8173.8-177.7-165.21.2112.6K155 N156 V157 R163K155-R159 WeakPolarHBondContact O-CB 2.95Å; K155-R159 WeakPolarHBondContact O-CG 3.37Å; K155-R159 PolarHBondContact O-N 3.19Å; N156-R159 PolarHBondContact O-N 2.99Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.91Å; R159-R163 PolarHBondContact O-N 3.44Å
160R76.1Confident77.8Confident188 Ų188103 Ų10371%0.70952%0.518SS*.Hα-helixtrans-70.8-47.2176.9-165.4176.5-176-179.60.5110.9N156 V157 R158 A162 R163 V164N156-R160 WeakPolarHBondContact O-CB 3.44Å; N156-R160 PolarHBondContact O-N 3.09Å; V157-R160 WeakPolarHBondContact O-CB 3.48Å; V157-R160 PolarHBondContact O-N 3.38Å; V157-R160 VanDerWaalsContact O-N 3.08Å; R158-R160 VanDerWaalsContact C-N 3.31Å; R158-R160 PolarHBondContact O-N 3.14Å; R160-A162 PolarHBondContact O-N 3.4Å; R160-R163 PolarHBondContact O-N 2.9Å; R160-V164 WeakPolarHBondContact O-CG2 3.38Å; R160-V164 PolarHBondContact O-N 3.22Å; R160-V164 VanDerWaalsContact O-N 3.11Å
161S79.4Confident76.6Confident65 Ų65103.8 Ų103.846%0.45553%0.53SS..Hα-helixtrans-59.3-45.1176.4174.60000112.4V157 R158 R163 V164 H165V157-S161 PolarHBondContact O-N 3.28Å; R158-S161 PolarHBondContact O-N 3.37Å; S161-R163 VanDerWaalsContact C-N 3.32Å; S161-R163 PolarHBondContact O-N 3.22Å; S161-V164 PolarHBondContact O-N 3.1Å; S161-H165 PolarHBondContact O-N 2.74Å; S161-H165 VanDerWaalsContact O-N 3.14Å
162A74.2Confident75.1Confident62 Ų62108 Ų10851%0.51257%0.572SS.*Hα-helixtrans-62.7-36.117700000113.3R158 R160 H166R158-A162 WeakPolarHBondContact O-CB 3.31Å; R158-A162 PolarHBondContact O-N 3.17Å; R160-A162 PolarHBondContact O-N 3.4Å; A162-H166 PolarHBondContact O-N 3.21Å
163R71.9Confident74.6Confident172 Ų172110.8 Ų110.865%0.64959%0.587SS**Hα-helixtrans-65.8-41.2174.5-98.4-172.9-76.5178.9-4.4112.2R159 R160 S161 H166 L167R159-R163 PolarHBondContact O-N 3.44Å; R160-R163 PolarHBondContact O-N 2.9Å; S161-R163 VanDerWaalsContact C-N 3.32Å; S161-R163 PolarHBondContact O-N 3.22Å; R163-H166 PolarHBondContact O-N 3.29Å; R163-L167 WeakPolarHBondContact O-CG 3.46Å; R163-L167 PolarHBondContact O-N 3.16Å; R163-L167 VanDerWaalsContact O-N 3.09Å
164V73.7Confident74Confident74 Ų74112.6 Ų112.645%0.44859%0.594SS.*Hα-helixtrans-62.6-46.4178.9172.80000110.9R160 S161 H166 L167 I168R160-V164 WeakPolarHBondContact O-CG2 3.38Å; R160-V164 PolarHBondContact O-N 3.22Å; R160-V164 VanDerWaalsContact O-N 3.11Å; S161-V164 PolarHBondContact O-N 3.1Å; V164-H166 VanDerWaalsContact C-N 3.34Å; V164-H166 PolarHBondContact O-N 2.64Å; V164-L167 PolarHBondContact O-N 3.38Å; V164-I168 HydrophobicContact CG1-CD1 3.8Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.39Å; V164-I168 VanDerWaalsContact O-N 3.09Å
165H70.1Confident73.3Confident133 Ų133113.3 Ų113.362%0.61660%0.598SS**Hα-helixtrans-59.2-42176.8-90.4-87.8000113.2S161 I168 S169S161-H165 PolarHBondContact O-N 2.74Å; S161-H165 VanDerWaalsContact O-N 3.14Å; H165-I168 PolarHBondContact O-N 2.7Å; H165-S169 PolarHBondContact O-N 2.77Å; H165-S169 PolarHBondContact O-OG 3.49Å
166H69.1Low72.8Confident122 Ų122114.2 Ų114.257%0.56561%0.608SS**Hα-helixtrans-67.2-34.7178.5-173.9-71.6000112.8A162 R163 V164 S169 S170A162-H166 PolarHBondContact O-N 3.21Å; R163-H166 PolarHBondContact O-N 3.29Å; V164-H166 VanDerWaalsContact C-N 3.34Å; V164-H166 PolarHBondContact O-N 2.64Å; H166-S169 PolarHBondContact O-OG 3.49Å; H166-S170 WeakPolarHBondContact O-CB 3.5Å; H166-S170 PolarHBondContact O-N 2.96Å
167L72.3Confident72.2Confident121 Ų121116.6 Ų116.663%0.63462%0.621SS**Hα-helixtrans-67.6-43.3176.1-71.5169.2000111R163 V164 S170 S171R163-L167 WeakPolarHBondContact O-CG 3.46Å; R163-L167 PolarHBondContact O-N 3.16Å; R163-L167 VanDerWaalsContact O-N 3.09Å; V164-L167 PolarHBondContact O-N 3.38Å; L167-S170 PolarHBondContact O-N 3.37Å; L167-S171 PolarHBondContact O-N 3.47Å; L167-S171 PolarHBondContact O-OG 3.17Å; L167-S171 VanDerWaalsContact O-OG 3.12Å
168I74.3Confident71.3Confident102 Ų102118.4 Ų118.452%0.52363%0.626SS.*Hα-helixtrans-63.4-43.1178.1-64.1166.7000111.2V164 H165 S170 S171 A172V164-I168 HydrophobicContact CG1-CD1 3.8Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.39Å; V164-I168 VanDerWaalsContact O-N 3.09Å; H165-I168 PolarHBondContact O-N 2.7Å; I168-S170 PolarHBondContact O-N 3.21Å; I168-S171 PolarHBondContact O-N 3Å; I168-S171 PolarHBondContact O-OG 3.03Å; I168-A172 PolarHBondContact O-N 3.01Å
169S70.1Confident70.5Confident81 Ų81112.6 Ų112.657%0.56662%0.616SS**Hα-helixtrans-72.6-15.5178.973.50000114.1H165 H166H165-S169 PolarHBondContact O-N 2.77Å; H165-S169 PolarHBondContact O-OG 3.49Å; H166-S169 PolarHBondContact O-OG 3.49Å
170S66.6Low70.2Confident89 Ų89111.4 Ų111.462%0.62263%0.627SS**Hα-helixtrans-94.3-14.2177.1-177.90000112.6H166 L167 I168H166-S170 WeakPolarHBondContact O-CB 3.5Å; H166-S170 PolarHBondContact O-N 2.96Å; L167-S170 PolarHBondContact O-N 3.37Å; I168-S170 PolarHBondContact O-N 3.21Å
171S61.8Low69.7Low100 Ų100105 Ų10570%0.69962%0.62SS**  trans-98.7-5.8178.355.70000114L167 I168L167-S171 PolarHBondContact O-N 3.47Å; L167-S171 PolarHBondContact O-OG 3.17Å; L167-S171 VanDerWaalsContact O-OG 3.12Å; I168-S171 PolarHBondContact O-N 3Å; I168-S171 PolarHBondContact O-OG 3.03Å
172A52.8Low68.8Low139 Ų139108.6 Ų108.6100%1.14964%0.635SS**  trans-103.60172.800000109.4I168I168-A172 PolarHBondContact O-N 3.01Å

Retrieved 172 of 172 residues in 114.4 ms (Link to these results)