A0A077ZG06_TRITR Loading...

Phosphate transporter family protein

AlphaFold DB , UniProt , Accession A0A077ZG06, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M47.2Very low51.9Low220 Ų220163.5 Ų163.5100%1.08478%0.776SS**  0-23.60-77.6173.276.400115.4K3 L4M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.45Å; M1-L4 PolarHBondContact O-N 3.22Å
2K47.5Very low53.4Low189 Ų189155.7 Ų155.782%0.82274%0.739SS**THydrogen-bonded Turntrans-63.4-19.2178.9-113.5176.5177.7-178.40116.1
3K47.8Very low55.5Low204 Ų204148.3 Ų148.389%0.88771%0.714SS**THydrogen-bonded Turntrans-83.1-12-179.1-83.7-169.1174-169.20115.4M1M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.45Å
4L47.7Very low57.4Low151 Ų151144.5 Ų144.579%0.79171%0.707SS**SBendtrans-90.1-13174.1-144.581.8000112.6M1 I6M1-L4 PolarHBondContact O-N 3.22Å; L4-I6 VanDerWaalsContact C-N 3.35Å
5L49Very low59.4Low119 Ų119141.9 Ų141.962%0.62370%0.703SS**SBendtrans-83.6-8.6-173.5-95.1157.3000114.4
6I50.6Low61.2Low122 Ų122136.7 Ų136.763%0.62668%0.681SS**  trans-103.770.1167.8-49.3171.6000104.7L4 E8L4-I6 VanDerWaalsContact C-N 3.35Å; I6-E8 HydrophobicContact CG2-CB 4.03Å; I6-E8 HydrophobicContact CG2-CG 3.74Å; I6-E8 PolarHBondContact O-N 2.75Å
7L51.2Low62.6Low139 Ų139130.8 Ų130.873%0.72866%0.656SS**  trans-64.979.7148.9-79.2174.6000104.6R9L7-R9 PolarHBondContact O-N 2.75Å; L7-R9 VanDerWaalsContact O-N 3.14Å
8E53.9Low64.1Low161 Ų161132.1 Ų132.175%0.75266%0.656SS**  trans-46.2119.4174.1-129.1165.7-15100105I6 K10I6-E8 HydrophobicContact CG2-CB 4.03Å; I6-E8 HydrophobicContact CG2-CG 3.74Å; I6-E8 PolarHBondContact O-N 2.75Å; E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.14Å
9R57.3Low65.6Low211 Ų211130.5 Ų130.580%0.79665%0.65SS**  trans-38.3103.2165.6176.5-168.3-169-150.27.1106.4L7 P11L7-R9 PolarHBondContact O-N 2.75Å; L7-R9 VanDerWaalsContact O-N 3.14Å; R9-P11 WeakPolarHBondContact O-CD 3.02Å
10K56.3Low67Low189 Ų189126.3 Ų126.382%0.82263%0.628SS**  trans-67.8107.9166.7-169.2175.2-175.8173.90102.6E8 E12E8-K10 VanDerWaalsContact C-N 3.31Å; E8-K10 PolarHBondContact O-N 3.14Å; K10-E12 PolarHBondContact O-N 3Å
11P62.5Low68.3Low94 Ų94124.3 Ų124.361%0.6162%0.618SS**PPolyproline II helixtrans-53.5124.4-179.422.9-31.9000106.2R9 S13R9-P11 WeakPolarHBondContact O-CD 3.02Å; P11-S13 PolarHBondContact O-N 2.87Å
12E70Confident70.5Confident69 Ų69117.6 Ų117.632%0.32259%0.593SS.*PPolyproline II helixtrans-52.2133177.4-72.2174.9-169.300107.2K10 C17 S100 V102K10-E12 PolarHBondContact O-N 3Å; E12-C17 WeakPolarHBondContact CB-SG 3.33Å; E12-C17 PolarHBondContact OE2-SG 3.1Å; E12-C17 VanDerWaalsContact OE2-SG 3.33Å; E12-S100 PolarHBondContact OE1-OG 3.32Å; E12-V102 VanDerWaalsContact CD-CG2 3.41Å; E12-V102 HydrophobicContact CG-CG2 4.5Å; E12-V102 WeakPolarHBondContact OE1-CG2 3.26Å; E12-V102 WeakPolarHBondContact OE2-CG2 3.16Å
13S80.1Confident72.8Confident60 Ų60111.3 Ų111.342%0.4257%0.568SS.*PPolyproline II helixtrans-53.3137-180164.90000108.6P11 T15 V16 C17P11-S13 PolarHBondContact O-N 2.87Å; S13-T15 PolarHBondContact O-N 2.59Å; S13-V16 WeakPolarHBondContact O-CA 3.36Å; S13-V16 WeakPolarHBondContact O-CB 3.34Å; S13-V16 PolarHBondContact O-N 3.46Å; S13-C17 PolarHBondContact O-N 2.68Å
14P82.4Confident75Confident95 Ų95103.6 Ų103.662%0.61754%0.535SS*.Hα-helixtrans-55.7-29.5-177.520.1-31.9000112.2K18P14-K18 WeakPolarHBondContact O-CG 3.37Å; P14-K18 PolarHBondContact O-N 3.01Å; P14-K18 VanDerWaalsContact O-N 3.1Å
15T88.2Confident77.3Confident105 Ų105100.6 Ų100.664%0.64452%0.523SS*.Hα-helixtrans-67.1-42.4173.2-500000112.2S13 K18 L19S13-T15 PolarHBondContact O-N 2.59Å; T15-K18 PolarHBondContact O-N 3.33Å; T15-L19 PolarHBondContact O-N 3.22Å; T15-L19 VanDerWaalsContact O-N 3.1Å
16V88.2Confident79.6Confident59 Ų5999.6 Ų99.636%0.35852%0.518SS..Hα-helixtrans-65.7-46.4177175.90000109.9S13 K18 L19 F20 V102S13-V16 WeakPolarHBondContact O-CA 3.36Å; S13-V16 WeakPolarHBondContact O-CB 3.34Å; S13-V16 PolarHBondContact O-N 3.46Å; V16-K18 VanDerWaalsContact C-N 3.34Å; V16-K18 PolarHBondContact O-N 3.27Å; V16-L19 PolarHBondContact O-N 3.35Å; V16-F20 HydrophobicContact CG1-CD2 3.6Å; V16-F20 HydrophobicContact CG1-CE2 3.81Å; V16-F20 WeakPolarHBondContact O-CD2 3.36Å; V16-F20 PolarHBondContact O-N 3.1Å; V16-V102 HydrophobicContact CG1-CG2 4.21Å
17C84.6Confident81.7Confident37 Ų3794.8 Ų94.825%0.2550%0.495CS..Hα-helixtrans-57-47.1176.3-69.20000111.8E12 S13 L19 F20 I21E12-C17 WeakPolarHBondContact CB-SG 3.33Å; E12-C17 PolarHBondContact OE2-SG 3.1Å; E12-C17 VanDerWaalsContact OE2-SG 3.33Å; S13-C17 PolarHBondContact O-N 2.68Å; C17-L19 VanDerWaalsContact C-N 3.35Å; C17-L19 PolarHBondContact O-N 3.25Å; C17-F20 PolarHBondContact O-N 3.38Å; C17-I21 WeakPolarHBondContact O-CB 3.39Å; C17-I21 WeakPolarHBondContact O-CD1 3.44Å; C17-I21 WeakPolarHBondContact O-CG1 3.34Å; C17-I21 PolarHBondContact O-N 3.46Å
18K89.7Confident83.7Confident153 Ų15389.5 Ų89.567%0.66547%0.471SS*.Hα-helixtrans-59.9-44.3178.9-76.1177.7-177.6-177.30112.3P14 T15 V16 S22P14-K18 WeakPolarHBondContact O-CG 3.37Å; P14-K18 PolarHBondContact O-N 3.01Å; P14-K18 VanDerWaalsContact O-N 3.1Å; T15-K18 PolarHBondContact O-N 3.33Å; V16-K18 VanDerWaalsContact C-N 3.34Å; V16-K18 PolarHBondContact O-N 3.27Å; K18-S22 PolarHBondContact O-N 3.24Å; K18-S22 PolarHBondContact O-OG 3.38Å
19L93Very high85.8Confident102 Ų10285.6 Ų85.653%0.53446%0.461SS..Hα-helixtrans-62.2-50.1177.517862000111.3T15 V16 C17 I21 S22 L23T15-L19 PolarHBondContact O-N 3.22Å; T15-L19 VanDerWaalsContact O-N 3.1Å; V16-L19 PolarHBondContact O-N 3.35Å; C17-L19 VanDerWaalsContact C-N 3.35Å; C17-L19 PolarHBondContact O-N 3.25Å; L19-I21 PolarHBondContact O-N 2.95Å; L19-S22 WeakPolarHBondContact O-CB 3.31Å; L19-S22 PolarHBondContact O-N 3.06Å; L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.4Å; L19-L23 HydrophobicContact CG-CD1 4.07Å; L19-L23 WeakPolarHBondContact O-CG 3.1Å; L19-L23 PolarHBondContact O-N 2.96Å
20F93.1Very high87.5Confident46 Ų4682.4 Ų82.420%0.20245%0.453CS..Hα-helixtrans-72.7-25-177-84.1-89.1000113.7V16 C17 L23 Q24 P101 V102 F105V16-F20 HydrophobicContact CG1-CD2 3.6Å; V16-F20 HydrophobicContact CG1-CE2 3.81Å; V16-F20 WeakPolarHBondContact O-CD2 3.36Å; V16-F20 PolarHBondContact O-N 3.1Å; C17-F20 PolarHBondContact O-N 3.38Å; F20-L23 HydrophobicContact CD1-CD1 4.37Å; F20-Q24 WeakPolarHBondContact O-CA 3.5Å; F20-Q24 WeakPolarHBondContact O-CB 3.38Å; F20-Q24 PolarHBondContact O-N 2.91Å; F20-P101 HydrophobicContact CB-CB 4.38Å; F20-V102 HydrophobicContact CB-CB 4.47Å; F20-V102 HydrophobicContact CB-CG2 3.67Å; F20-V102 HydrophobicContact CD1-CB 4.15Å; F20-V102 HydrophobicContact CD1-CG1 4.18Å; F20-V102 HydrophobicContact CD1-CG2 3.99Å; F20-V102 HydrophobicContact CD2-CG2 3.71Å; F20-V102 HydrophobicContact CE1-CG1 4.03Å; F20-V102 HydrophobicContact CE2-CG2 4.27Å; F20-V102 HydrophobicContact CG-CB 4.19Å; F20-V102 HydrophobicContact CG-CG1 4.47Å; F20-V102 HydrophobicContact CG-CG2 3.52Å; F20-V102 HydrophobicContact CZ-CG1 4.21Å; F20-F105 HydrophobicContact CD1-CB 4.02Å; F20-F105 HydrophobicContact CD1-CD1 4.1Å; F20-F105 HydrophobicContact CD1-CG 4.19Å; F20-F105 HydrophobicContact CE1-CB 4.44Å; F20-F105 AromaticContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CE1 4.42Å; F20-F105 HydrophobicContact CE1-CG 4.32Å
21I94.3Very high89.2Confident85 Ų8574.2 Ų74.244%0.43642%0.421SS..Hα-helixtrans-61.6-48.6168.5-73.3163.5000109.6C17 L19 L23 Q24 V25 P101C17-I21 WeakPolarHBondContact O-CB 3.39Å; C17-I21 WeakPolarHBondContact O-CD1 3.44Å; C17-I21 WeakPolarHBondContact O-CG1 3.34Å; C17-I21 PolarHBondContact O-N 3.46Å; L19-I21 PolarHBondContact O-N 2.95Å; I21-L23 PolarHBondContact O-N 3.02Å; I21-Q24 PolarHBondContact O-N 3.33Å; I21-V25 WeakPolarHBondContact O-CG2 3.31Å; I21-V25 PolarHBondContact O-N 2.8Å; I21-P101 HydrophobicContact CG1-CB 3.89Å; I21-P101 HydrophobicContact CG1-CG 3.68Å
22S93.7Very high90.6Very high80 Ų8073.4 Ų73.456%0.55942%0.418SS*.Hα-helixtrans-61.9-44.7177.7-59.70000112K18 L19 Q24 V25 L26K18-S22 PolarHBondContact O-N 3.24Å; K18-S22 PolarHBondContact O-OG 3.38Å; L19-S22 WeakPolarHBondContact O-CB 3.31Å; L19-S22 PolarHBondContact O-N 3.06Å; S22-Q24 VanDerWaalsContact C-N 3.34Å; S22-V25 PolarHBondContact O-N 3.39Å; S22-L26 WeakPolarHBondContact O-CB 3.34Å; S22-L26 PolarHBondContact O-N 2.76Å
23L95.1Very high91.7Very high56 Ų5678.5 Ų78.529%0.29344%0.439SS..Hα-helixtrans-65.1-37.7176.3-66.2176.9000112.3L19 F20 I21 L26 S27 F105L19-L23 HydrophobicContact CD1-CD1 4.31Å; L19-L23 HydrophobicContact CD1-CG 4.4Å; L19-L23 HydrophobicContact CG-CD1 4.07Å; L19-L23 WeakPolarHBondContact O-CG 3.1Å; L19-L23 PolarHBondContact O-N 2.96Å; F20-L23 HydrophobicContact CD1-CD1 4.37Å; I21-L23 PolarHBondContact O-N 3.02Å; L23-L26 PolarHBondContact O-N 3.22Å; L23-S27 VanDerWaalsContact O-CB 3.31Å; L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 3.11Å; L23-S27 PolarHBondContact O-OG 3.02Å; L23-F105 HydrophobicContact CB-CD2 3.77Å; L23-F105 HydrophobicContact CB-CE2 3.88Å; L23-F105 HydrophobicContact CB-CG 4.37Å
24Q95Very high92.3Very high42 Ų4278.9 Ų78.920%0.19645%0.445CS..Hα-helixtrans-67.3-44.4178.1177.256.616.400111.1F20 I21 S22 L26 S27 A28 P101 G104F20-Q24 WeakPolarHBondContact O-CA 3.5Å; F20-Q24 WeakPolarHBondContact O-CB 3.38Å; F20-Q24 PolarHBondContact O-N 2.91Å; I21-Q24 PolarHBondContact O-N 3.33Å; S22-Q24 VanDerWaalsContact C-N 3.34Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 2.84Å; Q24-S27 WeakPolarHBondContact CA-OG 3.4Å; Q24-S27 PolarHBondContact O-OG 2.83Å; Q24-S27 VanDerWaalsContact O-OG 3.05Å; Q24-A28 WeakPolarHBondContact O-CB 3.37Å; Q24-A28 PolarHBondContact O-N 3.07Å; Q24-P101 HydrophobicContact CB-CB 4.35Å; Q24-G104 PolarHBondContact OE1-O 2.83Å
25V96.2Very high92.6Very high89 Ų8976.4 Ų76.454%0.53943%0.426SS..Hα-helixtrans-60.5-47.5175.8171.30000110I21 S22 A28 C29I21-V25 WeakPolarHBondContact O-CG2 3.31Å; I21-V25 PolarHBondContact O-N 2.8Å; S22-V25 PolarHBondContact O-N 3.39Å; V25-A28 PolarHBondContact O-N 2.91Å; V25-C29 PolarHBondContact O-N 3.18Å; V25-C29 PolarHBondContact O-SG 3.17Å
26L96Very high92.7Very high98 Ų9872.8 Ų72.851%0.51341%0.409SS..Hα-helixtrans-61.2-50.8179.7-175.864.6000112.2S22 L23 Q24 C29 F30S22-L26 WeakPolarHBondContact O-CB 3.34Å; S22-L26 PolarHBondContact O-N 2.76Å; L23-L26 PolarHBondContact O-N 3.22Å; Q24-L26 VanDerWaalsContact C-N 3.34Å; Q24-L26 PolarHBondContact O-N 2.84Å; L26-C29 WeakPolarHBondContact O-CB 3.19Å; L26-C29 PolarHBondContact O-N 3.27Å; L26-F30 HydrophobicContact CD1-CD2 4.14Å; L26-F30 HydrophobicContact CD1-CE2 3.62Å; L26-F30 HydrophobicContact CG-CD2 4.16Å; L26-F30 HydrophobicContact CG-CE2 3.95Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.44Å; L26-F30 PolarHBondContact O-N 2.81Å
27S94.2Very high92.8Very high21 Ų2172.3 Ų72.315%0.14742%0.416CS..Hα-helixtrans-63.3-41.1178.756.90000112L23 Q24 C29 F30 A31L23-S27 VanDerWaalsContact O-CB 3.31Å; L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 3.11Å; L23-S27 PolarHBondContact O-OG 3.02Å; Q24-S27 WeakPolarHBondContact CA-OG 3.4Å; Q24-S27 PolarHBondContact O-OG 2.83Å; Q24-S27 VanDerWaalsContact O-OG 3.05Å; S27-C29 VanDerWaalsContact C-N 3.33Å; S27-C29 PolarHBondContact O-N 3.05Å; S27-F30 PolarHBondContact O-N 3.44Å; S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.05Å
28A94.8Very high93.1Very high27 Ų2773.5 Ų73.522%0.22342%0.42CS..Hα-helixtrans-62.2-38.2175.700000111.9Q24 V25 S32Q24-A28 WeakPolarHBondContact O-CB 3.37Å; Q24-A28 PolarHBondContact O-N 3.07Å; V25-A28 PolarHBondContact O-N 2.91Å; A28-S32 WeakPolarHBondContact O-CB 3.47Å; A28-S32 PolarHBondContact O-N 3.39Å; A28-S32 PolarHBondContact O-OG 3.43Å
29C96.4Very high93.1Very high79 Ų7967.6 Ų67.653%0.53440%0.395SS..Hα-helixtrans-61.7-50174.7-72.40000111.8V25 L26 S27 S32 F33V25-C29 PolarHBondContact O-N 3.18Å; V25-C29 PolarHBondContact O-SG 3.17Å; L26-C29 WeakPolarHBondContact O-CB 3.19Å; L26-C29 PolarHBondContact O-N 3.27Å; S27-C29 VanDerWaalsContact C-N 3.33Å; S27-C29 PolarHBondContact O-N 3.05Å; C29-S32 PolarHBondContact O-N 2.77Å; C29-F33 WeakPolarHBondContact O-CB 3.16Å; C29-F33 PolarHBondContact O-N 3.21Å
30F93.9Very high93.1Very high144 Ų14463.9 Ų63.963%0.63238%0.377SS*.Hα-helixtrans-63.9-44.7177.8-78.2-67.9000112.1L26 S27 S32 F33 A34L26-F30 HydrophobicContact CD1-CD2 4.14Å; L26-F30 HydrophobicContact CD1-CE2 3.62Å; L26-F30 HydrophobicContact CG-CD2 4.16Å; L26-F30 HydrophobicContact CG-CE2 3.95Å; L26-F30 VanDerWaalsContact O-CD2 3.27Å; L26-F30 WeakPolarHBondContact O-CD2 3.44Å; L26-F30 PolarHBondContact O-N 2.81Å; S27-F30 PolarHBondContact O-N 3.44Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.15Å; F30-F33 PolarHBondContact O-N 2.83Å; F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.82Å
31A92.4Very high93Very high18 Ų1865 Ų6515%0.14939%0.391CS..Hα-helixtrans-62.4-42177.800000111.3S27 H35 E108S27-A31 WeakPolarHBondContact O-CB 3.38Å; S27-A31 PolarHBondContact O-N 3.05Å; A31-H35 WeakPolarHBondContact O-CB 3.42Å; A31-H35 PolarHBondContact O-N 3.22Å; A31-E108 HydrophobicContact CB-CG 4.48Å; A31-E108 WeakPolarHBondContact CB-OE2 3.15Å
32S92.2Very high92.8Very high77 Ų7765.6 Ų65.654%0.53840%0.395SS..Hα-helixtrans-66.9-39177.8-59.50000111.8A28 C29 F30 G36A28-S32 WeakPolarHBondContact O-CB 3.47Å; A28-S32 PolarHBondContact O-N 3.39Å; A28-S32 PolarHBondContact O-OG 3.43Å; C29-S32 PolarHBondContact O-N 2.77Å; F30-S32 VanDerWaalsContact C-N 3.34Å; F30-S32 PolarHBondContact O-N 3.15Å; S32-G36 PolarHBondContact O-N 3.5Å
33F93.1Very high92.7Very high176 Ų17664.5 Ų64.577%0.77239%0.391SS*.Hα-helixtrans-64.5-49.7175.9-176.3-96.2000111.8C29 F30 G37C29-F33 WeakPolarHBondContact O-CB 3.16Å; C29-F33 PolarHBondContact O-N 3.21Å; F30-F33 PolarHBondContact O-N 2.83Å; F33-G37 PolarHBondContact O-N 3.23Å; F33-G37 VanDerWaalsContact O-N 3.07Å
34A91.5Very high92.6Very high67 Ų6762.4 Ų62.455%0.55438%0.379SS*.Hα-helixtrans-64.7-42.3178.600000112.3F30 N38F30-A34 WeakPolarHBondContact O-CB 3.4Å; F30-A34 PolarHBondContact O-N 2.82Å; A34-N38 PolarHBondContact O-N 3.09Å
35H88.7Confident92.4Very high44 Ų4463 Ų6320%0.20439%0.391CS..Hα-helixtrans-68.2-45.4179.3-165.662.6000111.3A31 G37 N38 D39 T127A31-H35 WeakPolarHBondContact O-CB 3.42Å; A31-H35 PolarHBondContact O-N 3.22Å; H35-G37 PolarHBondContact O-N 3.12Å; H35-N38 WeakPolarHBondContact O-CB 3.33Å; H35-N38 PolarHBondContact O-N 2.95Å; H35-N38 VanDerWaalsContact O-N 3.15Å; H35-D39 IonicContact CD2-OD2 3.06Å; H35-D39 IonicContact CE1-OD1 3.92Å; H35-D39 IonicContact NE2-OD2 2.83Å; H35-D39 WeakPolarHBondContact O-CB 3.48Å; H35-D39 PolarHBondContact O-N 3.48Å; H35-T127 PolarHBondContact CE1-OG1 3.45Å; H35-T127 PolarHBondContact ND1-OG1 3.39Å; H35-T127 VanDerWaalsContact ND1-OG1 3.13Å
36G91.3Very high92.1Very high28 Ų2862.9 Ų62.929%0.28939%0.393SS..Hα-helixtrans-60.8-41.9177.400000113S32 N38 D39 V40S32-G36 PolarHBondContact O-N 3.5Å; G36-N38 VanDerWaalsContact C-N 3.34Å; G36-N38 PolarHBondContact O-N 2.99Å; G36-D39 PolarHBondContact O-N 3.05Å; G36-V40 WeakPolarHBondContact O-CG2 3.27Å; G36-V40 PolarHBondContact O-N 2.85Å
37G89.9Confident91.9Very high49 Ų4961.5 Ų61.551%0.50539%0.385SS..Hα-helixtrans-62.5-39.8174.700000113F33 H35 S41F33-G37 PolarHBondContact O-N 3.23Å; F33-G37 VanDerWaalsContact O-N 3.07Å; H35-G37 PolarHBondContact O-N 3.12Å; G37-S41 WeakPolarHBondContact O-CB 3.49Å; G37-S41 PolarHBondContact O-N 3.42Å
38N89.9Confident91.7Very high63 Ų6361.2 Ų61.234%0.33738%0.383SS..Hα-helixtrans-65-46.2175.3-171.4-104.5000111.6A34 H35 G36 S41 N42A34-N38 PolarHBondContact O-N 3.09Å; H35-N38 WeakPolarHBondContact O-CB 3.33Å; H35-N38 PolarHBondContact O-N 2.95Å; H35-N38 VanDerWaalsContact O-N 3.15Å; G36-N38 VanDerWaalsContact C-N 3.34Å; G36-N38 PolarHBondContact O-N 2.99Å; N38-S41 WeakPolarHBondContact O-CB 3.21Å; N38-S41 PolarHBondContact O-N 2.99Å; N38-N42 PolarHBondContact O-N 2.95Å; N38-N42 PolarHBondContact O-ND2 3.38Å; N38-N42 PolarHBondContact OD1-ND2 3.47Å
39D91.6Very high91.5Very high28 Ų2861.7 Ų61.715%0.1539%0.39CS..Hα-helixtrans-65.3-44.2-176.8-81.86.9000112.5H35 G36 S41 N42 A43 M77H35-D39 IonicContact CD2-OD2 3.06Å; H35-D39 IonicContact CE1-OD1 3.92Å; H35-D39 IonicContact NE2-OD2 2.83Å; H35-D39 WeakPolarHBondContact O-CB 3.48Å; H35-D39 PolarHBondContact O-N 3.48Å; G36-D39 PolarHBondContact O-N 3.05Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.2Å; D39-N42 PolarHBondContact O-N 3.21Å; D39-A43 WeakPolarHBondContact O-CB 3.4Å; D39-A43 PolarHBondContact O-N 2.76Å; D39-M77 HydrophobicContact CB-CE 3.67Å
40V92.6Very high91.2Very high24 Ų2463.4 Ų63.415%0.14539%0.393CS..Hα-helixtrans-62-42.2175.4172.70000111G36 A43 I44 A74 M77G36-V40 WeakPolarHBondContact O-CG2 3.27Å; G36-V40 PolarHBondContact O-N 2.85Å; V40-A43 PolarHBondContact O-N 2.84Å; V40-I44 WeakPolarHBondContact O-CB 3.46Å; V40-I44 WeakPolarHBondContact O-CG2 3.32Å; V40-I44 PolarHBondContact O-N 2.91Å; V40-A74 HydrophobicContact CG1-CB 4.32Å; V40-A74 HydrophobicContact CG2-CB 4.2Å; V40-M77 HydrophobicContact CG2-CB 4.44Å; V40-M77 HydrophobicContact CG2-CG 4.19Å
41S90.1Very high91Very high71 Ų7160.1 Ų60.150%0.49738%0.376SS..Hα-helixtrans-61.7-46.5177.5-172.90000111.7G37 N38 D39 A43 I44 A45G37-S41 WeakPolarHBondContact O-CB 3.49Å; G37-S41 PolarHBondContact O-N 3.42Å; N38-S41 WeakPolarHBondContact O-CB 3.21Å; N38-S41 PolarHBondContact O-N 2.99Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.2Å; S41-A43 PolarHBondContact O-N 3.35Å; S41-I44 PolarHBondContact O-N 3.42Å; S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.1Å; S41-A45 VanDerWaalsContact O-N 3.09Å
42N89.7Confident90.7Very high97 Ų9759.9 Ų59.952%0.51937%0.373SS..Hα-helixtrans-64.8-39.8178.5-66.9-24.3000112N38 D39N38-N42 PolarHBondContact O-N 2.95Å; N38-N42 PolarHBondContact O-ND2 3.38Å; N38-N42 PolarHBondContact OD1-ND2 3.47Å; D39-N42 PolarHBondContact O-N 3.21Å
43A91.5Very high90.5Very high57 Ų5759.2 Ų59.247%0.47137%0.366SS..Hα-helixtrans-68.7-38.4-179.900000112.7D39 V40 S41 M77D39-A43 WeakPolarHBondContact O-CB 3.4Å; D39-A43 PolarHBondContact O-N 2.76Å; V40-A43 PolarHBondContact O-N 2.84Å; S41-A43 PolarHBondContact O-N 3.35Å; A43-M77 HydrophobicContact CB-SD 4.3Å
44I93.9Very high90.3Very high11 Ų1159.8 Ų59.86%0.05636%0.364CS..Hα-helixtrans-87-20.7-175.2-152.767.7000113.3V40 S41 L47 V48 L69 Y72V40-I44 WeakPolarHBondContact O-CB 3.46Å; V40-I44 WeakPolarHBondContact O-CG2 3.32Å; V40-I44 PolarHBondContact O-N 2.91Å; S41-I44 PolarHBondContact O-N 3.42Å; I44-L47 HydrophobicContact CD1-CB 4.24Å; I44-L47 HydrophobicContact CD1-CD2 3.71Å; I44-L47 HydrophobicContact CD1-CG 4.5Å; I44-L47 WeakPolarHBondContact O-CB 3.48Å; I44-L47 PolarHBondContact O-N 3.22Å; I44-V48 HydrophobicContact CG1-CG2 4.04Å; I44-V48 HydrophobicContact CG2-CG2 4.02Å; I44-V48 WeakPolarHBondContact O-CG2 3.05Å; I44-V48 PolarHBondContact O-N 3.24Å; I44-L69 VanDerWaalsContact CD1-O 3.23Å; I44-L69 WeakPolarHBondContact CD1-O 3.44Å; I44-L69 HydrophobicContact CG1-CB 4.18Å; I44-L69 WeakPolarHBondContact CG1-O 3.05Å; I44-Y72 HydrophobicContact CD1-CD1 3.99Å
45A90.2Very high90Very high54 Ų5464.1 Ų64.145%0.44637%0.366SS..Hα-helixtrans-50.9-44.2-174.300000114.5S41 L47 V48 G49S41-A45 WeakPolarHBondContact O-CB 3.37Å; S41-A45 PolarHBondContact O-N 3.1Å; S41-A45 VanDerWaalsContact O-N 3.09Å; A45-L47 PolarHBondContact O-N 3.32Å; A45-V48 PolarHBondContact O-N 3.48Å; A45-G49 PolarHBondContact O-N 2.88Å
46P90.8Very high89.7Confident87 Ų8765.4 Ų65.457%0.56537%0.374SS*.Hα-helixtrans-62.6-42.1175.4-22.834.8000113V48 G49 I50P46-V48 VanDerWaalsContact C-N 3.34Å; P46-V48 PolarHBondContact O-N 2.89Å; P46-G49 PolarHBondContact O-N 3.46Å; P46-I50 WeakPolarHBondContact O-CG1 3.49Å; P46-I50 PolarHBondContact O-N 3.11Å
47L91.4Very high89.2Confident69 Ų6967.4 Ų67.436%0.36140%0.395SS..Hα-helixtrans-65.7-39.3178.7-176.961.9000111.5I44 A45 G49 I50 W51 L69 Y72I44-L47 HydrophobicContact CD1-CB 4.24Å; I44-L47 HydrophobicContact CD1-CD2 3.71Å; I44-L47 HydrophobicContact CD1-CG 4.5Å; I44-L47 WeakPolarHBondContact O-CB 3.48Å; I44-L47 PolarHBondContact O-N 3.22Å; A45-L47 PolarHBondContact O-N 3.32Å; L47-G49 VanDerWaalsContact C-N 3.34Å; L47-I50 PolarHBondContact O-N 3.44Å; L47-W51 WeakPolarHBondContact O-CB 3.26Å; L47-W51 PolarHBondContact O-N 2.86Å; L47-L69 HydrophobicContact CB-CD2 4.43Å; L47-L69 HydrophobicContact CD2-CD2 3.87Å; L47-L69 HydrophobicContact CG-CD2 3.71Å; L47-Y72 HydrophobicContact CD2-CD1 4.01Å; L47-Y72 HydrophobicContact CD2-CE1 4.05Å
48V90.7Very high88.5Confident16 Ų1667.4 Ų67.410%0.09739%0.388CS..Hα-helixtrans-61.9-43.5173.9177.30000110.6I44 A45 P46 I50 W51 V52 T65 L69I44-V48 HydrophobicContact CG1-CG2 4.04Å; I44-V48 HydrophobicContact CG2-CG2 4.02Å; I44-V48 WeakPolarHBondContact O-CG2 3.05Å; I44-V48 PolarHBondContact O-N 3.24Å; A45-V48 PolarHBondContact O-N 3.48Å; P46-V48 VanDerWaalsContact C-N 3.34Å; P46-V48 PolarHBondContact O-N 2.89Å; V48-I50 VanDerWaalsContact C-N 3.35Å; V48-I50 PolarHBondContact O-N 2.84Å; V48-W51 PolarHBondContact O-N 3.37Å; V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CG2 3.41Å; V48-V52 PolarHBondContact O-N 3.32Å; V48-T65 HydrophobicContact CB-CG2 4.45Å; V48-T65 HydrophobicContact CG1-CG2 4.09Å; V48-T65 HydrophobicContact CG2-CG2 3.44Å; V48-T65 VanDerWaalsContact CG2-CG2 3.44Å; V48-L69 HydrophobicContact CG2-CD2 4.06Å
49G89.1Confident87.6Confident36 Ų3670.4 Ų70.437%0.37141%0.408SS..Hα-helixtrans-58.6-43.9176.300000113A45 P46 L47 T53A45-G49 PolarHBondContact O-N 2.88Å; P46-G49 PolarHBondContact O-N 3.46Å; L47-G49 VanDerWaalsContact C-N 3.34Å; G49-T53 WeakPolarHBondContact O-CB 3.38Å; G49-T53 PolarHBondContact O-N 3.48Å; G49-T53 VanDerWaalsContact O-N 3.09Å; G49-T53 PolarHBondContact O-OG1 3.29Å
50I90.3Very high86.4Confident116 Ų11672 Ų7260%0.59542%0.421SS*.Hα-helixtrans-63.9-46175.1-65.5166.1000110.7P46 L47 V48 T53 Y54P46-I50 WeakPolarHBondContact O-CG1 3.49Å; P46-I50 PolarHBondContact O-N 3.11Å; L47-I50 PolarHBondContact O-N 3.44Å; V48-I50 VanDerWaalsContact C-N 3.35Å; V48-I50 PolarHBondContact O-N 2.84Å; I50-T53 PolarHBondContact O-N 3.25Å; I50-Y54 WeakPolarHBondContact O-CB 3.13Å; I50-Y54 PolarHBondContact O-N 3.46Å
51W89.4Confident84.9Confident74 Ų7474.7 Ų74.728%0.2845%0.446SS..Hα-helixtrans-62.2-46.1-178.1179-100000112.9L47 V48 Y54 R55 W68 L69L47-W51 WeakPolarHBondContact O-CB 3.26Å; L47-W51 PolarHBondContact O-N 2.86Å; V48-W51 PolarHBondContact O-N 3.37Å; W51-Y54 PolarHBondContact O-N 3.5Å; W51-R55 VanDerWaalsContact CE2-CD 3.46Å; W51-R55 HydrophobicContact CZ2-CG 4.22Å; W51-R55 VanDerWaalsContact NE1-CD 3.29Å; W51-R55 PolarHBondContact O-N 3.31Å; W51-W68 HydrophobicContact CD2-CZ2 4.1Å; W51-W68 AromaticContact CE2-CZ2 3.83Å; W51-W68 HydrophobicContact CE3-CH2 4.34Å; W51-W68 HydrophobicContact CE3-CZ2 4.2Å; W51-W68 HydrophobicContact CH2-CH2 4.42Å; W51-W68 AromaticContact CH2-CZ2 3.81Å; W51-W68 HydrophobicContact CH2-CZ2 3.81Å; W51-W68 AromaticContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ3-CH2 4.27Å; W51-W68 HydrophobicContact CZ3-CZ2 4.06Å; W51-L69 HydrophobicContact CB-CD2 4.29Å; W51-L69 HydrophobicContact CD2-CD1 4.37Å; W51-L69 HydrophobicContact CG-CD1 4.09Å; W51-L69 HydrophobicContact CG-CD2 4.5Å
52V87.2Confident83.7Confident13 Ų1380.2 Ų80.28%0.07946%0.461CS..Hα-helixtrans-63.8-45177.3171.80000110.3V48 Y54 R55 D56V48-V52 HydrophobicContact CG1-CG2 4.19Å; V48-V52 WeakPolarHBondContact O-CG2 3.41Å; V48-V52 PolarHBondContact O-N 3.32Å; V52-Y54 VanDerWaalsContact C-N 3.3Å; V52-Y54 PolarHBondContact O-N 2.96Å; V52-R55 PolarHBondContact O-N 2.96Å; V52-D56 PolarHBondContact O-N 3.23Å
53T88.1Confident82.8Confident63 Ų6381.7 Ų81.739%0.38747%0.465SS..Hα-helixtrans-61.1-40.7177.4-550000111.7G49 I50 G57G49-T53 WeakPolarHBondContact O-CB 3.38Å; G49-T53 PolarHBondContact O-N 3.48Å; G49-T53 VanDerWaalsContact O-N 3.09Å; G49-T53 PolarHBondContact O-OG1 3.29Å; I50-T53 PolarHBondContact O-N 3.25Å; T53-G57 VanDerWaalsContact O-CA 3.31Å; T53-G57 WeakPolarHBondContact O-CA 3.48Å; T53-G57 PolarHBondContact O-N 3.28Å; T53-G57 VanDerWaalsContact O-N 3.12Å
54Y88Confident82.2Confident189 Ų18983.4 Ų83.474%0.74148%0.479SS*.Hα-helixtrans-67-39.2177.7175.4-101.2000112.8I50 W51 V52I50-Y54 WeakPolarHBondContact O-CB 3.13Å; I50-Y54 PolarHBondContact O-N 3.46Å; W51-Y54 PolarHBondContact O-N 3.5Å; V52-Y54 VanDerWaalsContact C-N 3.3Å; V52-Y54 PolarHBondContact O-N 2.96Å
55R85.9Confident81.6Confident158 Ų15885.7 Ų85.760%0.59649%0.493SS*.Hα-helixtrans-79.4-48.9-178.1-80.1-168.265.499.50.6113.8W51 V52W51-R55 VanDerWaalsContact CE2-CD 3.46Å; W51-R55 HydrophobicContact CZ2-CG 4.22Å; W51-R55 VanDerWaalsContact NE1-CD 3.29Å; W51-R55 PolarHBondContact O-N 3.31Å; V52-R55 PolarHBondContact O-N 2.96Å
56D83Confident81.5Confident70 Ų7084.9 Ų84.937%0.37448%0.484SS..Hα-helixtrans-100.6-7.3-167.2-57.7-27000112.1V52 S58V52-D56 PolarHBondContact O-N 3.23Å; D56-S58 PolarHBondContact O-N 2.93Å
57G79.9Confident81.6Confident70 Ų7086.8 Ų86.872%0.72249%0.488SS*.SBendtrans62.310.4-173.800000113.3T53T53-G57 VanDerWaalsContact O-CA 3.31Å; T53-G57 WeakPolarHBondContact O-CA 3.48Å; T53-G57 PolarHBondContact O-N 3.28Å; T53-G57 VanDerWaalsContact O-N 3.12Å
58S75.3Confident81.6Confident50 Ų5089.8 Ų89.835%0.3549%0.494SS..SBendtrans-132.3146.9-177.292.60000110.1D56 S60D56-S58 PolarHBondContact O-N 2.93Å; S58-S60 PolarHBondContact O-N 3.5Å; S58-S60 PolarHBondContact OG-N 2.84Å
59V71.9Confident81.7Confident126 Ų12689.1 Ų89.176%0.76449%0.49SS*.  trans-81.82.7176.5-162.90000111.1A61V59-A61 PolarHBondContact O-N 3.24Å
60S64.6Low81.9Confident62 Ų6291.8 Ų91.843%0.43449%0.494SS..  trans-79.398.2-175.2-1490000109.6S58 K62S58-S60 PolarHBondContact O-N 3.5Å; S58-S60 PolarHBondContact OG-N 2.84Å; S60-K62 PolarHBondContact O-N 2.88Å
61A61.9Low82.1Confident80 Ų8091.2 Ų91.266%0.66149%0.492SS*.  trans-68.752.3173.900000112.4V59 E63V59-A61 PolarHBondContact O-N 3.24Å; A61-E63 VanDerWaalsContact C-N 3.32Å
62K64.1Low82.3Confident186 Ų18694.9 Ų94.981%0.80951%0.506SS*.  trans-76-25174.8-74.6-172.1179.9-178.70111.9S60S60-K62 PolarHBondContact O-N 2.88Å
63E70.9Confident82.7Confident129 Ų12994.6 Ų94.660%0.60351%0.506SS*.SBendtrans-84.8145.8177.6-66.3-159.316700112.1A61A61-E63 VanDerWaalsContact C-N 3.32Å
64A78.8Confident83.1Confident92 Ų9293.2 Ų93.276%0.7650%0.501SS*.PPolyproline II helixtrans-63.7140.2174.800000110.5P66A64-P66 WeakPolarHBondContact O-CD 3.5Å
65T82.8Confident83.4Confident59 Ų5989.9 Ų89.936%0.36250%0.495SS..PPolyproline II helixtrans-54.6124.9175-56.20000110.7V48 I67 M70V48-T65 HydrophobicContact CB-CG2 4.45Å; V48-T65 HydrophobicContact CG1-CG2 4.09Å; V48-T65 HydrophobicContact CG2-CG2 3.44Å; V48-T65 VanDerWaalsContact CG2-CG2 3.44Å; T65-I67 PolarHBondContact O-N 3.44Å; T65-M70 HydrophobicContact CG2-CG 3.83Å; T65-M70 HydrophobicContact CG2-SD 4.43Å
66P88.3Confident83.9Confident38 Ų3884.4 Ų84.425%0.24749%0.488CS..PPolyproline II helixtrans-61.6135179.3-20.128.7000111.9A64 W68 L69 M70A64-P66 WeakPolarHBondContact O-CD 3.5Å; P66-W68 PolarHBondContact O-N 3.35Å; P66-L69 HydrophobicContact CB-CD1 3.73Å; P66-L69 HydrophobicContact CG-CD1 3.65Å; P66-L69 WeakPolarHBondContact O-CB 3.07Å; P66-L69 PolarHBondContact O-N 3.39Å; P66-M70 PolarHBondContact O-N 3.43Å
67I91.2Very high84.4Confident127 Ų12783.5 Ų83.565%0.65148%0.482SS*.Hα-helixtrans-58.5-36.5-175-62.3172.5000111.9T65 L69 M70 L71T65-I67 PolarHBondContact O-N 3.44Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 3.24Å; I67-M70 WeakPolarHBondContact O-CB 3.46Å; I67-M70 PolarHBondContact O-N 3.22Å; I67-M70 VanDerWaalsContact O-N 3.11Å; I67-L71 HydrophobicContact CG2-CD1 4.2Å; I67-L71 HydrophobicContact CG2-CG 4.25Å; I67-L71 WeakPolarHBondContact O-CG 3.39Å; I67-L71 PolarHBondContact O-N 3.44Å
68W92.9Very high85.1Confident132 Ų13284.1 Ų84.150%0.548%0.475SS..Hα-helixtrans-65-32.3-179.872.6-97.4000112.7W51 P66 L71 Y72W51-W68 HydrophobicContact CD2-CZ2 4.1Å; W51-W68 AromaticContact CE2-CZ2 3.83Å; W51-W68 HydrophobicContact CE3-CH2 4.34Å; W51-W68 HydrophobicContact CE3-CZ2 4.2Å; W51-W68 HydrophobicContact CH2-CH2 4.42Å; W51-W68 AromaticContact CH2-CZ2 3.81Å; W51-W68 HydrophobicContact CH2-CZ2 3.81Å; W51-W68 AromaticContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ2-CZ2 3.69Å; W51-W68 HydrophobicContact CZ3-CH2 4.27Å; W51-W68 HydrophobicContact CZ3-CZ2 4.06Å; P66-W68 PolarHBondContact O-N 3.35Å; W68-L71 PolarHBondContact O-N 2.94Å; W68-Y72 WeakPolarHBondContact O-CB 3.31Å; W68-Y72 PolarHBondContact O-N 2.78Å
69L92.9Very high86.1Confident1 Ų186 Ų861%0.00548%0.484CS..Hα-helixtrans-67.4-41.1172.3-84.9110.5000110.6I44 L47 V48 W51 P66 I67 L71 Y72 G73I44-L69 VanDerWaalsContact CD1-O 3.23Å; I44-L69 WeakPolarHBondContact CD1-O 3.44Å; I44-L69 HydrophobicContact CG1-CB 4.18Å; I44-L69 WeakPolarHBondContact CG1-O 3.05Å; L47-L69 HydrophobicContact CB-CD2 4.43Å; L47-L69 HydrophobicContact CD2-CD2 3.87Å; L47-L69 HydrophobicContact CG-CD2 3.71Å; V48-L69 HydrophobicContact CG2-CD2 4.06Å; W51-L69 HydrophobicContact CB-CD2 4.29Å; W51-L69 HydrophobicContact CD2-CD1 4.37Å; W51-L69 HydrophobicContact CG-CD1 4.09Å; W51-L69 HydrophobicContact CG-CD2 4.5Å; P66-L69 HydrophobicContact CB-CD1 3.73Å; P66-L69 HydrophobicContact CG-CD1 3.65Å; P66-L69 WeakPolarHBondContact O-CB 3.07Å; P66-L69 PolarHBondContact O-N 3.39Å; I67-L69 VanDerWaalsContact C-N 3.3Å; I67-L69 PolarHBondContact O-N 3.24Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.91Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 2.96Å; L69-G73 PolarHBondContact O-N 2.85Å
70M91.8Very high87.2Confident92 Ų9281.6 Ų81.645%0.45346%0.464SS..Hα-helixtrans-62.6-41.7175.7-60.7-177.96800111.5T65 P66 I67 Y72 G73 A74T65-M70 HydrophobicContact CG2-CG 3.83Å; T65-M70 HydrophobicContact CG2-SD 4.43Å; P66-M70 PolarHBondContact O-N 3.43Å; I67-M70 WeakPolarHBondContact O-CB 3.46Å; I67-M70 PolarHBondContact O-N 3.22Å; I67-M70 VanDerWaalsContact O-N 3.11Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; M70-G73 PolarHBondContact O-N 3.24Å; M70-A74 WeakPolarHBondContact O-CB 3.37Å; M70-A74 PolarHBondContact O-N 3.05Å
71L94.7Very high88.5Confident104 Ų10484.1 Ų84.155%0.54547%0.467SS..Hα-helixtrans-63.5-40.4174.6-70.3175.9000111.8I67 W68 L69 A74 L75I67-L71 HydrophobicContact CG2-CD1 4.2Å; I67-L71 HydrophobicContact CG2-CG 4.25Å; I67-L71 WeakPolarHBondContact O-CG 3.39Å; I67-L71 PolarHBondContact O-N 3.44Å; W68-L71 PolarHBondContact O-N 2.94Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 2.91Å; L71-A74 PolarHBondContact O-N 3.43Å; L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 VanDerWaalsContact O-CG 3.3Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.02Å
72Y95.1Very high90Very high151 Ų15191.3 Ų91.359%0.59248%0.477SS*.Hα-helixtrans-59.5-48.4174.1176.6-93.9000111.5I44 L47 W68 L69 M70 L75 G76I44-Y72 HydrophobicContact CD1-CD1 3.99Å; L47-Y72 HydrophobicContact CD2-CD1 4.01Å; L47-Y72 HydrophobicContact CD2-CE1 4.05Å; W68-Y72 WeakPolarHBondContact O-CB 3.31Å; W68-Y72 PolarHBondContact O-N 2.78Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 2.96Å; M70-Y72 VanDerWaalsContact C-N 3.35Å; Y72-L75 PolarHBondContact O-N 3.47Å; Y72-G76 PolarHBondContact O-N 2.8Å
73G95.1Very high91.6Very high7 Ų786.1 Ų86.17%0.07246%0.461CS..Hα-helixtrans-60.7-45.2175.700000112.7L69 M70 L75 G76 M77L69-G73 PolarHBondContact O-N 2.85Å; M70-G73 PolarHBondContact O-N 3.24Å; G73-L75 PolarHBondContact O-N 3.2Å; G73-G76 PolarHBondContact O-N 3.35Å; G73-M77 WeakPolarHBondContact O-CB 3.23Å; G73-M77 VanDerWaalsContact O-CG 3.29Å; G73-M77 WeakPolarHBondContact O-CG 3.22Å; G73-M77 PolarHBondContact O-N 3.47Å
74A95.1Very high92.7Very high34 Ų3485.1 Ų85.128%0.28146%0.46SS..Hα-helixtrans-60.9-45.2177.500000112.3V40 M70 L71 M77 C78V40-A74 HydrophobicContact CG1-CB 4.32Å; V40-A74 HydrophobicContact CG2-CB 4.2Å; M70-A74 WeakPolarHBondContact O-CB 3.37Å; M70-A74 PolarHBondContact O-N 3.05Å; L71-A74 PolarHBondContact O-N 3.43Å; A74-M77 PolarHBondContact O-N 2.83Å; A74-C78 PolarHBondContact O-N 2.91Å; A74-C78 PolarHBondContact O-SG 3.39Å
75L96Very high93.3Very high119 Ų11981 Ų8162%0.62343%0.426SS*.Hα-helixtrans-64-44.4176.5-73.2173000111.7L71 Y72 G73 M77 C78 V79L71-L75 WeakPolarHBondContact O-CB 3.44Å; L71-L75 VanDerWaalsContact O-CG 3.3Å; L71-L75 WeakPolarHBondContact O-CG 3.49Å; L71-L75 PolarHBondContact O-N 3.02Å; Y72-L75 PolarHBondContact O-N 3.47Å; G73-L75 PolarHBondContact O-N 3.2Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 3.41Å; L75-C78 PolarHBondContact O-N 2.82Å; L75-V79 WeakPolarHBondContact O-CG2 3.43Å; L75-V79 PolarHBondContact O-N 3.49Å
76G95.8Very high93.9Very high43 Ų4383.4 Ų83.444%0.44343%0.433SS..Hα-helixtrans-58-43.4175.600000112.3Y72 G73 V79 G80Y72-G76 PolarHBondContact O-N 2.8Å; G73-G76 PolarHBondContact O-N 3.35Å; G76-V79 PolarHBondContact O-N 2.96Å; G76-G80 PolarHBondContact O-N 3.05Å
77M93.3Very high94.1Very high52 Ų5285.7 Ų85.726%0.25644%0.443SS..Hα-helixtrans-64.7-44.2175.4-70.8-63.2-8700112.1D39 V40 A43 G73 A74 L75 V79 G80 F81D39-M77 HydrophobicContact CB-CE 3.67Å; V40-M77 HydrophobicContact CG2-CB 4.44Å; V40-M77 HydrophobicContact CG2-CG 4.19Å; A43-M77 HydrophobicContact CB-SD 4.3Å; G73-M77 WeakPolarHBondContact O-CB 3.23Å; G73-M77 VanDerWaalsContact O-CG 3.29Å; G73-M77 WeakPolarHBondContact O-CG 3.22Å; G73-M77 PolarHBondContact O-N 3.47Å; A74-M77 PolarHBondContact O-N 2.83Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 3.41Å; M77-V79 VanDerWaalsContact C-N 3.32Å; M77-V79 PolarHBondContact O-N 3.21Å; M77-G80 PolarHBondContact O-N 2.75Å; M77-F81 HydrophobicContact CB-CD2 4.5Å; M77-F81 HydrophobicContact CB-CE2 4.45Å; M77-F81 HydrophobicContact CE-CE2 4.1Å; M77-F81 HydrophobicContact CE-CZ 4.38Å; M77-F81 WeakPolarHBondContact O-CD2 3.34Å; M77-F81 PolarHBondContact O-N 3.26Å
78C94.9Very high94.1Very high82 Ų8284 Ų8455%0.55444%0.438SS*.Hα-helixtrans-57.6-44.2175.3-72.60000112.2A74 L75 F81 W82A74-C78 PolarHBondContact O-N 2.91Å; A74-C78 PolarHBondContact O-SG 3.39Å; L75-C78 PolarHBondContact O-N 2.82Å; C78-F81 PolarHBondContact O-N 2.8Å; C78-W82 PolarHBondContact O-N 3.47Å
79V96.5Very high94Very high91 Ų9183.7 Ų83.755%0.55245%0.445SS*.Hα-helixtrans-65.6-43.1176.8173.70000110.9L75 G76 M77 F81 W82 T83L75-V79 WeakPolarHBondContact O-CG2 3.43Å; L75-V79 PolarHBondContact O-N 3.49Å; G76-V79 PolarHBondContact O-N 2.96Å; M77-V79 VanDerWaalsContact C-N 3.32Å; M77-V79 PolarHBondContact O-N 3.21Å; V79-F81 PolarHBondContact O-N 2.87Å; V79-W82 PolarHBondContact O-N 2.97Å; V79-T83 HydrophobicContact CG1-CG2 4.44Å; V79-T83 WeakPolarHBondContact O-CB 3.42Å; V79-T83 WeakPolarHBondContact O-CG2 3.5Å; V79-T83 PolarHBondContact O-N 3.23Å; V79-T83 PolarHBondContact O-OG1 2.96Å
80G94.3Very high94Very high33 Ų3388.9 Ų88.934%0.3447%0.469SS..Hα-helixtrans-59.4-43.6174.700000112.6G76 M77 T83 L84 G85G76-G80 PolarHBondContact O-N 3.05Å; M77-G80 PolarHBondContact O-N 2.75Å; G80-T83 PolarHBondContact O-N 3.05Å; G80-T83 PolarHBondContact O-OG1 3.48Å; G80-L84 PolarHBondContact O-N 2.98Å; G80-G85 PolarHBondContact O-N 3.35Å
81F91.8Very high93.9Very high114 Ų11487.2 Ų87.250%0.546%0.464SS..Hα-helixtrans-67.1-40.3176.8-79.9-58.7000112.9M77 C78 V79 T83 G85M77-F81 HydrophobicContact CB-CD2 4.5Å; M77-F81 HydrophobicContact CB-CE2 4.45Å; M77-F81 HydrophobicContact CE-CE2 4.1Å; M77-F81 HydrophobicContact CE-CZ 4.38Å; M77-F81 WeakPolarHBondContact O-CD2 3.34Å; M77-F81 PolarHBondContact O-N 3.26Å; C78-F81 PolarHBondContact O-N 2.8Å; V79-F81 PolarHBondContact O-N 2.87Å; F81-T83 VanDerWaalsContact C-N 3.34Å; F81-G85 WeakPolarHBondContact O-CA 3.29Å; F81-G85 PolarHBondContact O-N 2.85Å
82W94.5Very high93.7Very high231 Ų23184 Ų8488%0.87545%0.449SS*.Hα-helixtrans-61.1-47175.4-166.6-34.5000110.5C78 V79C78-W82 PolarHBondContact O-N 3.47Å; V79-W82 PolarHBondContact O-N 2.97Å
83T96.3Very high93.2Very high77 Ų7778 Ų7847%0.47243%0.432SS..Hα-helixtrans-78.7-42.6-172.452.30000113.8V79 G80 F81V79-T83 HydrophobicContact CG1-CG2 4.44Å; V79-T83 WeakPolarHBondContact O-CB 3.42Å; V79-T83 WeakPolarHBondContact O-CG2 3.5Å; V79-T83 PolarHBondContact O-N 3.23Å; V79-T83 PolarHBondContact O-OG1 2.96Å; G80-T83 PolarHBondContact O-N 3.05Å; G80-T83 PolarHBondContact O-OG1 3.48Å; F81-T83 VanDerWaalsContact C-N 3.34Å
84L94.9Very high92.8Very high109 Ų10984.2 Ų84.257%0.57146%0.46SS*.Hα-helixtrans-123.7-11.9-170-61.9173.1000113.5G80 H86 L87G80-L84 PolarHBondContact O-N 2.98Å; L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 3.29Å; L84-L87 HydrophobicContact CD2-CD1 4.18Å; L84-L87 WeakPolarHBondContact O-CB 3.48Å; L84-L87 PolarHBondContact O-N 3.42Å; L84-L87 VanDerWaalsContact O-N 3.12Å
85G92.2Very high92.4Very high5 Ų583.5 Ų83.55%0.05246%0.456CS..Hα-helixtrans-61.6-31.7-174.900000113.8G80 F81 L87 V88 I89G80-G85 PolarHBondContact O-N 3.35Å; F81-G85 WeakPolarHBondContact O-CA 3.29Å; F81-G85 PolarHBondContact O-N 2.85Å; G85-L87 PolarHBondContact O-N 3.09Å; G85-V88 PolarHBondContact O-N 3.22Å; G85-V88 VanDerWaalsContact O-N 3.09Å; G85-I89 WeakPolarHBondContact O-CG1 3.35Å; G85-I89 PolarHBondContact O-N 3.35Å
86H94.1Very high92.1Very high109 Ų10977.9 Ų77.951%0.50543%0.426SS..Hα-helixtrans-58.1-32.3176.973.1120.1000113.2L84 I89 Q90L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 3.29Å; H86-I89 PolarHBondContact O-N 3.2Å; H86-Q90 WeakPolarHBondContact O-CB 3.37Å; H86-Q90 PolarHBondContact O-N 3.12Å
87L93.2Very high91.8Very high87 Ų8775.9 Ų75.946%0.45541%0.405SS..Hα-helixtrans-66.3-39.7177.5-56.6177.1000111.6L84 G85 T91L84-L87 HydrophobicContact CD2-CD1 4.18Å; L84-L87 WeakPolarHBondContact O-CB 3.48Å; L84-L87 PolarHBondContact O-N 3.42Å; L84-L87 VanDerWaalsContact O-N 3.12Å; G85-L87 PolarHBondContact O-N 3.09Å; L87-T91 WeakPolarHBondContact O-CB 3.43Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 2.84Å
88V90.7Very high91.5Very high92 Ų9278.2 Ų78.256%0.55842%0.416SS*.Hα-helixtrans-72.4-44.7178.5-177.30000110.3G85 Q90 T91 V92G85-V88 PolarHBondContact O-N 3.22Å; G85-V88 VanDerWaalsContact O-N 3.09Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 2.63Å; V88-T91 PolarHBondContact O-N 3.14Å; V88-V92 HydrophobicContact CG1-CG2 4.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.38Å; V88-V92 PolarHBondContact O-N 3.37Å
89I92Very high91.3Very high124 Ų12477.1 Ų77.164%0.63640%0.404SS*.Hα-helixtrans-59.1-43.8177.8-65.6165.8000110.3G85 H86 G93G85-I89 WeakPolarHBondContact O-CG1 3.35Å; G85-I89 PolarHBondContact O-N 3.35Å; H86-I89 PolarHBondContact O-N 3.2Å; I89-G93 VanDerWaalsContact O-CA 3.31Å; I89-G93 WeakPolarHBondContact O-CA 3.46Å; I89-G93 PolarHBondContact O-N 3.13Å
90Q91Very high91Very high110 Ų11073.8 Ų73.851%0.51439%0.385SS..Hα-helixtrans-64.8-44.6176.4-169.8176.123.900111.5H86 V88 V92 E94 G95H86-Q90 WeakPolarHBondContact O-CB 3.37Å; H86-Q90 PolarHBondContact O-N 3.12Å; V88-Q90 VanDerWaalsContact C-N 3.3Å; V88-Q90 PolarHBondContact O-N 2.63Å; Q90-V92 PolarHBondContact O-N 3.38Å; Q90-E94 CarbonylContact O-C 3.58Å; Q90-E94 PolarHBondContact O-N 2.95Å; Q90-G95 PolarHBondContact O-N 3.39Å
91T90.2Very high90.8Very high57 Ų5774.3 Ų74.335%0.3538%0.382SS..Hα-helixtrans-63.1-41.7-179.1-59.40000112.3L87 V88 G95 L96 T152 I156L87-T91 WeakPolarHBondContact O-CB 3.43Å; L87-T91 PolarHBondContact O-N 3.42Å; L87-T91 PolarHBondContact O-OG1 2.84Å; V88-T91 PolarHBondContact O-N 3.14Å; T91-G95 CarbonylContact O-C 3.5Å; T91-G95 WeakPolarHBondContact O-CA 3.44Å; T91-G95 PolarHBondContact O-N 2.6Å; T91-L96 PolarHBondContact O-N 2.91Å; T91-T152 HydrophobicContact CG2-CG2 3.73Å; T91-I156 HydrophobicContact CG2-CD1 4.26Å; T91-I156 HydrophobicContact CG2-CG1 4.42Å
92V90.1Very high90.7Very high37 Ų3770.4 Ų70.422%0.22437%0.367CS..Hα-helixtrans-85.2-46.9-177.9179.90000111.5V88 Q90 I132 V135V88-V92 HydrophobicContact CG1-CG2 4.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.38Å; V88-V92 PolarHBondContact O-N 3.37Å; Q90-V92 PolarHBondContact O-N 3.38Å; V92-I132 HydrophobicContact CG1-CD1 4.05Å; V92-I132 HydrophobicContact CG2-CD1 3.73Å; V92-V135 HydrophobicContact CG1-CG2 4.25Å
93G85.6Confident90.6Very high24 Ų2459.8 Ų59.825%0.24733%0.328CS..Hα-helixtrans-76.6-32.3-171.900000114.7I89I89-G93 VanDerWaalsContact O-CA 3.31Å; I89-G93 WeakPolarHBondContact O-CA 3.46Å; I89-G93 PolarHBondContact O-N 3.13Å
94E86Confident90.5Very high139 Ų13956.2 Ų56.265%0.6531%0.307SS*.THydrogen-bonded Turntrans-123.7-22.9-179.7-64.8-178.1172.300112.8Q90 R149Q90-E94 CarbonylContact O-C 3.58Å; Q90-E94 PolarHBondContact O-N 2.95Å; E94-R149 PolarHBondContact O-NH1 3.25Å; E94-R149 PolarHBondContact O-NH2 3.06Å
95G86.7Confident90.5Very high19 Ų1953.2 Ų53.220%0.19629%0.289CS..THydrogen-bonded Turntrans-98.2-15.5-170.300000115.5Q90 T91 R149 T152Q90-G95 PolarHBondContact O-N 3.39Å; T91-G95 CarbonylContact O-C 3.5Å; T91-G95 WeakPolarHBondContact O-CA 3.44Å; T91-G95 PolarHBondContact O-N 2.6Å; G95-R149 VanDerWaalsContact C-CZ 3.46Å; G95-R149 VanDerWaalsContact C-NE 3.26Å; G95-R149 VanDerWaalsContact CA-NH2 3.34Å; G95-R149 PolarHBondContact O-NE 3.48Å; G95-R149 PolarHBondContact O-NH2 3.37Å; G95-T152 VanDerWaalsContact O-CB 3.31Å; G95-T152 WeakPolarHBondContact O-CB 3.27Å; G95-T152 WeakPolarHBondContact O-CG2 3.39Å; G95-T152 PolarHBondContact O-OG1 2.91Å
96L89.7Confident90.6Very high0 Ų056.1 Ų56.10%031%0.306CS..THydrogen-bonded Turntrans-103.2-50.9175.5-177.957.1000113.2T91 I132 V135 V148 R149 L153 I156T91-L96 PolarHBondContact O-N 2.91Å; L96-I132 HydrophobicContact CD2-CD1 4.38Å; L96-I132 HydrophobicContact CD2-CG2 4.15Å; L96-V135 HydrophobicContact CB-CG1 4.36Å; L96-V135 HydrophobicContact CD2-CB 4.07Å; L96-V135 HydrophobicContact CD2-CG1 3.6Å; L96-V135 HydrophobicContact CG-CG1 3.94Å; L96-V148 HydrophobicContact CD1-CG1 3.91Å; L96-R149 PolarHBondContact O-N 3.27Å; L96-R149 PolarHBondContact O-NH2 3.44Å; L96-L153 HydrophobicContact CD1-CB 3.71Å; L96-L153 HydrophobicContact CD1-CD1 4.16Å; L96-L153 HydrophobicContact CD1-CG 4.46Å; L96-L153 HydrophobicContact CD2-CD1 4.4Å; L96-I156 HydrophobicContact CD2-CD1 4.29Å
97T90.7Very high90.6Very high1 Ų151.3 Ų51.31%0.00628%0.284CS..SBendtrans-147.8159.5170.3-168.10000108.3I99 V135 D146T97-I99 HydrophobicContact CG2-CG1 3.94Å; T97-V135 HydrophobicContact CG2-CG1 3.36Å; T97-D146 PolarHBondContact OG1-O 2.96Å; T97-D146 VanDerWaalsContact OG1-O 3.07Å
98E87.1Confident90.7Very high102 Ų10248.9 Ų48.948%0.47727%0.27SS..  trans-74.8126.3170-170.2-179157.800110.1
99I89.7Confident91Very high58 Ų5848.7 Ų48.730%0.29727%0.265SS..  trans-106.6106.1-177.6-55-173.3000110.3T97 I107T97-I99 HydrophobicContact CG2-CG1 3.94Å; I99-I107 HydrophobicContact CD1-CD1 4.07Å; I99-I107 HydrophobicContact CG1-CD1 4.19Å; I99-I107 HydrophobicContact CG2-CD1 4.35Å
100S89.5Confident91.2Very high22 Ų2244 Ų4415%0.15425%0.247CC..  trans-83.9160.9163.8730000111.2E12 V102 S103 G104 R142E12-S100 PolarHBondContact OE1-OG 3.32Å; S100-V102 VanDerWaalsContact C-N 3.27Å; S100-V102 PolarHBondContact O-N 2.87Å; S100-S103 PolarHBondContact N-OG 2.93Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 PolarHBondContact O-N 2.9Å; S100-S103 PolarHBondContact O-OG 3.39Å; S100-S103 PolarHBondContact OG-N 2.71Å; S100-S103 PolarHBondContact OG-OG 2.84Å; S100-G104 PolarHBondContact O-N 2.92Å; S100-R142 PolarHBondContact OG-NH1 3.09Å
101P90.4Very high91.4Very high43 Ų4338.9 Ų38.928%0.27922%0.224SC..Hα-helixtrans-52.8-40178.4-28.335.6000114.1F20 I21 Q24 G104 F105F20-P101 HydrophobicContact CB-CB 4.38Å; I21-P101 HydrophobicContact CG1-CB 3.89Å; I21-P101 HydrophobicContact CG1-CG 3.68Å; Q24-P101 HydrophobicContact CB-CB 4.35Å; P101-G104 PolarHBondContact O-N 3.5Å; P101-F105 WeakPolarHBondContact O-CB 3.32Å; P101-F105 PolarHBondContact O-N 2.91Å
102V91Very high91.6Very high33 Ų3338.3 Ų38.320%0.222%0.224CC..Hα-helixtrans-63.8-47.9176.2179.10000111.3E12 V16 F20 S100 F105 T106E12-V102 VanDerWaalsContact CD-CG2 3.41Å; E12-V102 HydrophobicContact CG-CG2 4.5Å; E12-V102 WeakPolarHBondContact OE1-CG2 3.26Å; E12-V102 WeakPolarHBondContact OE2-CG2 3.16Å; V16-V102 HydrophobicContact CG1-CG2 4.21Å; F20-V102 HydrophobicContact CB-CB 4.47Å; F20-V102 HydrophobicContact CB-CG2 3.67Å; F20-V102 HydrophobicContact CD1-CB 4.15Å; F20-V102 HydrophobicContact CD1-CG1 4.18Å; F20-V102 HydrophobicContact CD1-CG2 3.99Å; F20-V102 HydrophobicContact CD2-CG2 3.71Å; F20-V102 HydrophobicContact CE1-CG1 4.03Å; F20-V102 HydrophobicContact CE2-CG2 4.27Å; F20-V102 HydrophobicContact CG-CB 4.19Å; F20-V102 HydrophobicContact CG-CG1 4.47Å; F20-V102 HydrophobicContact CG-CG2 3.52Å; F20-V102 HydrophobicContact CZ-CG1 4.21Å; S100-V102 VanDerWaalsContact C-N 3.27Å; S100-V102 PolarHBondContact O-N 2.87Å; V102-F105 PolarHBondContact O-N 3.39Å; V102-T106 PolarHBondContact O-N 2.65Å; V102-T106 PolarHBondContact O-OG1 2.81Å
103S91.5Very high91.9Very high7 Ų739.8 Ų39.85%0.04924%0.236CC..Hα-helixtrans-68.3-37178.557.40000112.3S100 F105 T106 I107 R142S100-S103 PolarHBondContact N-OG 2.93Å; S100-S103 CarbonylContact O-C 3.53Å; S100-S103 PolarHBondContact O-N 2.9Å; S100-S103 PolarHBondContact O-OG 3.39Å; S100-S103 PolarHBondContact OG-N 2.71Å; S100-S103 PolarHBondContact OG-OG 2.84Å; S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3.39Å; S103-T106 WeakPolarHBondContact O-CB 3.41Å; S103-T106 PolarHBondContact O-N 2.79Å; S103-I107 WeakPolarHBondContact O-CB 3.38Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.25Å; S103-I107 PolarHBondContact O-N 3.41Å; S103-R142 PolarHBondContact OG-NH1 3.48Å; S103-R142 VanDerWaalsContact OG-NH1 3.15Å
104G93.4Very high92.4Very high3 Ų341.9 Ų41.93%0.03124%0.243CC..Hα-helixtrans-58.9-44.4174.700000111.3Q24 S100 P101 T106 I107 E108Q24-G104 PolarHBondContact OE1-O 2.83Å; S100-G104 PolarHBondContact O-N 2.92Å; P101-G104 PolarHBondContact O-N 3.5Å; G104-T106 VanDerWaalsContact C-N 3.31Å; G104-T106 PolarHBondContact O-N 3.06Å; G104-I107 WeakPolarHBondContact O-CB 3.24Å; G104-I107 PolarHBondContact O-N 2.86Å; G104-E108 PolarHBondContact O-N 3.48Å
105F94.7Very high92.8Very high45 Ų4536.9 Ų36.920%0.19722%0.222CC..Hα-helixtrans-66.3-41.2179.8177.3-97.4000110.4F20 L23 P101 V102 S103 I107 E108 M109F20-F105 HydrophobicContact CD1-CB 4.02Å; F20-F105 HydrophobicContact CD1-CD1 4.1Å; F20-F105 HydrophobicContact CD1-CG 4.19Å; F20-F105 HydrophobicContact CE1-CB 4.44Å; F20-F105 AromaticContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CD1 3.76Å; F20-F105 HydrophobicContact CE1-CE1 4.42Å; F20-F105 HydrophobicContact CE1-CG 4.32Å; L23-F105 HydrophobicContact CB-CD2 3.77Å; L23-F105 HydrophobicContact CB-CE2 3.88Å; L23-F105 HydrophobicContact CB-CG 4.37Å; P101-F105 WeakPolarHBondContact O-CB 3.32Å; P101-F105 PolarHBondContact O-N 2.91Å; V102-F105 PolarHBondContact O-N 3.39Å; S103-F105 VanDerWaalsContact C-N 3.31Å; S103-F105 PolarHBondContact O-N 3.39Å; F105-I107 VanDerWaalsContact C-N 3.34Å; F105-E108 PolarHBondContact O-N 3.24Å; F105-M109 HydrophobicContact CE1-CE 4.32Å; F105-M109 HydrophobicContact CE2-CE 4.15Å; F105-M109 HydrophobicContact CZ-CE 3.69Å; F105-M109 VanDerWaalsContact O-CB 3.28Å; F105-M109 WeakPolarHBondContact O-CB 3.49Å; F105-M109 PolarHBondContact O-N 3.42Å
106T94.7Very high93.1Very high67 Ų6741.4 Ų41.441%0.41124%0.242SC..Hα-helixtrans-63.1-41175.7-54.80000111.6V102 S103 G104 M109 G110 V138V102-T106 PolarHBondContact O-N 2.65Å; V102-T106 PolarHBondContact O-OG1 2.81Å; S103-T106 WeakPolarHBondContact O-CB 3.41Å; S103-T106 PolarHBondContact O-N 2.79Å; G104-T106 VanDerWaalsContact C-N 3.31Å; G104-T106 PolarHBondContact O-N 3.06Å; T106-M109 PolarHBondContact O-N 3.48Å; T106-G110 PolarHBondContact O-N 3.39Å; T106-V138 HydrophobicContact CG2-CG2 3.9Å
107I95.6Very high93.4Very high8 Ų848.1 Ų48.14%0.04127%0.271CS..Hα-helixtrans-62.4-50.8178.3-74.4162.5000110.1I99 S103 G104 F105 G110 A111 S134 V135 V138I99-I107 HydrophobicContact CD1-CD1 4.07Å; I99-I107 HydrophobicContact CG1-CD1 4.19Å; I99-I107 HydrophobicContact CG2-CD1 4.35Å; S103-I107 WeakPolarHBondContact O-CB 3.38Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.25Å; S103-I107 PolarHBondContact O-N 3.41Å; G104-I107 WeakPolarHBondContact O-CB 3.24Å; G104-I107 PolarHBondContact O-N 2.86Å; F105-I107 VanDerWaalsContact C-N 3.34Å; I107-G110 PolarHBondContact O-N 3.32Å; I107-A111 WeakPolarHBondContact O-CB 3.18Å; I107-A111 PolarHBondContact O-N 3.43Å; I107-S134 VanDerWaalsContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CA-OG 3.44Å; I107-S134 WeakPolarHBondContact O-CB 3.38Å; I107-S134 PolarHBondContact O-OG 2.93Å; I107-V135 HydrophobicContact CD1-CB 4.41Å; I107-V135 HydrophobicContact CD1-CG1 4.45Å; I107-V135 HydrophobicContact CD1-CG2 4.1Å; I107-V135 HydrophobicContact CG1-CG2 4.41Å; I107-V135 HydrophobicContact CG2-CG2 3.54Å; I107-V138 HydrophobicContact CD1-CB 4.39Å; I107-V138 HydrophobicContact CD1-CG1 4.41Å; I107-V138 HydrophobicContact CG1-CB 3.88Å; I107-V138 HydrophobicContact CG1-CG1 4.23Å; I107-V138 HydrophobicContact CG1-CG2 3.75Å
108E94.9Very high93.6Very high35 Ų3548.3 Ų48.316%0.16427%0.272CS..Hα-helixtrans-64-43179.6-73.2-67.9174.300111.2A31 G104 F105 A111 A112 K131A31-E108 HydrophobicContact CB-CG 4.48Å; A31-E108 WeakPolarHBondContact CB-OE2 3.15Å; G104-E108 PolarHBondContact O-N 3.48Å; F105-E108 PolarHBondContact O-N 3.24Å; E108-A111 PolarHBondContact O-N 3.34Å; E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.29Å; E108-A112 PolarHBondContact O-N 2.93Å; E108-K131 IonicContact OE1-NZ 3.25Å; E108-K131 PolarHBondContact OE1-NZ 3.15Å; E108-K131 VanDerWaalsContact OE2-CE 3.24Å; E108-K131 WeakPolarHBondContact OE2-CE 3.39Å; E108-K131 IonicContact OE2-NZ 3.67Å; E108-K131 PolarHBondContact OE2-NZ 3.41Å
109M95.4Very high93.8Very high89 Ų8946.9 Ų46.944%0.43827%0.274SS..Hα-helixtrans-63.3-45.1176.4-169.259.359.300111.8F105 T106 A111 A112 C113F105-M109 HydrophobicContact CE1-CE 4.32Å; F105-M109 HydrophobicContact CE2-CE 4.15Å; F105-M109 HydrophobicContact CZ-CE 3.69Å; F105-M109 VanDerWaalsContact O-CB 3.28Å; F105-M109 WeakPolarHBondContact O-CB 3.49Å; F105-M109 PolarHBondContact O-N 3.42Å; T106-M109 PolarHBondContact O-N 3.48Å; M109-A111 PolarHBondContact O-N 2.93Å; M109-A112 PolarHBondContact O-N 3.39Å; M109-C113 WeakPolarHBondContact O-CB 3.14Å; M109-C113 PolarHBondContact O-N 3.27Å; M109-C113 PolarHBondContact O-SG 3.34Å
110G96.5Very high94Very high25 Ų2553.1 Ų53.126%0.25830%0.299SS..Hα-helixtrans-60-46.8176.900000111.8T106 I107 C113 T114T106-G110 PolarHBondContact O-N 3.39Å; I107-G110 PolarHBondContact O-N 3.32Å; G110-C113 PolarHBondContact O-N 3.37Å; G110-T114 PolarHBondContact O-N 2.92Å; G110-T114 PolarHBondContact O-OG1 3.16Å
111A96.3Very high94.3Very high3 Ų357 Ų573%0.02532%0.317CS..Hα-helixtrans-63-44.7177.100000111.8I107 E108 M109 T114 V115 C130 K131I107-A111 WeakPolarHBondContact O-CB 3.18Å; I107-A111 PolarHBondContact O-N 3.43Å; E108-A111 PolarHBondContact O-N 3.34Å; M109-A111 PolarHBondContact O-N 2.93Å; A111-T114 PolarHBondContact O-N 3.49Å; A111-V115 VanDerWaalsContact O-CG2 3.31Å; A111-V115 WeakPolarHBondContact O-CG2 3.19Å; A111-V115 PolarHBondContact O-N 2.89Å; A111-C130 HydrophobicContact CB-CB 4.32Å; A111-K131 HydrophobicContact CB-CB 4.43Å; A111-K131 HydrophobicContact CB-CG 3.81Å
112A94.9Very high94.3Very high44 Ų4458 Ų5836%0.36434%0.335SS..Hα-helixtrans-61.4-45.2177.100000111.7E108 M109 T114 V115 L116E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.29Å; E108-A112 PolarHBondContact O-N 2.93Å; M109-A112 PolarHBondContact O-N 3.39Å; A112-T114 PolarHBondContact O-N 3.19Å; A112-V115 PolarHBondContact O-N 3.36Å; A112-L116 WeakPolarHBondContact O-CB 3.27Å; A112-L116 VanDerWaalsContact O-CG 3.27Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 3.36Å
113C95.7Very high94.3Very high69 Ų6961.2 Ų61.247%0.46635%0.349SS..Hα-helixtrans-58.9-45.3174.9-74.20000111.8M109 G110 L116 F117M109-C113 WeakPolarHBondContact O-CB 3.14Å; M109-C113 PolarHBondContact O-N 3.27Å; M109-C113 PolarHBondContact O-SG 3.34Å; G110-C113 PolarHBondContact O-N 3.37Å; C113-L116 PolarHBondContact O-N 2.95Å; C113-F117 VanDerWaalsContact O-CB 3.29Å; C113-F117 WeakPolarHBondContact O-CB 3.46Å; C113-F117 PolarHBondContact O-N 2.9Å
114T95.7Very high94.1Very high67 Ų6767.4 Ų67.441%0.41139%0.389SS..Hα-helixtrans-61.7-45176.6-56.40000111.8G110 A111 A112 F117 A118 I125 C130G110-T114 PolarHBondContact O-N 2.92Å; G110-T114 PolarHBondContact O-OG1 3.16Å; A111-T114 PolarHBondContact O-N 3.49Å; A112-T114 PolarHBondContact O-N 3.19Å; T114-F117 PolarHBondContact O-N 3.49Å; T114-A118 WeakPolarHBondContact O-CB 3.45Å; T114-A118 PolarHBondContact O-N 3.28Å; T114-I125 HydrophobicContact CG2-CD1 4.34Å; T114-C130 HydrophobicContact CG2-CB 4.46Å
115V94.1Very high94Very high34 Ų3471 Ų7121%0.20641%0.407CS..Hα-helixtrans-62.6-44.9177.7171.10000111A111 A112 A118 S119 T127 C130A111-V115 VanDerWaalsContact O-CG2 3.31Å; A111-V115 WeakPolarHBondContact O-CG2 3.19Å; A111-V115 PolarHBondContact O-N 2.89Å; A112-V115 PolarHBondContact O-N 3.36Å; V115-A118 PolarHBondContact O-N 3.47Å; V115-S119 VanDerWaalsContact O-CB 3.23Å; V115-S119 WeakPolarHBondContact O-CB 3.49Å; V115-S119 PolarHBondContact O-N 3.4Å; V115-S119 PolarHBondContact O-OG 3.19Å; V115-T127 HydrophobicContact CG1-CG2 4.48Å; V115-T127 HydrophobicContact CG2-CG2 4.14Å; V115-C130 HydrophobicContact CG2-CB 3.82Å
116L93.4Very high93.8Very high115 Ų11571.1 Ų71.160%0.60241%0.414SS*.Hα-helixtrans-64.1-42.8178.7-73.7173.4000111.6A112 C113 S119 K120A112-L116 WeakPolarHBondContact O-CB 3.27Å; A112-L116 VanDerWaalsContact O-CG 3.27Å; A112-L116 WeakPolarHBondContact O-CG 3.41Å; A112-L116 PolarHBondContact O-N 3.36Å; C113-L116 PolarHBondContact O-N 2.95Å; L116-S119 PolarHBondContact O-N 3.34Å; L116-K120 WeakPolarHBondContact O-CB 2.95Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.15Å
117F95.7Very high93.4Very high141 Ų14169.2 Ų69.262%0.61840%0.402SS*.Hα-helixtrans-62.8-48.4177.5-175.1-100.4000111.6C113 T114 S119 K120 L121C113-F117 VanDerWaalsContact O-CB 3.29Å; C113-F117 WeakPolarHBondContact O-CB 3.46Å; C113-F117 PolarHBondContact O-N 2.9Å; T114-F117 PolarHBondContact O-N 3.49Å; F117-S119 VanDerWaalsContact C-N 3.35Å; F117-S119 PolarHBondContact O-N 3.25Å; F117-K120 PolarHBondContact O-N 3.03Å; F117-L121 HydrophobicContact CD1-CD1 3.95Å; F117-L121 HydrophobicContact CE1-CD1 3.43Å; F117-L121 VanDerWaalsContact CE1-CD1 3.43Å; F117-L121 HydrophobicContact CE1-CG 4.49Å; F117-L121 HydrophobicContact CZ-CD1 3.83Å; F117-L121 PolarHBondContact O-N 2.99Å
118A94.9Very high93.2Very high4 Ų471.2 Ų71.23%0.03342%0.415CS..Hα-helixtrans-62.2-41.8175.800000112.2T114 V115 K120 L121 G122 M123 I125T114-A118 WeakPolarHBondContact O-CB 3.45Å; T114-A118 PolarHBondContact O-N 3.28Å; V115-A118 PolarHBondContact O-N 3.47Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.92Å; A118-L121 CarbonylContact O-C 3.01Å; A118-L121 PolarHBondContact O-N 3.49Å; A118-L121 VanDerWaalsContact O-N 3.08Å; A118-G122 PolarHBondContact O-N 3.31Å; A118-G122 VanDerWaalsContact O-N 3.16Å; A118-M123 HydrophobicContact CB-CE 4.49Å; A118-M123 PolarHBondContact O-N 3.39Å; A118-I125 HydrophobicContact CB-CB 4.04Å; A118-I125 HydrophobicContact CB-CD1 4.14Å; A118-I125 HydrophobicContact CB-CG2 3.61Å
119S91.8Very high93.1Very high73 Ų7373.9 Ų73.951%0.5143%0.427SS..Hα-helixtrans-60.2-39.9175.9-61.70000111.9V115 L116 F117 L121 G122V115-S119 VanDerWaalsContact O-CB 3.23Å; V115-S119 WeakPolarHBondContact O-CB 3.49Å; V115-S119 PolarHBondContact O-N 3.4Å; V115-S119 PolarHBondContact O-OG 3.19Å; L116-S119 PolarHBondContact O-N 3.34Å; F117-S119 VanDerWaalsContact C-N 3.35Å; F117-S119 PolarHBondContact O-N 3.25Å; S119-L121 VanDerWaalsContact C-N 3.27Å; S119-L121 PolarHBondContact O-N 3.29Å; S119-G122 PolarHBondContact O-N 3.41Å
120K93.7Very high93.1Very high188 Ų18870.1 Ų70.182%0.81741%0.409SS*.Hα-helixtrans-65.8-30.2175.6-78.5-62.9-166.2-177.50113.1L116 F117 A118L116-K120 WeakPolarHBondContact O-CB 2.95Å; L116-K120 WeakPolarHBondContact O-CG 3.3Å; L116-K120 PolarHBondContact O-N 3.15Å; F117-K120 PolarHBondContact O-N 3.03Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.92Å
121L95.2Very high93Very high103 Ų10370.9 Ų70.954%0.53941%0.405SS..THydrogen-bonded Turntrans-83.30.3173.9-65.1175000112.8F117 A118 S119 M123F117-L121 HydrophobicContact CD1-CD1 3.95Å; F117-L121 HydrophobicContact CE1-CD1 3.43Å; F117-L121 VanDerWaalsContact CE1-CD1 3.43Å; F117-L121 HydrophobicContact CE1-CG 4.49Å; F117-L121 HydrophobicContact CZ-CD1 3.83Å; F117-L121 PolarHBondContact O-N 2.99Å; A118-L121 CarbonylContact O-C 3.01Å; A118-L121 PolarHBondContact O-N 3.49Å; A118-L121 VanDerWaalsContact O-N 3.08Å; S119-L121 VanDerWaalsContact C-N 3.27Å; S119-L121 PolarHBondContact O-N 3.29Å; L121-M123 HydrophobicContact CB-CE 3.84Å; L121-M123 HydrophobicContact CB-CG 4.12Å; L121-M123 HydrophobicContact CD1-CE 3.49Å; L121-M123 VanDerWaalsContact CD1-CE 3.49Å; L121-M123 HydrophobicContact CG-CE 4.31Å; L121-M123 PolarHBondContact O-N 3.49Å
122G91.2Very high92.9Very high64 Ų6471.3 Ų71.366%0.6641%0.407SS*.THydrogen-bonded Turntrans68.116-177.200000113.6A118 S119A118-G122 PolarHBondContact O-N 3.31Å; A118-G122 VanDerWaalsContact O-N 3.16Å; S119-G122 PolarHBondContact O-N 3.41Å
123M90.3Very high93Very high101 Ų10171.2 Ų71.250%0.49841%0.41SS..  trans-86124.9-178.4-67.4-170.3-63.600110.1A118 L121 I125A118-M123 HydrophobicContact CB-CE 4.49Å; A118-M123 PolarHBondContact O-N 3.39Å; L121-M123 HydrophobicContact CB-CE 3.84Å; L121-M123 HydrophobicContact CB-CG 4.12Å; L121-M123 HydrophobicContact CD1-CE 3.49Å; L121-M123 VanDerWaalsContact CD1-CE 3.49Å; L121-M123 HydrophobicContact CG-CE 4.31Å; L121-M123 PolarHBondContact O-N 3.49Å; M123-I125 PolarHBondContact O-N 2.99Å
124P88.2Confident93Very high137 Ų13768.6 Ų68.689%0.8939%0.393SS*.  trans-67.7119171.628.4-32.3000108.8
125I91.3Very high93Very high78 Ų7865.6 Ų65.640%0.437%0.374SS..  trans-129.1145.7177-161.4163.3000110.5T114 A118 M123 C130T114-I125 HydrophobicContact CG2-CD1 4.34Å; A118-I125 HydrophobicContact CB-CB 4.04Å; A118-I125 HydrophobicContact CB-CD1 4.14Å; A118-I125 HydrophobicContact CB-CG2 3.61Å; M123-I125 PolarHBondContact O-N 2.99Å; I125-C130 VanDerWaalsContact CD1-SG 3.5Å
126S89.4Confident93Very high49 Ų4964.3 Ų64.334%0.34337%0.368SS..  trans-80126.3174.5172.30000110.7T128 H129 C130S126-T128 VanDerWaalsContact C-N 3.27Å; S126-T128 PolarHBondContact O-N 3.13Å; S126-T128 PolarHBondContact OG-N 3.34Å; S126-H129 PolarHBondContact O-N 2.97Å; S126-C130 PolarHBondContact O-N 2.92Å; S126-C130 VanDerWaalsContact O-N 3.15Å; S126-C130 PolarHBondContact O-SG 2.88Å; S126-C130 VanDerWaalsContact O-SG 3.34Å
127T88.2Confident93Very high27 Ų2761 Ų6117%0.16636%0.357CS..Hα-helixtrans-62-36.5175.460.30000111.5H35 V115 H129 C130 K131H35-T127 PolarHBondContact CE1-OG1 3.45Å; H35-T127 PolarHBondContact ND1-OG1 3.39Å; H35-T127 VanDerWaalsContact ND1-OG1 3.13Å; V115-T127 HydrophobicContact CG1-CG2 4.48Å; V115-T127 HydrophobicContact CG2-CG2 4.14Å; T127-H129 PolarHBondContact O-N 3.36Å; T127-C130 WeakPolarHBondContact O-CB 3.46Å; T127-C130 PolarHBondContact O-N 3.36Å; T127-K131 WeakPolarHBondContact O-CG 3.15Å; T127-K131 PolarHBondContact O-N 3.48Å
128T90.3Very high92.9Very high50 Ų5055.4 Ų55.431%0.30733%0.334SS..Hα-helixtrans-61.5-44.1177.1-520000111.8S126 K131 I132S126-T128 VanDerWaalsContact C-N 3.27Å; S126-T128 PolarHBondContact O-N 3.13Å; S126-T128 PolarHBondContact OG-N 3.34Å; T128-K131 PolarHBondContact O-N 3.29Å; T128-I132 WeakPolarHBondContact O-CG1 3.33Å; T128-I132 PolarHBondContact O-N 2.86Å
129H93Very high92.8Very high91 Ų9155.2 Ų55.242%0.42133%0.332SS..Hα-helixtrans-65.5-40.9176.4-70.5179.1000111.6S126 T127 K131 G133 W160S126-H129 PolarHBondContact O-N 2.97Å; T127-H129 PolarHBondContact O-N 3.36Å; H129-K131 VanDerWaalsContact C-N 3.34Å; H129-K131 PolarHBondContact O-N 3.46Å; H129-G133 PolarHBondContact O-N 2.84Å; H129-W160 AromaticContact CD2-CD2 3.89Å; H129-W160 AromaticContact CD2-CE2 3.7Å; H129-W160 AromaticContact CD2-CE3 3.82Å; H129-W160 AromaticContact CD2-CH2 3.43Å; H129-W160 VanDerWaalsContact CD2-CH2 3.43Å; H129-W160 WeakPolarHBondContact CD2-CH2 3.42Å; H129-W160 AromaticContact CD2-CZ2 3.48Å; H129-W160 VanDerWaalsContact CD2-CZ2 3.48Å; H129-W160 WeakPolarHBondContact CD2-CZ2 3.42Å; H129-W160 AromaticContact CD2-CZ3 3.61Å; H129-W160 AromaticContact NE2-CD2 3.38Å; H129-W160 AromaticContact NE2-CE2 3.62Å; H129-W160 AromaticContact NE2-CE3 3.42Å; H129-W160 AromaticContact NE2-CG 3.94Å; H129-W160 AromaticContact NE2-CH2 3.95Å; H129-W160 AromaticContact NE2-CZ2 3.9Å; H129-W160 AromaticContact NE2-CZ3 3.72Å
130C94.9Very high92.7Very high9 Ų957 Ų576%0.06133%0.334CS..Hα-helixtrans-59.9-44.3174.4-64.90000111.7A111 T114 V115 I125 S126 T127 S134A111-C130 HydrophobicContact CB-CB 4.32Å; T114-C130 HydrophobicContact CG2-CB 4.46Å; V115-C130 HydrophobicContact CG2-CB 3.82Å; I125-C130 VanDerWaalsContact CD1-SG 3.5Å; S126-C130 PolarHBondContact O-N 2.92Å; S126-C130 VanDerWaalsContact O-N 3.15Å; S126-C130 PolarHBondContact O-SG 2.88Å; S126-C130 VanDerWaalsContact O-SG 3.34Å; T127-C130 WeakPolarHBondContact O-CB 3.46Å; T127-C130 PolarHBondContact O-N 3.36Å; C130-S134 VanDerWaalsContact O-CB 3.26Å; C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.38Å
131K94.1Very high92.5Very high41 Ų4154.4 Ų54.418%0.17833%0.334CS..Hα-helixtrans-63.4-53.4177-73.4-164.8179.7-1550111.9E108 A111 T127 T128 H129 G133 S134 V135E108-K131 IonicContact OE1-NZ 3.25Å; E108-K131 PolarHBondContact OE1-NZ 3.15Å; E108-K131 VanDerWaalsContact OE2-CE 3.24Å; E108-K131 WeakPolarHBondContact OE2-CE 3.39Å; E108-K131 IonicContact OE2-NZ 3.67Å; E108-K131 PolarHBondContact OE2-NZ 3.41Å; A111-K131 HydrophobicContact CB-CB 4.43Å; A111-K131 HydrophobicContact CB-CG 3.81Å; T127-K131 WeakPolarHBondContact O-CG 3.15Å; T127-K131 PolarHBondContact O-N 3.48Å; T128-K131 PolarHBondContact O-N 3.29Å; H129-K131 VanDerWaalsContact C-N 3.34Å; H129-K131 PolarHBondContact O-N 3.46Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 2.87Å; K131-S134 WeakPolarHBondContact O-CB 3.31Å; K131-S134 PolarHBondContact O-N 3.34Å; K131-S134 VanDerWaalsContact O-N 3.13Å; K131-V135 VanDerWaalsContact O-CG2 3.26Å; K131-V135 WeakPolarHBondContact O-CG2 3.01Å; K131-V135 PolarHBondContact O-N 2.82Å
132I95.6Very high91.8Very high13 Ų1352.8 Ų52.87%0.06732%0.32CS..Hα-helixtrans-61.6-39.6179.7-64.6-63.6000111.7V92 L96 T128 V135 A136 L153 I156 W160V92-I132 HydrophobicContact CG1-CD1 4.05Å; V92-I132 HydrophobicContact CG2-CD1 3.73Å; L96-I132 HydrophobicContact CD2-CD1 4.38Å; L96-I132 HydrophobicContact CD2-CG2 4.15Å; T128-I132 WeakPolarHBondContact O-CG1 3.33Å; T128-I132 PolarHBondContact O-N 2.86Å; I132-V135 PolarHBondContact O-N 3.18Å; I132-A136 WeakPolarHBondContact O-CB 3.46Å; I132-A136 PolarHBondContact O-N 3.07Å; I132-L153 HydrophobicContact CG2-CD1 3.76Å; I132-I156 HydrophobicContact CG2-CG2 4.47Å; I132-W160 HydrophobicContact CB-CH2 4Å; I132-W160 HydrophobicContact CB-CZ2 4.29Å; I132-W160 HydrophobicContact CG1-CH2 4.26Å; I132-W160 HydrophobicContact CG1-CZ2 4.02Å; I132-W160 HydrophobicContact CG2-CH2 3.84Å; I132-W160 HydrophobicContact CG2-CZ2 4.35Å
133G95.7Very high90.6Very high41 Ų4152 Ų5242%0.42331%0.305SS..Hα-helixtrans-62.3-41.917400000112.5H129 K131 A136 A137H129-G133 PolarHBondContact O-N 2.84Å; K131-G133 VanDerWaalsContact C-N 3.31Å; K131-G133 PolarHBondContact O-N 2.87Å; G133-A136 PolarHBondContact O-N 2.98Å; G133-A137 WeakPolarHBondContact O-CB 3.44Å; G133-A137 PolarHBondContact O-N 3.4Å
134S96Very high89.3Confident14 Ų1458 Ų5810%0.09832%0.322CS..Hα-helixtrans-65.2-42.8175.3-169.30000112.1I107 C130 K131 A136 A137 V138I107-S134 VanDerWaalsContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CA-OG 3.44Å; I107-S134 WeakPolarHBondContact O-CB 3.38Å; I107-S134 PolarHBondContact O-OG 2.93Å; C130-S134 VanDerWaalsContact O-CB 3.26Å; C130-S134 WeakPolarHBondContact O-CB 3.49Å; C130-S134 PolarHBondContact O-N 3.38Å; K131-S134 WeakPolarHBondContact O-CB 3.31Å; K131-S134 PolarHBondContact O-N 3.34Å; K131-S134 VanDerWaalsContact O-N 3.13Å; S134-A136 VanDerWaalsContact C-N 3.33Å; S134-A136 PolarHBondContact O-N 2.92Å; S134-A137 PolarHBondContact O-N 2.89Å; S134-V138 WeakPolarHBondContact O-CG2 3.32Å; S134-V138 PolarHBondContact O-N 3.29Å
135V95Very high88.2Confident4 Ų456.8 Ų56.82%0.02432%0.316CS..Hα-helixtrans-56.7-48.2172.8178.80000110.5V92 L96 T97 I107 K131 I132 G139V92-V135 HydrophobicContact CG1-CG2 4.25Å; L96-V135 HydrophobicContact CB-CG1 4.36Å; L96-V135 HydrophobicContact CD2-CB 4.07Å; L96-V135 HydrophobicContact CD2-CG1 3.6Å; L96-V135 HydrophobicContact CG-CG1 3.94Å; T97-V135 HydrophobicContact CG2-CG1 3.36Å; I107-V135 HydrophobicContact CD1-CB 4.41Å; I107-V135 HydrophobicContact CD1-CG1 4.45Å; I107-V135 HydrophobicContact CD1-CG2 4.1Å; I107-V135 HydrophobicContact CG1-CG2 4.41Å; I107-V135 HydrophobicContact CG2-CG2 3.54Å; K131-V135 VanDerWaalsContact O-CG2 3.26Å; K131-V135 WeakPolarHBondContact O-CG2 3.01Å; K131-V135 PolarHBondContact O-N 2.82Å; I132-V135 PolarHBondContact O-N 3.18Å; V135-G139 PolarHBondContact O-N 2.95Å
136A94.6Very high87.1Confident8 Ų855.2 Ų55.27%0.06631%0.309CS..Hα-helixtrans-64.1-42.6177.700000111.9I132 G133 S134 G139 M140 V148 L153I132-A136 WeakPolarHBondContact O-CB 3.46Å; I132-A136 PolarHBondContact O-N 3.07Å; G133-A136 PolarHBondContact O-N 2.98Å; S134-A136 VanDerWaalsContact C-N 3.33Å; S134-A136 PolarHBondContact O-N 2.92Å; A136-G139 PolarHBondContact O-N 3.46Å; A136-M140 VanDerWaalsContact O-CG 3.32Å; A136-M140 WeakPolarHBondContact O-CG 3.42Å; A136-M140 PolarHBondContact O-N 3.11Å; A136-V148 HydrophobicContact CB-CG1 4.47Å; A136-V148 HydrophobicContact CB-CG2 4.28Å; A136-V148 WeakPolarHBondContact O-CG2 3.4Å; A136-L153 HydrophobicContact CB-CD2 4.23Å
137A94.5Very high86.9Confident45 Ų4553.6 Ų53.637%0.37230%0.3SS..Hα-helixtrans-60.7-48.1177.800000112.2G133 S134 G139 M140 V141G133-A137 WeakPolarHBondContact O-CB 3.44Å; G133-A137 PolarHBondContact O-N 3.4Å; S134-A137 PolarHBondContact O-N 2.89Å; A137-G139 PolarHBondContact O-N 3.39Å; A137-M140 HydrophobicContact CB-CE 4.46Å; A137-M140 PolarHBondContact O-N 3.25Å; A137-V141 PolarHBondContact O-N 2.86Å
138V93.4Very high87.1Confident23 Ų2352.9 Ų52.914%0.13930%0.296CS..Hα-helixtrans-63.5-42.4176.5172.40000110.9T106 I107 S134 M140 V141 R142T106-V138 HydrophobicContact CG2-CG2 3.9Å; I107-V138 HydrophobicContact CD1-CB 4.39Å; I107-V138 HydrophobicContact CD1-CG1 4.41Å; I107-V138 HydrophobicContact CG1-CB 3.88Å; I107-V138 HydrophobicContact CG1-CG1 4.23Å; I107-V138 HydrophobicContact CG1-CG2 3.75Å; S134-V138 WeakPolarHBondContact O-CG2 3.32Å; S134-V138 PolarHBondContact O-N 3.29Å; V138-M140 VanDerWaalsContact C-N 3.31Å; V138-M140 PolarHBondContact O-N 2.99Å; V138-V141 PolarHBondContact O-N 2.69Å; V138-R142 WeakPolarHBondContact O-CG 3.38Å; V138-R142 PolarHBondContact O-N 3.48Å
139G91.5Very high87.2Confident0 Ų055.3 Ų55.30%030%0.299CS..Hα-helixtrans-61.6-34.9175.300000113.4V135 A136 A137 V141 R142 G147V135-G139 PolarHBondContact O-N 2.95Å; A136-G139 PolarHBondContact O-N 3.46Å; A137-G139 PolarHBondContact O-N 3.39Å; G139-V141 PolarHBondContact O-N 2.97Å; G139-R142 PolarHBondContact O-N 2.92Å; G139-G147 WeakPolarHBondContact O-CA 3.45Å
140M91.1Very high87.1Confident112 Ų11258.4 Ų58.455%0.55231%0.307SS*.Hα-helixtrans-69.3-32178.2-76.9-173-67.300113.1A136 A137 V138 V148 W150A136-M140 VanDerWaalsContact O-CG 3.32Å; A136-M140 WeakPolarHBondContact O-CG 3.42Å; A136-M140 PolarHBondContact O-N 3.11Å; A137-M140 HydrophobicContact CB-CE 4.46Å; A137-M140 PolarHBondContact O-N 3.25Å; V138-M140 VanDerWaalsContact C-N 3.31Å; V138-M140 PolarHBondContact O-N 2.99Å; M140-V148 HydrophobicContact CG-CG2 3.79Å; M140-W150 HydrophobicContact CG-CH2 4.14Å; M140-W150 HydrophobicContact CG-CZ2 4Å; M140-W150 HydrophobicContact SD-CH2 3.69Å; M140-W150 HydrophobicContact SD-CZ2 4.03Å
141V88.7Confident87.1Confident133 Ų13363.3 Ų63.381%0.80633%0.332SS*.Hα-helixtrans-80.5-21.8178.7178.20000111.5A137 V138 G139A137-V141 PolarHBondContact O-N 2.86Å; V138-V141 PolarHBondContact O-N 2.69Å; G139-V141 PolarHBondContact O-N 2.97Å
142R81Confident87.1Confident69 Ų6962.8 Ų62.826%0.2633%0.332SS..SBendtrans-75.5162.7176.6-72.7179.969.7130.75.4112.2S100 S103 V138 G139 D146S100-R142 PolarHBondContact OG-NH1 3.09Å; S103-R142 PolarHBondContact OG-NH1 3.48Å; S103-R142 VanDerWaalsContact OG-NH1 3.15Å; V138-R142 WeakPolarHBondContact O-CG 3.38Å; V138-R142 PolarHBondContact O-N 3.48Å; G139-R142 PolarHBondContact O-N 2.92Å; R142-D146 IonicContact NH2-OD2 3.7Å; R142-D146 PolarHBondContact NH2-OD2 3.3Å
143S65.2Low87.1Confident47 Ų4763.5 Ų63.533%0.32934%0.336SS..  trans-57.4151-179-173.70000112.1S145 D146 G147S143-S145 PolarHBondContact O-N 3.4Å; S143-D146 CarbonylContact O-C 3.44Å; S143-D146 PolarHBondContact O-N 3.03Å; S143-G147 PolarHBondContact O-N 3.49Å; S143-G147 VanDerWaalsContact O-N 3.1Å
144R64.1Low87.1Confident227 Ų22768.4 Ų68.486%0.85734%0.342SS*.G310 helixtrans-55.3-27.2-172.1-173.5168.7171.5126.3-4114.5
145S64.5Low87.1Confident111 Ų11171.8 Ų71.878%0.77636%0.359SS*.G310 helixtrans-72.6-32.1176.3-164.80000113S143S143-S145 PolarHBondContact O-N 3.4Å
146D68.8Low87Confident45 Ų4572.6 Ų72.624%0.24136%0.363CS..G310 helixtrans-107.418-178.3-52.8-7.7000110.8T97 R142 S143T97-D146 PolarHBondContact OG1-O 2.96Å; T97-D146 VanDerWaalsContact OG1-O 3.07Å; R142-D146 IonicContact NH2-OD2 3.7Å; R142-D146 PolarHBondContact NH2-OD2 3.3Å; S143-D146 CarbonylContact O-C 3.44Å; S143-D146 PolarHBondContact O-N 3.03Å
147G84.5Confident87.1Confident16 Ų1675.1 Ų75.117%0.16538%0.377CS..SBendtrans-71.1179-176.300000112.7G139 S143 R149G139-G147 WeakPolarHBondContact O-CA 3.45Å; S143-G147 PolarHBondContact O-N 3.49Å; S143-G147 VanDerWaalsContact O-N 3.1Å; G147-R149 PolarHBondContact O-N 3.37Å
148V91.8Very high87.1Confident12 Ų1276.8 Ų76.87%0.07338%0.379CS..  trans-65.3126.5175.7-175.90000111L96 A136 M140 W150 L153L96-V148 HydrophobicContact CD1-CG1 3.91Å; A136-V148 HydrophobicContact CB-CG1 4.47Å; A136-V148 HydrophobicContact CB-CG2 4.28Å; A136-V148 WeakPolarHBondContact O-CG2 3.4Å; M140-V148 HydrophobicContact CG-CG2 3.79Å; V148-W150 HydrophobicContact CB-CZ2 4.3Å; V148-W150 HydrophobicContact CG1-CD2 4.27Å; V148-W150 HydrophobicContact CG1-CE3 4.35Å; V148-W150 VanDerWaalsContact O-CD1 3.29Å; V148-W150 PolarHBondContact O-N 2.88Å; V148-W150 VanDerWaalsContact O-N 3.11Å; V148-L153 HydrophobicContact CG1-CB 4.39Å; V148-L153 HydrophobicContact CG1-CD2 4.13Å
149R92.6Very high87.1Confident101 Ų10178.3 Ų78.338%0.38139%0.391SS..  trans-77.893166.3-75.3180-66.5-93.7-19.3110.2E94 G95 L96 G147 I151 T152 L153E94-R149 PolarHBondContact O-NH1 3.25Å; E94-R149 PolarHBondContact O-NH2 3.06Å; G95-R149 VanDerWaalsContact C-CZ 3.46Å; G95-R149 VanDerWaalsContact C-NE 3.26Å; G95-R149 VanDerWaalsContact CA-NH2 3.34Å; G95-R149 PolarHBondContact O-NE 3.48Å; G95-R149 PolarHBondContact O-NH2 3.37Å; L96-R149 PolarHBondContact O-N 3.27Å; L96-R149 PolarHBondContact O-NH2 3.44Å; G147-R149 PolarHBondContact O-N 3.37Å; R149-I151 VanDerWaalsContact C-N 3.25Å; R149-I151 PolarHBondContact O-N 3.19Å; R149-T152 WeakPolarHBondContact O-CB 3.29Å; R149-T152 PolarHBondContact O-N 3.25Å; R149-L153 PolarHBondContact O-N 3.11Å
150W92.5Very high87.2Confident155 Ų15581.9 Ų81.959%0.58740%0.404SS*.Hα-helixtrans-58.6-31.1-176.8-64.5103.8000114.5M140 V148 L153 R154M140-W150 HydrophobicContact CG-CH2 4.14Å; M140-W150 HydrophobicContact CG-CZ2 4Å; M140-W150 HydrophobicContact SD-CH2 3.69Å; M140-W150 HydrophobicContact SD-CZ2 4.03Å; V148-W150 HydrophobicContact CB-CZ2 4.3Å; V148-W150 HydrophobicContact CG1-CD2 4.27Å; V148-W150 HydrophobicContact CG1-CE3 4.35Å; V148-W150 VanDerWaalsContact O-CD1 3.29Å; V148-W150 PolarHBondContact O-N 2.88Å; V148-W150 VanDerWaalsContact O-N 3.11Å; W150-L153 HydrophobicContact CE3-CD2 3.8Å; W150-L153 HydrophobicContact CZ3-CD2 3.68Å; W150-L153 PolarHBondContact O-N 3.46Å; W150-R154 WeakPolarHBondContact O-CB 3.4Å; W150-R154 PolarHBondContact O-N 3.16Å
151I94.3Very high87.3Confident113 Ų11382.2 Ų82.258%0.57941%0.407SS*.Hα-helixtrans-65.3-45.4175.5-65.4167.6000110.1R149 R154 N155R149-I151 VanDerWaalsContact C-N 3.25Å; R149-I151 PolarHBondContact O-N 3.19Å; I151-R154 PolarHBondContact O-N 3.22Å; I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-OD1 3.43Å
152T93.2Very high87.5Confident30 Ų3079.5 Ų79.518%0.18439%0.391CS..Hα-helixtrans-62.7-47.3175.8-47.40000110.7T91 G95 R149 R154 N155 I156T91-T152 HydrophobicContact CG2-CG2 3.73Å; G95-T152 VanDerWaalsContact O-CB 3.31Å; G95-T152 WeakPolarHBondContact O-CB 3.27Å; G95-T152 WeakPolarHBondContact O-CG2 3.39Å; G95-T152 PolarHBondContact O-OG1 2.91Å; R149-T152 WeakPolarHBondContact O-CB 3.29Å; R149-T152 PolarHBondContact O-N 3.25Å; T152-R154 VanDerWaalsContact C-N 3.3Å; T152-R154 PolarHBondContact O-N 3.08Å; T152-N155 PolarHBondContact O-N 3.21Å; T152-N155 VanDerWaalsContact O-N 3.11Å; T152-I156 HydrophobicContact CG2-CD1 4.22Å; T152-I156 WeakPolarHBondContact O-CG1 3.46Å; T152-I156 PolarHBondContact O-N 3.36Å
153L95.4Very high87.9Confident27 Ų2780.3 Ų80.314%0.14140%0.404CS..Hα-helixtrans-57.6-45.6177.6-174.460.7000111.5L96 I132 A136 V148 R149 W150 N155 I156 V157L96-L153 HydrophobicContact CD1-CB 3.71Å; L96-L153 HydrophobicContact CD1-CD1 4.16Å; L96-L153 HydrophobicContact CD1-CG 4.46Å; L96-L153 HydrophobicContact CD2-CD1 4.4Å; I132-L153 HydrophobicContact CG2-CD1 3.76Å; A136-L153 HydrophobicContact CB-CD2 4.23Å; V148-L153 HydrophobicContact CG1-CB 4.39Å; V148-L153 HydrophobicContact CG1-CD2 4.13Å; R149-L153 PolarHBondContact O-N 3.11Å; W150-L153 HydrophobicContact CE3-CD2 3.8Å; W150-L153 HydrophobicContact CZ3-CD2 3.68Å; W150-L153 PolarHBondContact O-N 3.46Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 2.91Å; L153-I156 WeakPolarHBondContact O-CB 3.23Å; L153-I156 PolarHBondContact O-N 3.4Å; L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 2.84Å
154R95.9Very high89Confident144 Ų14483.3 Ų83.354%0.54342%0.42SS..Hα-helixtrans-59.2-44176.1-178.1-170.766.6-175.80.7111.3W150 I151 T152 I156 V157 I158W150-R154 WeakPolarHBondContact O-CB 3.4Å; W150-R154 PolarHBondContact O-N 3.16Å; I151-R154 PolarHBondContact O-N 3.22Å; T152-R154 VanDerWaalsContact C-N 3.3Å; T152-R154 PolarHBondContact O-N 3.08Å; R154-I156 VanDerWaalsContact C-N 3.31Å; R154-I156 PolarHBondContact O-N 2.99Å; R154-V157 PolarHBondContact O-N 3.46Å; R154-I158 HydrophobicContact CG-CD1 3.81Å; R154-I158 HydrophobicContact CG-CG1 4.38Å; R154-I158 WeakPolarHBondContact O-CB 3.44Å; R154-I158 VanDerWaalsContact O-CG1 3.27Å; R154-I158 WeakPolarHBondContact O-CG1 3.49Å; R154-I158 PolarHBondContact O-N 3.18Å
155N95.8Very high90.2Very high85 Ų8575.6 Ų75.646%0.45540%0.399SS..Hα-helixtrans-64.3-37.2178.8-67.1-6.1000111.8I151 T152 L153 I158 S159I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-OD1 3.43Å; T152-N155 PolarHBondContact O-N 3.21Å; T152-N155 VanDerWaalsContact O-N 3.11Å; L153-N155 VanDerWaalsContact C-N 3.32Å; L153-N155 PolarHBondContact O-N 2.91Å; N155-I158 PolarHBondContact O-N 2.89Å; N155-S159 WeakPolarHBondContact O-CB 3.38Å; N155-S159 PolarHBondContact O-N 3.37Å
156I94.4Very high91.4Very high21 Ų2175.6 Ų75.611%0.10839%0.394CS..Hα-helixtrans-62-48.9172.9-65.8164.8000110T91 L96 I132 T152 L153 R154 I158 S159 W160T91-I156 HydrophobicContact CG2-CD1 4.26Å; T91-I156 HydrophobicContact CG2-CG1 4.42Å; L96-I156 HydrophobicContact CD2-CD1 4.29Å; I132-I156 HydrophobicContact CG2-CG2 4.47Å; T152-I156 HydrophobicContact CG2-CD1 4.22Å; T152-I156 WeakPolarHBondContact O-CG1 3.46Å; T152-I156 PolarHBondContact O-N 3.36Å; L153-I156 WeakPolarHBondContact O-CB 3.23Å; L153-I156 PolarHBondContact O-N 3.4Å; R154-I156 VanDerWaalsContact C-N 3.31Å; R154-I156 PolarHBondContact O-N 2.99Å; I156-I158 VanDerWaalsContact C-N 3.35Å; I156-I158 PolarHBondContact O-N 3.24Å; I156-S159 WeakPolarHBondContact O-CB 3.23Å; I156-S159 PolarHBondContact O-N 3.49Å; I156-S159 VanDerWaalsContact O-N 3.09Å; I156-S159 PolarHBondContact O-OG 3.41Å; I156-W160 HydrophobicContact CG2-CD2 4.24Å; I156-W160 HydrophobicContact CG2-CH2 3.79Å; I156-W160 HydrophobicContact CG2-CZ2 3.32Å; I156-W160 HydrophobicContact CG2-CZ3 4.4Å; I156-W160 PolarHBondContact O-N 3.29Å; I156-W160 VanDerWaalsContact O-N 3.14Å
157V95.4Very high92Very high61 Ų6177.2 Ų77.237%0.3741%0.414SS..Hα-helixtrans-61.3-43.4178.4173.70000111.6L153 R154 S159 W160 L161L153-V157 WeakPolarHBondContact O-CG2 3.46Å; L153-V157 PolarHBondContact O-N 2.84Å; R154-V157 PolarHBondContact O-N 3.46Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.37Å; V157-W160 HydrophobicContact CB-CE3 4.44Å; V157-W160 HydrophobicContact CG2-CE3 4.16Å; V157-W160 HydrophobicContact CG2-CZ3 3.95Å; V157-W160 PolarHBondContact O-N 3.06Å; V157-L161 HydrophobicContact CG1-CD1 4.41Å; V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.06Å; V157-L161 VanDerWaalsContact O-N 3.12Å
158I95.9Very high91.6Very high80 Ų8079 Ų7941%0.4143%0.433SS..Hα-helixtrans-60.6-40.9175-69.5168.6000110.3R154 N155 I156 W160 L161 V162R154-I158 HydrophobicContact CG-CD1 3.81Å; R154-I158 HydrophobicContact CG-CG1 4.38Å; R154-I158 WeakPolarHBondContact O-CB 3.44Å; R154-I158 VanDerWaalsContact O-CG1 3.27Å; R154-I158 WeakPolarHBondContact O-CG1 3.49Å; R154-I158 PolarHBondContact O-N 3.18Å; N155-I158 PolarHBondContact O-N 2.89Å; I156-I158 VanDerWaalsContact C-N 3.35Å; I156-I158 PolarHBondContact O-N 3.24Å; I158-W160 VanDerWaalsContact C-N 3.29Å; I158-W160 PolarHBondContact O-N 2.98Å; I158-L161 PolarHBondContact O-N 2.9Å; I158-V162 HydrophobicContact CG2-CG2 3.9Å; I158-V162 WeakPolarHBondContact O-CB 3.49Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.35Å; I158-V162 PolarHBondContact O-N 3.42Å
159S93.3Very high89.8Confident55 Ų5586.4 Ų86.439%0.38547%0.466SS..Hα-helixtrans-60.1-39.1177.975.70000112.1N155 I156 V157 T163N155-S159 WeakPolarHBondContact O-CB 3.38Å; N155-S159 PolarHBondContact O-N 3.37Å; I156-S159 WeakPolarHBondContact O-CB 3.23Å; I156-S159 PolarHBondContact O-N 3.49Å; I156-S159 VanDerWaalsContact O-N 3.09Å; I156-S159 PolarHBondContact O-OG 3.41Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 3.37Å; S159-T163 WeakPolarHBondContact O-CB 3.35Å; S159-T163 PolarHBondContact O-N 2.74Å; S159-T163 PolarHBondContact O-OG1 3.09Å
160W92Very high87.6Confident75 Ų7596.2 Ų96.228%0.28450%0.504SS..Hα-helixtrans-65.6-44.4175.9-59.5-30.1000112H129 I132 I156 V157 I158 T163H129-W160 AromaticContact CD2-CD2 3.89Å; H129-W160 AromaticContact CD2-CE2 3.7Å; H129-W160 AromaticContact CD2-CE3 3.82Å; H129-W160 AromaticContact CD2-CH2 3.43Å; H129-W160 VanDerWaalsContact CD2-CH2 3.43Å; H129-W160 WeakPolarHBondContact CD2-CH2 3.42Å; H129-W160 AromaticContact CD2-CZ2 3.48Å; H129-W160 VanDerWaalsContact CD2-CZ2 3.48Å; H129-W160 WeakPolarHBondContact CD2-CZ2 3.42Å; H129-W160 AromaticContact CD2-CZ3 3.61Å; H129-W160 AromaticContact NE2-CD2 3.38Å; H129-W160 AromaticContact NE2-CE2 3.62Å; H129-W160 AromaticContact NE2-CE3 3.42Å; H129-W160 AromaticContact NE2-CG 3.94Å; H129-W160 AromaticContact NE2-CH2 3.95Å; H129-W160 AromaticContact NE2-CZ2 3.9Å; H129-W160 AromaticContact NE2-CZ3 3.72Å; I132-W160 HydrophobicContact CB-CH2 4Å; I132-W160 HydrophobicContact CB-CZ2 4.29Å; I132-W160 HydrophobicContact CG1-CH2 4.26Å; I132-W160 HydrophobicContact CG1-CZ2 4.02Å; I132-W160 HydrophobicContact CG2-CH2 3.84Å; I132-W160 HydrophobicContact CG2-CZ2 4.35Å; I156-W160 HydrophobicContact CG2-CD2 4.24Å; I156-W160 HydrophobicContact CG2-CH2 3.79Å; I156-W160 HydrophobicContact CG2-CZ2 3.32Å; I156-W160 HydrophobicContact CG2-CZ3 4.4Å; I156-W160 PolarHBondContact O-N 3.29Å; I156-W160 VanDerWaalsContact O-N 3.14Å; V157-W160 HydrophobicContact CB-CE3 4.44Å; V157-W160 HydrophobicContact CG2-CE3 4.16Å; V157-W160 HydrophobicContact CG2-CZ3 3.95Å; V157-W160 PolarHBondContact O-N 3.06Å; I158-W160 VanDerWaalsContact C-N 3.29Å; I158-W160 PolarHBondContact O-N 2.98Å; W160-T163 PolarHBondContact O-N 3.12Å
161L93.3Very high87.4Confident119 Ų11993.3 Ų93.362%0.62350%0.499SS*.Hα-helixtrans-65.6-39.5178.8-67177.8000112.4V157 I158 P165V157-L161 HydrophobicContact CG1-CD1 4.41Å; V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.06Å; V157-L161 VanDerWaalsContact O-N 3.12Å; I158-L161 PolarHBondContact O-N 2.9Å; L161-P165 WeakPolarHBondContact O-CD 3.47Å
162V93.9Very high87Confident76 Ų7692.3 Ų92.346%0.46150%0.495SS..Hα-helixtrans-73.1-30.7178.5171.70000111.7I158 V164 P165 V166I158-V162 HydrophobicContact CG2-CG2 3.9Å; I158-V162 WeakPolarHBondContact O-CB 3.49Å; I158-V162 VanDerWaalsContact O-CG2 3.29Å; I158-V162 WeakPolarHBondContact O-CG2 3.35Å; I158-V162 PolarHBondContact O-N 3.42Å; V162-V164 VanDerWaalsContact C-N 3.28Å; V162-V164 PolarHBondContact O-N 3.37Å; V162-P165 VanDerWaalsContact O-CD 3.23Å; V162-P165 WeakPolarHBondContact O-CD 3.39Å; V162-P165 WeakPolarHBondContact O-CG 3.43Å; V162-V166 HydrophobicContact CG1-CG2 3.94Å; V162-V166 WeakPolarHBondContact O-CB 3.37Å; V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.35Å
163T89.2Confident86.7Confident86 Ų8695.7 Ų95.753%0.52851%0.513SS..Hα-helixtrans-62.2-36.7179.3-61.90000111.7S159 W160 A167S159-T163 WeakPolarHBondContact O-CB 3.35Å; S159-T163 PolarHBondContact O-N 2.74Å; S159-T163 PolarHBondContact O-OG1 3.09Å; W160-T163 PolarHBondContact O-N 3.12Å; T163-A167 WeakPolarHBondContact O-CB 3.31Å; T163-A167 PolarHBondContact O-N 2.76Å
164V88.2Confident86.2Confident110 Ų11099.8 Ų99.867%0.66753%0.534SS*.Hα-helixtrans-60-58.2-179.2177.80000113.5V162 V166 A167 G168V162-V164 VanDerWaalsContact C-N 3.28Å; V162-V164 PolarHBondContact O-N 3.37Å; V164-V166 PolarHBondContact O-N 3.04Å; V164-A167 PolarHBondContact O-N 3.4Å; V164-G168 PolarHBondContact O-N 2.88Å
165P88.9Confident85.6Confident65 Ų6597 Ų9742%0.42253%0.534SS..Hα-helixtrans-64.6-39.6179.124.6-33.1000111.9L161 V162 A167 G168 E169L161-P165 WeakPolarHBondContact O-CD 3.47Å; V162-P165 VanDerWaalsContact O-CD 3.23Å; V162-P165 WeakPolarHBondContact O-CD 3.39Å; V162-P165 WeakPolarHBondContact O-CG 3.43Å; P165-A167 VanDerWaalsContact C-N 3.29Å; P165-A167 PolarHBondContact O-N 3.25Å; P165-G168 PolarHBondContact O-N 2.98Å; P165-G168 VanDerWaalsContact O-N 3.16Å; P165-E169 WeakPolarHBondContact O-CG 3.38Å; P165-E169 PolarHBondContact O-N 3.36Å
166V89.6Confident84.9Confident111 Ų11197.8 Ų97.867%0.67354%0.539SS*.Hα-helixtrans-64.1-36.2179.4174.20000111.7V162 V164V162-V166 HydrophobicContact CG1-CG2 3.94Å; V162-V166 WeakPolarHBondContact O-CB 3.37Å; V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.35Å; V164-V166 PolarHBondContact O-N 3.04Å
167A82.4Confident84.2Confident79 Ų79103.3 Ų103.365%0.65357%0.57SS**Hα-helixtrans-77.9-26.5176.100000113.2T163 V164 P165T163-A167 WeakPolarHBondContact O-CB 3.31Å; T163-A167 PolarHBondContact O-N 2.76Å; V164-A167 PolarHBondContact O-N 3.4Å; P165-A167 VanDerWaalsContact C-N 3.29Å; P165-A167 PolarHBondContact O-N 3.25Å
168G74.8Confident83.3Confident55 Ų55106.5 Ų106.557%0.56759%0.585SS**Hα-helixtrans-91.2-12.8-173.600000116.3V164 P165 R170V164-G168 PolarHBondContact O-N 2.88Å; P165-G168 PolarHBondContact O-N 2.98Å; P165-G168 VanDerWaalsContact O-N 3.16Å; G168-R170 VanDerWaalsContact C-N 3.26Å; G168-R170 PolarHBondContact O-N 3.05Å; G168-R170 VanDerWaalsContact O-N 3.11Å
169E55.5Low82.3Confident166 Ų166108.8 Ų108.878%0.77660%0.6SS**  trans-8127.8-172.8-82.8-168.2178.900116.2P165P165-E169 WeakPolarHBondContact O-CG 3.38Å; P165-E169 PolarHBondContact O-N 3.36Å
170R46.7Very low81.3Confident308 Ų308113.6 Ų113.6100%1.16262%0.62SS**  trans-142.10167.9-69.1-171.5-174.8165.82.5112G168G168-R170 VanDerWaalsContact C-N 3.26Å; G168-R170 PolarHBondContact O-N 3.05Å; G168-R170 VanDerWaalsContact O-N 3.11Å

Retrieved 170 of 170 residues in 119.6 ms (Link to these results)