A0A146MGE2_SCHMA Loading...

Dolichol-phosphate mannosyltransferase subunit 3

Stabilizer subunit of the dolichol-phosphate mannose (DPM) synthase complex; tethers catalytic subunit to the ER.

AlphaFold DB , UniProt , Accession A0A146MGE2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 93 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
1M77.5Confident93Very high202 Ų202125.8 Ų125.8100%0.99561%0.611SS**  0-57.20-62.7-165.6-71.700112.9K3 I4 V5M1-K3 PolarHBondContact O-N 3.31Å; M1-I4 PolarHBondContact O-N 3.29Å; M1-V5 PolarHBondContact O-N 2.84Å
2K91.2Very high93.4Very high174 Ų174121.3 Ų121.376%0.75760%0.602SS**Hα-helixtrans-49.4-48.3-175.8-63.3-172.2179-177.40114.6I4 V5 E6K2-I4 VanDerWaalsContact C-N 3.31Å; K2-I4 PolarHBondContact O-N 3.05Å; K2-V5 PolarHBondContact O-N 3.04Å; K2-V5 VanDerWaalsContact O-N 3.12Å; K2-E6 WeakPolarHBondContact O-CG 3.32Å; K2-E6 PolarHBondContact O-N 3.23Å
3K92.7Very high93.6Very high140 Ų140119.8 Ų119.861%0.60960%0.597SS**Hα-helixtrans-58.8-36.5179.5-164.8171.2-175.7177.70114.2M1 E6 W7M1-K3 PolarHBondContact O-N 3.31Å; K3-E6 PolarHBondContact O-N 3.43Å; K3-W7 PolarHBondContact O-N 3.36Å; K3-W7 VanDerWaalsContact O-N 3.11Å
4I93.1Very high93.6Very high114 Ų114115.9 Ų115.959%0.58558%0.578SS**Hα-helixtrans-68.4-42.8178.7-64.9169.7000109.9M1 K2 E6 W7 L8M1-I4 PolarHBondContact O-N 3.29Å; K2-I4 VanDerWaalsContact C-N 3.31Å; K2-I4 PolarHBondContact O-N 3.05Å; I4-E6 VanDerWaalsContact C-N 3.32Å; I4-E6 PolarHBondContact O-N 3.4Å; I4-W7 PolarHBondContact O-N 2.99Å; I4-L8 HydrophobicContact CG2-CD1 3.97Å; I4-L8 HydrophobicContact CG2-CG 4.27Å; I4-L8 WeakPolarHBondContact O-CB 3.23Å; I4-L8 WeakPolarHBondContact O-CG 3.48Å; I4-L8 PolarHBondContact O-N 2.87Å
5V95.7Very high93.8Very high94 Ų94111.5 Ų111.557%0.5756%0.563SS**Hα-helixtrans-62-41.7177.4178.30000110.9M1 K2 L8 L9M1-V5 PolarHBondContact O-N 2.84Å; K2-V5 PolarHBondContact O-N 3.04Å; K2-V5 VanDerWaalsContact O-N 3.12Å; V5-L8 PolarHBondContact O-N 3.43Å; V5-L9 WeakPolarHBondContact O-CB 3.28Å; V5-L9 PolarHBondContact O-N 3.17Å
6E95.6Very high93.9Very high118 Ų118107.5 Ų107.555%0.55155%0.552SS**Hα-helixtrans-58.1-48.6174.6-69.7161.7-166.700111.7K2 K3 I4 L9 V10K2-E6 WeakPolarHBondContact O-CG 3.32Å; K2-E6 PolarHBondContact O-N 3.23Å; K3-E6 PolarHBondContact O-N 3.43Å; I4-E6 VanDerWaalsContact C-N 3.32Å; I4-E6 PolarHBondContact O-N 3.4Å; E6-L9 PolarHBondContact O-N 3.34Å; E6-V10 WeakPolarHBondContact O-CG2 3.45Å; E6-V10 PolarHBondContact O-N 3.35Å; E6-V10 VanDerWaalsContact O-N 3.1Å
7W94.4Very high93.8Very high165 Ų165106.5 Ų106.563%0.62555%0.546SS*.Hα-helixtrans-65.6-38.4177.4-76.4114.9000113.3K3 I4 L9 V10 L11K3-W7 PolarHBondContact O-N 3.36Å; K3-W7 VanDerWaalsContact O-N 3.11Å; I4-W7 PolarHBondContact O-N 2.99Å; W7-L9 VanDerWaalsContact C-N 3.31Å; W7-L9 PolarHBondContact O-N 3.39Å; W7-V10 PolarHBondContact O-N 3.28Å; W7-L11 WeakPolarHBondContact O-CB 3.29Å; W7-L11 PolarHBondContact O-N 2.89Å
8L95.7Very high93.8Very high102 Ų102104.6 Ų104.653%0.53453%0.531SS..Hα-helixtrans-63.5-38.4175.5-76.2174.6000111.6I4 V5 L11 S12I4-L8 HydrophobicContact CG2-CD1 3.97Å; I4-L8 HydrophobicContact CG2-CG 4.27Å; I4-L8 WeakPolarHBondContact O-CB 3.23Å; I4-L8 WeakPolarHBondContact O-CG 3.48Å; I4-L8 PolarHBondContact O-N 2.87Å; V5-L8 PolarHBondContact O-N 3.43Å; L8-L11 PolarHBondContact O-N 2.98Å; L8-S12 VanDerWaalsContact O-CB 3.3Å; L8-S12 WeakPolarHBondContact O-CB 3.29Å; L8-S12 PolarHBondContact O-N 3.49Å
9L96.4Very high93.8Very high102 Ų102102.7 Ų102.753%0.53453%0.526SS..Hα-helixtrans-64.8-47176.8-158.6162.8000110.5V5 E6 W7 L11 S12 L13V5-L9 WeakPolarHBondContact O-CB 3.28Å; V5-L9 PolarHBondContact O-N 3.17Å; E6-L9 PolarHBondContact O-N 3.34Å; W7-L9 VanDerWaalsContact C-N 3.31Å; W7-L9 PolarHBondContact O-N 3.39Å; L9-L11 PolarHBondContact O-N 3.41Å; L9-S12 WeakPolarHBondContact O-CB 3.37Å; L9-S12 PolarHBondContact O-N 3.18Å; L9-L13 HydrophobicContact CD2-CD1 3.65Å; L9-L13 HydrophobicContact CD2-CG 4.06Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 3.09Å
10V95.6Very high93.9Very high69 Ų6999.2 Ų99.242%0.41851%0.511SS..Hα-helixtrans-58.8-46.9175.1173.40000111.2E6 W7 S12 L13 I14E6-V10 WeakPolarHBondContact O-CG2 3.45Å; E6-V10 PolarHBondContact O-N 3.35Å; E6-V10 VanDerWaalsContact O-N 3.1Å; W7-V10 PolarHBondContact O-N 3.28Å; V10-S12 VanDerWaalsContact C-N 3.33Å; V10-S12 PolarHBondContact O-N 3.07Å; V10-L13 PolarHBondContact O-N 3.31Å; V10-I14 HydrophobicContact CG1-CD1 3.84Å; V10-I14 WeakPolarHBondContact O-CG1 3.43Å; V10-I14 PolarHBondContact O-N 2.94Å; V10-I14 VanDerWaalsContact O-N 3.08Å
11L95.6Very high93.8Very high104 Ų10496 Ų9655%0.54549%0.493SS..Hα-helixtrans-60.9-42.6177.5-178.863.2000111.6W7 L8 L9 L13 I14 S15W7-L11 WeakPolarHBondContact O-CB 3.29Å; W7-L11 PolarHBondContact O-N 2.89Å; L8-L11 PolarHBondContact O-N 2.98Å; L9-L11 PolarHBondContact O-N 3.41Å; L11-L13 PolarHBondContact O-N 3.43Å; L11-I14 PolarHBondContact O-N 3.02Å; L11-S15 VanDerWaalsContact O-CB 3.29Å; L11-S15 WeakPolarHBondContact O-CB 3.49Å; L11-S15 PolarHBondContact O-N 3.44Å; L11-S15 PolarHBondContact O-OG 3.47Å
12S96.8Very high94.4Very high71 Ų7190.8 Ų90.850%0.49747%0.468SS..Hα-helixtrans-59.5-45.4177.1-174.30000111.3L8 L9 V10 S15 A16L8-S12 VanDerWaalsContact O-CB 3.3Å; L8-S12 WeakPolarHBondContact O-CB 3.29Å; L8-S12 PolarHBondContact O-N 3.49Å; L9-S12 WeakPolarHBondContact O-CB 3.37Å; L9-S12 PolarHBondContact O-N 3.18Å; V10-S12 VanDerWaalsContact C-N 3.33Å; V10-S12 PolarHBondContact O-N 3.07Å; S12-S15 WeakPolarHBondContact CA-OG 3.44Å; S12-S15 PolarHBondContact O-N 3.34Å; S12-S15 PolarHBondContact O-OG 2.9Å; S12-A16 WeakPolarHBondContact O-CB 3.39Å; S12-A16 PolarHBondContact O-N 3.12Å
13L96.2Very high94.5Very high103 Ų10389.2 Ų89.254%0.53947%0.465SS..Hα-helixtrans-64.3-45.8179.1-68.8174.3000112.1L9 V10 L11 S15 A16 I17L9-L13 HydrophobicContact CD2-CD1 3.65Å; L9-L13 HydrophobicContact CD2-CG 4.06Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 3.09Å; V10-L13 PolarHBondContact O-N 3.31Å; L11-L13 PolarHBondContact O-N 3.43Å; L13-S15 VanDerWaalsContact C-N 3.33Å; L13-S15 PolarHBondContact O-N 3.3Å; L13-A16 PolarHBondContact O-N 2.99Å; L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.34Å; L13-I17 VanDerWaalsContact O-N 3.13Å
14I94.5Very high94.5Very high65 Ų6584.8 Ų84.833%0.33346%0.46SS..Hα-helixtrans-61.4-44.7177.2-65.8167.8000110.4V10 L11 A16 I17 W18 L40 I44V10-I14 HydrophobicContact CG1-CD1 3.84Å; V10-I14 WeakPolarHBondContact O-CG1 3.43Å; V10-I14 PolarHBondContact O-N 2.94Å; V10-I14 VanDerWaalsContact O-N 3.08Å; L11-I14 PolarHBondContact O-N 3.02Å; I14-A16 VanDerWaalsContact C-N 3.34Å; I14-A16 PolarHBondContact O-N 2.96Å; I14-I17 PolarHBondContact O-N 2.86Å; I14-W18 PolarHBondContact O-N 3.28Å; I14-W18 VanDerWaalsContact O-N 3.12Å; I14-L40 HydrophobicContact CG2-CD2 4.32Å; I14-I44 HydrophobicContact CG2-CD1 3.8Å
15S95.4Very high94.4Very high50 Ų5085.5 Ų85.535%0.3546%0.464SS..Hα-helixtrans-64.5-38178.673.50000112.1L11 S12 L13 I17 W18 V19L11-S15 VanDerWaalsContact O-CB 3.29Å; L11-S15 WeakPolarHBondContact O-CB 3.49Å; L11-S15 PolarHBondContact O-N 3.44Å; L11-S15 PolarHBondContact O-OG 3.47Å; S12-S15 WeakPolarHBondContact CA-OG 3.44Å; S12-S15 PolarHBondContact O-N 3.34Å; S12-S15 PolarHBondContact O-OG 2.9Å; L13-S15 VanDerWaalsContact C-N 3.33Å; L13-S15 PolarHBondContact O-N 3.3Å; S15-I17 PolarHBondContact O-N 2.87Å; S15-W18 PolarHBondContact O-N 3.26Å; S15-V19 WeakPolarHBondContact O-CB 3.45Å; S15-V19 VanDerWaalsContact O-CG2 3.28Å; S15-V19 WeakPolarHBondContact O-CG2 3.28Å; S15-V19 PolarHBondContact O-N 3.34Å
16A95.6Very high94.1Very high47 Ų4784.4 Ų84.439%0.38845%0.454SS..Hα-helixtrans-63.1-42.4177.100000111.8S12 L13 I14 S20S12-A16 WeakPolarHBondContact O-CB 3.39Å; S12-A16 PolarHBondContact O-N 3.12Å; L13-A16 PolarHBondContact O-N 2.99Å; I14-A16 VanDerWaalsContact C-N 3.34Å; I14-A16 PolarHBondContact O-N 2.96Å; A16-S20 VanDerWaalsContact O-CB 3.26Å; A16-S20 WeakPolarHBondContact O-CB 3.42Å; A16-S20 PolarHBondContact O-N 3.13Å; A16-S20 PolarHBondContact O-OG 3.34Å
17I92.3Very high93.7Very high90 Ų9084.3 Ų84.346%0.46246%0.462SS..Hα-helixtrans-60.6-47.6175.1-65.5165.9000110.5L13 I14 S15 S20 K21L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.34Å; L13-I17 VanDerWaalsContact O-N 3.13Å; I14-I17 PolarHBondContact O-N 2.86Å; S15-I17 PolarHBondContact O-N 2.87Å; I17-S20 PolarHBondContact O-N 3.35Å; I17-K21 PolarHBondContact O-N 2.96Å; I17-K21 VanDerWaalsContact O-N 3.09Å
18W94Very high93.3Very high72 Ų7278.5 Ų78.527%0.27344%0.444SS..Hα-helixtrans-63.3-47.3-179.6-174.958000112.4I14 S15 S20 K21 L22 L37 L40 P41I14-W18 PolarHBondContact O-N 3.28Å; I14-W18 VanDerWaalsContact O-N 3.12Å; S15-W18 PolarHBondContact O-N 3.26Å; W18-S20 VanDerWaalsContact C-N 3.31Å; W18-S20 PolarHBondContact O-N 3.49Å; W18-K21 WeakPolarHBondContact O-CB 3.45Å; W18-K21 PolarHBondContact O-N 2.67Å; W18-L22 HydrophobicContact CD2-CD1 4.07Å; W18-L22 HydrophobicContact CE3-CD1 4.13Å; W18-L22 HydrophobicContact CH2-CD1 3.84Å; W18-L22 HydrophobicContact CZ2-CD1 3.76Å; W18-L22 HydrophobicContact CZ2-CG 4.49Å; W18-L22 HydrophobicContact CZ3-CD1 4.03Å; W18-L22 WeakPolarHBondContact O-CG 3.42Å; W18-L22 PolarHBondContact O-N 2.89Å; W18-L37 PolarHBondContact NE1-O 3.42Å; W18-L40 HydrophobicContact CB-CD2 4.06Å; W18-L40 HydrophobicContact CG-CD2 4.29Å; W18-P41 HydrophobicContact CH2-CG 3.96Å; W18-P41 HydrophobicContact CZ2-CG 3.51Å
19V94.8Very high92.9Very high70 Ų7082.7 Ų82.742%0.42446%0.461SS..Hα-helixtrans-62.1-40.1176.5171.40000110.9S15 K21 L22 M23S15-V19 WeakPolarHBondContact O-CB 3.45Å; S15-V19 VanDerWaalsContact O-CG2 3.28Å; S15-V19 WeakPolarHBondContact O-CG2 3.28Å; S15-V19 PolarHBondContact O-N 3.34Å; V19-K21 VanDerWaalsContact C-N 3.27Å; V19-K21 PolarHBondContact O-N 3.49Å; V19-L22 WeakPolarHBondContact O-CB 3.26Å; V19-L22 PolarHBondContact O-N 3.48Å; V19-L22 VanDerWaalsContact O-N 3.07Å; V19-M23 HydrophobicContact CG1-CG 4.17Å; V19-M23 VanDerWaalsContact O-CG 3.29Å; V19-M23 WeakPolarHBondContact O-CG 3.4Å; V19-M23 PolarHBondContact O-N 2.97Å
20S94.6Very high92.5Very high32 Ų3281 Ų8122%0.22446%0.458CS..Hα-helixtrans-61.5-36.4177.1-600000112A16 I17 W18 G24 I25 I26A16-S20 VanDerWaalsContact O-CB 3.26Å; A16-S20 WeakPolarHBondContact O-CB 3.42Å; A16-S20 PolarHBondContact O-N 3.13Å; A16-S20 PolarHBondContact O-OG 3.34Å; I17-S20 PolarHBondContact O-N 3.35Å; W18-S20 VanDerWaalsContact C-N 3.31Å; W18-S20 PolarHBondContact O-N 3.49Å; S20-G24 PolarHBondContact O-N 2.92Å; S20-I25 WeakPolarHBondContact O-CB 3.36Å; S20-I25 PolarHBondContact O-N 3.12Å; S20-I26 PolarHBondContact O-N 2.89Å
21K91.3Very high92.3Very high32 Ų3284.2 Ų84.214%0.13947%0.473CS..Hα-helixtrans-66.4-44170.8-179.5-92.4-174.1-160.50112.1I17 W18 V19 M23 G24 L37 N38I17-K21 PolarHBondContact O-N 2.96Å; I17-K21 VanDerWaalsContact O-N 3.09Å; W18-K21 WeakPolarHBondContact O-CB 3.45Å; W18-K21 PolarHBondContact O-N 2.67Å; V19-K21 VanDerWaalsContact C-N 3.27Å; V19-K21 PolarHBondContact O-N 3.49Å; K21-M23 VanDerWaalsContact C-N 3.27Å; K21-M23 PolarHBondContact O-N 3.24Å; K21-G24 PolarHBondContact O-N 3.49Å; K21-L37 HydrophobicContact CB-CD2 3.83Å; K21-L37 HydrophobicContact CB-CG 4.16Å; K21-L37 HydrophobicContact CD-CG 4.3Å; K21-L37 HydrophobicContact CG-CD2 3.66Å; K21-L37 HydrophobicContact CG-CG 3.93Å; K21-N38 PolarHBondContact NZ-OD1 3.46Å
22L91.5Very high92Very high92 Ų9283.4 Ų83.448%0.48248%0.475SS..Hα-helixtrans-61.7-37.5178.3-67.7178.2000112.1W18 V19 G24W18-L22 HydrophobicContact CD2-CD1 4.07Å; W18-L22 HydrophobicContact CE3-CD1 4.13Å; W18-L22 HydrophobicContact CH2-CD1 3.84Å; W18-L22 HydrophobicContact CZ2-CD1 3.76Å; W18-L22 HydrophobicContact CZ2-CG 4.49Å; W18-L22 HydrophobicContact CZ3-CD1 4.03Å; W18-L22 WeakPolarHBondContact O-CG 3.42Å; W18-L22 PolarHBondContact O-N 2.89Å; V19-L22 WeakPolarHBondContact O-CB 3.26Å; V19-L22 PolarHBondContact O-N 3.48Å; V19-L22 VanDerWaalsContact O-N 3.07Å; L22-G24 PolarHBondContact O-N 2.77Å
23M93.6Very high91.6Very high141 Ų14181 Ų8170%0.69546%0.461SS*.THydrogen-bonded Turntrans-75-2.4176.2-63.8-62.2-72.600113.3V19 K21 I25V19-M23 HydrophobicContact CG1-CG 4.17Å; V19-M23 VanDerWaalsContact O-CG 3.29Å; V19-M23 WeakPolarHBondContact O-CG 3.4Å; V19-M23 PolarHBondContact O-N 2.97Å; K21-M23 VanDerWaalsContact C-N 3.27Å; K21-M23 PolarHBondContact O-N 3.24Å; M23-I25 HydrophobicContact CB-CD1 4Å; M23-I25 HydrophobicContact CB-CG1 3.93Å; M23-I25 PolarHBondContact O-N 3.31Å
24G90.8Very high91.3Very high48 Ų4879.2 Ų79.250%0.49545%0.452SS..THydrogen-bonded Turntrans72.19.9-177.600000114.5S20 K21 L22 I26S20-G24 PolarHBondContact O-N 2.92Å; K21-G24 PolarHBondContact O-N 3.49Å; L22-G24 PolarHBondContact O-N 2.77Å; G24-I26 VanDerWaalsContact C-N 3.3Å
25I92.2Very high91.2Very high129 Ų12981.2 Ų81.266%0.66246%0.462SS*.SBendtrans-67.9-37.3176.8-57.5172.5000109.8S20 M23S20-I25 WeakPolarHBondContact O-CB 3.36Å; S20-I25 PolarHBondContact O-N 3.12Å; M23-I25 HydrophobicContact CB-CD1 4Å; M23-I25 HydrophobicContact CB-CG1 3.93Å; M23-I25 PolarHBondContact O-N 3.31Å
26I89.2Confident91Very high71 Ų7182.9 Ų82.936%0.36447%0.466SS..SBendtrans-111.5118.4177.4-59.4174.5000108.8S20 G24 V28S20-I26 PolarHBondContact O-N 2.89Å; G24-I26 VanDerWaalsContact C-N 3.3Å; I26-V28 HydrophobicContact CG2-CG2 4.44Å
27T87.7Confident90.7Very high116 Ų11681.9 Ų81.971%0.71245%0.454SS*.  trans-104.6123.4172.557.40000110.1
28V86.2Confident90.7Very high42 Ų4281 Ų8126%0.25545%0.45SS..  trans-98.8119175.3-179.20000108.4I26 S30 L37I26-V28 HydrophobicContact CG2-CG2 4.44Å; V28-S30 WeakPolarHBondContact CG1-OG 3.37Å; V28-L37 HydrophobicContact CG2-CD2 3.78Å
29Q86.4Confident90.7Very high190 Ų19083.9 Ų83.989%0.88846%0.461SS*.  trans-76.7-22.9-178-65.9-179.827.700113.3
30S89.1Confident90.6Very high68 Ų6882.2 Ų82.248%0.47645%0.45SS..  trans-80.2127.117860.60000110.8V28 C32 G33 N34V28-S30 WeakPolarHBondContact CG1-OG 3.37Å; S30-C32 VanDerWaalsContact C-N 3.29Å; S30-C32 PolarHBondContact O-N 3.35Å; S30-G33 PolarHBondContact O-N 2.96Å; S30-G33 VanDerWaalsContact O-N 3.17Å; S30-G33 WeakPolarHBondContact OG-CA 3.49Å; S30-G33 PolarHBondContact OG-N 3.22Å; S30-N34 WeakPolarHBondContact O-CB 3.5Å; S30-N34 PolarHBondContact O-N 3.29Å
31D89.6Confident90.6Very high136 Ų13683 Ų8373%0.72745%0.454SS*.Hα-helixtrans-56.7-45177.6-68.6-25000111.5G33 N34 I35D31-G33 PolarHBondContact O-N 2.79Å; D31-N34 PolarHBondContact O-N 3.47Å; D31-I35 VanDerWaalsContact O-CG1 3.32Å; D31-I35 WeakPolarHBondContact O-CG1 3.44Å; D31-I35 PolarHBondContact O-N 3.47Å
32C89.6Confident90.7Very high87 Ų8787.6 Ų87.659%0.58847%0.474SS*.Hα-helixtrans-61-46.3177.2-175.20000112S30 N34 I35 I36S30-C32 VanDerWaalsContact C-N 3.29Å; S30-C32 PolarHBondContact O-N 3.35Å; C32-N34 VanDerWaalsContact C-N 3.31Å; C32-N34 PolarHBondContact O-N 3.4Å; C32-I35 PolarHBondContact O-N 3.46Å; C32-I36 VanDerWaalsContact O-CG1 3.29Å; C32-I36 WeakPolarHBondContact O-CG1 3.32Å; C32-I36 PolarHBondContact O-N 2.85Å
33G88.3Confident90.9Very high20 Ų2087.1 Ų87.121%0.20647%0.469CS..Hα-helixtrans-64.4-37.3178.100000112.2S30 D31 L37S30-G33 PolarHBondContact O-N 2.96Å; S30-G33 VanDerWaalsContact O-N 3.17Å; S30-G33 WeakPolarHBondContact OG-CA 3.49Å; S30-G33 PolarHBondContact OG-N 3.22Å; D31-G33 PolarHBondContact O-N 2.79Å; G33-L37 VanDerWaalsContact O-CB 3.23Å; G33-L37 WeakPolarHBondContact O-CB 3.27Å; G33-L37 PolarHBondContact O-N 2.88Å
34N90.7Very high91Very high65 Ų6584 Ų8435%0.34846%0.455SS..Hα-helixtrans-64.1-46.8176.7-161.4-53.3000111.4S30 D31 C32 L37 N38S30-N34 WeakPolarHBondContact O-CB 3.5Å; S30-N34 PolarHBondContact O-N 3.29Å; D31-N34 PolarHBondContact O-N 3.47Å; C32-N34 VanDerWaalsContact C-N 3.31Å; C32-N34 PolarHBondContact O-N 3.4Å; N34-L37 PolarHBondContact O-N 2.87Å; N34-N38 VanDerWaalsContact O-CB 3.28Å; N34-N38 WeakPolarHBondContact O-CB 3.35Å; N34-N38 PolarHBondContact O-N 3.35Å
35I91.3Very high91.2Very high108 Ų10887.1 Ų87.155%0.55446%0.46SS*.Hα-helixtrans-60-49.9177.7-67.7165.2000110.8D31 C32 L37 N38 W39D31-I35 VanDerWaalsContact O-CG1 3.32Å; D31-I35 WeakPolarHBondContact O-CG1 3.44Å; D31-I35 PolarHBondContact O-N 3.47Å; C32-I35 PolarHBondContact O-N 3.46Å; I35-L37 VanDerWaalsContact C-N 3.34Å; I35-L37 PolarHBondContact O-N 3.4Å; I35-N38 PolarHBondContact O-N 3.28Å; I35-W39 PolarHBondContact O-N 3.08Å
36I91.2Very high91.5Very high85 Ų8588.1 Ų88.144%0.43646%0.46SS..Hα-helixtrans-58.9-48.2179.9-67.3165.8000110.4C32 N38 W39 L40C32-I36 VanDerWaalsContact O-CG1 3.29Å; C32-I36 WeakPolarHBondContact O-CG1 3.32Å; C32-I36 PolarHBondContact O-N 2.85Å; I36-N38 VanDerWaalsContact C-N 3.32Å; I36-N38 PolarHBondContact O-N 2.9Å; I36-W39 CarbonylContact O-C 3.51Å; I36-W39 PolarHBondContact O-N 2.83Å; I36-L40 WeakPolarHBondContact O-CA 3.33Å; I36-L40 PolarHBondContact O-N 2.88Å
37L90.9Very high91.9Very high26 Ų2689.7 Ų89.714%0.13647%0.468CS..Hα-helixtrans-69.9-30.5-176.6-166.854.7000112.2W18 K21 V28 G33 N34 I35 L40W18-L37 PolarHBondContact NE1-O 3.42Å; K21-L37 HydrophobicContact CB-CD2 3.83Å; K21-L37 HydrophobicContact CB-CG 4.16Å; K21-L37 HydrophobicContact CD-CG 4.3Å; K21-L37 HydrophobicContact CG-CD2 3.66Å; K21-L37 HydrophobicContact CG-CG 3.93Å; V28-L37 HydrophobicContact CG2-CD2 3.78Å; G33-L37 VanDerWaalsContact O-CB 3.23Å; G33-L37 WeakPolarHBondContact O-CB 3.27Å; G33-L37 PolarHBondContact O-N 2.88Å; N34-L37 PolarHBondContact O-N 2.87Å; I35-L37 VanDerWaalsContact C-N 3.34Å; I35-L37 PolarHBondContact O-N 3.4Å; L37-L40 HydrophobicContact CD1-CB 4.41Å; L37-L40 HydrophobicContact CD1-CD2 3.73Å; L37-L40 WeakPolarHBondContact O-CB 3.29Å; L37-L40 PolarHBondContact O-N 3.47Å
38N92.1Very high92.3Very high70 Ų7090.7 Ų90.737%0.37446%0.462SS..Hα-helixtrans-64.3-41.7175.4-161.665.3000112.1K21 N34 I35 I36K21-N38 PolarHBondContact NZ-OD1 3.46Å; N34-N38 VanDerWaalsContact O-CB 3.28Å; N34-N38 WeakPolarHBondContact O-CB 3.35Å; N34-N38 PolarHBondContact O-N 3.35Å; I35-N38 PolarHBondContact O-N 3.28Å; I36-N38 VanDerWaalsContact C-N 3.32Å; I36-N38 PolarHBondContact O-N 2.9Å
39W93.4Very high92.9Very high134 Ų13490.2 Ų90.251%0.50847%0.466SS..THydrogen-bonded Turntrans-98.212.5-179.4-67.293.2000113.1I35 I36 P41 F42 H43I35-W39 PolarHBondContact O-N 3.08Å; I36-W39 CarbonylContact O-C 3.51Å; I36-W39 PolarHBondContact O-N 2.83Å; W39-P41 VanDerWaalsContact C-CD 3.44Å; W39-F42 HydrophobicContact CD2-CD2 4.5Å; W39-F42 HydrophobicContact CE3-CB 4.46Å; W39-F42 AromaticContact CE3-CD2 3.46Å; W39-F42 HydrophobicContact CE3-CD2 3.46Å; W39-F42 VanDerWaalsContact CE3-CD2 3.46Å; W39-F42 AromaticContact CE3-CE2 3.85Å; W39-F42 HydrophobicContact CE3-CE2 3.85Å; W39-F42 HydrophobicContact CE3-CG 4.07Å; W39-F42 AromaticContact CZ3-CD2 3.99Å; W39-F42 HydrophobicContact CZ3-CD2 3.99Å; W39-F42 AromaticContact CZ3-CE2 3.95Å; W39-F42 HydrophobicContact CZ3-CE2 3.95Å; W39-F42 HydrophobicContact CZ3-CZ 4.5Å; W39-F42 WeakPolarHBondContact O-CB 3.22Å; W39-F42 PolarHBondContact O-N 2.71Å; W39-H43 VanDerWaalsContact C-ND1 3.27Å; W39-H43 VanDerWaalsContact CB-CE1 3.45Å; W39-H43 WeakPolarHBondContact CB-CE1 3.2Å; W39-H43 PolarHBondContact O-N 2.9Å; W39-H43 VanDerWaalsContact O-N 3.12Å; W39-H43 PolarHBondContact O-ND1 3.43Å
40L92.8Very high93.4Very high35 Ų3583.9 Ų83.918%0.18344%0.44CS..Hα-helixtrans-45.9-48-176-175.563.6000114.6I14 W18 I36 L37 F42 H43 I44I14-L40 HydrophobicContact CG2-CD2 4.32Å; W18-L40 HydrophobicContact CB-CD2 4.06Å; W18-L40 HydrophobicContact CG-CD2 4.29Å; I36-L40 WeakPolarHBondContact O-CA 3.33Å; I36-L40 PolarHBondContact O-N 2.88Å; L37-L40 HydrophobicContact CD1-CB 4.41Å; L37-L40 HydrophobicContact CD1-CD2 3.73Å; L37-L40 WeakPolarHBondContact O-CB 3.29Å; L37-L40 PolarHBondContact O-N 3.47Å; L40-F42 VanDerWaalsContact C-N 3.29Å; L40-F42 PolarHBondContact O-N 3.45Å; L40-H43 PolarHBondContact O-N 2.84Å; L40-I44 HydrophobicContact CD1-CD1 4.06Å; L40-I44 HydrophobicContact CD1-CG1 4.24Å; L40-I44 HydrophobicContact CD2-CD1 4.47Å; L40-I44 HydrophobicContact CG-CD1 3.87Å; L40-I44 HydrophobicContact CG-CG1 4.43Å; L40-I44 WeakPolarHBondContact O-CG1 3.29Å; L40-I44 PolarHBondContact O-N 3.44Å
41P93.7Very high93.9Very high49 Ų4983.9 Ų83.932%0.31844%0.437SS..Hα-helixtrans-60.7-36.5179.724.1-36.8000113.1W18 W39 I44 L45W18-P41 HydrophobicContact CH2-CG 3.96Å; W18-P41 HydrophobicContact CZ2-CG 3.51Å; W39-P41 VanDerWaalsContact C-CD 3.44Å; P41-I44 PolarHBondContact O-N 3.23Å; P41-L45 WeakPolarHBondContact O-CB 3.3Å; P41-L45 PolarHBondContact O-N 3.39Å
42F95.5Very high94.3Very high127 Ų12779 Ų7956%0.55741%0.414SS*.Hα-helixtrans-70.7-39.9178.2-66.7-80.7000111.8W39 L40 L45 F46W39-F42 HydrophobicContact CD2-CD2 4.5Å; W39-F42 HydrophobicContact CE3-CB 4.46Å; W39-F42 AromaticContact CE3-CD2 3.46Å; W39-F42 HydrophobicContact CE3-CD2 3.46Å; W39-F42 VanDerWaalsContact CE3-CD2 3.46Å; W39-F42 AromaticContact CE3-CE2 3.85Å; W39-F42 HydrophobicContact CE3-CE2 3.85Å; W39-F42 HydrophobicContact CE3-CG 4.07Å; W39-F42 AromaticContact CZ3-CD2 3.99Å; W39-F42 HydrophobicContact CZ3-CD2 3.99Å; W39-F42 AromaticContact CZ3-CE2 3.95Å; W39-F42 HydrophobicContact CZ3-CE2 3.95Å; W39-F42 HydrophobicContact CZ3-CZ 4.5Å; W39-F42 WeakPolarHBondContact O-CB 3.22Å; W39-F42 PolarHBondContact O-N 2.71Å; L40-F42 VanDerWaalsContact C-N 3.29Å; L40-F42 PolarHBondContact O-N 3.45Å; F42-L45 PolarHBondContact O-N 2.93Å; F42-F46 WeakPolarHBondContact O-CB 3.36Å; F42-F46 PolarHBondContact O-N 3.34Å
43H94.6Very high94.7Very high82 Ų8278.7 Ų78.738%0.3841%0.409SS..Hα-helixtrans-61-45.4173.7-67102.4000111.5W39 L40 L45 F46 I47W39-H43 VanDerWaalsContact C-ND1 3.27Å; W39-H43 VanDerWaalsContact CB-CE1 3.45Å; W39-H43 WeakPolarHBondContact CB-CE1 3.2Å; W39-H43 PolarHBondContact O-N 2.9Å; W39-H43 VanDerWaalsContact O-N 3.12Å; W39-H43 PolarHBondContact O-ND1 3.43Å; L40-H43 PolarHBondContact O-N 2.84Å; H43-L45 PolarHBondContact O-N 3.29Å; H43-F46 PolarHBondContact O-N 3.1Å; H43-I47 WeakPolarHBondContact O-CB 3.27Å; H43-I47 WeakPolarHBondContact O-CD1 3.47Å; H43-I47 VanDerWaalsContact O-CG1 3.27Å; H43-I47 WeakPolarHBondContact O-CG1 3.38Å; H43-I47 PolarHBondContact O-N 3.26Å
44I95.3Very high95.1Very high75 Ų7583 Ų8339%0.38543%0.426SS..Hα-helixtrans-60.6-46.5177-68.7170.6000110.3I14 L40 P41 F46 I47 F48I14-I44 HydrophobicContact CG2-CD1 3.8Å; L40-I44 HydrophobicContact CD1-CD1 4.06Å; L40-I44 HydrophobicContact CD1-CG1 4.24Å; L40-I44 HydrophobicContact CD2-CD1 4.47Å; L40-I44 HydrophobicContact CG-CD1 3.87Å; L40-I44 HydrophobicContact CG-CG1 4.43Å; L40-I44 WeakPolarHBondContact O-CG1 3.29Å; L40-I44 PolarHBondContact O-N 3.44Å; P41-I44 PolarHBondContact O-N 3.23Å; I44-F46 PolarHBondContact O-N 2.9Å; I44-I47 PolarHBondContact O-N 3.45Å; I44-F48 WeakPolarHBondContact O-CB 3.48Å; I44-F48 PolarHBondContact O-N 3.49Å
45L96.5Very high95.4Very high115 Ų11583.1 Ų83.160%0.60243%0.427SS*.Hα-helixtrans-61.4-43.7179-174.962.3000112P41 F42 H43 F48 G49P41-L45 WeakPolarHBondContact O-CB 3.3Å; P41-L45 PolarHBondContact O-N 3.39Å; F42-L45 PolarHBondContact O-N 2.93Å; H43-L45 PolarHBondContact O-N 3.29Å; L45-F48 PolarHBondContact O-N 3.01Å; L45-G49 PolarHBondContact O-N 2.95Å
46F97.7Very high95.7Very high150 Ų15082.9 Ų82.966%0.65843%0.425SS*.Hα-helixtrans-63.5-46.5178.5-179.9-100.2000112.1F42 H43 I44 G49 T50F42-F46 WeakPolarHBondContact O-CB 3.36Å; F42-F46 PolarHBondContact O-N 3.34Å; H43-F46 PolarHBondContact O-N 3.1Å; I44-F46 PolarHBondContact O-N 2.9Å; F46-G49 PolarHBondContact O-N 3.43Å; F46-T50 WeakPolarHBondContact O-CB 3.44Å; F46-T50 PolarHBondContact O-N 2.84Å; F46-T50 PolarHBondContact O-OG1 3.4Å
47I96.9Very high95.9Very high104 Ų10484.1 Ų84.153%0.53343%0.432SS..Hα-helixtrans-62.5-48.5176.5-67.5164.3000109.9H43 I44 G49 T50 V51H43-I47 WeakPolarHBondContact O-CB 3.27Å; H43-I47 WeakPolarHBondContact O-CD1 3.47Å; H43-I47 VanDerWaalsContact O-CG1 3.27Å; H43-I47 WeakPolarHBondContact O-CG1 3.38Å; H43-I47 PolarHBondContact O-N 3.26Å; I44-I47 PolarHBondContact O-N 3.45Å; I47-G49 PolarHBondContact O-N 2.88Å; I47-T50 PolarHBondContact O-N 3.34Å; I47-V51 HydrophobicContact CG2-CG2 4.25Å; I47-V51 WeakPolarHBondContact O-CB 3.36Å; I47-V51 VanDerWaalsContact O-CG2 3.27Å; I47-V51 WeakPolarHBondContact O-CG2 3.44Å; I47-V51 PolarHBondContact O-N 3.39Å
48F96.7Very high96.1Very high137 Ų13790.6 Ų90.660%0.60146%0.456SS*.Hα-helixtrans-59.7-46.3179.7176.1-100.2000111.9I44 L45 S52I44-F48 WeakPolarHBondContact O-CB 3.48Å; I44-F48 PolarHBondContact O-N 3.49Å; L45-F48 PolarHBondContact O-N 3.01Å; F48-S52 VanDerWaalsContact O-CB 3.22Å; F48-S52 WeakPolarHBondContact O-CB 3.3Å; F48-S52 PolarHBondContact O-N 2.9Å; F48-S52 PolarHBondContact O-OG 3.32Å
49G98Very high96.1Very high31 Ų3195.6 Ų95.632%0.3247%0.469SS..Hα-helixtrans-61.7-48.717700000111.9L45 F46 I47 S52 V53L45-G49 PolarHBondContact O-N 2.95Å; F46-G49 PolarHBondContact O-N 3.43Å; I47-G49 PolarHBondContact O-N 2.88Å; G49-S52 PolarHBondContact O-N 3.3Å; G49-V53 WeakPolarHBondContact O-CG2 3.38Å; G49-V53 PolarHBondContact O-N 2.95Å
50T98.4Very high96.1Very high58 Ų5894 Ų9436%0.35648%0.475SS..Hα-helixtrans-60.4-49.7179.1-56.70000111.5F46 I47 S52 V53 L54F46-T50 WeakPolarHBondContact O-CB 3.44Å; F46-T50 PolarHBondContact O-N 2.84Å; F46-T50 PolarHBondContact O-OG1 3.4Å; I47-T50 PolarHBondContact O-N 3.34Å; T50-S52 VanDerWaalsContact C-N 3.32Å; T50-S52 PolarHBondContact O-N 3.11Å; T50-V53 PolarHBondContact O-N 2.87Å; T50-L54 HydrophobicContact CG2-CD1 4.09Å; T50-L54 WeakPolarHBondContact O-CB 3.22Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.47Å; T50-L54 PolarHBondContact O-N 3.27Å
51V98.1Very high95.9Very high68 Ų68102.3 Ų102.341%0.41251%0.505SS..Hα-helixtrans-61.2-42.5177.8170.30000111I47 L54 I55I47-V51 HydrophobicContact CG2-CG2 4.25Å; I47-V51 WeakPolarHBondContact O-CB 3.36Å; I47-V51 VanDerWaalsContact O-CG2 3.27Å; I47-V51 WeakPolarHBondContact O-CG2 3.44Å; I47-V51 PolarHBondContact O-N 3.39Å; V51-L54 PolarHBondContact O-N 3.39Å; V51-I55 HydrophobicContact CG1-CD1 3.65Å; V51-I55 HydrophobicContact CG1-CG1 4.37Å; V51-I55 WeakPolarHBondContact O-CB 3.25Å; V51-I55 VanDerWaalsContact O-CG1 3.25Å; V51-I55 WeakPolarHBondContact O-CG1 3.45Å; V51-I55 PolarHBondContact O-N 3.41Å
52S97.9Very high95.7Very high34 Ų34102.8 Ų102.824%0.23851%0.51CS..Hα-helixtrans-61.7-47.6177.9-62.50000111.6F48 G49 T50 I55 I56F48-S52 VanDerWaalsContact O-CB 3.22Å; F48-S52 WeakPolarHBondContact O-CB 3.3Å; F48-S52 PolarHBondContact O-N 2.9Å; F48-S52 PolarHBondContact O-OG 3.32Å; G49-S52 PolarHBondContact O-N 3.3Å; T50-S52 VanDerWaalsContact C-N 3.32Å; T50-S52 PolarHBondContact O-N 3.11Å; S52-I55 PolarHBondContact O-N 3.46Å; S52-I56 WeakPolarHBondContact O-CB 3.2Å; S52-I56 WeakPolarHBondContact O-CD1 3.32Å; S52-I56 VanDerWaalsContact O-CG1 3.22Å; S52-I56 WeakPolarHBondContact O-CG1 3.34Å; S52-I56 PolarHBondContact O-N 3.05Å
53V98.3Very high95Very high80 Ų80104.4 Ų104.449%0.48552%0.517SS..Hα-helixtrans-60.9-46.9177.3170.50000110.8G49 T50 I55 I56 L57G49-V53 WeakPolarHBondContact O-CG2 3.38Å; G49-V53 PolarHBondContact O-N 2.95Å; T50-V53 PolarHBondContact O-N 2.87Å; V53-I55 VanDerWaalsContact C-N 3.33Å; V53-I55 PolarHBondContact O-N 2.8Å; V53-I56 PolarHBondContact O-N 3.19Å; V53-L57 HydrophobicContact CG1-CD1 3.72Å; V53-L57 HydrophobicContact CG1-CG 4.15Å; V53-L57 WeakPolarHBondContact O-CB 3.46Å; V53-L57 VanDerWaalsContact O-CG 3.3Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 3.08Å
54L98.1Very high93.9Very high109 Ų109107 Ų10757%0.57153%0.534SS*.Hα-helixtrans-58.6-44.1177.6-72.5172.5000112.1T50 V51 Y58T50-L54 HydrophobicContact CG2-CD1 4.09Å; T50-L54 WeakPolarHBondContact O-CB 3.22Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.47Å; T50-L54 PolarHBondContact O-N 3.27Å; V51-L54 PolarHBondContact O-N 3.39Å; L54-Y58 WeakPolarHBondContact O-CB 3.45Å; L54-Y58 PolarHBondContact O-N 2.88Å
55I96.9Very high92.7Very high69 Ų69109.8 Ų109.835%0.35455%0.549SS..Hα-helixtrans-65.9-43.6178.3-71.2169.4000111.2V51 S52 V53 R59V51-I55 HydrophobicContact CG1-CD1 3.65Å; V51-I55 HydrophobicContact CG1-CG1 4.37Å; V51-I55 WeakPolarHBondContact O-CB 3.25Å; V51-I55 VanDerWaalsContact O-CG1 3.25Å; V51-I55 WeakPolarHBondContact O-CG1 3.45Å; V51-I55 PolarHBondContact O-N 3.41Å; S52-I55 PolarHBondContact O-N 3.46Å; V53-I55 VanDerWaalsContact C-N 3.33Å; V53-I55 PolarHBondContact O-N 2.8Å; I55-R59 HydrophobicContact CG2-CG 4.46Å; I55-R59 WeakPolarHBondContact O-CB 3.19Å; I55-R59 WeakPolarHBondContact O-CG 3.32Å; I55-R59 PolarHBondContact O-N 2.85Å
56I96.6Very high91.9Very high103 Ų103107.5 Ų107.553%0.52854%0.542SS..Hα-helixtrans-62.9-51.6178.5-68.9163.6000109.3S52 V53 Y58 R59 T60S52-I56 WeakPolarHBondContact O-CB 3.2Å; S52-I56 WeakPolarHBondContact O-CD1 3.32Å; S52-I56 VanDerWaalsContact O-CG1 3.22Å; S52-I56 WeakPolarHBondContact O-CG1 3.34Å; S52-I56 PolarHBondContact O-N 3.05Å; V53-I56 PolarHBondContact O-N 3.19Å; I56-Y58 VanDerWaalsContact C-N 3.34Å; I56-Y58 PolarHBondContact O-N 3.27Å; I56-R59 PolarHBondContact O-N 3.44Å; I56-T60 WeakPolarHBondContact O-CB 3.38Å; I56-T60 PolarHBondContact O-N 3.49Å; I56-T60 PolarHBondContact O-OG1 3.12Å; I56-T60 VanDerWaalsContact O-OG1 3.05Å
57L96Very high91.2Very high110 Ų110104.4 Ų104.458%0.57654%0.537SS*.Hα-helixtrans-57.3-47178-71.9175.5000111.6V53 R59 T60 Y61V53-L57 HydrophobicContact CG1-CD1 3.72Å; V53-L57 HydrophobicContact CG1-CG 4.15Å; V53-L57 WeakPolarHBondContact O-CB 3.46Å; V53-L57 VanDerWaalsContact O-CG 3.3Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 3.08Å; L57-R59 PolarHBondContact O-N 3.05Å; L57-T60 PolarHBondContact O-N 3.48Å; L57-Y61 WeakPolarHBondContact O-CB 3.42Å; L57-Y61 PolarHBondContact O-N 3.38Å
58Y94.9Very high90.6Very high163 Ų163106.8 Ų106.864%0.63955%0.546SS*.Hα-helixtrans-59.9-47.1177.1177.3-99.6000111.5L54 I56 Y61 S62L54-Y58 WeakPolarHBondContact O-CB 3.45Å; L54-Y58 PolarHBondContact O-N 2.88Å; I56-Y58 VanDerWaalsContact C-N 3.34Å; I56-Y58 PolarHBondContact O-N 3.27Å; Y58-Y61 PolarHBondContact O-N 3.22Å; Y58-S62 VanDerWaalsContact O-CB 3.24Å; Y58-S62 WeakPolarHBondContact O-CB 3.24Å; Y58-S62 PolarHBondContact O-N 2.8Å; Y58-S62 PolarHBondContact O-OG 3.26Å; Y58-S62 VanDerWaalsContact O-OG 3.08Å
59R92.6Very high90.2Very high174 Ų174102.5 Ų102.566%0.65754%0.536SS*.Hα-helixtrans-68.4-38.2-179.7-77.2-175.3176.2136.34.8112.9I55 I56 L57 S62 F63I55-R59 HydrophobicContact CG2-CG 4.46Å; I55-R59 WeakPolarHBondContact O-CB 3.19Å; I55-R59 WeakPolarHBondContact O-CG 3.32Å; I55-R59 PolarHBondContact O-N 2.85Å; I56-R59 PolarHBondContact O-N 3.44Å; L57-R59 PolarHBondContact O-N 3.05Å; R59-S62 CarbonylContact O-C 3.51Å; R59-F63 WeakPolarHBondContact O-CB 3.34Å; R59-F63 PolarHBondContact O-N 3.02Å
60T91.9Very high89.7Confident102 Ų102103.9 Ų103.963%0.62654%0.541SS*.Hα-helixtrans-66.8-43.4175.4-62.70000110.4I56 L57 F63I56-T60 WeakPolarHBondContact O-CB 3.38Å; I56-T60 PolarHBondContact O-N 3.49Å; I56-T60 PolarHBondContact O-OG1 3.12Å; I56-T60 VanDerWaalsContact O-OG1 3.05Å; L57-T60 PolarHBondContact O-N 3.48Å; T60-F63 WeakPolarHBondContact O-CB 3.47Å; T60-F63 PolarHBondContact O-N 3.04Å
61Y89.7Confident89.4Confident208 Ų208105.5 Ų105.582%0.81655%0.551SS**Hα-helixtrans-65.7-39.1176-176.8-95.3000112.5L57 Y58 F63L57-Y61 WeakPolarHBondContact O-CB 3.42Å; L57-Y61 PolarHBondContact O-N 3.38Å; Y58-Y61 PolarHBondContact O-N 3.22Å; Y61-F63 VanDerWaalsContact C-N 3.32Å
62S88.4Confident89.1Confident60 Ų60108.2 Ų108.242%0.4256%0.559SS.*THydrogen-bonded Turntrans-84.3-2.5176.2-61.30000113.9Y58 R59 N64Y58-S62 VanDerWaalsContact O-CB 3.24Å; Y58-S62 WeakPolarHBondContact O-CB 3.24Å; Y58-S62 PolarHBondContact O-N 2.8Å; Y58-S62 PolarHBondContact O-OG 3.26Å; Y58-S62 VanDerWaalsContact O-OG 3.08Å; R59-S62 CarbonylContact O-C 3.51Å; S62-N64 PolarHBondContact O-N 2.74Å
63F81.5Confident88.9Confident160 Ų160112.1 Ų112.170%0.70258%0.577SS**SBendtrans-7179.4167.9-167.7-100.1000105.5R59 T60 Y61 D65R59-F63 WeakPolarHBondContact O-CB 3.34Å; R59-F63 PolarHBondContact O-N 3.02Å; T60-F63 WeakPolarHBondContact O-CB 3.47Å; T60-F63 PolarHBondContact O-N 3.04Å; Y61-F63 VanDerWaalsContact C-N 3.32Å; F63-D65 PolarHBondContact O-N 2.81Å
64N70.9Confident88.7Confident136 Ų136114.2 Ų114.273%0.72758%0.583SS**  trans-52.4115.5178.4-177.959.2000106.4S62 C66S62-N64 PolarHBondContact O-N 2.74Å; N64-C66 PolarHBondContact O-N 2.95Å
65D71.2Confident88.6Confident134 Ų134116 Ų11672%0.71759%0.586SS**  trans-48.4117.6171.4-76-40.1000106.3F63 P67F63-D65 PolarHBondContact O-N 2.81Å; D65-P67 WeakPolarHBondContact O-CD 3.28Å
66C80Confident88.5Confident67 Ų67117.3 Ų117.345%0.45359%0.593SS.*  trans-99.879.9176-169.80000106.6N64 E68 A69 S70N64-C66 PolarHBondContact O-N 2.95Å; C66-E68 PolarHBondContact O-N 3.12Å; C66-A69 HydrophobicContact CB-CB 3.93Å; C66-A69 PolarHBondContact O-N 2.91Å; C66-A69 VanDerWaalsContact O-N 3.13Å; C66-A69 WeakPolarHBondContact SG-CB 3.43Å; C66-S70 PolarHBondContact O-N 3.46Å; C66-S70 VanDerWaalsContact O-N 3.1Å
67P81.4Confident88.4Confident85 Ų85115.8 Ų115.855%0.55259%0.589SS**Hα-helixtrans-60.5-29.9-178.526.2-36000110.8D65 S70 T71D65-P67 WeakPolarHBondContact O-CD 3.28Å; P67-S70 WeakPolarHBondContact CA-OG 3.49Å; P67-S70 PolarHBondContact O-N 3.33Å; P67-S70 PolarHBondContact O-OG 2.81Å; P67-T71 WeakPolarHBondContact O-CB 2.87Å; P67-T71 PolarHBondContact O-N 2.71Å; P67-T71 PolarHBondContact O-OG1 3.21Å
68E85.8Confident88.4Confident154 Ų154115.2 Ų115.272%0.7259%0.586SS**Hα-helixtrans-60.6-51.3174.2-173.2172.5-16900111.7C66 S70 T71 E72C66-E68 PolarHBondContact O-N 3.12Å; E68-S70 VanDerWaalsContact C-N 3.28Å; E68-S70 PolarHBondContact O-N 3.33Å; E68-T71 PolarHBondContact O-N 3.13Å; E68-T71 VanDerWaalsContact O-N 3.12Å; E68-E72 PolarHBondContact O-N 3.26Å
69A86.7Confident88.4Confident48 Ų48112.3 Ų112.340%0.39758%0.578SS.*Hα-helixtrans-61.3-37.3176.500000111.9C66 L73C66-A69 HydrophobicContact CB-CB 3.93Å; C66-A69 PolarHBondContact O-N 2.91Å; C66-A69 VanDerWaalsContact O-N 3.13Å; C66-A69 WeakPolarHBondContact SG-CB 3.43Å; A69-L73 VanDerWaalsContact O-CB 3.24Å; A69-L73 WeakPolarHBondContact O-CB 3.47Å; A69-L73 PolarHBondContact O-N 2.91Å
70S88.4Confident88.5Confident60 Ų60106.4 Ų106.442%0.4257%0.567SS.*Hα-helixtrans-64.8-40.5175.679.20000112.2C66 P67 E68 L73 M74C66-S70 PolarHBondContact O-N 3.46Å; C66-S70 VanDerWaalsContact O-N 3.1Å; P67-S70 WeakPolarHBondContact CA-OG 3.49Å; P67-S70 PolarHBondContact O-N 3.33Å; P67-S70 PolarHBondContact O-OG 2.81Å; E68-S70 VanDerWaalsContact C-N 3.28Å; E68-S70 PolarHBondContact O-N 3.33Å; S70-L73 PolarHBondContact O-N 3.1Å; S70-M74 WeakPolarHBondContact O-CB 3.5Å; S70-M74 VanDerWaalsContact O-CG 3.28Å; S70-M74 WeakPolarHBondContact O-CG 3.33Å; S70-M74 PolarHBondContact O-N 2.95Å
71T91.5Very high88.7Confident92 Ų92106.1 Ų106.156%0.56456%0.557SS**Hα-helixtrans-69.5-43.4-179.2-57.60000110.9P67 E68 M74 K75P67-T71 WeakPolarHBondContact O-CB 2.87Å; P67-T71 PolarHBondContact O-N 2.71Å; P67-T71 PolarHBondContact O-OG1 3.21Å; E68-T71 PolarHBondContact O-N 3.13Å; E68-T71 VanDerWaalsContact O-N 3.12Å; T71-M74 PolarHBondContact O-N 2.94Å; T71-K75 WeakPolarHBondContact O-CB 3.44Å; T71-K75 PolarHBondContact O-N 3.4Å
72E92.7Very high88.8Confident124 Ų124104.6 Ų104.658%0.57955%0.55SS*.Hα-helixtrans-61.8-46.4174.9-173.8179.9-164.500111.1E68 M74 K75 L76E68-E72 PolarHBondContact O-N 3.26Å; E72-M74 VanDerWaalsContact C-N 3.35Å; E72-M74 PolarHBondContact O-N 3.49Å; E72-K75 WeakPolarHBondContact O-CB 3.41Å; E72-K75 PolarHBondContact O-N 3.28Å; E72-L76 WeakPolarHBondContact O-CG 3.24Å; E72-L76 PolarHBondContact O-N 2.98Å
73L92.8Very high89.2Confident117 Ų117105.6 Ų105.661%0.61355%0.55SS*.Hα-helixtrans-59.9-44.9176.8-161.189.9000111.3A69 S70 K75 L76 V77A69-L73 VanDerWaalsContact O-CB 3.24Å; A69-L73 WeakPolarHBondContact O-CB 3.47Å; A69-L73 PolarHBondContact O-N 2.91Å; S70-L73 PolarHBondContact O-N 3.1Å; L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 3.49Å; L73-L76 PolarHBondContact O-N 3.42Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.45Å
74M94.7Very high89.8Confident124 Ų124100.9 Ų100.961%0.61153%0.532SS*.Hα-helixtrans-63.8-37.1177.2-75.3-174.875.200112.5S70 T71 E72 V77 N78S70-M74 WeakPolarHBondContact O-CB 3.5Å; S70-M74 VanDerWaalsContact O-CG 3.28Å; S70-M74 WeakPolarHBondContact O-CG 3.33Å; S70-M74 PolarHBondContact O-N 2.95Å; T71-M74 PolarHBondContact O-N 2.94Å; E72-M74 VanDerWaalsContact C-N 3.35Å; E72-M74 PolarHBondContact O-N 3.49Å; M74-V77 PolarHBondContact O-N 3.25Å; M74-N78 VanDerWaalsContact O-CG 3.31Å; M74-N78 PolarHBondContact O-N 3.43Å; M74-N78 PolarHBondContact O-ND2 2.91Å
75K95.8Very high90.9Very high147 Ų14798.3 Ų98.364%0.63952%0.521SS*.Hα-helixtrans-61.6-46.7174.3-176.6-175.9174.4-172.60111.1T71 E72 L73 V77 N78 E79T71-K75 WeakPolarHBondContact O-CB 3.44Å; T71-K75 PolarHBondContact O-N 3.4Å; E72-K75 WeakPolarHBondContact O-CB 3.41Å; E72-K75 PolarHBondContact O-N 3.28Å; L73-K75 VanDerWaalsContact C-N 3.33Å; L73-K75 PolarHBondContact O-N 3.49Å; K75-V77 PolarHBondContact O-N 3.19Å; K75-N78 PolarHBondContact O-N 3.38Å; K75-E79 PolarHBondContact O-N 2.95Å
76L95.5Very high92Very high95 Ų95101.9 Ų101.950%0.49753%0.526SS..Hα-helixtrans-63.1-40.1177.2-68.1172.9000112E72 L73 N78 E79 A80E72-L76 WeakPolarHBondContact O-CG 3.24Å; E72-L76 PolarHBondContact O-N 2.98Å; L73-L76 PolarHBondContact O-N 3.42Å; L76-N78 PolarHBondContact O-N 3.02Å; L76-E79 PolarHBondContact O-N 2.72Å; L76-A80 WeakPolarHBondContact O-CB 3.42Å; L76-A80 PolarHBondContact O-N 2.86Å
77V94.9Very high92.7Very high72 Ų72106.8 Ų106.844%0.43654%0.535SS..Hα-helixtrans-61.2-44.1174.7168.90000111.2L73 M74 K75 A80 K81L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.45Å; M74-V77 PolarHBondContact O-N 3.25Å; K75-V77 PolarHBondContact O-N 3.19Å; V77-A80 PolarHBondContact O-N 2.94Å; V77-K81 HydrophobicContact CG1-CD 4.46Å; V77-K81 WeakPolarHBondContact O-CB 3.43Å; V77-K81 WeakPolarHBondContact O-CG 3.39Å; V77-K81 PolarHBondContact O-N 3.45Å
78N94.7Very high93.3Very high98 Ų98105.7 Ų105.752%0.52454%0.54SS..Hα-helixtrans-67-39.2178.6-72.5-28.2000112.2M74 K75 L76 K81 R82M74-N78 VanDerWaalsContact O-CG 3.31Å; M74-N78 PolarHBondContact O-N 3.43Å; M74-N78 PolarHBondContact O-ND2 2.91Å; K75-N78 PolarHBondContact O-N 3.38Å; L76-N78 PolarHBondContact O-N 3.02Å; N78-K81 PolarHBondContact O-N 2.89Å; N78-R82 PolarHBondContact O-N 3.33Å
79E95.6Very high93.7Very high102 Ų102104.1 Ų104.148%0.47753%0.53SS..Hα-helixtrans-63.7-44.8174.7-176.3166.7-162.900111.8K75 L76 R82 D83K75-E79 PolarHBondContact O-N 2.95Å; L76-E79 PolarHBondContact O-N 2.72Å; E79-R82 WeakPolarHBondContact O-CB 3.43Å; E79-R82 PolarHBondContact O-N 3.4Å; E79-D83 PolarHBondContact O-N 3.22Å
80A95.2Very high93.9Very high50 Ų50108.5 Ų108.541%0.41355%0.552SS.*Hα-helixtrans-63.2-42.7175.700000112.2L76 V77 R82 D83 L84L76-A80 WeakPolarHBondContact O-CB 3.42Å; L76-A80 PolarHBondContact O-N 2.86Å; V77-A80 PolarHBondContact O-N 2.94Å; A80-R82 VanDerWaalsContact C-N 3.29Å; A80-R82 PolarHBondContact O-N 3.49Å; A80-D83 PolarHBondContact O-N 3.31Å; A80-L84 WeakPolarHBondContact O-CB 3.4Å; A80-L84 VanDerWaalsContact O-CG 3.31Å; A80-L84 WeakPolarHBondContact O-CG 3.41Å; A80-L84 PolarHBondContact O-N 3.47Å
81K94.6Very high93.7Very high95 Ų95109.8 Ų109.841%0.41355%0.55SS.*Hα-helixtrans-59.3-40.7174-80-173.9177.4-171.10111.6V77 N78 L84 T85 F91V77-K81 HydrophobicContact CG1-CD 4.46Å; V77-K81 WeakPolarHBondContact O-CB 3.43Å; V77-K81 WeakPolarHBondContact O-CG 3.39Å; V77-K81 PolarHBondContact O-N 3.45Å; N78-K81 PolarHBondContact O-N 2.89Å; K81-L84 PolarHBondContact O-N 2.94Å; K81-T85 WeakPolarHBondContact O-CB 3.31Å; K81-T85 PolarHBondContact O-N 3.02Å; K81-T85 PolarHBondContact O-OG1 3.39Å; K81-F91 HydrophobicContact CB-CE2 4.33Å; K81-F91 HydrophobicContact CG-CD2 4.41Å; K81-F91 HydrophobicContact CG-CE2 4.32Å; K81-F91 HydrophobicContact CG-CZ 4.38Å
82R93.2Very high93.2Very high177 Ų177114.7 Ų114.767%0.66857%0.567SS**Hα-helixtrans-66.2-44.4177.6-172.2179.564.6131.60.9112.1N78 E79 A80 L84 T85 Y86N78-R82 PolarHBondContact O-N 3.33Å; E79-R82 WeakPolarHBondContact O-CB 3.43Å; E79-R82 PolarHBondContact O-N 3.4Å; A80-R82 VanDerWaalsContact C-N 3.29Å; A80-R82 PolarHBondContact O-N 3.49Å; R82-L84 VanDerWaalsContact C-N 3.34Å; R82-T85 PolarHBondContact O-N 2.9Å; R82-Y86 PolarHBondContact O-N 2.99Å
83D95.6Very high92.1Very high80 Ų80117.9 Ų117.943%0.42860%0.603SS.*Hα-helixtrans-61.8-42.7175.8-173.167.6000111.5E79 A80 T85 Y86 R87E79-D83 PolarHBondContact O-N 3.22Å; A80-D83 PolarHBondContact O-N 3.31Å; D83-T85 PolarHBondContact O-N 2.95Å; D83-Y86 WeakPolarHBondContact O-CB 3.35Å; D83-Y86 PolarHBondContact O-N 3.17Å; D83-R87 WeakPolarHBondContact O-CG 3.35Å; D83-R87 PolarHBondContact O-N 3.33Å; D83-R87 WeakPolarHBondContact OD2-CD 3.43Å; D83-R87 IonicContact OD2-NE 3.07Å; D83-R87 PolarHBondContact OD2-NE 2.99Å
84L94.9Very high92.1Very high62 Ų62117.9 Ų117.933%0.32560%0.602SS.*Hα-helixtrans-67.5-36.7177-70.1172.7000112.3A80 K81 R82 Y86 R87 G88 F89 F91A80-L84 WeakPolarHBondContact O-CB 3.4Å; A80-L84 VanDerWaalsContact O-CG 3.31Å; A80-L84 WeakPolarHBondContact O-CG 3.41Å; A80-L84 PolarHBondContact O-N 3.47Å; K81-L84 PolarHBondContact O-N 2.94Å; R82-L84 VanDerWaalsContact C-N 3.34Å; L84-Y86 VanDerWaalsContact C-N 3.33Å; L84-Y86 PolarHBondContact O-N 3.07Å; L84-R87 CarbonylContact O-C 3.4Å; L84-R87 WeakPolarHBondContact O-CA 3.49Å; L84-R87 WeakPolarHBondContact O-CB 3.46Å; L84-R87 PolarHBondContact O-N 3.07Å; L84-R87 VanDerWaalsContact O-N 3.07Å; L84-G88 PolarHBondContact O-N 3.5Å; L84-F89 HydrophobicContact CB-CB 4.17Å; L84-F89 HydrophobicContact CB-CD2 4.28Å; L84-F89 HydrophobicContact CB-CG 4.48Å; L84-F89 HydrophobicContact CD2-CD2 3.99Å; L84-F89 HydrophobicContact CD2-CE2 4.21Å; L84-F89 WeakPolarHBondContact O-CB 3.41Å; L84-F89 WeakPolarHBondContact O-CD2 3.41Å; L84-F89 PolarHBondContact O-N 2.97Å; L84-F91 HydrophobicContact CB-CE2 3.71Å; L84-F91 HydrophobicContact CB-CZ 3.58Å; L84-F91 HydrophobicContact CD1-CE1 4.43Å; L84-F91 HydrophobicContact CD1-CZ 3.64Å; L84-F91 HydrophobicContact CG-CZ 4.25Å
85T94.5Very high92Very high82 Ų82117.6 Ų117.650%0.50360%0.602SS.*Hα-helixtrans-63.4-41.1173-54.60000111.1K81 R82 D83 R87 G88 F89K81-T85 WeakPolarHBondContact O-CB 3.31Å; K81-T85 PolarHBondContact O-N 3.02Å; K81-T85 PolarHBondContact O-OG1 3.39Å; R82-T85 PolarHBondContact O-N 2.9Å; D83-T85 PolarHBondContact O-N 2.95Å; T85-R87 PolarHBondContact O-N 3.37Å; T85-G88 PolarHBondContact O-N 3.25Å; T85-F89 WeakPolarHBondContact CA-O 3.49Å
86Y94Very high91.7Very high208 Ų208115.9 Ų115.982%0.81660%0.6SS**Hα-helixtrans-61.1-32.7172.4179.5-101.6000112.2R82 D83 L84 G88R82-Y86 PolarHBondContact O-N 2.99Å; D83-Y86 WeakPolarHBondContact O-CB 3.35Å; D83-Y86 PolarHBondContact O-N 3.17Å; L84-Y86 VanDerWaalsContact C-N 3.33Å; L84-Y86 PolarHBondContact O-N 3.07Å; Y86-G88 PolarHBondContact O-N 2.95Å
87R95.1Very high91.5Very high170 Ų170117.2 Ų117.264%0.64261%0.606SS**THydrogen-bonded Turntrans-79.83.7173.9-68167.4168.4-93.8-4114.3D83 L84 T85 F89D83-R87 WeakPolarHBondContact O-CG 3.35Å; D83-R87 PolarHBondContact O-N 3.33Å; D83-R87 WeakPolarHBondContact OD2-CD 3.43Å; D83-R87 IonicContact OD2-NE 3.07Å; D83-R87 PolarHBondContact OD2-NE 2.99Å; L84-R87 CarbonylContact O-C 3.4Å; L84-R87 WeakPolarHBondContact O-CA 3.49Å; L84-R87 WeakPolarHBondContact O-CB 3.46Å; L84-R87 PolarHBondContact O-N 3.07Å; L84-R87 VanDerWaalsContact O-N 3.07Å; T85-R87 PolarHBondContact O-N 3.37Å; R87-F89 HydrophobicContact CB-CD2 4.02Å; R87-F89 HydrophobicContact CB-CE2 4.2Å
88G94Very high91.3Very high63 Ų63120 Ų12065%0.64962%0.616SS**THydrogen-bonded Turntrans90.49.7175.500000115.5L84 T85 Y86L84-G88 PolarHBondContact O-N 3.5Å; T85-G88 PolarHBondContact O-N 3.25Å; Y86-G88 PolarHBondContact O-N 2.95Å
89F93.8Very high91.1Very high120 Ų120121.5 Ų121.553%0.52662%0.622SS.*  trans-81.6132.9173.1-67.2-91.9000110.6L84 T85 R87 F91L84-F89 HydrophobicContact CB-CB 4.17Å; L84-F89 HydrophobicContact CB-CD2 4.28Å; L84-F89 HydrophobicContact CB-CG 4.48Å; L84-F89 HydrophobicContact CD2-CD2 3.99Å; L84-F89 HydrophobicContact CD2-CE2 4.21Å; L84-F89 WeakPolarHBondContact O-CB 3.41Å; L84-F89 WeakPolarHBondContact O-CD2 3.41Å; L84-F89 PolarHBondContact O-N 2.97Å; T85-F89 WeakPolarHBondContact CA-O 3.49Å; R87-F89 HydrophobicContact CB-CD2 4.02Å; R87-F89 HydrophobicContact CB-CE2 4.2Å; F89-F91 HydrophobicContact CB-CE2 4.27Å; F89-F91 HydrophobicContact CB-CZ 4.37Å
90V89.7Confident90.8Very high140 Ų140122.9 Ų122.985%0.84863%0.633SS**  trans-104.6127.7174.3-177.30000108.1
91F86.1Confident90.4Very high88 Ų88128.5 Ų128.539%0.38665%0.65SS.*  trans-99.5130174.8-61.7-86.3000108.9K81 L84 F89K81-F91 HydrophobicContact CB-CE2 4.33Å; K81-F91 HydrophobicContact CG-CD2 4.41Å; K81-F91 HydrophobicContact CG-CE2 4.32Å; K81-F91 HydrophobicContact CG-CZ 4.38Å; L84-F91 HydrophobicContact CB-CE2 3.71Å; L84-F91 HydrophobicContact CB-CZ 3.58Å; L84-F91 HydrophobicContact CD1-CE1 4.43Å; L84-F91 HydrophobicContact CD1-CZ 3.64Å; L84-F91 HydrophobicContact CG-CZ 4.25Å; F89-F91 HydrophobicContact CB-CE2 4.27Å; F89-F91 HydrophobicContact CB-CZ 4.37Å
92E81.1Confident90.1Very high194 Ų194131.3 Ų131.391%0.90767%0.669SS**  trans-64.9138.9163.9-78-178.5150.200109.3
93S69.1Low89.8Confident191 Ų191127.1 Ų127.1100%1.33667%0.67SS**  trans-73.50177.861.50000112

Retrieved 93 of 93 residues in 322.6 ms (Link to these results)

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