G4VK41_SCHMA Loading...

Mitochondrial carrier protein-related

AlphaFold DB , UniProt , Accession G4VK41, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 348 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
1M63.8Low85.9Confident118 Ų11879.6 Ų79.658%0.58142%0.418SS*.  0133.30-178.6161.463.600109.2T5 K6 I9 L345M1-T5 HydrophobicContact CG-CG2 4.03Å; M1-T5 HydrophobicContact SD-CG2 4.1Å; M1-K6 HydrophobicContact CB-CG 4.16Å; M1-K6 HydrophobicContact CE-CB 4.14Å; M1-K6 HydrophobicContact CE-CD 4.1Å; M1-K6 HydrophobicContact CE-CG 3.54Å; M1-K6 HydrophobicContact CG-CG 3.81Å; M1-K6 WeakPolarHBondContact O-CE 3.43Å; M1-K6 HydrophobicContact SD-CG 4.33Å; M1-I9 HydrophobicContact CE-CD1 4.45Å; M1-I9 HydrophobicContact SD-CD1 3.72Å; M1-L345 HydrophobicContact CE-CB 4.16Å; M1-L345 HydrophobicContact CE-CD1 4.39Å; M1-L345 HydrophobicContact CE-CD2 3.94Å; M1-L345 HydrophobicContact CE-CG 4.4Å
2K81.6Confident86.3Confident165 Ų16579.7 Ų79.772%0.71743%0.43SS*.  trans-63.1146.1178.2-75.2-176.7177.5-178.60110.5D4 T5 K6K2-D4 PolarHBondContact O-N 3.36Å; K2-T5 WeakPolarHBondContact O-CB 3.47Å; K2-T5 PolarHBondContact O-N 3.45Å; K2-K6 WeakPolarHBondContact O-CG 3.41Å; K2-K6 PolarHBondContact O-N 3.36Å
3N84Confident86.8Confident108 Ų10879.2 Ų79.258%0.57843%0.426SS*.Hα-helixtrans-56.5-39.4-176.2-155.628.7000112.2T5 K6 N7N3-T5 VanDerWaalsContact C-N 3.35Å; N3-T5 PolarHBondContact O-N 2.92Å; N3-K6 WeakPolarHBondContact O-CB 3.33Å; N3-K6 PolarHBondContact O-N 2.75Å; N3-K6 VanDerWaalsContact O-N 3.14Å; N3-N7 PolarHBondContact O-N 3.42Å; N3-N7 PolarHBondContact O-ND2 3.26Å
4D86.4Confident87.2Confident116 Ų11673.7 Ų73.762%0.6240%0.397SS*.Hα-helixtrans-62-41.7178-53-30.6000112.3K2 N7 L8K2-D4 PolarHBondContact O-N 3.36Å; D4-N7 PolarHBondContact O-N 3.17Å; D4-L8 WeakPolarHBondContact O-CB 3.09Å; D4-L8 WeakPolarHBondContact O-CG 3.42Å; D4-L8 PolarHBondContact O-N 3.31Å
5T88.9Confident87.5Confident63 Ų6370.1 Ų70.139%0.38738%0.384SS..Hα-helixtrans-66.6-39175.7-47.20000111M1 K2 N3 L8 I9M1-T5 HydrophobicContact CG-CG2 4.03Å; M1-T5 HydrophobicContact SD-CG2 4.1Å; K2-T5 WeakPolarHBondContact O-CB 3.47Å; K2-T5 PolarHBondContact O-N 3.45Å; N3-T5 VanDerWaalsContact C-N 3.35Å; N3-T5 PolarHBondContact O-N 2.92Å; T5-L8 PolarHBondContact O-N 2.98Å; T5-I9 HydrophobicContact CG2-CD1 3.91Å; T5-I9 HydrophobicContact CG2-CG1 4.47Å; T5-I9 VanDerWaalsContact O-CG1 3.27Å; T5-I9 WeakPolarHBondContact O-CG1 3.45Å; T5-I9 PolarHBondContact O-N 3.44Å
6K88.2Confident87.9Confident29 Ų2972.3 Ų72.313%0.12639%0.389CS..Hα-helixtrans-59.1-50.1175.1-55.3-155.4167.1-163.70110.5M1 K2 N3 L8 I9 A10 L345 C348M1-K6 HydrophobicContact CB-CG 4.16Å; M1-K6 HydrophobicContact CE-CB 4.14Å; M1-K6 HydrophobicContact CE-CD 4.1Å; M1-K6 HydrophobicContact CE-CG 3.54Å; M1-K6 HydrophobicContact CG-CG 3.81Å; M1-K6 WeakPolarHBondContact O-CE 3.43Å; M1-K6 HydrophobicContact SD-CG 4.33Å; K2-K6 WeakPolarHBondContact O-CG 3.41Å; K2-K6 PolarHBondContact O-N 3.36Å; N3-K6 WeakPolarHBondContact O-CB 3.33Å; N3-K6 PolarHBondContact O-N 2.75Å; N3-K6 VanDerWaalsContact O-N 3.14Å; K6-L8 PolarHBondContact O-N 2.9Å; K6-I9 PolarHBondContact O-N 2.88Å; K6-A10 WeakPolarHBondContact O-CB 3.4Å; K6-A10 PolarHBondContact O-N 3.18Å; K6-L345 WeakPolarHBondContact CD-O 3.44Å; K6-L345 WeakPolarHBondContact CE-O 3.39Å; K6-L345 PolarHBondContact NZ-O 3.04Å; K6-L345 WeakPolarHBondContact O-CD1 3.48Å; K6-C348 PolarHBondContact NZ-OXT 3.12Å
7N88.8Confident88.3Confident66 Ų6669.5 Ų69.535%0.35338%0.375SS..Hα-helixtrans-64-40-179.1-67.8-21.7000112.3N3 D4 G11N3-N7 PolarHBondContact O-N 3.42Å; N3-N7 PolarHBondContact O-ND2 3.26Å; D4-N7 PolarHBondContact O-N 3.17Å; N7-G11 PolarHBondContact O-N 3.29Å
8L88.8Confident88.7Confident120 Ų12065.8 Ų65.863%0.62836%0.355SS*.Hα-helixtrans-63.9-43.5175.8-82171.2000112.3D4 T5 K6 S12D4-L8 WeakPolarHBondContact O-CB 3.09Å; D4-L8 WeakPolarHBondContact O-CG 3.42Å; D4-L8 PolarHBondContact O-N 3.31Å; T5-L8 PolarHBondContact O-N 2.98Å; K6-L8 PolarHBondContact O-N 2.9Å; L8-S12 VanDerWaalsContact O-CB 3.31Å; L8-S12 WeakPolarHBondContact O-CB 3.47Å; L8-S12 PolarHBondContact O-N 3.06Å; L8-S12 PolarHBondContact O-OG 2.68Å
9I91.3Very high88.9Confident63 Ų6365.5 Ų65.532%0.32335%0.348SS..Hα-helixtrans-67.5-46.4177.9-66.2168.9000110M1 T5 K6 G11 S12 L13 L345M1-I9 HydrophobicContact CE-CD1 4.45Å; M1-I9 HydrophobicContact SD-CD1 3.72Å; T5-I9 HydrophobicContact CG2-CD1 3.91Å; T5-I9 HydrophobicContact CG2-CG1 4.47Å; T5-I9 VanDerWaalsContact O-CG1 3.27Å; T5-I9 WeakPolarHBondContact O-CG1 3.45Å; T5-I9 PolarHBondContact O-N 3.44Å; K6-I9 PolarHBondContact O-N 2.88Å; I9-G11 VanDerWaalsContact C-N 3.35Å; I9-G11 PolarHBondContact O-N 3.15Å; I9-S12 PolarHBondContact O-N 3.47Å; I9-L13 HydrophobicContact CG2-CD1 3.79Å; I9-L13 HydrophobicContact CG2-CG 4.29Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.38Å; I9-L13 PolarHBondContact O-N 2.6Å; I9-L345 HydrophobicContact CB-CD1 3.97Å; I9-L345 HydrophobicContact CG2-CD1 3.79Å
10A92.3Very high89.2Confident0 Ų066.5 Ų66.50%035%0.35CS..Hα-helixtrans-58.7-45177.200000112K6 S14 F338 S342 L345K6-A10 WeakPolarHBondContact O-CB 3.4Å; K6-A10 PolarHBondContact O-N 3.18Å; A10-S14 WeakPolarHBondContact O-CB 3.47Å; A10-S14 PolarHBondContact O-N 3.02Å; A10-S14 PolarHBondContact O-OG 3.11Å; A10-F338 HydrophobicContact CB-CD2 4.14Å; A10-F338 HydrophobicContact CB-CE2 4.06Å; A10-S342 WeakPolarHBondContact CB-OG 3.31Å; A10-L345 HydrophobicContact CB-CD1 4.09Å
11G90.3Very high89.5Confident28 Ų2867 Ų6729%0.28935%0.353SS..Hα-helixtrans-65.8-37.8176.600000113.4N7 I9 S14 G15N7-G11 PolarHBondContact O-N 3.29Å; I9-G11 VanDerWaalsContact C-N 3.35Å; I9-G11 PolarHBondContact O-N 3.15Å; G11-S14 PolarHBondContact O-OG 2.85Å; G11-G15 PolarHBondContact O-N 2.7Å
12S90.6Very high90.9Very high80 Ų8061.5 Ų61.556%0.55933%0.326SS*.Hα-helixtrans-68.4-45177.2-60.80000111.6L8 I9 G15 F16L8-S12 VanDerWaalsContact O-CB 3.31Å; L8-S12 WeakPolarHBondContact O-CB 3.47Å; L8-S12 PolarHBondContact O-N 3.06Å; L8-S12 PolarHBondContact O-OG 2.68Å; I9-S12 PolarHBondContact O-N 3.47Å; S12-G15 PolarHBondContact O-N 2.71Å; S12-F16 WeakPolarHBondContact O-CB 3.47Å; S12-F16 PolarHBondContact O-N 3.06Å
13L93.2Very high91.5Very high73 Ų7353.7 Ų53.738%0.38229%0.291SS..Hα-helixtrans-66.3-42.7177.3-71173.7000111.5I9 F16 T17 Y341I9-L13 HydrophobicContact CG2-CD1 3.79Å; I9-L13 HydrophobicContact CG2-CG 4.29Å; I9-L13 WeakPolarHBondContact O-CB 3.33Å; I9-L13 WeakPolarHBondContact O-CG 3.38Å; I9-L13 PolarHBondContact O-N 2.6Å; L13-F16 PolarHBondContact O-N 2.75Å; L13-T17 WeakPolarHBondContact O-CB 3.43Å; L13-T17 PolarHBondContact O-N 3.34Å; L13-T17 PolarHBondContact O-OG1 2.88Å; L13-Y341 HydrophobicContact CB-CD1 4.49Å; L13-Y341 HydrophobicContact CB-CD2 3.75Å; L13-Y341 HydrophobicContact CB-CE1 4.48Å; L13-Y341 HydrophobicContact CB-CE2 3.74Å; L13-Y341 HydrophobicContact CB-CG 4.16Å; L13-Y341 HydrophobicContact CD1-CD1 4.39Å
14S93Very high92.1Very high3 Ų349.4 Ų49.42%0.02127%0.269CS..Hα-helixtrans-62.4-45.7176.272.10000111.1A10 G11 F16 T17 V18A10-S14 WeakPolarHBondContact O-CB 3.47Å; A10-S14 PolarHBondContact O-N 3.02Å; A10-S14 PolarHBondContact O-OG 3.11Å; G11-S14 PolarHBondContact O-OG 2.85Å; S14-F16 PolarHBondContact O-N 3.34Å; S14-T17 PolarHBondContact O-N 3.26Å; S14-V18 WeakPolarHBondContact O-CB 3.47Å; S14-V18 WeakPolarHBondContact O-CG2 3.27Å; S14-V18 PolarHBondContact O-N 3.49Å
15G91.6Very high92.5Very high19 Ų1945 Ų4520%0.19625%0.246CC..Hα-helixtrans-57.6-45.8175.400000112.5G11 S12 R19G11-G15 PolarHBondContact O-N 2.7Å; S12-G15 PolarHBondContact O-N 2.71Å; G15-R19 WeakPolarHBondContact O-CB 3.33Å; G15-R19 VanDerWaalsContact O-CG 3.31Å; G15-R19 WeakPolarHBondContact O-CG 3.5Å; G15-R19 PolarHBondContact O-N 3.09Å; G15-R19 VanDerWaalsContact O-N 3.16Å
16F93.8Very high92.8Very high105 Ų10542.2 Ų42.246%0.46123%0.228SC..Hα-helixtrans-62.1-51.5177.4-177.4-89.7000111.9S12 L13 S14 R19 F20 Q74S12-F16 WeakPolarHBondContact O-CB 3.47Å; S12-F16 PolarHBondContact O-N 3.06Å; L13-F16 PolarHBondContact O-N 2.75Å; S14-F16 PolarHBondContact O-N 3.34Å; F16-R19 PolarHBondContact O-N 3.46Å; F16-F20 PolarHBondContact O-N 3.19Å; F16-Q74 HydrophobicContact CD2-CG 4.23Å; F16-Q74 HydrophobicContact CE2-CG 4.01Å; F16-Q74 PolarHBondContact O-NE2 3.44Å
17T94.9Very high93.1Very high25 Ų2540.8 Ų40.815%0.15322%0.222CC..Hα-helixtrans-64.3-44-177-620000111.9L13 S14 R19 F20 L21 F337 Y341L13-T17 WeakPolarHBondContact O-CB 3.43Å; L13-T17 PolarHBondContact O-N 3.34Å; L13-T17 PolarHBondContact O-OG1 2.88Å; S14-T17 PolarHBondContact O-N 3.26Å; T17-R19 VanDerWaalsContact C-N 3.33Å; T17-R19 PolarHBondContact O-N 2.87Å; T17-F20 WeakPolarHBondContact O-CB 3.44Å; T17-F20 PolarHBondContact O-N 3.25Å; T17-F20 VanDerWaalsContact O-N 3.14Å; T17-L21 HydrophobicContact CG2-CD1 4.02Å; T17-L21 HydrophobicContact CG2-CG 4.45Å; T17-L21 WeakPolarHBondContact O-CG 3.27Å; T17-L21 PolarHBondContact O-N 3.46Å; T17-F337 HydrophobicContact CG2-CD1 3.93Å; T17-F337 HydrophobicContact CG2-CD2 4.25Å; T17-F337 HydrophobicContact CG2-CE1 3.61Å; T17-F337 HydrophobicContact CG2-CE2 3.97Å; T17-F337 HydrophobicContact CG2-CG 4.24Å; T17-F337 HydrophobicContact CG2-CZ 3.61Å; T17-Y341 PolarHBondContact OG1-OH 3.28Å
18V94.6Very high93.4Very high3 Ų337.8 Ų37.82%0.01821%0.206CC..Hα-helixtrans-62.8-41.1177.6174.20000111.1S14 F20 L21 T22 T330 L333 M334 F337S14-V18 WeakPolarHBondContact O-CB 3.47Å; S14-V18 WeakPolarHBondContact O-CG2 3.27Å; S14-V18 PolarHBondContact O-N 3.49Å; V18-F20 VanDerWaalsContact C-N 3.32Å; V18-F20 PolarHBondContact O-N 3.31Å; V18-L21 PolarHBondContact O-N 3.04Å; V18-T22 HydrophobicContact CG1-CG2 4.1Å; V18-T22 WeakPolarHBondContact O-CB 3.45Å; V18-T22 VanDerWaalsContact O-CG2 3.23Å; V18-T22 WeakPolarHBondContact O-CG2 2.93Å; V18-T22 PolarHBondContact O-N 2.95Å; V18-T22 PolarHBondContact O-OG1 3.24Å; V18-T330 HydrophobicContact CG1-CG2 3.79Å; V18-L333 HydrophobicContact CG1-CB 4.28Å; V18-L333 HydrophobicContact CG2-CB 3.88Å; V18-M334 HydrophobicContact CG2-CB 4.35Å; V18-F337 HydrophobicContact CG2-CD2 3.95Å
19R92.5Very high93.6Very high60 Ų6032.9 Ų32.923%0.22618%0.18CC..Hα-helixtrans-65.4-36.4174.9-73.1-169.382.7113.3-3.2112.2G15 F16 T17 Q23 A73 S77G15-R19 WeakPolarHBondContact O-CB 3.33Å; G15-R19 VanDerWaalsContact O-CG 3.31Å; G15-R19 WeakPolarHBondContact O-CG 3.5Å; G15-R19 PolarHBondContact O-N 3.09Å; G15-R19 VanDerWaalsContact O-N 3.16Å; F16-R19 PolarHBondContact O-N 3.46Å; T17-R19 VanDerWaalsContact C-N 3.33Å; T17-R19 PolarHBondContact O-N 2.87Å; R19-Q23 WeakPolarHBondContact O-CB 3.47Å; R19-Q23 PolarHBondContact O-N 3.46Å; R19-Q23 VanDerWaalsContact O-N 3.1Å; R19-A73 VanDerWaalsContact CZ-O 3.28Å; R19-A73 PolarHBondContact NE-O 3.37Å; R19-A73 PolarHBondContact NH2-O 3.07Å; R19-S77 VanDerWaalsContact CD-OG 3.29Å; R19-S77 WeakPolarHBondContact CD-OG 3.36Å; R19-S77 PolarHBondContact NE-OG 3.46Å; R19-S77 VanDerWaalsContact NE-OG 3.14Å; R19-S77 PolarHBondContact NH1-OG 3.48Å
20F95Very high93.8Very high86 Ų8630 Ų3038%0.37717%0.165SC..Hα-helixtrans-63.5-45.6174.9-179.7-92.3000111.6F16 T17 V18 Q23 W67 H70F16-F20 PolarHBondContact O-N 3.19Å; T17-F20 WeakPolarHBondContact O-CB 3.44Å; T17-F20 PolarHBondContact O-N 3.25Å; T17-F20 VanDerWaalsContact O-N 3.14Å; V18-F20 VanDerWaalsContact C-N 3.32Å; V18-F20 PolarHBondContact O-N 3.31Å; F20-Q23 WeakPolarHBondContact O-CB 3.35Å; F20-W67 AromaticContact CD2-CD1 3.87Å; F20-W67 AromaticContact CD2-NE1 3.46Å; F20-W67 HydrophobicContact CE1-CZ2 4.03Å; F20-W67 AromaticContact CE1-NE1 3.82Å; F20-W67 AromaticContact CE2-CD1 3.64Å; F20-W67 AromaticContact CE2-NE1 3.21Å; F20-W67 AromaticContact CG-NE1 3.86Å; F20-W67 AromaticContact CZ-CE2 3.83Å; F20-W67 HydrophobicContact CZ-CZ2 4.03Å; F20-W67 AromaticContact CZ-NE1 3.41Å; F20-W67 PolarHBondContact O-NE1 2.95Å; F20-H70 VanDerWaalsContact CA-CE1 3.42Å; F20-H70 WeakPolarHBondContact CA-CE1 3.14Å; F20-H70 AromaticContact CD2-NE2 3.87Å
21L94.9Very high93.8Very high78 Ų7830.1 Ų30.141%0.40817%0.166SC..Hα-helixtrans-72.3-33.8-179.5-66.8173.9000113.4T17 V18 P24 L333 F337T17-L21 HydrophobicContact CG2-CD1 4.02Å; T17-L21 HydrophobicContact CG2-CG 4.45Å; T17-L21 WeakPolarHBondContact O-CG 3.27Å; T17-L21 PolarHBondContact O-N 3.46Å; V18-L21 PolarHBondContact O-N 3.04Å; L21-P24 WeakPolarHBondContact O-CD 3.12Å; L21-L333 HydrophobicContact CB-CD1 4.22Å; L21-L333 HydrophobicContact CD1-CD1 4.08Å; L21-F337 HydrophobicContact CD1-CD2 4.48Å; L21-F337 HydrophobicContact CD1-CE2 3.34Å; L21-F337 HydrophobicContact CD1-CZ 3.49Å; L21-F337 VanDerWaalsContact CD1-CZ 3.49Å
22T94Very high93.8Very high2 Ų229.2 Ų29.21%0.01215%0.154CC..Hα-helixtrans-86.3-6.5179.959.40000113.5V18 P24 L25 D26 L329V18-T22 HydrophobicContact CG1-CG2 4.1Å; V18-T22 WeakPolarHBondContact O-CB 3.45Å; V18-T22 VanDerWaalsContact O-CG2 3.23Å; V18-T22 WeakPolarHBondContact O-CG2 2.93Å; V18-T22 PolarHBondContact O-N 2.95Å; V18-T22 PolarHBondContact O-OG1 3.24Å; T22-P24 VanDerWaalsContact C-CD 3.48Å; T22-L25 WeakPolarHBondContact O-CB 3.27Å; T22-L25 PolarHBondContact O-N 3.37Å; T22-L25 VanDerWaalsContact O-N 3.11Å; T22-D26 PolarHBondContact O-N 3.35Å; T22-L329 HydrophobicContact CG2-CD2 3.34Å
23Q95.3Very high93.9Very high0 Ų025.4 Ų25.40%013%0.127CC..Hα-helixtrans-55.9-41.6-178.3-172.768.119.900114R19 F20 L25 D26 V27 W67 K68 H70R19-Q23 WeakPolarHBondContact O-CB 3.47Å; R19-Q23 PolarHBondContact O-N 3.46Å; R19-Q23 VanDerWaalsContact O-N 3.1Å; F20-Q23 WeakPolarHBondContact O-CB 3.35Å; Q23-L25 VanDerWaalsContact C-N 3.26Å; Q23-L25 PolarHBondContact O-N 2.98Å; Q23-D26 WeakPolarHBondContact O-CA 3.22Å; Q23-D26 WeakPolarHBondContact O-CB 3.38Å; Q23-D26 PolarHBondContact O-N 3.39Å; Q23-V27 PolarHBondContact O-N 3.39Å; Q23-W67 HydrophobicContact CG-CG 4.43Å; Q23-K68 PolarHBondContact NE2-O 3.44Å; Q23-H70 HydrophobicContact CG-CB 4.06Å; Q23-H70 PolarHBondContact OE1-ND1 2.91Å
24P96Very high93.7Very high18 Ų1821.9 Ų21.912%0.11711%0.109CC..Hα-helixtrans-57.9-38.3176.9-2737.1000113L21 T22 D26 V27 I28 L66 W67L21-P24 WeakPolarHBondContact O-CD 3.12Å; T22-P24 VanDerWaalsContact C-CD 3.48Å; P24-D26 VanDerWaalsContact C-N 3.33Å; P24-V27 PolarHBondContact O-N 2.87Å; P24-I28 VanDerWaalsContact O-CG1 3.26Å; P24-I28 WeakPolarHBondContact O-CG1 3.18Å; P24-I28 PolarHBondContact O-N 2.93Å; P24-L66 WeakPolarHBondContact CA-O 3.25Å; P24-L66 HydrophobicContact CB-CB 4.15Å; P24-L66 HydrophobicContact CB-CD2 4.27Å; P24-L66 HydrophobicContact CG-CB 4.23Å; P24-W67 HydrophobicContact CG-CH2 4.21Å; P24-W67 HydrophobicContact CG-CZ2 4.27Å; P24-W67 HydrophobicContact CG-CZ3 4.43Å
25L95.1Very high93.4Very high23 Ų2321.8 Ų21.812%0.1211%0.108CC..Hα-helixtrans-69-32.9176.2-67.9175.6000112.1T22 Q23 K29 L325 K326 L329T22-L25 WeakPolarHBondContact O-CB 3.27Å; T22-L25 PolarHBondContact O-N 3.37Å; T22-L25 VanDerWaalsContact O-N 3.11Å; Q23-L25 VanDerWaalsContact C-N 3.26Å; Q23-L25 PolarHBondContact O-N 2.98Å; L25-K29 VanDerWaalsContact O-CB 3.28Å; L25-K29 WeakPolarHBondContact O-CB 3.42Å; L25-K29 PolarHBondContact O-N 3.47Å; L25-L325 HydrophobicContact CD1-CD2 4.33Å; L25-L325 HydrophobicContact CD1-CG 4.12Å; L25-L325 HydrophobicContact CD2-CD2 3.79Å; L25-L325 HydrophobicContact CD2-CG 4.41Å; L25-K326 HydrophobicContact CB-CB 4.1Å; L25-K326 HydrophobicContact CD1-CB 4.16Å; L25-L329 HydrophobicContact CD1-CD1 4.24Å
26D93.8Very high92.8Very high5 Ų521.2 Ų21.23%0.02710%0.101CC..Hα-helixtrans-67.4-43.7173.3-86.7-37.8000112.6T22 Q23 P24 I28 K29 I30 R132 K326T22-D26 PolarHBondContact O-N 3.35Å; Q23-D26 WeakPolarHBondContact O-CA 3.22Å; Q23-D26 WeakPolarHBondContact O-CB 3.38Å; Q23-D26 PolarHBondContact O-N 3.39Å; P24-D26 VanDerWaalsContact C-N 3.33Å; D26-I28 VanDerWaalsContact C-N 3.3Å; D26-I28 PolarHBondContact O-N 3.47Å; D26-K29 PolarHBondContact O-N 2.96Å; D26-I30 WeakPolarHBondContact O-CB 3.46Å; D26-I30 WeakPolarHBondContact O-CG1 3.45Å; D26-I30 PolarHBondContact O-N 2.9Å; D26-R132 VanDerWaalsContact CB-NH2 3.29Å; D26-R132 IonicContact OD1-NH2 3.14Å; D26-R132 IonicContact OD2-CZ 2.71Å; D26-R132 IonicContact OD2-NH2 3.21Å; D26-R132 PolarHBondContact OD2-NH2 2.87Å; D26-K326 WeakPolarHBondContact OD1-CD 3.19Å; D26-K326 WeakPolarHBondContact OD1-CE 3.37Å; D26-K326 IonicContact OD1-NZ 2.71Å; D26-K326 PolarHBondContact OD1-NZ 3.03Å; D26-K326 WeakPolarHBondContact OD2-CE 3.27Å; D26-K326 IonicContact OD2-NZ 3.51Å; D26-K326 PolarHBondContact OD2-NZ 3.18Å
27V95.2Very high91.9Very high0 Ų017 Ų170%08%0.083CC..Hα-helixtrans-57.8-48.5175.2169.60000109.7Q23 P24 R31 I57 L66 I136Q23-V27 PolarHBondContact O-N 3.39Å; P24-V27 PolarHBondContact O-N 2.87Å; V27-R31 VanDerWaalsContact O-CB 3.29Å; V27-R31 WeakPolarHBondContact O-CB 3.49Å; V27-R31 VanDerWaalsContact O-CG 3.27Å; V27-R31 WeakPolarHBondContact O-CG 3.43Å; V27-R31 PolarHBondContact O-N 3.48Å; V27-I57 HydrophobicContact CG1-CD1 4.3Å; V27-L66 WeakPolarHBondContact CG2-O 3.45Å; V27-I136 HydrophobicContact CB-CG2 4.38Å; V27-I136 HydrophobicContact CG1-CG2 4.17Å; V27-I136 HydrophobicContact CG2-CD1 4.26Å; V27-I136 HydrophobicContact CG2-CG1 4.18Å; V27-I136 HydrophobicContact CG2-CG2 4.45Å
28I94.8Very high90.9Very high3 Ų318 Ų182%0.0159%0.087CC..Hα-helixtrans-64.3-47.4178.9-65.4166.5000110.7P24 D26 I30 R31 F32 L50 A53 F54 I57 P322P24-I28 VanDerWaalsContact O-CG1 3.26Å; P24-I28 WeakPolarHBondContact O-CG1 3.18Å; P24-I28 PolarHBondContact O-N 2.93Å; D26-I28 VanDerWaalsContact C-N 3.3Å; D26-I28 PolarHBondContact O-N 3.47Å; I28-I30 PolarHBondContact O-N 2.78Å; I28-R31 PolarHBondContact O-N 3.1Å; I28-F32 HydrophobicContact CG2-CD2 3.47Å; I28-F32 VanDerWaalsContact CG2-CD2 3.47Å; I28-F32 HydrophobicContact CG2-CE2 3.5Å; I28-F32 VanDerWaalsContact O-CD2 3.31Å; I28-F32 WeakPolarHBondContact O-CD2 3.27Å; I28-F32 PolarHBondContact O-N 3.17Å; I28-L50 HydrophobicContact CG2-CD1 3.65Å; I28-A53 HydrophobicContact CG2-CB 4.29Å; I28-F54 HydrophobicContact CD1-CB 4Å; I28-F54 HydrophobicContact CD1-CD2 4.02Å; I28-I57 HydrophobicContact CG1-CD1 3.86Å; I28-P322 HydrophobicContact CG2-CB 4.21Å; I28-P322 HydrophobicContact CG2-CG 4.37Å
29K94.3Very high89.7Confident16 Ų1619 Ų197%0.079%0.092CC..Hα-helixtrans-51-56.2176.7178.8-161175.2-161.60110.8L25 D26 R31 F32 Q33 D254 P322L25-K29 VanDerWaalsContact O-CB 3.28Å; L25-K29 WeakPolarHBondContact O-CB 3.42Å; L25-K29 PolarHBondContact O-N 3.47Å; D26-K29 PolarHBondContact O-N 2.96Å; K29-R31 VanDerWaalsContact C-N 3.32Å; K29-R31 PolarHBondContact O-N 3.01Å; K29-F32 PolarHBondContact O-N 2.82Å; K29-Q33 WeakPolarHBondContact O-CG 3.44Å; K29-Q33 PolarHBondContact O-N 3.33Å; K29-D254 IonicContact NZ-OD2 3.68Å; K29-D254 PolarHBondContact NZ-OD2 3.46Å; K29-P322 HydrophobicContact CB-CB 4.19Å; K29-P322 HydrophobicContact CB-CG 4.25Å
30I94.1Very high88.6Confident4 Ų421.7 Ų21.72%0.02111%0.105CC..Hα-helixtrans-63.1-43.7-175.6-72167.3000109.4D26 I28 F32 Q33 L34 T133 I136D26-I30 WeakPolarHBondContact O-CB 3.46Å; D26-I30 WeakPolarHBondContact O-CG1 3.45Å; D26-I30 PolarHBondContact O-N 2.9Å; I28-I30 PolarHBondContact O-N 2.78Å; I30-F32 PolarHBondContact O-N 3.03Å; I30-Q33 WeakPolarHBondContact O-CB 3.29Å; I30-Q33 PolarHBondContact O-N 3.42Å; I30-Q33 VanDerWaalsContact O-N 3.1Å; I30-L34 HydrophobicContact CG2-CD1 3.56Å; I30-L34 HydrophobicContact CG2-CG 4.13Å; I30-L34 WeakPolarHBondContact O-CB 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.26Å; I30-L34 PolarHBondContact O-N 3.06Å; I30-T133 HydrophobicContact CG2-CG2 3.99Å; I30-I136 HydrophobicContact CB-CG2 3.86Å; I30-I136 HydrophobicContact CD1-CD1 3.51Å; I30-I136 HydrophobicContact CG2-CB 4.21Å; I30-I136 HydrophobicContact CG2-CG2 3.64Å
31R92.3Very high86.9Confident1 Ų123.5 Ų23.50%0.00413%0.126CC..Hα-helixtrans-59.2-42176.4-80.5-177.9176.5-137.30.1113.9V27 I28 K29 L34 Q35 Y47 E61 I136 Q138 F272V27-R31 VanDerWaalsContact O-CB 3.29Å; V27-R31 WeakPolarHBondContact O-CB 3.49Å; V27-R31 VanDerWaalsContact O-CG 3.27Å; V27-R31 WeakPolarHBondContact O-CG 3.43Å; V27-R31 PolarHBondContact O-N 3.48Å; I28-R31 PolarHBondContact O-N 3.1Å; K29-R31 VanDerWaalsContact C-N 3.32Å; K29-R31 PolarHBondContact O-N 3.01Å; R31-L34 PolarHBondContact O-N 3.11Å; R31-Q35 PolarHBondContact O-N 2.77Å; R31-Y47 HydrophobicContact CB-CE2 3.91Å; R31-Y47 PolarHBondContact NH1-OH 3.27Å; R31-Y47 VanDerWaalsContact NH1-OH 3.1Å; R31-E61 IonicContact CZ-OE1 2.65Å; R31-E61 IonicContact CZ-OE2 3.51Å; R31-E61 IonicContact NH1-OE1 3.6Å; R31-E61 PolarHBondContact NH1-OE1 2.92Å; R31-E61 IonicContact NH1-OE2 2.69Å; R31-E61 IonicContact NH2-OE1 2.63Å; R31-E61 PolarHBondContact NH2-OE1 3.1Å; R31-E61 IonicContact NH2-OE2 3.63Å; R31-E61 PolarHBondContact NH2-OE2 2.88Å; R31-I136 HydrophobicContact CG-CG2 4.2Å; R31-I136 PolarHBondContact NE-O 3.31Å; R31-I136 VanDerWaalsContact NE-O 3.11Å; R31-I136 PolarHBondContact NH2-O 3.12Å; R31-Q138 PolarHBondContact NH2-O 3.4Å; R31-F272 HydrophobicContact CB-CE2 4.14Å; R31-F272 HydrophobicContact CB-CZ 3.72Å; R31-F272 HydrophobicContact CG-CE2 3.85Å; R31-F272 HydrophobicContact CG-CZ 3.76Å
32F91.8Very high85.1Confident9 Ų925.8 Ų25.84%0.03915%0.148CC..Hα-helixtrans-64.5-39.7173.6-90.6-82.8000112.5I28 K29 I30 L34 Q35 I39 Y47 A53 G319 P322I28-F32 HydrophobicContact CG2-CD2 3.47Å; I28-F32 VanDerWaalsContact CG2-CD2 3.47Å; I28-F32 HydrophobicContact CG2-CE2 3.5Å; I28-F32 VanDerWaalsContact O-CD2 3.31Å; I28-F32 WeakPolarHBondContact O-CD2 3.27Å; I28-F32 PolarHBondContact O-N 3.17Å; K29-F32 PolarHBondContact O-N 2.82Å; I30-F32 PolarHBondContact O-N 3.03Å; F32-L34 VanDerWaalsContact C-N 3.25Å; F32-L34 PolarHBondContact O-N 3.26Å; F32-Q35 PolarHBondContact O-N 2.89Å; F32-I39 HydrophobicContact CD1-CD1 3.56Å; F32-I39 HydrophobicContact CD1-CG1 4.12Å; F32-I39 HydrophobicContact CE1-CD1 3.8Å; F32-I39 HydrophobicContact CE1-CG1 4.1Å; F32-I39 HydrophobicContact CE1-CG2 4.21Å; F32-Y47 HydrophobicContact CZ-CG 4.47Å; F32-A53 HydrophobicContact CE2-CB 3.6Å; F32-A53 HydrophobicContact CZ-CB 4.05Å; F32-G319 VanDerWaalsContact CB-CA 3.47Å; F32-P322 HydrophobicContact CD2-CG 4.37Å
33Q91.3Very high83.5Confident0 Ų028 Ų280%017%0.171CC..Hα-helixtrans-64-34.4175.8-74179.9-48.700112.1K29 I30 Y251 L255 K258 R259 K318K29-Q33 WeakPolarHBondContact O-CG 3.44Å; K29-Q33 PolarHBondContact O-N 3.33Å; I30-Q33 WeakPolarHBondContact O-CB 3.29Å; I30-Q33 PolarHBondContact O-N 3.42Å; I30-Q33 VanDerWaalsContact O-N 3.1Å; Q33-Y251 WeakPolarHBondContact CG-OH 3.32Å; Q33-Y251 PolarHBondContact NE2-OH 3.27Å; Q33-Y251 VanDerWaalsContact NE2-OH 3.08Å; Q33-L255 VanDerWaalsContact CA-CD1 3.43Å; Q33-L255 HydrophobicContact CB-CD1 3.63Å; Q33-L255 HydrophobicContact CG-CD1 3.93Å; Q33-L255 WeakPolarHBondContact O-CD1 3.28Å; Q33-K258 HydrophobicContact CB-CB 4.38Å; Q33-R259 PolarHBondContact O-NE 3.23Å; Q33-R259 VanDerWaalsContact O-NE 3.1Å; Q33-K318 WeakPolarHBondContact CG-O 3.36Å
34L89.4Confident82.2Confident0 Ų036.7 Ų36.70%021%0.209CC..Hα-helixtrans-80-27.2-179.3-68.1173.8000113.1I30 R31 F32 V36 T133 A137 K258 I262 R269 F272I30-L34 HydrophobicContact CG2-CD1 3.56Å; I30-L34 HydrophobicContact CG2-CG 4.13Å; I30-L34 WeakPolarHBondContact O-CB 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.26Å; I30-L34 PolarHBondContact O-N 3.06Å; R31-L34 PolarHBondContact O-N 3.11Å; F32-L34 VanDerWaalsContact C-N 3.25Å; F32-L34 PolarHBondContact O-N 3.26Å; L34-V36 PolarHBondContact O-N 2.96Å; L34-T133 HydrophobicContact CD1-CG2 4.41Å; L34-T133 HydrophobicContact CD2-CG2 4.48Å; L34-A137 HydrophobicContact CD1-CB 3.62Å; L34-K258 HydrophobicContact CD2-CB 4.28Å; L34-K258 VanDerWaalsContact CD2-O 3.31Å; L34-K258 WeakPolarHBondContact CD2-O 3.1Å; L34-I262 HydrophobicContact CD1-CD1 3.2Å; L34-I262 HydrophobicContact CD1-CG1 4.44Å; L34-I262 HydrophobicContact CD2-CB 4.46Å; L34-I262 HydrophobicContact CD2-CD1 3.25Å; L34-I262 HydrophobicContact CD2-CG1 3.79Å; L34-I262 HydrophobicContact CG-CD1 3.74Å; L34-R269 VanDerWaalsContact O-CZ 3.3Å; L34-R269 PolarHBondContact O-NH1 3.23Å; L34-R269 PolarHBondContact O-NH2 3.1Å; L34-F272 HydrophobicContact CB-CE1 4.27Å
35Q86.2Confident81.3Confident1 Ų136.5 Ų36.51%0.00521%0.208CC..  trans-59.2125.7177.8-169.8179.1-5600110.3R31 F32 E37 S45 Y47 R259R31-Q35 PolarHBondContact O-N 2.77Å; F32-Q35 PolarHBondContact O-N 2.89Å; Q35-E37 WeakPolarHBondContact CG-OE2 3.46Å; Q35-E37 PolarHBondContact NE2-O 3.48Å; Q35-S45 PolarHBondContact NE2-OG 3.47Å; Q35-Y47 PolarHBondContact NE2-O 2.87Å; Q35-Y47 VanDerWaalsContact OE1-CD2 3.3Å; Q35-R259 PolarHBondContact O-NH2 3.49Å
36V79.5Confident80.5Confident7 Ų736.4 Ų36.44%0.04221%0.206CC..  trans-84.2-44179.91800000109L34 E274 P276 H311 K318L34-V36 PolarHBondContact O-N 2.96Å; V36-E274 HydrophobicContact CB-CB 4.34Å; V36-E274 WeakPolarHBondContact CG2-O 3.31Å; V36-P276 HydrophobicContact CG2-CB 4.17Å; V36-H311 PolarHBondContact O-CE1 2.99Å; V36-H311 PolarHBondContact O-NE2 3.39Å; V36-H311 VanDerWaalsContact O-NE2 3.07Å; V36-K318 PolarHBondContact O-NZ 3.42Å
37E74.9Confident80Confident17 Ų1736.2 Ų36.28%0.07921%0.205CC..SBendtrans-62152.8-177.2-48.296.6138.200112.6Q35 G273 E274 K318Q35-E37 WeakPolarHBondContact CG-OE2 3.46Å; Q35-E37 PolarHBondContact NE2-O 3.48Å; E37-G273 VanDerWaalsContact OE1-C 3.24Å; E37-G273 WeakPolarHBondContact OE1-CA 3.44Å; E37-E274 HydrophobicContact CG-CB 3.91Å; E37-E274 HydrophobicContact CG-CG 3.7Å; E37-E274 PolarHBondContact OE1-N 3.45Å; E37-K318 WeakPolarHBondContact O-CE 3.27Å; E37-K318 PolarHBondContact O-NZ 2.82Å
38D73.3Confident79.4Confident44 Ų4438.9 Ų38.924%0.23522%0.221CC..  trans-65.4138.2173.8-76.4-11.4000111.9K40 S45 H311 K318D38-K40 HydrophobicContact CB-CD 4.04Å; D38-K40 HydrophobicContact CB-CG 4.09Å; D38-K40 PolarHBondContact O-N 3.01Å; D38-K40 IonicContact OD2-NZ 3.86Å; D38-K40 PolarHBondContact OD2-NZ 3.43Å; D38-S45 WeakPolarHBondContact O-CB 3.12Å; D38-S45 PolarHBondContact O-OG 3.31Å; D38-H311 IonicContact OD1-CE1 2.8Å; D38-H311 IonicContact OD1-CG 2.93Å; D38-H311 IonicContact OD1-ND1 3.45Å; D38-H311 PolarHBondContact OD1-ND1 2.88Å; D38-K318 IonicContact OD1-NZ 2.7Å; D38-K318 PolarHBondContact OD1-NZ 2.92Å
39I69.3Low79Confident25 Ų2540 Ų4013%0.12823%0.234CC..  trans-75.180.9173.6-51.4164.8000107.7F32 T48 Y314 K318F32-I39 HydrophobicContact CD1-CD1 3.56Å; F32-I39 HydrophobicContact CD1-CG1 4.12Å; F32-I39 HydrophobicContact CE1-CD1 3.8Å; F32-I39 HydrophobicContact CE1-CG1 4.1Å; F32-I39 HydrophobicContact CE1-CG2 4.21Å; I39-T48 WeakPolarHBondContact CG2-O 3.26Å; I39-Y314 HydrophobicContact CB-CE1 4.3Å; I39-Y314 HydrophobicContact CD1-CE1 4.49Å; I39-K318 HydrophobicContact CD1-CB 4.36Å; I39-K318 HydrophobicContact CD1-CG 3.99Å; I39-K318 HydrophobicContact CG1-CG 4.49Å
40K69.9Low78.8Confident117 Ų11741.7 Ų41.751%0.50924%0.243SC..  trans-127.6135.9177-70.5175.6-177.4160.90109.7D38 S42 S45D38-K40 HydrophobicContact CB-CD 4.04Å; D38-K40 HydrophobicContact CB-CG 4.09Å; D38-K40 PolarHBondContact O-N 3.01Å; D38-K40 IonicContact OD2-NZ 3.86Å; D38-K40 PolarHBondContact OD2-NZ 3.43Å; K40-S42 PolarHBondContact O-N 3.38Å; K40-S45 WeakPolarHBondContact O-CB 3.36Å
41P60.6Low78.7Confident124 Ų12447.9 Ų47.981%0.80528%0.276SS*.THydrogen-bonded Turntrans-65.5-24.1-179.924.1-32000113.6
42S56.2Low78.6Confident125 Ų12550.8 Ų50.887%0.87429%0.289SS*.THydrogen-bonded Turntrans-105.216.4-174.5-170.50000114.3K40K40-S42 PolarHBondContact O-N 3.38Å
43G61.2Low78.6Confident48 Ų4850.3 Ų50.350%0.49529%0.287SS..SBendtrans-121.1-178.7-177.800000113.7S45G43-S45 PolarHBondContact O-N 2.86Å
44K67.9Low78.8Confident184 Ų18454.5 Ų54.580%0.831%0.305SS*.SBendtrans-68.631.7170.1-66.5-177.4178.5177.10113Y46K44-Y46 PolarHBondContact O-N 2.71Å
45S77.2Confident79Confident14 Ų1458.6 Ų58.610%0.09833%0.327CS..  trans-75.2124-178.6-168.10000110.4Q35 D38 K40 G43 Y47Q35-S45 PolarHBondContact NE2-OG 3.47Å; D38-S45 WeakPolarHBondContact O-CB 3.12Å; D38-S45 PolarHBondContact O-OG 3.31Å; K40-S45 WeakPolarHBondContact O-CB 3.36Å; G43-S45 PolarHBondContact O-N 2.86Å; S45-Y47 PolarHBondContact OG-O 2.95Å
46Y77.6Confident79.2Confident21 Ų2162.2 Ų62.28%0.08234%0.34CS..SBendtrans-68-40176.7-172-98.1000112K44 Q52 R56 E60 F272K44-Y46 PolarHBondContact O-N 2.71Å; Y46-Q52 PolarHBondContact O-NE2 3.37Å; Y46-R56 PolarHBondContact O-NH1 3.04Å; Y46-E60 PolarHBondContact OH-OE2 3.42Å; Y46-F272 HydrophobicContact CD1-CD2 4.08Å; Y46-F272 HydrophobicContact CD1-CE2 4.01Å; Y46-F272 AromaticContact CE1-CD2 3.56Å; Y46-F272 HydrophobicContact CE1-CD2 3.56Å; Y46-F272 AromaticContact CE1-CE2 3.69Å; Y46-F272 HydrophobicContact CE1-CE2 3.69Å; Y46-F272 HydrophobicContact CE1-CG 4.46Å
47Y82.8Confident79.8Confident1 Ų162 Ų620%0.00434%0.339CS..  trans-119.2132.9169.4-58-59.4000112.9R31 F32 Q35 S45 A53 R56 I57 F272R31-Y47 HydrophobicContact CB-CE2 3.91Å; R31-Y47 PolarHBondContact NH1-OH 3.27Å; R31-Y47 VanDerWaalsContact NH1-OH 3.1Å; F32-Y47 HydrophobicContact CZ-CG 4.47Å; Q35-Y47 PolarHBondContact NE2-O 2.87Å; Q35-Y47 VanDerWaalsContact OE1-CD2 3.3Å; S45-Y47 PolarHBondContact OG-O 2.95Å; Y47-A53 VanDerWaalsContact CD1-CA 3.46Å; Y47-A53 HydrophobicContact CD1-CB 3.44Å; Y47-A53 VanDerWaalsContact CD1-CB 3.44Å; Y47-A53 HydrophobicContact CE1-CB 3.84Å; Y47-A53 HydrophobicContact CG-CB 3.83Å; Y47-R56 HydrophobicContact CE1-CB 4.28Å; Y47-R56 HydrophobicContact CE1-CG 4.38Å; Y47-I57 HydrophobicContact CE1-CG1 4.3Å; Y47-I57 VanDerWaalsContact OH-CG1 3.27Å; Y47-I57 WeakPolarHBondContact OH-CG1 3.35Å; Y47-F272 HydrophobicContact CD2-CE2 4.44Å; Y47-F272 HydrophobicContact CD2-CZ 4.33Å; Y47-F272 HydrophobicContact CE2-CD2 4.47Å; Y47-F272 AromaticContact CE2-CE2 3.35Å; Y47-F272 HydrophobicContact CE2-CE2 3.35Å; Y47-F272 AromaticContact CE2-CZ 3.55Å; Y47-F272 HydrophobicContact CE2-CZ 3.55Å; Y47-F272 AromaticContact CZ-CE2 3.77Å; Y47-F272 WeakPolarHBondContact OH-CE2 3.39Å
48T82.6Confident80.6Confident56 Ų5667.2 Ų67.234%0.34436%0.358SS..  trans-109.6-22.9-17956.10000112.8I39I39-T48 WeakPolarHBondContact CG2-O 3.26Å
49G87Confident81.5Confident27 Ų2773.1 Ų73.128%0.27838%0.382SS..SBendtrans-164.7166.5-179.600000112.5L51 Q52 A53G49-L51 PolarHBondContact O-N 2.87Å; G49-Q52 PolarHBondContact O-N 3.39Å; G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 3.28Å
50L89.9Confident82.4Confident51 Ų5175.3 Ų75.327%0.26739%0.392SS..Hα-helixtrans-59.6-48.4-174.8-170.878000112.5I28 A53 F54 P322 L325I28-L50 HydrophobicContact CG2-CD1 3.65Å; L50-A53 PolarHBondContact O-N 3.04Å; L50-F54 PolarHBondContact O-N 3.36Å; L50-P322 HydrophobicContact CD1-CB 3.76Å; L50-P322 HydrophobicContact CD1-CG 4.33Å; L50-L325 HydrophobicContact CD2-CD2 3.75Å
51L91.1Very high83.3Confident134 Ų13471.3 Ų71.370%0.70238%0.375SS*.Hα-helixtrans-66.8-41.4-179.9-66.9178.6000111.8G49 A53 F54 I55G49-L51 PolarHBondContact O-N 2.87Å; L51-A53 VanDerWaalsContact C-N 3.33Å; L51-A53 PolarHBondContact O-N 3.42Å; L51-F54 PolarHBondContact O-N 2.88Å; L51-I55 WeakPolarHBondContact O-CB 3.37Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.41Å; L51-I55 PolarHBondContact O-N 3.46Å
52Q91.9Very high84.7Confident61 Ų6166.8 Ų66.829%0.28535%0.351SS..Hα-helixtrans-63.5-41.5176.2-178.3-85.5-13.100110.8Y46 G49 R56Y46-Q52 PolarHBondContact O-NE2 3.37Å; G49-Q52 PolarHBondContact O-N 3.39Å; Q52-R56 WeakPolarHBondContact O-CB 3.47Å; Q52-R56 PolarHBondContact O-N 2.95Å
53A91.8Very high86.4Confident0 Ų064.2 Ų64.20%033%0.33CS..Hα-helixtrans-62.9-45.717600000111.8I28 F32 Y47 G49 L50 L51 R56 I57I28-A53 HydrophobicContact CG2-CB 4.29Å; F32-A53 HydrophobicContact CE2-CB 3.6Å; F32-A53 HydrophobicContact CZ-CB 4.05Å; Y47-A53 VanDerWaalsContact CD1-CA 3.46Å; Y47-A53 HydrophobicContact CD1-CB 3.44Å; Y47-A53 VanDerWaalsContact CD1-CB 3.44Å; Y47-A53 HydrophobicContact CE1-CB 3.84Å; Y47-A53 HydrophobicContact CG-CB 3.83Å; G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 3.28Å; L50-A53 PolarHBondContact O-N 3.04Å; L51-A53 VanDerWaalsContact C-N 3.33Å; L51-A53 PolarHBondContact O-N 3.42Å; A53-R56 PolarHBondContact O-N 2.82Å; A53-I57 WeakPolarHBondContact O-CB 3.31Å; A53-I57 WeakPolarHBondContact O-CD1 3.38Å; A53-I57 WeakPolarHBondContact O-CG1 3.13Å; A53-I57 PolarHBondContact O-N 3.47Å
54F93.5Very high87.8Confident87 Ų8771.5 Ų71.538%0.38234%0.344SS..Hα-helixtrans-58.3-53.2176.3-178.3-87.9000111.9I28 L50 L51 R56 I57 Y58 L66I28-F54 HydrophobicContact CD1-CB 4Å; I28-F54 HydrophobicContact CD1-CD2 4.02Å; L50-F54 PolarHBondContact O-N 3.36Å; L51-F54 PolarHBondContact O-N 2.88Å; F54-R56 VanDerWaalsContact C-N 3.31Å; F54-R56 PolarHBondContact O-N 3.11Å; F54-I57 PolarHBondContact O-N 2.66Å; F54-Y58 WeakPolarHBondContact O-CB 3.48Å; F54-Y58 PolarHBondContact O-N 3.49Å; F54-L66 HydrophobicContact CD2-CD1 4.13Å; F54-L66 HydrophobicContact CD2-CD2 3.97Å; F54-L66 HydrophobicContact CE2-CD1 3.48Å; F54-L66 VanDerWaalsContact CE2-CD1 3.48Å; F54-L66 HydrophobicContact CE2-CD2 4.11Å; F54-L66 HydrophobicContact CE2-CG 4.45Å; F54-L66 HydrophobicContact CZ-CD1 3.73Å
55I94.1Very high88.8Confident87 Ų8762.8 Ų62.845%0.44631%0.306SS..Hα-helixtrans-61.9-41-179.4-66.6166.3000110.6L51 Y58 K59L51-I55 WeakPolarHBondContact O-CB 3.37Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.41Å; L51-I55 PolarHBondContact O-N 3.46Å; I55-Y58 PolarHBondContact O-N 2.89Å; I55-K59 HydrophobicContact CG2-CD 4.02Å; I55-K59 HydrophobicContact CG2-CG 4.39Å; I55-K59 WeakPolarHBondContact O-CB 3.27Å; I55-K59 WeakPolarHBondContact O-CG 3.29Å; I55-K59 PolarHBondContact O-N 3.24Å
56R90.6Very high89.6Confident77 Ų7762.3 Ų62.329%0.29130%0.302SS..Hα-helixtrans-66.5-45.1179.9-173171.5-167162.311.5111.9Y46 Y47 Q52 A53 F54 Y58 K59 E60Y46-R56 PolarHBondContact O-NH1 3.04Å; Y47-R56 HydrophobicContact CE1-CB 4.28Å; Y47-R56 HydrophobicContact CE1-CG 4.38Å; Q52-R56 WeakPolarHBondContact O-CB 3.47Å; Q52-R56 PolarHBondContact O-N 2.95Å; A53-R56 PolarHBondContact O-N 2.82Å; F54-R56 VanDerWaalsContact C-N 3.31Å; F54-R56 PolarHBondContact O-N 3.11Å; R56-Y58 VanDerWaalsContact C-N 3.33Å; R56-Y58 PolarHBondContact O-N 2.9Å; R56-K59 PolarHBondContact O-N 3.38Å; R56-E60 HydrophobicContact CG-CG 4.27Å; R56-E60 WeakPolarHBondContact CG-OE1 3.42Å; R56-E60 IonicContact CZ-OE1 3.62Å; R56-E60 IonicContact NE-OE1 2.75Å; R56-E60 PolarHBondContact NE-OE1 3.28Å; R56-E60 IonicContact NH2-OE1 3.36Å; R56-E60 PolarHBondContact NH2-OE1 3.41Å; R56-E60 WeakPolarHBondContact O-CB 3.43Å; R56-E60 WeakPolarHBondContact O-CG 3.46Å; R56-E60 PolarHBondContact O-N 2.7Å
57I91.6Very high90.5Very high1 Ų164.9 Ų64.91%0.00531%0.312CS..Hα-helixtrans-60.4-46175.9-66.6162.4000110V27 I28 Y47 A53 F54 K59 E60 E61 L66V27-I57 HydrophobicContact CG1-CD1 4.3Å; I28-I57 HydrophobicContact CG1-CD1 3.86Å; Y47-I57 HydrophobicContact CE1-CG1 4.3Å; Y47-I57 VanDerWaalsContact OH-CG1 3.27Å; Y47-I57 WeakPolarHBondContact OH-CG1 3.35Å; A53-I57 WeakPolarHBondContact O-CB 3.31Å; A53-I57 WeakPolarHBondContact O-CD1 3.38Å; A53-I57 WeakPolarHBondContact O-CG1 3.13Å; A53-I57 PolarHBondContact O-N 3.47Å; F54-I57 PolarHBondContact O-N 2.66Å; I57-K59 VanDerWaalsContact C-N 3.34Å; I57-K59 PolarHBondContact O-N 3.17Å; I57-E60 PolarHBondContact O-N 2.86Å; I57-E61 WeakPolarHBondContact O-CB 3.42Å; I57-E61 PolarHBondContact O-N 3.14Å; I57-L66 HydrophobicContact CB-CD2 4.16Å; I57-L66 HydrophobicContact CD1-CD2 4.49Å; I57-L66 HydrophobicContact CG2-CD2 3.74Å; I57-L66 HydrophobicContact CG2-CG 4.11Å
58Y92.7Very high90.9Very high127 Ų12766 Ų6650%0.49832%0.317SS..Hα-helixtrans-60.2-42.4177.4-179-91000112.2F54 I55 R56 G62 V63F54-Y58 WeakPolarHBondContact O-CB 3.48Å; F54-Y58 PolarHBondContact O-N 3.49Å; I55-Y58 PolarHBondContact O-N 2.89Å; R56-Y58 VanDerWaalsContact C-N 3.33Å; R56-Y58 PolarHBondContact O-N 2.9Å; Y58-G62 WeakPolarHBondContact O-CA 3.33Å; Y58-G62 PolarHBondContact O-N 3.37Å; Y58-V63 HydrophobicContact CD2-CG2 4.19Å; Y58-V63 HydrophobicContact CE2-CG2 3.54Å
59K91.7Very high91.4Very high168 Ų16863.6 Ų63.673%0.7330%0.303SS*.Hα-helixtrans-71.5-39.3179.2-75.7-177.3177.4-1740113.6I55 R56 I57I55-K59 HydrophobicContact CG2-CD 4.02Å; I55-K59 HydrophobicContact CG2-CG 4.39Å; I55-K59 WeakPolarHBondContact O-CB 3.27Å; I55-K59 WeakPolarHBondContact O-CG 3.29Å; I55-K59 PolarHBondContact O-N 3.24Å; R56-K59 PolarHBondContact O-N 3.38Å; I57-K59 VanDerWaalsContact C-N 3.34Å; I57-K59 PolarHBondContact O-N 3.17Å
60E89.5Confident91.7Very high72 Ų7263.4 Ų63.434%0.33630%0.295SS..Hα-helixtrans-86.2-30.7-174.4-69-175.7-16800113.3Y46 R56 I57Y46-E60 PolarHBondContact OH-OE2 3.42Å; R56-E60 HydrophobicContact CG-CG 4.27Å; R56-E60 WeakPolarHBondContact CG-OE1 3.42Å; R56-E60 IonicContact CZ-OE1 3.62Å; R56-E60 IonicContact NE-OE1 2.75Å; R56-E60 PolarHBondContact NE-OE1 3.28Å; R56-E60 IonicContact NH2-OE1 3.36Å; R56-E60 PolarHBondContact NH2-OE1 3.41Å; R56-E60 WeakPolarHBondContact O-CB 3.43Å; R56-E60 WeakPolarHBondContact O-CG 3.46Å; R56-E60 PolarHBondContact O-N 2.7Å; I57-E60 PolarHBondContact O-N 2.86Å
61E88.7Confident92Very high32 Ų3264.7 Ų64.715%0.1531%0.305CS..Hα-helixtrans-124.6-5.3-172-56.8-178.2-168.900113.8R31 I57 G65 K68 G139R31-E61 IonicContact CZ-OE1 2.65Å; R31-E61 IonicContact CZ-OE2 3.51Å; R31-E61 IonicContact NH1-OE1 3.6Å; R31-E61 PolarHBondContact NH1-OE1 2.92Å; R31-E61 IonicContact NH1-OE2 2.69Å; R31-E61 IonicContact NH2-OE1 2.63Å; R31-E61 PolarHBondContact NH2-OE1 3.1Å; R31-E61 IonicContact NH2-OE2 3.63Å; R31-E61 PolarHBondContact NH2-OE2 2.88Å; I57-E61 WeakPolarHBondContact O-CB 3.42Å; I57-E61 PolarHBondContact O-N 3.14Å; E61-G65 WeakPolarHBondContact OE2-CA 3.37Å; E61-K68 VanDerWaalsContact CD-NZ 3.29Å; E61-K68 IonicContact OE1-NZ 3.73Å; E61-K68 WeakPolarHBondContact OE2-CE 3.39Å; E61-K68 IonicContact OE2-NZ 2.68Å; E61-K68 PolarHBondContact OE2-NZ 2.72Å; E61-G139 WeakPolarHBondContact OE1-CA 3.43Å
62G90.4Very high92.1Very high29 Ų2958.4 Ų58.430%0.29927%0.272SS..Hα-helixtrans71.6-171.4-174.200000113.2Y58 Y64 G65Y58-G62 WeakPolarHBondContact O-CA 3.33Å; Y58-G62 PolarHBondContact O-N 3.37Å; G62-Y64 VanDerWaalsContact C-N 3.25Å; G62-Y64 PolarHBondContact O-N 3.02Å; G62-G65 PolarHBondContact O-N 2.95Å
63V91.1Very high92.3Very high72 Ų7255.5 Ų55.544%0.43626%0.259SS..Hα-helixtrans-57.3-40.4178.41790000111.2Y58 G65 L66 W67Y58-V63 HydrophobicContact CD2-CG2 4.19Å; Y58-V63 HydrophobicContact CE2-CG2 3.54Å; V63-G65 PolarHBondContact O-N 3.37Å; V63-L66 PolarHBondContact O-N 3.46Å; V63-W67 HydrophobicContact CG1-CE3 3.96Å; V63-W67 HydrophobicContact CG1-CZ3 3.67Å
64Y90Very high92.4Very high201 Ų20157 Ų5779%0.78827%0.265SS*.Hα-helixtrans-61-27.6-178.7-66.1-72.3000113.5G62 L66 W67 K68G62-Y64 VanDerWaalsContact C-N 3.25Å; G62-Y64 PolarHBondContact O-N 3.02Å; Y64-L66 PolarHBondContact O-N 2.96Å; Y64-W67 CarbonylContact O-C 3.58Å; Y64-W67 PolarHBondContact O-N 2.95Å; Y64-W67 VanDerWaalsContact O-N 3.11Å; Y64-K68 PolarHBondContact O-N 3.35Å; Y64-K68 VanDerWaalsContact O-N 3.15Å
65G90.2Very high92.5Very high0 Ų057.8 Ų57.80%027%0.269CS..Hα-helixtrans-55.9-37.8173.900000112.9E61 G62 V63 W67 K68E61-G65 WeakPolarHBondContact OE2-CA 3.37Å; G62-G65 PolarHBondContact O-N 2.95Å; V63-G65 PolarHBondContact O-N 3.37Å; G65-W67 VanDerWaalsContact C-N 3.33Å; G65-W67 PolarHBondContact O-N 3.29Å; G65-K68 PolarHBondContact O-N 3.26Å
66L94Very high92.6Very high5 Ų554.7 Ų54.73%0.02625%0.253CS..Hα-helixtrans-76.4-16.8-180-63171.1000113.7P24 V27 F54 I57 V63 Y64P24-L66 WeakPolarHBondContact CA-O 3.25Å; P24-L66 HydrophobicContact CB-CB 4.15Å; P24-L66 HydrophobicContact CB-CD2 4.27Å; P24-L66 HydrophobicContact CG-CB 4.23Å; V27-L66 WeakPolarHBondContact CG2-O 3.45Å; F54-L66 HydrophobicContact CD2-CD1 4.13Å; F54-L66 HydrophobicContact CD2-CD2 3.97Å; F54-L66 HydrophobicContact CE2-CD1 3.48Å; F54-L66 VanDerWaalsContact CE2-CD1 3.48Å; F54-L66 HydrophobicContact CE2-CD2 4.11Å; F54-L66 HydrophobicContact CE2-CG 4.45Å; F54-L66 HydrophobicContact CZ-CD1 3.73Å; I57-L66 HydrophobicContact CB-CD2 4.16Å; I57-L66 HydrophobicContact CD1-CD2 4.49Å; I57-L66 HydrophobicContact CG2-CD2 3.74Å; I57-L66 HydrophobicContact CG2-CG 4.11Å; V63-L66 PolarHBondContact O-N 3.46Å; Y64-L66 PolarHBondContact O-N 2.96Å
67W95Very high92.7Very high75 Ų7552.5 Ų52.528%0.28425%0.249SC..THydrogen-bonded Turntrans-107.28.8175.7-83.5-94.1000113.7F20 Q23 P24 V63 Y64 G65 G69 H70F20-W67 AromaticContact CD2-CD1 3.87Å; F20-W67 AromaticContact CD2-NE1 3.46Å; F20-W67 HydrophobicContact CE1-CZ2 4.03Å; F20-W67 AromaticContact CE1-NE1 3.82Å; F20-W67 AromaticContact CE2-CD1 3.64Å; F20-W67 AromaticContact CE2-NE1 3.21Å; F20-W67 AromaticContact CG-NE1 3.86Å; F20-W67 AromaticContact CZ-CE2 3.83Å; F20-W67 HydrophobicContact CZ-CZ2 4.03Å; F20-W67 AromaticContact CZ-NE1 3.41Å; F20-W67 PolarHBondContact O-NE1 2.95Å; Q23-W67 HydrophobicContact CG-CG 4.43Å; P24-W67 HydrophobicContact CG-CH2 4.21Å; P24-W67 HydrophobicContact CG-CZ2 4.27Å; P24-W67 HydrophobicContact CG-CZ3 4.43Å; V63-W67 HydrophobicContact CG1-CE3 3.96Å; V63-W67 HydrophobicContact CG1-CZ3 3.67Å; Y64-W67 CarbonylContact O-C 3.58Å; Y64-W67 PolarHBondContact O-N 2.95Å; Y64-W67 VanDerWaalsContact O-N 3.11Å; G65-W67 VanDerWaalsContact C-N 3.33Å; G65-W67 PolarHBondContact O-N 3.29Å; W67-G69 PolarHBondContact O-N 3.31Å; W67-H70 VanDerWaalsContact O-CB 3.25Å; W67-H70 WeakPolarHBondContact O-CB 3.49Å; W67-H70 PolarHBondContact O-N 3.28Å; W67-H70 VanDerWaalsContact O-N 3.12Å
68K92.2Very high92.9Very high24 Ų2457.2 Ų57.210%0.10428%0.278CS..THydrogen-bonded Turntrans-54.7137.1173.2-79.6177.2170.6176.10110.8Q23 E61 Y64 G65 H70 I136 Q138 G139Q23-K68 PolarHBondContact NE2-O 3.44Å; E61-K68 VanDerWaalsContact CD-NZ 3.29Å; E61-K68 IonicContact OE1-NZ 3.73Å; E61-K68 WeakPolarHBondContact OE2-CE 3.39Å; E61-K68 IonicContact OE2-NZ 2.68Å; E61-K68 PolarHBondContact OE2-NZ 2.72Å; Y64-K68 PolarHBondContact O-N 3.35Å; Y64-K68 VanDerWaalsContact O-N 3.15Å; G65-K68 PolarHBondContact O-N 3.26Å; K68-H70 VanDerWaalsContact C-N 3.25Å; K68-H70 PolarHBondContact O-N 3.03Å; K68-I136 HydrophobicContact CB-CG1 4.22Å; K68-I136 WeakPolarHBondContact O-CG1 3.28Å; K68-Q138 PolarHBondContact NZ-O 3.39Å; K68-G139 PolarHBondContact NZ-O 3.02Å
69G92.6Very high93Very high6 Ų653.4 Ų53.46%0.06227%0.268CS..THydrogen-bonded Turntrans70.711.5-179.300000115.2W67 P72 A73W67-G69 PolarHBondContact O-N 3.31Å; G69-P72 WeakPolarHBondContact O-CD 3.21Å; G69-P72 WeakPolarHBondContact O-CG 3.47Å; G69-A73 WeakPolarHBondContact O-CB 3.37Å; G69-A73 PolarHBondContact O-N 3.15Å; G69-A73 VanDerWaalsContact O-N 3.12Å
70H94.1Very high93.2Very high23 Ų2349.1 Ų49.111%0.10625%0.25CC..Hα-helixtrans-64.2-45.2177.8-173.766.1000112.5F20 Q23 W67 K68 A73 Q74F20-H70 VanDerWaalsContact CA-CE1 3.42Å; F20-H70 WeakPolarHBondContact CA-CE1 3.14Å; F20-H70 AromaticContact CD2-NE2 3.87Å; Q23-H70 HydrophobicContact CG-CB 4.06Å; Q23-H70 PolarHBondContact OE1-ND1 2.91Å; W67-H70 VanDerWaalsContact O-CB 3.25Å; W67-H70 WeakPolarHBondContact O-CB 3.49Å; W67-H70 PolarHBondContact O-N 3.28Å; W67-H70 VanDerWaalsContact O-N 3.12Å; K68-H70 VanDerWaalsContact C-N 3.25Å; K68-H70 PolarHBondContact O-N 3.03Å; H70-A73 WeakPolarHBondContact O-CA 3.26Å; H70-A73 WeakPolarHBondContact O-CB 3.31Å; H70-A73 PolarHBondContact O-N 3.36Å; H70-A73 VanDerWaalsContact O-N 3.1Å; H70-Q74 PolarHBondContact CE1-NE2 3.13Å; H70-Q74 PolarHBondContact NE2-NE2 3.25Å; H70-Q74 VanDerWaalsContact NE2-NE2 3.15Å; H70-Q74 PolarHBondContact O-N 3.48Å
71V94.5Very high93.4Very high78 Ų7848.5 Ų48.547%0.47325%0.253SS..Hα-helixtrans-57-56.7179.2176.40000112.4A73 Q74 F75 F147V71-A73 PolarHBondContact O-N 3.32Å; V71-Q74 PolarHBondContact O-N 3.42Å; V71-Q74 VanDerWaalsContact O-N 3.09Å; V71-F75 HydrophobicContact CG1-CD2 3.83Å; V71-F75 HydrophobicContact CG1-CE2 3.62Å; V71-F75 VanDerWaalsContact O-CD2 3.29Å; V71-F75 WeakPolarHBondContact O-CD2 3.29Å; V71-F75 PolarHBondContact O-N 3.4Å; V71-F75 VanDerWaalsContact O-N 3.13Å; V71-F147 HydrophobicContact CG1-CD1 4.4Å
72P94.9Very high93.7Very high2 Ų249.2 Ų49.21%0.01327%0.269CS..Hα-helixtrans-64.1-26.5175.924.8-34.2000112.6G69 Q74 L76 M131 R132 L135 F147G69-P72 WeakPolarHBondContact O-CD 3.21Å; G69-P72 WeakPolarHBondContact O-CG 3.47Å; P72-Q74 VanDerWaalsContact C-N 3.33Å; P72-L76 WeakPolarHBondContact O-CB 3.33Å; P72-L76 PolarHBondContact O-N 2.97Å; P72-M131 HydrophobicContact CB-CB 4.45Å; P72-R132 HydrophobicContact CB-CB 4.22Å; P72-R132 HydrophobicContact CG-CB 4.01Å; P72-L135 HydrophobicContact CG-CD1 3.83Å; P72-F147 HydrophobicContact CB-CD2 3.85Å; P72-F147 HydrophobicContact CB-CE2 3.73Å; P72-F147 HydrophobicContact CB-CZ 4.4Å; P72-F147 HydrophobicContact CG-CD2 4.18Å
73A94.7Very high94Very high0 Ų048.5 Ų48.50%026%0.26CS..Hα-helixtrans-66.9-33.3174.100000112.6R19 G69 H70 V71 S77 R132R19-A73 VanDerWaalsContact CZ-O 3.28Å; R19-A73 PolarHBondContact NE-O 3.37Å; R19-A73 PolarHBondContact NH2-O 3.07Å; G69-A73 WeakPolarHBondContact O-CB 3.37Å; G69-A73 PolarHBondContact O-N 3.15Å; G69-A73 VanDerWaalsContact O-N 3.12Å; H70-A73 WeakPolarHBondContact O-CA 3.26Å; H70-A73 WeakPolarHBondContact O-CB 3.31Å; H70-A73 PolarHBondContact O-N 3.36Å; H70-A73 VanDerWaalsContact O-N 3.1Å; V71-A73 PolarHBondContact O-N 3.32Å; A73-S77 PolarHBondContact O-N 2.78Å; A73-S77 PolarHBondContact O-OG 3.29Å; A73-R132 HydrophobicContact CB-CG 4.45Å
74Q94.9Very high94.2Very high30 Ų3048.9 Ų48.914%0.1426%0.257CS..Hα-helixtrans-70.3-50.8173.2-67.5-64.7-3.300110.7F16 H70 V71 P72 L76 S77 V78F16-Q74 HydrophobicContact CD2-CG 4.23Å; F16-Q74 HydrophobicContact CE2-CG 4.01Å; F16-Q74 PolarHBondContact O-NE2 3.44Å; H70-Q74 PolarHBondContact CE1-NE2 3.13Å; H70-Q74 PolarHBondContact NE2-NE2 3.25Å; H70-Q74 VanDerWaalsContact NE2-NE2 3.15Å; H70-Q74 PolarHBondContact O-N 3.48Å; V71-Q74 PolarHBondContact O-N 3.42Å; V71-Q74 VanDerWaalsContact O-N 3.09Å; P72-Q74 VanDerWaalsContact C-N 3.33Å; Q74-L76 PolarHBondContact O-N 3.09Å; Q74-S77 WeakPolarHBondContact O-CB 3.39Å; Q74-S77 PolarHBondContact O-N 2.92Å; Q74-V78 PolarHBondContact O-N 2.96Å; Q74-V78 VanDerWaalsContact O-N 3.09Å
75F96Very high94.4Very high105 Ų10544.9 Ų44.946%0.46124%0.244SC..Hα-helixtrans-55.2-41.8174.3-76.8-69.8000111.6V71 S77 V78 T79 L128 F147V71-F75 HydrophobicContact CG1-CD2 3.83Å; V71-F75 HydrophobicContact CG1-CE2 3.62Å; V71-F75 VanDerWaalsContact O-CD2 3.29Å; V71-F75 WeakPolarHBondContact O-CD2 3.29Å; V71-F75 PolarHBondContact O-N 3.4Å; V71-F75 VanDerWaalsContact O-N 3.13Å; F75-S77 PolarHBondContact O-N 3.32Å; F75-V78 PolarHBondContact O-N 2.92Å; F75-T79 VanDerWaalsContact O-CB 3.3Å; F75-T79 WeakPolarHBondContact O-CB 3.13Å; F75-T79 PolarHBondContact O-N 3.45Å; F75-T79 PolarHBondContact O-OG1 3.1Å; F75-T79 VanDerWaalsContact O-OG1 3.04Å; F75-L128 HydrophobicContact CB-CD1 3.97Å; F75-L128 HydrophobicContact CB-CD2 3.88Å; F75-F147 HydrophobicContact CD2-CE1 4.26Å; F75-F147 HydrophobicContact CE2-CE1 4.49Å
76L95.4Very high94.6Very high21 Ų2146.9 Ų46.911%0.1127%0.265CS..Hα-helixtrans-55.5-42.4176.8178.770.8000111.4P72 Q74 F80 S125 L128 D129P72-L76 WeakPolarHBondContact O-CB 3.33Å; P72-L76 PolarHBondContact O-N 2.97Å; Q74-L76 PolarHBondContact O-N 3.09Å; L76-F80 WeakPolarHBondContact O-CB 3.42Å; L76-F80 PolarHBondContact O-N 3.12Å; L76-S125 WeakPolarHBondContact CD1-O 3.23Å; L76-L128 HydrophobicContact CB-CB 3.94Å; L76-L128 HydrophobicContact CD1-CB 3.92Å; L76-D129 HydrophobicContact CD1-CB 4.05Å; L76-D129 HydrophobicContact CD2-CB 4.25Å
77S93.3Very high94.7Very high31 Ų3147.2 Ų47.222%0.21727%0.267CS..Hα-helixtrans-65-48.7178.3-45.30000111.5R19 A73 Q74 F75 F80 C81R19-S77 VanDerWaalsContact CD-OG 3.29Å; R19-S77 WeakPolarHBondContact CD-OG 3.36Å; R19-S77 PolarHBondContact NE-OG 3.46Å; R19-S77 VanDerWaalsContact NE-OG 3.14Å; R19-S77 PolarHBondContact NH1-OG 3.48Å; A73-S77 PolarHBondContact O-N 2.78Å; A73-S77 PolarHBondContact O-OG 3.29Å; Q74-S77 WeakPolarHBondContact O-CB 3.39Å; Q74-S77 PolarHBondContact O-N 2.92Å; F75-S77 PolarHBondContact O-N 3.32Å; S77-F80 PolarHBondContact O-N 3.15Å; S77-C81 WeakPolarHBondContact O-CB 3.38Å; S77-C81 PolarHBondContact O-N 3.34Å
78V94.7Very high94.7Very high101 Ų10147.3 Ų47.361%0.61227%0.27SS*.Hα-helixtrans-65-46.1-177.8176.80000110.1Q74 F75 G82Q74-V78 PolarHBondContact O-N 2.96Å; Q74-V78 VanDerWaalsContact O-N 3.09Å; F75-V78 PolarHBondContact O-N 2.92Å; V78-G82 PolarHBondContact O-N 3.48Å
79T96Very high94.7Very high47 Ų4752.6 Ų52.629%0.28829%0.29SS..Hα-helixtrans-65.6-44.4178.3-60.80000111.5F75 A83 L128F75-T79 VanDerWaalsContact O-CB 3.3Å; F75-T79 WeakPolarHBondContact O-CB 3.13Å; F75-T79 PolarHBondContact O-N 3.45Å; F75-T79 PolarHBondContact O-OG1 3.1Å; F75-T79 VanDerWaalsContact O-OG1 3.04Å; T79-A83 WeakPolarHBondContact O-CB 3.33Å; T79-A83 PolarHBondContact O-N 3.14Å; T79-L128 HydrophobicContact CG2-CD1 4.05Å; T79-L128 VanDerWaalsContact OG1-CD1 3.3Å; T79-L128 WeakPolarHBondContact OG1-CD1 3.27Å
80F95Very high94.8Very high78 Ų7854.8 Ų54.834%0.34231%0.307SS..Hα-helixtrans-62.4-47.9177.2-177.6-91.6000111.3L76 S77 A83 Q84 A121L76-F80 WeakPolarHBondContact O-CB 3.42Å; L76-F80 PolarHBondContact O-N 3.12Å; S77-F80 PolarHBondContact O-N 3.15Å; F80-A83 PolarHBondContact O-N 2.96Å; F80-Q84 VanDerWaalsContact O-CB 3.22Å; F80-Q84 WeakPolarHBondContact O-CB 2.95Å; F80-Q84 PolarHBondContact O-N 3.2Å; F80-A121 HydrophobicContact CD2-CB 4.1Å; F80-A121 HydrophobicContact CE2-CB 3.99Å
81C93.9Very high94.8Very high58 Ų5854.5 Ų54.539%0.39231%0.306SS..Hα-helixtrans-61-52.9178.5-176.50000111.6S77 A83 Q84 F85S77-C81 WeakPolarHBondContact O-CB 3.38Å; S77-C81 PolarHBondContact O-N 3.34Å; C81-A83 PolarHBondContact O-N 3.47Å; C81-Q84 PolarHBondContact O-N 3.25Å; C81-F85 VanDerWaalsContact O-CD2 3.22Å; C81-F85 WeakPolarHBondContact O-CD2 3.33Å; C81-F85 PolarHBondContact O-N 3.32Å; C81-F85 WeakPolarHBondContact SG-CE2 3.4Å
82G95.6Very high94.6Very high47 Ų4753.9 Ų53.949%0.48530%0.298SS..Hα-helixtrans-62.2-40.9179.100000112.7V78 G86V78-G82 PolarHBondContact O-N 3.48Å; G82-G86 PolarHBondContact O-N 2.97Å
83A95.9Very high94.4Very high14 Ų1458.1 Ų58.112%0.11632%0.321CS..Hα-helixtrans-65.8-40.9175.100000111.6T79 F80 C81 S87 A121 L124T79-A83 WeakPolarHBondContact O-CB 3.33Å; T79-A83 PolarHBondContact O-N 3.14Å; F80-A83 PolarHBondContact O-N 2.96Å; C81-A83 PolarHBondContact O-N 3.47Å; A83-S87 WeakPolarHBondContact O-CB 3.36Å; A83-S87 PolarHBondContact O-N 3.37Å; A83-S87 PolarHBondContact O-OG 3.24Å; A83-A121 HydrophobicContact CB-CB 4.06Å; A83-L124 HydrophobicContact CB-CB 4.26Å; A83-L124 HydrophobicContact CB-CD1 3.79Å
84Q94.9Very high94.2Very high81 Ų8162.4 Ų62.438%0.37934%0.343SS..Hα-helixtrans-62.1-53.5178.2-174.6173.826.500111F80 C81 S87 F88 T117 A121F80-Q84 VanDerWaalsContact O-CB 3.22Å; F80-Q84 WeakPolarHBondContact O-CB 2.95Å; F80-Q84 PolarHBondContact O-N 3.2Å; C81-Q84 PolarHBondContact O-N 3.25Å; Q84-S87 PolarHBondContact O-OG 3.17Å; Q84-F88 VanDerWaalsContact O-CB 3.23Å; Q84-F88 WeakPolarHBondContact O-CB 3.44Å; Q84-F88 PolarHBondContact O-N 3.04Å; Q84-T117 HydrophobicContact CB-CG2 4.48Å; Q84-T117 HydrophobicContact CG-CG2 3.87Å; Q84-T117 WeakPolarHBondContact O-CG2 3.44Å; Q84-A121 HydrophobicContact CB-CB 4.13Å
85F94.2Very high93.9Very high117 Ų11761.3 Ų61.351%0.51334%0.338SS..Hα-helixtrans-64.5-47.9178.6-73.4-68.4000112.1C81 S87 F88 Y89C81-F85 VanDerWaalsContact O-CD2 3.22Å; C81-F85 WeakPolarHBondContact O-CD2 3.33Å; C81-F85 PolarHBondContact O-N 3.32Å; C81-F85 WeakPolarHBondContact SG-CE2 3.4Å; F85-S87 PolarHBondContact O-N 2.66Å; F85-F88 PolarHBondContact O-N 3.03Å; F85-Y89 HydrophobicContact CB-CE2 4.43Å; F85-Y89 WeakPolarHBondContact O-CD2 3.37Å; F85-Y89 PolarHBondContact O-N 2.78Å; F85-Y89 VanDerWaalsContact O-N 3.11Å
86G95.6Very high93.6Very high42 Ų4258.8 Ų58.843%0.43333%0.332SS..Hα-helixtrans-62.6-42.7-178.900000113.1G82 A90G82-G86 PolarHBondContact O-N 2.97Å; G86-A90 WeakPolarHBondContact O-CB 3.35Å; G86-A90 PolarHBondContact O-N 3.08Å; G86-A90 VanDerWaalsContact O-N 3.12Å
87S95.2Very high93.3Very high11 Ų1162.9 Ų62.98%0.07735%0.353CS..Hα-helixtrans-72.4-34.8177.862.90000112.4A83 Q84 F85 A90 I91 T117A83-S87 WeakPolarHBondContact O-CB 3.36Å; A83-S87 PolarHBondContact O-N 3.37Å; A83-S87 PolarHBondContact O-OG 3.24Å; Q84-S87 PolarHBondContact O-OG 3.17Å; F85-S87 PolarHBondContact O-N 2.66Å; S87-A90 PolarHBondContact O-N 3.02Å; S87-I91 WeakPolarHBondContact O-CB 3.42Å; S87-I91 WeakPolarHBondContact O-CD1 3.42Å; S87-I91 WeakPolarHBondContact O-CG1 3.38Å; S87-I91 PolarHBondContact O-N 3.15Å; S87-T117 WeakPolarHBondContact OG-CG2 3.47Å
88F94.6Very high92.9Very high77 Ų7770.9 Ų70.934%0.33838%0.379SS..Hα-helixtrans-59-52.7174.7-174.7-94.3000111.3Q84 F85 A90 I91 E92 A113 T117Q84-F88 VanDerWaalsContact O-CB 3.23Å; Q84-F88 WeakPolarHBondContact O-CB 3.44Å; Q84-F88 PolarHBondContact O-N 3.04Å; F85-F88 PolarHBondContact O-N 3.03Å; F88-A90 VanDerWaalsContact C-N 3.3Å; F88-A90 PolarHBondContact O-N 3.25Å; F88-I91 PolarHBondContact O-N 3.25Å; F88-E92 WeakPolarHBondContact CE1-OE2 3.28Å; F88-E92 VanDerWaalsContact O-CB 3.31Å; F88-E92 WeakPolarHBondContact O-CB 3.34Å; F88-E92 PolarHBondContact O-N 2.86Å; F88-A113 HydrophobicContact CE2-CB 4.27Å; F88-T117 WeakPolarHBondContact CA-OG1 3.49Å; F88-T117 HydrophobicContact CB-CG2 3.92Å
89Y93.5Very high92.3Very high136 Ų13671.4 Ų71.453%0.53338%0.377SS..Hα-helixtrans-60.1-39.1177-70.8-59.2000112.5F85 N93F85-Y89 HydrophobicContact CB-CE2 4.43Å; F85-Y89 WeakPolarHBondContact O-CD2 3.37Å; F85-Y89 PolarHBondContact O-N 2.78Å; F85-Y89 VanDerWaalsContact O-N 3.11Å; Y89-N93 WeakPolarHBondContact O-CB 3.28Å; Y89-N93 VanDerWaalsContact O-CG 3.29Å; Y89-N93 PolarHBondContact O-N 3.28Å; Y89-N93 VanDerWaalsContact O-N 3.1Å; Y89-N93 PolarHBondContact O-ND2 3.18Å
90A94.6Very high91.6Very high51 Ų5175.6 Ų75.642%0.42140%0.398SS..Hα-helixtrans-66.2-44.2177.400000111.9G86 S87 F88 L94G86-A90 WeakPolarHBondContact O-CB 3.35Å; G86-A90 PolarHBondContact O-N 3.08Å; G86-A90 VanDerWaalsContact O-N 3.12Å; S87-A90 PolarHBondContact O-N 3.02Å; F88-A90 VanDerWaalsContact C-N 3.3Å; F88-A90 PolarHBondContact O-N 3.25Å; A90-L94 VanDerWaalsContact O-CG 3.25Å; A90-L94 WeakPolarHBondContact O-CG 3.06Å; A90-L94 PolarHBondContact O-N 2.73Å
91I93.4Very high90.8Very high17 Ų1773.8 Ų73.89%0.08739%0.392CS..Hα-helixtrans-68.9-42.5-179.3-69.4160.1000111S87 F88 N93 L94 L95 A113 A116 T117 I120S87-I91 WeakPolarHBondContact O-CB 3.42Å; S87-I91 WeakPolarHBondContact O-CD1 3.42Å; S87-I91 WeakPolarHBondContact O-CG1 3.38Å; S87-I91 PolarHBondContact O-N 3.15Å; F88-I91 PolarHBondContact O-N 3.25Å; I91-N93 PolarHBondContact O-N 3.05Å; I91-L94 PolarHBondContact O-N 3.49Å; I91-L94 VanDerWaalsContact O-N 3.14Å; I91-L95 HydrophobicContact CG2-CD1 3.57Å; I91-L95 HydrophobicContact CG2-CG 4.09Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 WeakPolarHBondContact O-CG 3.46Å; I91-L95 PolarHBondContact O-N 2.95Å; I91-A113 HydrophobicContact CG2-CB 4.19Å; I91-A116 HydrophobicContact CD1-CB 3.49Å; I91-A116 VanDerWaalsContact CD1-CB 3.49Å; I91-A116 HydrophobicContact CG1-CB 4.31Å; I91-A116 HydrophobicContact CG2-CB 4.48Å; I91-T117 VanDerWaalsContact CD1-N 3.27Å; I91-T117 WeakPolarHBondContact CD1-OG1 3.23Å; I91-I120 HydrophobicContact CD1-CD1 3.88Å
92E90.8Very high89.8Confident65 Ų6574.3 Ų74.330%0.30440%0.396SS..Hα-helixtrans-58.5-48.1175.5-172.9177.3-167.700110.8F88 L94 L95 V96F88-E92 WeakPolarHBondContact CE1-OE2 3.28Å; F88-E92 VanDerWaalsContact O-CB 3.31Å; F88-E92 WeakPolarHBondContact O-CB 3.34Å; F88-E92 PolarHBondContact O-N 2.86Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 2.69Å; E92-L95 PolarHBondContact O-N 3.42Å; E92-V96 WeakPolarHBondContact O-CB 3.12Å; E92-V96 WeakPolarHBondContact O-CG2 3.32Å; E92-V96 PolarHBondContact O-N 2.98Å
93N90.5Very high88.4Confident92 Ų9275.2 Ų75.249%0.49240%0.395SS..Hα-helixtrans-60.4-36.3175.1-79.3-47.3000112.9Y89 I91 N97Y89-N93 WeakPolarHBondContact O-CB 3.28Å; Y89-N93 VanDerWaalsContact O-CG 3.29Å; Y89-N93 PolarHBondContact O-N 3.28Å; Y89-N93 VanDerWaalsContact O-N 3.1Å; Y89-N93 PolarHBondContact O-ND2 3.18Å; I91-N93 PolarHBondContact O-N 3.05Å; N93-N97 WeakPolarHBondContact O-CB 3.13Å; N93-N97 PolarHBondContact O-N 3.26Å; N93-N97 PolarHBondContact O-ND2 2.86Å
94L90.5Very high87Confident90 Ų9080 Ų8047%0.47143%0.427SS..Hα-helixtrans-71.3-44.2176.2-73171.5000111.9A90 I91 E92 R98 I99A90-L94 VanDerWaalsContact O-CG 3.25Å; A90-L94 WeakPolarHBondContact O-CG 3.06Å; A90-L94 PolarHBondContact O-N 2.73Å; I91-L94 PolarHBondContact O-N 3.49Å; I91-L94 VanDerWaalsContact O-N 3.14Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 2.69Å; L94-R98 HydrophobicContact CD2-CG 4.02Å; L94-R98 WeakPolarHBondContact O-CA 3.37Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 PolarHBondContact O-N 3.07Å; L94-I99 PolarHBondContact O-N 3.04Å
95L89.3Confident85.6Confident6 Ų678 Ų783%0.03142%0.422CS..Hα-helixtrans-64.2-46.8-179.2-73.5166.4000111.3I91 E92 I99 N100 L101 I112 A113I91-L95 HydrophobicContact CG2-CD1 3.57Å; I91-L95 HydrophobicContact CG2-CG 4.09Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 WeakPolarHBondContact O-CG 3.46Å; I91-L95 PolarHBondContact O-N 2.95Å; E92-L95 PolarHBondContact O-N 3.42Å; L95-I99 HydrophobicContact CD2-CD1 3.85Å; L95-I99 CarbonylContact O-C 3.41Å; L95-I99 WeakPolarHBondContact O-CB 3.31Å; L95-I99 PolarHBondContact O-N 3.37Å; L95-N100 PolarHBondContact O-N 3.26Å; L95-L101 HydrophobicContact CD2-CD2 4.17Å; L95-L101 PolarHBondContact O-N 3.48Å; L95-L101 VanDerWaalsContact O-N 3.07Å; L95-I112 HydrophobicContact CD1-CG2 4.25Å; L95-I112 HydrophobicContact CD2-CG2 3.86Å; L95-A113 HydrophobicContact CD1-CB 3.78Å
96V88.6Confident84.6Confident53 Ų5373.9 Ų73.932%0.32141%0.412SS..Hα-helixtrans-71.6-51.3-178.9176.10000111.1E92 N100E92-V96 WeakPolarHBondContact O-CB 3.12Å; E92-V96 WeakPolarHBondContact O-CG2 3.32Å; E92-V96 PolarHBondContact O-N 2.98Å; V96-N100 WeakPolarHBondContact O-CA 3.23Å
97N88.7Confident83.9Confident106 Ų10681.4 Ų81.457%0.56743%0.428SS*.Hα-helixtrans-86.4-23.3-170.2-59.3-48.4000114.5N93N93-N97 WeakPolarHBondContact O-CB 3.13Å; N93-N97 PolarHBondContact O-N 3.26Å; N93-N97 PolarHBondContact O-ND2 2.86Å
98R84.8Confident83.3Confident199 Ų19983.5 Ų83.575%0.75144%0.44SS*.THydrogen-bonded Turntrans-109.6-41.4-174.9-54.2-68.7-100-94.9-1.4112.6L94L94-R98 HydrophobicContact CD2-CG 4.02Å; L94-R98 WeakPolarHBondContact O-CA 3.37Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 PolarHBondContact O-N 3.07Å
99I83.7Confident83.1Confident112 Ų11280 Ų8057%0.57443%0.425SS*.SBendtrans-92.4-10.1-177.7-58.3167.3000110.4L94 L95 L101L94-I99 PolarHBondContact O-N 3.04Å; L95-I99 HydrophobicContact CD2-CD1 3.85Å; L95-I99 CarbonylContact O-C 3.41Å; L95-I99 WeakPolarHBondContact O-CB 3.31Å; L95-I99 PolarHBondContact O-N 3.37Å; I99-L101 HydrophobicContact CB-CB 4.41Å; I99-L101 HydrophobicContact CG2-CB 3.99Å; I99-L101 PolarHBondContact O-N 2.93Å
100N80.4Confident82.7Confident135 Ų13578.1 Ų78.172%0.72242%0.424SS*.  trans50.724.1-172-70-32000112.3L95 V96 S102L95-N100 PolarHBondContact O-N 3.26Å; V96-N100 WeakPolarHBondContact O-CA 3.23Å; N100-S102 PolarHBondContact O-N 3.46Å
101L78.2Confident82.3Confident41 Ų4181.6 Ų81.622%0.21543%0.433CS..  trans-80.883.8174.5-172.766.8000106.4L95 I99 S105 H109 I112L95-L101 HydrophobicContact CD2-CD2 4.17Å; L95-L101 PolarHBondContact O-N 3.48Å; L95-L101 VanDerWaalsContact O-N 3.07Å; I99-L101 HydrophobicContact CB-CB 4.41Å; I99-L101 HydrophobicContact CG2-CB 3.99Å; I99-L101 PolarHBondContact O-N 2.93Å; L101-S105 VanDerWaalsContact CD1-OG 3.27Å; L101-S105 WeakPolarHBondContact CD1-OG 3.46Å; L101-S105 WeakPolarHBondContact CG-OG 3.32Å; L101-H109 HydrophobicContact CD2-CB 4.23Å; L101-H109 HydrophobicContact CG-CB 4.33Å; L101-H109 PolarHBondContact O-CD2 3.1Å; L101-I112 HydrophobicContact CD2-CD1 4.11Å
102S72.2Confident82Confident69 Ų6984.2 Ų84.248%0.48345%0.447SS..  trans-60.3148.8179.2-179.20000110.4N100 S104 S105N100-S102 PolarHBondContact O-N 3.46Å; S102-S104 PolarHBondContact O-N 3.5Å; S102-S104 PolarHBondContact OG-N 2.88Å; S102-S105 WeakPolarHBondContact O-CB 3.36Å; S102-S105 PolarHBondContact O-N 2.72Å; S102-S105 PolarHBondContact O-OG 2.65Å
103S66.9Low82Confident66 Ų6681.1 Ų81.146%0.46243%0.432SS..G310 helixtrans-53.6-18.1172.2-44.20000112.4S105 G106S103-S105 PolarHBondContact O-N 3.39Å; S103-G106 WeakPolarHBondContact O-CA 3.04Å; S103-G106 PolarHBondContact O-N 2.63Å
104S66.3Low81.9Confident114 Ų11478.6 Ų78.680%0.79743%0.427SS*.G310 helixtrans-61.8-21.6170.8-171.30000114.1S102 G106S102-S104 PolarHBondContact O-N 3.5Å; S102-S104 PolarHBondContact OG-N 2.88Å; S104-G106 PolarHBondContact O-N 3.23Å
105S66Low81.8Confident40 Ų4077.1 Ų77.128%0.2843%0.425SS..G310 helixtrans-70.71.916965.30000113.2L101 S102 S103 W107 V108 H109L101-S105 VanDerWaalsContact CD1-OG 3.27Å; L101-S105 WeakPolarHBondContact CD1-OG 3.46Å; L101-S105 WeakPolarHBondContact CG-OG 3.32Å; S102-S105 WeakPolarHBondContact O-CB 3.36Å; S102-S105 PolarHBondContact O-N 2.72Å; S102-S105 PolarHBondContact O-OG 2.65Å; S103-S105 PolarHBondContact O-N 3.39Å; S105-W107 PolarHBondContact O-N 2.82Å; S105-V108 PolarHBondContact O-N 3.48Å; S105-H109 WeakPolarHBondContact OG-CB 3.39Å
106G72.1Confident81.9Confident29 Ų2978.3 Ų78.330%0.29944%0.435SS..THydrogen-bonded Turntrans55.6-103.7167.700000112.4S103 S104 D110S103-G106 WeakPolarHBondContact O-CA 3.04Å; S103-G106 PolarHBondContact O-N 2.63Å; S104-G106 PolarHBondContact O-N 3.23Å; G106-D110 VanDerWaalsContact O-CG 3.23Å; G106-D110 PolarHBondContact O-N 2.86Å
107W82Confident82.1Confident200 Ų20076 Ų7676%0.75842%0.421SS*.Hα-helixtrans-72.6-30.4-170.467.9-72000114.9S105 M111S105-W107 PolarHBondContact O-N 2.82Å; W107-M111 WeakPolarHBondContact O-CB 3.33Å; W107-M111 PolarHBondContact O-N 2.92Å
108V83.4Confident82.2Confident56 Ų5671.7 Ų71.734%0.33940%0.402SS..Hα-helixtrans-73.1-44.8-178.1179.50000110.7S105 D110 M111 I112S105-V108 PolarHBondContact O-N 3.48Å; V108-D110 VanDerWaalsContact C-N 3.34Å; V108-D110 PolarHBondContact O-N 3.41Å; V108-M111 PolarHBondContact O-N 3.37Å; V108-I112 HydrophobicContact CG1-CD1 3.87Å; V108-I112 WeakPolarHBondContact O-CG1 3.28Å; V108-I112 PolarHBondContact O-N 3.36Å
109H88.8Confident82.5Confident3 Ų365.9 Ų65.91%0.01439%0.385CS..Hα-helixtrans-54.4-52.5173171.9-86.8000110.6L101 S105 M111 I112 A113L101-H109 HydrophobicContact CD2-CB 4.23Å; L101-H109 HydrophobicContact CG-CB 4.33Å; L101-H109 PolarHBondContact O-CD2 3.1Å; S105-H109 WeakPolarHBondContact OG-CB 3.39Å; H109-M111 VanDerWaalsContact C-N 3.34Å; H109-M111 PolarHBondContact O-N 3.1Å; H109-I112 PolarHBondContact O-N 2.98Å; H109-A113 VanDerWaalsContact O-CB 3.31Å; H109-A113 WeakPolarHBondContact O-CB 3.11Å; H109-A113 PolarHBondContact O-N 2.9Å
110D86Confident83Confident97 Ų9763.9 Ų63.952%0.51938%0.375SS..Hα-helixtrans-66.7-35.7-175.9-64.4-11.5000112.4G106 V108 G114G106-D110 VanDerWaalsContact O-CG 3.23Å; G106-D110 PolarHBondContact O-N 2.86Å; V108-D110 VanDerWaalsContact C-N 3.34Å; V108-D110 PolarHBondContact O-N 3.41Å; D110-G114 PolarHBondContact O-N 2.75Å
111M85.1Confident83.7Confident123 Ų12357.4 Ų57.461%0.60634%0.341SS*.Hα-helixtrans-64.1-46.1174.6-175.466.470.300111.6W107 V108 H109 S115W107-M111 WeakPolarHBondContact O-CB 3.33Å; W107-M111 PolarHBondContact O-N 2.92Å; V108-M111 PolarHBondContact O-N 3.37Å; H109-M111 VanDerWaalsContact C-N 3.34Å; H109-M111 PolarHBondContact O-N 3.1Å; M111-S115 WeakPolarHBondContact O-CB 3.2Å; M111-S115 PolarHBondContact O-N 2.88Å; M111-S115 PolarHBondContact O-OG 3.33Å
112I88.3Confident84.4Confident73 Ų7356 Ų5637%0.37433%0.334SS..Hα-helixtrans-67.2-47.1179-65.3169.1000109.8L95 L101 V108 H109 S115 A116L95-I112 HydrophobicContact CD1-CG2 4.25Å; L95-I112 HydrophobicContact CD2-CG2 3.86Å; L101-I112 HydrophobicContact CD2-CD1 4.11Å; V108-I112 HydrophobicContact CG1-CD1 3.87Å; V108-I112 WeakPolarHBondContact O-CG1 3.28Å; V108-I112 PolarHBondContact O-N 3.36Å; H109-I112 PolarHBondContact O-N 2.98Å; I112-S115 PolarHBondContact O-OG 3.01Å; I112-A116 VanDerWaalsContact O-CB 3.22Å; I112-A116 WeakPolarHBondContact O-CB 3.42Å; I112-A116 PolarHBondContact O-N 2.89Å
113A90.4Very high85.4Confident0 Ų054.1 Ų54.10%032%0.32CS..Hα-helixtrans-59.1-51.3178.800000111.5F88 I91 L95 H109 T117F88-A113 HydrophobicContact CE2-CB 4.27Å; I91-A113 HydrophobicContact CG2-CB 4.19Å; L95-A113 HydrophobicContact CD1-CB 3.78Å; H109-A113 VanDerWaalsContact O-CB 3.31Å; H109-A113 WeakPolarHBondContact O-CB 3.11Å; H109-A113 PolarHBondContact O-N 2.9Å; A113-T117 WeakPolarHBondContact O-CB 3.44Å; A113-T117 PolarHBondContact O-N 3.33Å; A113-T117 PolarHBondContact O-OG1 2.97Å
114G88.9Confident86.7Confident38 Ų3855.6 Ų55.639%0.39232%0.322SS..Hα-helixtrans-65.4-45.3-179.200000113.3D110 G118D110-G114 PolarHBondContact O-N 2.75Å; G114-G118 PolarHBondContact O-N 2.98Å
115S88.1Confident88.1Confident60 Ų6050.5 Ų50.542%0.4229%0.286SS..Hα-helixtrans-66-47.5179.660.90000112.1M111 I112 T117 G118 L119M111-S115 WeakPolarHBondContact O-CB 3.2Å; M111-S115 PolarHBondContact O-N 2.88Å; M111-S115 PolarHBondContact O-OG 3.33Å; I112-S115 PolarHBondContact O-OG 3.01Å; S115-T117 VanDerWaalsContact C-N 3.34Å; S115-T117 PolarHBondContact O-N 3.25Å; S115-G118 PolarHBondContact O-N 3.47Å; S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.32Å; S115-L119 PolarHBondContact O-N 3.45Å
116A91.7Very high89.4Confident30 Ų3048.7 Ų48.725%0.24827%0.274CS..Hα-helixtrans-62.3-42.8178.100000111.5I91 I112 L119 I120I91-A116 HydrophobicContact CD1-CB 3.49Å; I91-A116 VanDerWaalsContact CD1-CB 3.49Å; I91-A116 HydrophobicContact CG1-CB 4.31Å; I91-A116 HydrophobicContact CG2-CB 4.48Å; I112-A116 VanDerWaalsContact O-CB 3.22Å; I112-A116 WeakPolarHBondContact O-CB 3.42Å; I112-A116 PolarHBondContact O-N 2.89Å; A116-L119 PolarHBondContact O-N 2.66Å; A116-I120 WeakPolarHBondContact O-CB 3.03Å; A116-I120 VanDerWaalsContact O-CG1 3.24Å; A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 3.09Å
117T93Very high90.5Very high4 Ų448.3 Ų48.33%0.02527%0.266CS..Hα-helixtrans-58.9-49.4175-62.30000111.1Q84 S87 F88 I91 A113 S115 L119 I120 A121Q84-T117 HydrophobicContact CB-CG2 4.48Å; Q84-T117 HydrophobicContact CG-CG2 3.87Å; Q84-T117 WeakPolarHBondContact O-CG2 3.44Å; S87-T117 WeakPolarHBondContact OG-CG2 3.47Å; F88-T117 WeakPolarHBondContact CA-OG1 3.49Å; F88-T117 HydrophobicContact CB-CG2 3.92Å; I91-T117 VanDerWaalsContact CD1-N 3.27Å; I91-T117 WeakPolarHBondContact CD1-OG1 3.23Å; A113-T117 WeakPolarHBondContact O-CB 3.44Å; A113-T117 PolarHBondContact O-N 3.33Å; A113-T117 PolarHBondContact O-OG1 2.97Å; S115-T117 VanDerWaalsContact C-N 3.34Å; S115-T117 PolarHBondContact O-N 3.25Å; T117-L119 PolarHBondContact O-N 3.16Å; T117-I120 PolarHBondContact O-N 3.41Å; T117-A121 WeakPolarHBondContact O-CB 3.31Å; T117-A121 PolarHBondContact O-N 3.06Å
118G90.7Very high91.2Very high16 Ų1639.9 Ų39.917%0.16524%0.235CC..Hα-helixtrans-62.3-40.9-179.600000113G114 S115 S122G114-G118 PolarHBondContact O-N 2.98Å; S115-G118 PolarHBondContact O-N 3.47Å; G118-S122 VanDerWaalsContact O-CB 3.26Å; G118-S122 WeakPolarHBondContact O-CB 3.32Å; G118-S122 PolarHBondContact O-N 3.2Å; G118-S122 PolarHBondContact O-OG 3.14Å
119L91.4Very high91.7Very high77 Ų7738 Ų3840%0.40322%0.223SC..Hα-helixtrans-65.5-44176.3-67.6173.8000111.6S115 A116 T117 T123 L171S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.32Å; S115-L119 PolarHBondContact O-N 3.45Å; A116-L119 PolarHBondContact O-N 2.66Å; T117-L119 PolarHBondContact O-N 3.16Å; L119-T123 VanDerWaalsContact O-CB 3.3Å; L119-T123 WeakPolarHBondContact O-CB 3.49Å; L119-T123 PolarHBondContact O-N 3.24Å; L119-T123 PolarHBondContact O-OG1 3.29Å; L119-L171 HydrophobicContact CD2-CB 4.15Å; L119-L171 HydrophobicContact CD2-CD1 4.33Å; L119-L171 HydrophobicContact CD2-CD2 3.59Å; L119-L171 HydrophobicContact CD2-CG 4.19Å
120I94Very high92Very high70 Ų7037.8 Ų37.836%0.35922%0.222SC..Hα-helixtrans-65.2-49.5178.6-68.3168.9000110.4I91 A116 T117 S122 T123 L124I91-I120 HydrophobicContact CD1-CD1 3.88Å; A116-I120 WeakPolarHBondContact O-CB 3.03Å; A116-I120 VanDerWaalsContact O-CG1 3.24Å; A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 3.09Å; T117-I120 PolarHBondContact O-N 3.41Å; I120-S122 VanDerWaalsContact C-N 3.34Å; I120-S122 PolarHBondContact O-N 3.31Å; I120-T123 PolarHBondContact O-N 3.34Å; I120-L124 HydrophobicContact CG2-CD1 3.76Å; I120-L124 HydrophobicContact CG2-CG 4.33Å; I120-L124 WeakPolarHBondContact O-CB 3.29Å; I120-L124 WeakPolarHBondContact O-CG 3.44Å; I120-L124 PolarHBondContact O-N 3.41Å
121A95Very high92.4Very high0 Ų033.2 Ų33.20%020%0.198CC..Hα-helixtrans-60.6-42.6179.700000112.1F80 A83 Q84 T117 S125F80-A121 HydrophobicContact CD2-CB 4.1Å; F80-A121 HydrophobicContact CE2-CB 3.99Å; A83-A121 HydrophobicContact CB-CB 4.06Å; Q84-A121 HydrophobicContact CB-CB 4.13Å; T117-A121 WeakPolarHBondContact O-CB 3.31Å; T117-A121 PolarHBondContact O-N 3.06Å; A121-S125 VanDerWaalsContact O-CB 3.26Å; A121-S125 WeakPolarHBondContact O-CB 3.08Å; A121-S125 PolarHBondContact O-N 3Å; A121-S125 VanDerWaalsContact O-N 3.1Å; A121-S125 PolarHBondContact O-OG 2.76Å
122S92.2Very high92.9Very high10 Ų1028.2 Ų28.27%0.0717%0.172CC..Hα-helixtrans-63.6-45.1175.2-57.30000111.3G118 I120 L124 S125 E126G118-S122 VanDerWaalsContact O-CB 3.26Å; G118-S122 WeakPolarHBondContact O-CB 3.32Å; G118-S122 PolarHBondContact O-N 3.2Å; G118-S122 PolarHBondContact O-OG 3.14Å; I120-S122 VanDerWaalsContact C-N 3.34Å; I120-S122 PolarHBondContact O-N 3.31Å; S122-L124 PolarHBondContact O-N 2.87Å; S122-S125 PolarHBondContact O-N 2.9Å; S122-S125 PolarHBondContact O-OG 2.94Å; S122-E126 WeakPolarHBondContact O-CB 3.47Å; S122-E126 PolarHBondContact O-N 2.9Å
123T93.1Very high93.1Very high30 Ų3024.7 Ų24.718%0.18415%0.154CC..Hα-helixtrans-64.8-38.7-179.4-57.50000112.6L119 I120 W164 L167 F289L119-T123 VanDerWaalsContact O-CB 3.3Å; L119-T123 WeakPolarHBondContact O-CB 3.49Å; L119-T123 PolarHBondContact O-N 3.24Å; L119-T123 PolarHBondContact O-OG1 3.29Å; I120-T123 PolarHBondContact O-N 3.34Å; T123-W164 PolarHBondContact O-NE1 3.26Å; T123-L167 HydrophobicContact CG2-CD2 4.11Å; T123-F289 HydrophobicContact CG2-CZ 4.49Å
124L94.9Very high93.2Very high98 Ų9824.7 Ų24.751%0.51315%0.154SC..Hα-helixtrans-74-30.2179.4-72.3175.4000113A83 I120 S122A83-L124 HydrophobicContact CB-CB 4.26Å; A83-L124 HydrophobicContact CB-CD1 3.79Å; I120-L124 HydrophobicContact CG2-CD1 3.76Å; I120-L124 HydrophobicContact CG2-CG 4.33Å; I120-L124 WeakPolarHBondContact O-CB 3.29Å; I120-L124 WeakPolarHBondContact O-CG 3.44Å; I120-L124 PolarHBondContact O-N 3.41Å; S122-L124 PolarHBondContact O-N 2.87Å
125S95.1Very high93.4Very high7 Ų723.9 Ų23.95%0.04914%0.141CC..Hα-helixtrans-90.4-20.1-177.164.30000113.3L76 A121 S122 P127 L128 D129L76-S125 WeakPolarHBondContact CD1-O 3.23Å; A121-S125 VanDerWaalsContact O-CB 3.26Å; A121-S125 WeakPolarHBondContact O-CB 3.08Å; A121-S125 PolarHBondContact O-N 3Å; A121-S125 VanDerWaalsContact O-N 3.1Å; A121-S125 PolarHBondContact O-OG 2.76Å; S122-S125 PolarHBondContact O-N 2.9Å; S122-S125 PolarHBondContact O-OG 2.94Å; S125-P127 VanDerWaalsContact C-CD 3.47Å; S125-L128 WeakPolarHBondContact O-CB 3.5Å; S125-L128 PolarHBondContact O-N 2.73Å; S125-D129 PolarHBondContact O-N 3.29Å
126E93.7Very high93.6Very high2 Ų221 Ų211%0.00912%0.121CC..Hα-helixtrans-52.9-42.1-178.8-165.868.8-175.800115.2S122 L128 D129 V130 L167 K257S122-E126 WeakPolarHBondContact O-CB 3.47Å; S122-E126 PolarHBondContact O-N 2.9Å; E126-L128 PolarHBondContact O-N 2.99Å; E126-L128 VanDerWaalsContact O-N 3.15Å; E126-D129 WeakPolarHBondContact O-CA 3.31Å; E126-D129 WeakPolarHBondContact O-CB 3.32Å; E126-D129 PolarHBondContact O-N 3.27Å; E126-V130 PolarHBondContact O-N 2.77Å; E126-L167 HydrophobicContact CB-CD1 4.21Å; E126-L167 HydrophobicContact CG-CB 4.19Å; E126-L167 HydrophobicContact CG-CD1 4.23Å; E126-L167 PolarHBondContact OE1-N 3.18Å; E126-K257 VanDerWaalsContact CD-CE 3.49Å; E126-K257 WeakPolarHBondContact OE1-CE 3.34Å; E126-K257 IonicContact OE1-NZ 3.08Å; E126-K257 PolarHBondContact OE1-NZ 2.96Å; E126-K257 VanDerWaalsContact OE2-CE 3.27Å; E126-K257 WeakPolarHBondContact OE2-CE 3.29Å; E126-K257 IonicContact OE2-NZ 2.78Å; E126-K257 PolarHBondContact OE2-NZ 2.84Å
127P94.7Very high93.5Very high21 Ų2119.6 Ų19.614%0.13611%0.109CC..Hα-helixtrans-52.8-37.1175.1-30.439.1000114.3S125 M131 L163 W164S125-P127 VanDerWaalsContact C-CD 3.47Å; P127-M131 WeakPolarHBondContact O-CG 3.49Å; P127-M131 PolarHBondContact O-N 2.76Å; P127-M131 VanDerWaalsContact O-N 3.14Å; P127-L163 VanDerWaalsContact CA-O 3.23Å; P127-L163 WeakPolarHBondContact CA-O 3.44Å; P127-L163 HydrophobicContact CB-CB 4Å; P127-L163 HydrophobicContact CB-CD2 4.16Å; P127-L163 HydrophobicContact CG-CB 4.19Å; P127-W164 HydrophobicContact CG-CD2 4.29Å; P127-W164 HydrophobicContact CG-CZ2 3.92Å
128L96.2Very high93.2Very high22 Ų2219.5 Ų19.512%0.11511%0.108CC..Hα-helixtrans-74.7-32.9179.6-61.6165.2000111F75 L76 T79 S125 E126 R132 F147F75-L128 HydrophobicContact CB-CD1 3.97Å; F75-L128 HydrophobicContact CB-CD2 3.88Å; L76-L128 HydrophobicContact CB-CB 3.94Å; L76-L128 HydrophobicContact CD1-CB 3.92Å; T79-L128 HydrophobicContact CG2-CD1 4.05Å; T79-L128 VanDerWaalsContact OG1-CD1 3.3Å; T79-L128 WeakPolarHBondContact OG1-CD1 3.27Å; S125-L128 WeakPolarHBondContact O-CB 3.5Å; S125-L128 PolarHBondContact O-N 2.73Å; E126-L128 PolarHBondContact O-N 2.99Å; E126-L128 VanDerWaalsContact O-N 3.15Å; L128-R132 VanDerWaalsContact O-CB 3.23Å; L128-R132 WeakPolarHBondContact O-CB 3.08Å; L128-R132 PolarHBondContact O-N 2.75Å; L128-F147 HydrophobicContact CD2-CE2 4.07Å; L128-F147 HydrophobicContact CD2-CZ 3.54Å
129D95.3Very high92.8Very high16 Ų1618.8 Ų18.89%0.08610%0.101CC..Hα-helixtrans-70.3-42175.6-153.616.6000111.4L76 S125 E126 M131 R132 T133 K257 K258L76-D129 HydrophobicContact CD1-CB 4.05Å; L76-D129 HydrophobicContact CD2-CB 4.25Å; S125-D129 PolarHBondContact O-N 3.29Å; E126-D129 WeakPolarHBondContact O-CA 3.31Å; E126-D129 WeakPolarHBondContact O-CB 3.32Å; E126-D129 PolarHBondContact O-N 3.27Å; D129-M131 PolarHBondContact O-N 3.09Å; D129-R132 WeakPolarHBondContact O-CB 3.4Å; D129-R132 PolarHBondContact O-N 2.48Å; D129-T133 PolarHBondContact O-N 3.47Å; D129-T133 PolarHBondContact O-OG1 3.26Å; D129-K257 WeakPolarHBondContact OD2-CE 3.48Å; D129-K257 IonicContact OD2-NZ 2.97Å; D129-K257 PolarHBondContact OD2-NZ 3.01Å; D129-K258 IonicContact OD1-NZ 3.74Å; D129-K258 PolarHBondContact OD1-NZ 2.95Å; D129-K258 IonicContact OD2-NZ 2.87Å; D129-K258 PolarHBondContact OD2-NZ 3.4Å
130V94.3Very high92.1Very high0 Ų022.8 Ų22.80%012%0.115CC..Hα-helixtrans-57.4-49.5172.7174.70000110.9E126 R132 T133 R134 L154 L163 R165 E261E126-V130 PolarHBondContact O-N 2.77Å; V130-R132 PolarHBondContact O-N 3.01Å; V130-T133 PolarHBondContact O-N 2.78Å; V130-R134 WeakPolarHBondContact O-CG 3.41Å; V130-R134 PolarHBondContact O-N 2.83Å; V130-L154 HydrophobicContact CG1-CD2 4.31Å; V130-L163 VanDerWaalsContact CG2-O 3.25Å; V130-L163 WeakPolarHBondContact CG2-O 3.49Å; V130-R165 WeakPolarHBondContact CG2-O 3.38Å; V130-E261 HydrophobicContact CG2-CB 4.4Å; V130-E261 HydrophobicContact CG2-CG 3.99Å
131M94.5Very high91.2Very high1 Ų123.9 Ų23.91%0.00512%0.122CC..Hα-helixtrans-62.4-42.7178.7-72.3-61.992.400112.8P72 P127 D129 T133 R134 L135 F147 I151 L154 L163P72-M131 HydrophobicContact CB-CB 4.45Å; P127-M131 WeakPolarHBondContact O-CG 3.49Å; P127-M131 PolarHBondContact O-N 2.76Å; P127-M131 VanDerWaalsContact O-N 3.14Å; D129-M131 PolarHBondContact O-N 3.09Å; M131-T133 PolarHBondContact O-N 2.97Å; M131-R134 PolarHBondContact O-N 2.86Å; M131-L135 WeakPolarHBondContact O-CB 3.4Å; M131-L135 VanDerWaalsContact O-CG 3.27Å; M131-L135 WeakPolarHBondContact O-CG 3.3Å; M131-L135 PolarHBondContact O-N 3.19Å; M131-F147 HydrophobicContact CB-CD2 3.99Å; M131-F147 HydrophobicContact CB-CE2 3.72Å; M131-F147 HydrophobicContact CG-CD2 4.34Å; M131-F147 HydrophobicContact CG-CE2 3.92Å; M131-I151 HydrophobicContact CG-CD1 4.43Å; M131-I151 HydrophobicContact CG-CG1 3.7Å; M131-I151 HydrophobicContact SD-CB 4.44Å; M131-I151 HydrophobicContact SD-CG1 3.67Å; M131-L154 HydrophobicContact CE-CB 4.04Å; M131-L154 HydrophobicContact CE-CD2 3.15Å; M131-L154 HydrophobicContact CE-CG 4.16Å; M131-L154 HydrophobicContact SD-CD2 4.38Å; M131-L163 HydrophobicContact CE-CD2 4.32Å; M131-L163 HydrophobicContact CG-CD2 4.34Å
132R94.9Very high90.4Very high17 Ų1729.6 Ų29.66%0.06415%0.149CC..Hα-helixtrans-56-52.8174.3176.3-170.2-173.2-179.410.9111D26 P72 A73 L128 D129 V130 R134 L135 I136D26-R132 VanDerWaalsContact CB-NH2 3.29Å; D26-R132 IonicContact OD1-NH2 3.14Å; D26-R132 IonicContact OD2-CZ 2.71Å; D26-R132 IonicContact OD2-NH2 3.21Å; D26-R132 PolarHBondContact OD2-NH2 2.87Å; P72-R132 HydrophobicContact CB-CB 4.22Å; P72-R132 HydrophobicContact CG-CB 4.01Å; A73-R132 HydrophobicContact CB-CG 4.45Å; L128-R132 VanDerWaalsContact O-CB 3.23Å; L128-R132 WeakPolarHBondContact O-CB 3.08Å; L128-R132 PolarHBondContact O-N 2.75Å; D129-R132 WeakPolarHBondContact O-CB 3.4Å; D129-R132 PolarHBondContact O-N 2.48Å; V130-R132 PolarHBondContact O-N 3.01Å; R132-R134 PolarHBondContact O-N 3.03Å; R132-L135 PolarHBondContact O-N 3.19Å; R132-I136 HydrophobicContact CG-CD1 3.83Å; R132-I136 WeakPolarHBondContact O-CB 3.3Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.07Å; R132-I136 PolarHBondContact O-N 3.04Å
133T93.8Very high89.7Confident0 Ų032.1 Ų32.10%016%0.161CC..Hα-helixtrans-64.6-41.6-176.3-62.90000111.8I30 L34 D129 V130 M131 I136 A137 K258 E261 I262I30-T133 HydrophobicContact CG2-CG2 3.99Å; L34-T133 HydrophobicContact CD1-CG2 4.41Å; L34-T133 HydrophobicContact CD2-CG2 4.48Å; D129-T133 PolarHBondContact O-N 3.47Å; D129-T133 PolarHBondContact O-OG1 3.26Å; V130-T133 PolarHBondContact O-N 2.78Å; M131-T133 PolarHBondContact O-N 2.97Å; T133-I136 PolarHBondContact O-N 2.89Å; T133-A137 VanDerWaalsContact O-CB 3.27Å; T133-A137 WeakPolarHBondContact O-CB 3.13Å; T133-A137 PolarHBondContact O-N 2.97Å; T133-K258 HydrophobicContact CG2-CB 4.49Å; T133-K258 HydrophobicContact CG2-CD 4.15Å; T133-K258 WeakPolarHBondContact OG1-CD 3.42Å; T133-K258 PolarHBondContact OG1-NZ 3.26Å; T133-E261 WeakPolarHBondContact CB-OE2 3.31Å; T133-E261 HydrophobicContact CG2-CB 4.15Å; T133-E261 VanDerWaalsContact CG2-OE2 3.26Å; T133-E261 WeakPolarHBondContact CG2-OE2 3.34Å; T133-E261 PolarHBondContact OG1-OE2 2.94Å; T133-I262 HydrophobicContact CG2-CD1 3.89Å; T133-I262 HydrophobicContact CG2-CG1 3.74Å
134R92.2Very high89.3Confident0 Ų030.9 Ų30.90%015%0.153CC..Hα-helixtrans-64.3-43.7176.9-70.7-173.8-179.3-1471.3112.7V130 M131 R132 I136 A137 Q138 Y144 L154 E158 E261 R263 F265V130-R134 WeakPolarHBondContact O-CG 3.41Å; V130-R134 PolarHBondContact O-N 2.83Å; M131-R134 PolarHBondContact O-N 2.86Å; R132-R134 PolarHBondContact O-N 3.03Å; R134-I136 VanDerWaalsContact C-N 3.3Å; R134-I136 PolarHBondContact O-N 2.94Å; R134-A137 PolarHBondContact O-N 3.37Å; R134-Q138 WeakPolarHBondContact O-CG 3.23Å; R134-Q138 PolarHBondContact O-N 3.15Å; R134-Y144 HydrophobicContact CB-CE2 3.92Å; R134-Y144 PolarHBondContact NH1-OH 3.18Å; R134-L154 VanDerWaalsContact NH1-CD1 3.3Å; R134-E158 IonicContact CZ-OE1 2.66Å; R134-E158 IonicContact CZ-OE2 2.76Å; R134-E158 IonicContact NH1-OE1 3.84Å; R134-E158 PolarHBondContact NH1-OE1 3.12Å; R134-E158 IonicContact NH1-OE2 2.85Å; R134-E158 IonicContact NH2-OE1 2.77Å; R134-E158 PolarHBondContact NH2-OE1 3.11Å; R134-E158 IonicContact NH2-OE2 2.97Å; R134-E158 PolarHBondContact NH2-OE2 2.66Å; R134-E261 PolarHBondContact NE-O 3.45Å; R134-E261 PolarHBondContact NH2-O 2.92Å; R134-R263 PolarHBondContact NH2-O 2.93Å; R134-F265 HydrophobicContact CB-CD1 4.01Å; R134-F265 HydrophobicContact CB-CE1 4.06Å; R134-F265 HydrophobicContact CG-CD1 4.07Å; R134-F265 HydrophobicContact CG-CG 4.44Å
135L92.8Very high88.6Confident20 Ų2031 Ų3111%0.10516%0.162CC..Hα-helixtrans-61.7-39.3176.2-72.2168.4000111.9P72 M131 R132 A137 Y144 F147P72-L135 HydrophobicContact CG-CD1 3.83Å; M131-L135 WeakPolarHBondContact O-CB 3.4Å; M131-L135 VanDerWaalsContact O-CG 3.27Å; M131-L135 WeakPolarHBondContact O-CG 3.3Å; M131-L135 PolarHBondContact O-N 3.19Å; R132-L135 PolarHBondContact O-N 3.19Å; L135-A137 VanDerWaalsContact C-N 3.32Å; L135-Y144 HydrophobicContact CD2-CD2 4.14Å; L135-F147 HydrophobicContact CD1-CB 4.34Å; L135-F147 HydrophobicContact CD1-CD2 4.44Å
136I92.7Very high88.2Confident0 Ų032 Ų320%017%0.173CC..Hα-helixtrans-68.8-33.8178.3-71.9173.5000112V27 I30 R31 K68 R132 T133 R134 Q138V27-I136 HydrophobicContact CB-CG2 4.38Å; V27-I136 HydrophobicContact CG1-CG2 4.17Å; V27-I136 HydrophobicContact CG2-CD1 4.26Å; V27-I136 HydrophobicContact CG2-CG1 4.18Å; V27-I136 HydrophobicContact CG2-CG2 4.45Å; I30-I136 HydrophobicContact CB-CG2 3.86Å; I30-I136 HydrophobicContact CD1-CD1 3.51Å; I30-I136 HydrophobicContact CG2-CB 4.21Å; I30-I136 HydrophobicContact CG2-CG2 3.64Å; R31-I136 HydrophobicContact CG-CG2 4.2Å; R31-I136 PolarHBondContact NE-O 3.31Å; R31-I136 VanDerWaalsContact NE-O 3.11Å; R31-I136 PolarHBondContact NH2-O 3.12Å; K68-I136 HydrophobicContact CB-CG1 4.22Å; K68-I136 WeakPolarHBondContact O-CG1 3.28Å; R132-I136 HydrophobicContact CG-CD1 3.83Å; R132-I136 WeakPolarHBondContact O-CB 3.3Å; R132-I136 VanDerWaalsContact O-CG1 3.28Å; R132-I136 WeakPolarHBondContact O-CG1 3.07Å; R132-I136 PolarHBondContact O-N 3.04Å; T133-I136 PolarHBondContact O-N 2.89Å; R134-I136 VanDerWaalsContact C-N 3.3Å; R134-I136 PolarHBondContact O-N 2.94Å; I136-Q138 VanDerWaalsContact C-N 3.33Å
137A90Very high88.1Confident0 Ų033.6 Ų33.60%018%0.18CC..Hα-helixtrans-76.6-17.2-178.500000115L34 T133 R134 L135 G139 I262 R269L34-A137 HydrophobicContact CD1-CB 3.62Å; T133-A137 VanDerWaalsContact O-CB 3.27Å; T133-A137 WeakPolarHBondContact O-CB 3.13Å; T133-A137 PolarHBondContact O-N 2.97Å; R134-A137 PolarHBondContact O-N 3.37Å; L135-A137 VanDerWaalsContact C-N 3.32Å; A137-G139 PolarHBondContact O-N 3.04Å; A137-I262 HydrophobicContact CB-CD1 3.12Å; A137-I262 HydrophobicContact CB-CG1 4.39Å; A137-R269 HydrophobicContact CB-CG 4.49Å
138Q86.9Confident87.9Confident3 Ų339 Ų391%0.01421%0.207CC..  trans-64.6126.3173.3-67.9174.7-104.100109.3R31 K68 R134 I136 Q142 Y144 F265 A268R31-Q138 PolarHBondContact NH2-O 3.4Å; K68-Q138 PolarHBondContact NZ-O 3.39Å; R134-Q138 WeakPolarHBondContact O-CG 3.23Å; R134-Q138 PolarHBondContact O-N 3.15Å; I136-Q138 VanDerWaalsContact C-N 3.33Å; Q138-Q142 VanDerWaalsContact NE2-CA 3.31Å; Q138-Y144 PolarHBondContact NE2-O 3.46Å; Q138-F265 HydrophobicContact CG-CE1 3.58Å; Q138-F265 HydrophobicContact CG-CZ 3.72Å; Q138-A268 HydrophobicContact CG-CB 4.13Å
139G80.8Confident87.7Confident1 Ų140.8 Ų40.81%0.0122%0.22CC..  trans-80.9-135.5172.400000112.2E61 K68 A137E61-G139 WeakPolarHBondContact OE1-CA 3.43Å; K68-G139 PolarHBondContact NZ-O 3.02Å; A137-G139 PolarHBondContact O-N 3.04Å
140K76.3Confident87.5Confident160 Ų16040 Ų4070%0.69622%0.216SC*.SBendtrans-65.9-37.2173.4-168.2175.4-177.1178.40112.3Q142K140-Q142 PolarHBondContact O-N 2.98Å
141N75.4Confident87.5Confident94 Ų9442 Ų4250%0.50323%0.227SC..SBendtrans-82.3108.1176.8-69.9-9.4000110.1T271N141-T271 HydrophobicContact CB-CG2 4.48Å
142Q78.5Confident87.4Confident120 Ų12051.5 Ų51.556%0.56126%0.262SS*.  trans-93.7113178.5-62.2-166.3-8.600111Q138 K140Q138-Q142 VanDerWaalsContact NE2-CA 3.31Å; K140-Q142 PolarHBondContact O-N 2.98Å
143I78.7Confident87.2Confident63 Ų6353.9 Ų53.932%0.32327%0.274SS..SBendtrans-78.3-42.5168.9-58-171.5000110.6F265 K267 A268I143-F265 HydrophobicContact CB-CE2 3.81Å; I143-F265 HydrophobicContact CB-CZ 3.97Å; I143-F265 HydrophobicContact CD1-CD2 4.39Å; I143-F265 HydrophobicContact CD1-CE2 3.79Å; I143-F265 HydrophobicContact CD1-CZ 4.31Å; I143-F265 HydrophobicContact CG1-CE2 4.23Å; I143-F265 HydrophobicContact CG1-CZ 4.41Å; I143-F265 HydrophobicContact CG2-CE2 3.97Å; I143-K267 HydrophobicContact CD1-CB 4.02Å; I143-A268 HydrophobicContact CD1-CB 3.61Å; I143-A268 HydrophobicContact CG1-CB 3.91Å
144Y83.3Confident87Confident4 Ų454 Ų542%0.01627%0.274CS..  trans-94.2124.3175.2-50.3-29.9000109.5R134 L135 Q138 G146 H153 F265R134-Y144 HydrophobicContact CB-CE2 3.92Å; R134-Y144 PolarHBondContact NH1-OH 3.18Å; L135-Y144 HydrophobicContact CD2-CD2 4.14Å; Q138-Y144 PolarHBondContact NE2-O 3.46Å; Y144-G146 VanDerWaalsContact C-N 3.3Å; Y144-H153 HydrophobicContact CD1-CB 4.22Å; Y144-H153 HydrophobicContact CE1-CB 3.93Å; Y144-H153 AromaticContact CE1-CD2 3.5Å; Y144-H153 VanDerWaalsContact CE1-CD2 3.5Å; Y144-H153 WeakPolarHBondContact CE1-CD2 3.13Å; Y144-H153 AromaticContact CE1-CG 3.89Å; Y144-F265 HydrophobicContact CD1-CE2 4.16Å; Y144-F265 HydrophobicContact CD1-CZ 4.3Å; Y144-F265 HydrophobicContact CD2-CE1 4.42Å; Y144-F265 HydrophobicContact CD2-CE2 4.21Å; Y144-F265 AromaticContact CD2-CZ 3.74Å; Y144-F265 HydrophobicContact CD2-CZ 3.74Å; Y144-F265 HydrophobicContact CE1-CD2 4.3Å; Y144-F265 AromaticContact CE1-CE2 3.47Å; Y144-F265 HydrophobicContact CE1-CE2 3.47Å; Y144-F265 VanDerWaalsContact CE1-CE2 3.47Å; Y144-F265 AromaticContact CE1-CZ 3.97Å; Y144-F265 HydrophobicContact CE1-CZ 3.97Å; Y144-F265 HydrophobicContact CE2-CD2 4.24Å; Y144-F265 AromaticContact CE2-CE1 3.99Å; Y144-F265 HydrophobicContact CE2-CE1 3.99Å; Y144-F265 AromaticContact CE2-CE2 3.57Å; Y144-F265 HydrophobicContact CE2-CE2 3.57Å; Y144-F265 AromaticContact CE2-CZ 3.4Å; Y144-F265 HydrophobicContact CE2-CZ 3.4Å; Y144-F265 HydrophobicContact CG-CE2 4.5Å; Y144-F265 HydrophobicContact CG-CZ 4.2Å; Y144-F265 AromaticContact CZ-CD2 3.71Å; Y144-F265 AromaticContact CZ-CE2 3.14Å; Y144-F265 AromaticContact CZ-CZ 3.54Å; Y144-F265 VanDerWaalsContact OH-CD2 3.29Å; Y144-F265 WeakPolarHBondContact OH-CD2 3.23Å; Y144-F265 VanDerWaalsContact OH-CE2 3.26Å; Y144-F265 WeakPolarHBondContact OH-CE2 3.14Å
145S81.6Confident87Confident101 Ų10156.8 Ų56.871%0.70629%0.289SS*.SBendtrans-75.6-20.9172.256.90000112.7C149S145-C149 WeakPolarHBondContact OG-CB 3.25Å
146G86.6Confident86.8Confident27 Ų2763.3 Ų63.328%0.27832%0.318SS..SBendtrans-174.5176.6-179.300000112.2Y144 C149 G150Y144-G146 VanDerWaalsContact C-N 3.3Å; G146-C149 PolarHBondContact O-N 3.1Å; G146-G150 PolarHBondContact O-N 2.76Å
147F89.9Confident86.4Confident35 Ų3569 Ų6915%0.15435%0.345CS..Hα-helixtrans-59.1-51.1-174.5169.9-120.8000113.5V71 P72 F75 L128 M131 L135 G150 I151V71-F147 HydrophobicContact CG1-CD1 4.4Å; P72-F147 HydrophobicContact CB-CD2 3.85Å; P72-F147 HydrophobicContact CB-CE2 3.73Å; P72-F147 HydrophobicContact CB-CZ 4.4Å; P72-F147 HydrophobicContact CG-CD2 4.18Å; F75-F147 HydrophobicContact CD2-CE1 4.26Å; F75-F147 HydrophobicContact CE2-CE1 4.49Å; L128-F147 HydrophobicContact CD2-CE2 4.07Å; L128-F147 HydrophobicContact CD2-CZ 3.54Å; M131-F147 HydrophobicContact CB-CD2 3.99Å; M131-F147 HydrophobicContact CB-CE2 3.72Å; M131-F147 HydrophobicContact CG-CD2 4.34Å; M131-F147 HydrophobicContact CG-CE2 3.92Å; L135-F147 HydrophobicContact CD1-CB 4.34Å; L135-F147 HydrophobicContact CD1-CD2 4.44Å; F147-G150 PolarHBondContact O-N 3.18Å; F147-I151 HydrophobicContact CD2-CD1 4.14Å; F147-I151 HydrophobicContact CD2-CG1 4.46Å; F147-I151 HydrophobicContact CE1-CD1 3.94Å; F147-I151 HydrophobicContact CE2-CD1 3.49Å; F147-I151 VanDerWaalsContact CE2-CD1 3.49Å; F147-I151 HydrophobicContact CE2-CG1 4.07Å; F147-I151 HydrophobicContact CZ-CD1 3.37Å; F147-I151 HydrophobicContact CZ-CG1 4.43Å; F147-I151 PolarHBondContact O-N 3.1Å
148L92Very high86.1Confident135 Ų13570.7 Ų70.771%0.70735%0.353SS*.Hα-helixtrans-68.2-38.4-178.6-64.3177000112.7G150 I151 R152L148-G150 VanDerWaalsContact C-N 3.32Å; L148-I151 PolarHBondContact O-N 3.4Å; L148-R152 PolarHBondContact O-N 3.29Å; L148-R152 VanDerWaalsContact O-N 3.09Å
149C91.6Very high86Confident59 Ų5972 Ų7240%0.39937%0.367SS..Hα-helixtrans-63.4-41.3173.7-175.40000110.8S145 G146 I151 R152 H153S145-C149 WeakPolarHBondContact OG-CB 3.25Å; G146-C149 PolarHBondContact O-N 3.1Å; C149-I151 PolarHBondContact O-N 3.13Å; C149-R152 PolarHBondContact O-N 3.05Å; C149-H153 WeakPolarHBondContact O-CB 3.46Å; C149-H153 PolarHBondContact O-N 2.86Å
150G91.5Very high86.3Confident0 Ų077.2 Ų77.20%039%0.394CS..Hα-helixtrans-60.2-42.8175.100000113.2G146 F147 L148 H153 L154G146-G150 PolarHBondContact O-N 2.76Å; F147-G150 PolarHBondContact O-N 3.18Å; L148-G150 VanDerWaalsContact C-N 3.32Å; G150-H153 PolarHBondContact O-N 3.36Å; G150-L154 VanDerWaalsContact O-CB 3.32Å; G150-L154 WeakPolarHBondContact O-CB 2.87Å; G150-L154 PolarHBondContact O-N 3.37Å
151I93Very high86.7Confident43 Ų4372.4 Ų72.422%0.22138%0.376CS..Hα-helixtrans-60.7-51.8174.1-70.6170.2000110.6M131 F147 L148 C149 H153 L154 I155M131-I151 HydrophobicContact CG-CD1 4.43Å; M131-I151 HydrophobicContact CG-CG1 3.7Å; M131-I151 HydrophobicContact SD-CB 4.44Å; M131-I151 HydrophobicContact SD-CG1 3.67Å; F147-I151 HydrophobicContact CD2-CD1 4.14Å; F147-I151 HydrophobicContact CD2-CG1 4.46Å; F147-I151 HydrophobicContact CE1-CD1 3.94Å; F147-I151 HydrophobicContact CE2-CD1 3.49Å; F147-I151 VanDerWaalsContact CE2-CD1 3.49Å; F147-I151 HydrophobicContact CE2-CG1 4.07Å; F147-I151 HydrophobicContact CZ-CD1 3.37Å; F147-I151 HydrophobicContact CZ-CG1 4.43Å; F147-I151 PolarHBondContact O-N 3.1Å; L148-I151 PolarHBondContact O-N 3.4Å; C149-I151 PolarHBondContact O-N 3.13Å; I151-H153 VanDerWaalsContact C-N 3.3Å; I151-H153 PolarHBondContact O-N 3.42Å; I151-L154 PolarHBondContact O-N 3.44Å; I151-I155 HydrophobicContact CG2-CD1 3.65Å; I151-I155 HydrophobicContact CG2-CG1 4.37Å; I151-I155 VanDerWaalsContact O-CG1 3.3Å; I151-I155 WeakPolarHBondContact O-CG1 3.45Å; I151-I155 PolarHBondContact O-N 3.34Å
152R93.5Very high87.2Confident200 Ų20068 Ų6876%0.75535%0.353SS*.Hα-helixtrans-58.7-44.4-179.1-178.6178.5176174.7-0.5111.3L148 C149 I155 H156L148-R152 PolarHBondContact O-N 3.29Å; L148-R152 VanDerWaalsContact O-N 3.09Å; C149-R152 PolarHBondContact O-N 3.05Å; R152-I155 PolarHBondContact O-N 2.95Å; R152-H156 WeakPolarHBondContact O-CB 3.02Å; R152-H156 PolarHBondContact O-N 3.45Å
153H90.9Very high87.7Confident67 Ų6763 Ų6331%0.3133%0.33SS..Hα-helixtrans-66.6-43.2179.1-171.196.1000111.8Y144 C149 G150 I151 I155 H156 E157Y144-H153 HydrophobicContact CD1-CB 4.22Å; Y144-H153 HydrophobicContact CE1-CB 3.93Å; Y144-H153 AromaticContact CE1-CD2 3.5Å; Y144-H153 VanDerWaalsContact CE1-CD2 3.5Å; Y144-H153 WeakPolarHBondContact CE1-CD2 3.13Å; Y144-H153 AromaticContact CE1-CG 3.89Å; C149-H153 WeakPolarHBondContact O-CB 3.46Å; C149-H153 PolarHBondContact O-N 2.86Å; G150-H153 PolarHBondContact O-N 3.36Å; I151-H153 VanDerWaalsContact C-N 3.3Å; I151-H153 PolarHBondContact O-N 3.42Å; H153-I155 PolarHBondContact O-N 3.19Å; H153-H156 PolarHBondContact O-N 3.38Å; H153-E157 WeakPolarHBondContact NE2-CG 3.23Å; H153-E157 WeakPolarHBondContact O-CG 3.42Å; H153-E157 PolarHBondContact O-N 2.79Å
154L89.6Confident88.3Confident1 Ų163 Ų631%0.00533%0.326CS..Hα-helixtrans-58.7-47.2175.2166.563.3000111.4V130 M131 R134 G150 I151 H156 E157 E158 L163V130-L154 HydrophobicContact CG1-CD2 4.31Å; M131-L154 HydrophobicContact CE-CB 4.04Å; M131-L154 HydrophobicContact CE-CD2 3.15Å; M131-L154 HydrophobicContact CE-CG 4.16Å; M131-L154 HydrophobicContact SD-CD2 4.38Å; R134-L154 VanDerWaalsContact NH1-CD1 3.3Å; G150-L154 VanDerWaalsContact O-CB 3.32Å; G150-L154 WeakPolarHBondContact O-CB 2.87Å; G150-L154 PolarHBondContact O-N 3.37Å; I151-L154 PolarHBondContact O-N 3.44Å; L154-H156 VanDerWaalsContact C-N 3.26Å; L154-H156 PolarHBondContact O-N 2.99Å; L154-E157 PolarHBondContact O-N 3.47Å; L154-E158 HydrophobicContact CD1-CB 3.68Å; L154-E158 VanDerWaalsContact CD1-CD 3.42Å; L154-E158 HydrophobicContact CD1-CG 3.82Å; L154-E158 WeakPolarHBondContact CD1-OE2 3.24Å; L154-E158 PolarHBondContact O-N 3.07Å; L154-L163 HydrophobicContact CD2-CB 4.44Å; L154-L163 HydrophobicContact CD2-CD2 3.38Å; L154-L163 HydrophobicContact CD2-CG 3.72Å; L154-L163 HydrophobicContact CG-CD2 4.46Å
155I90.4Very high88.5Confident59 Ų5963.2 Ų63.230%0.30333%0.327SS..Hα-helixtrans-63-37.6-179.7-66.4170.5000110.5I151 R152 H153 G159 L160 L163I151-I155 HydrophobicContact CG2-CD1 3.65Å; I151-I155 HydrophobicContact CG2-CG1 4.37Å; I151-I155 VanDerWaalsContact O-CG1 3.3Å; I151-I155 WeakPolarHBondContact O-CG1 3.45Å; I151-I155 PolarHBondContact O-N 3.34Å; R152-I155 PolarHBondContact O-N 2.95Å; H153-I155 PolarHBondContact O-N 3.19Å; I155-G159 WeakPolarHBondContact O-CA 3.23Å; I155-G159 PolarHBondContact O-N 3.15Å; I155-L160 HydrophobicContact CD1-CD2 3.85Å; I155-L160 HydrophobicContact CG1-CD2 3.99Å; I155-L160 HydrophobicContact CG2-CD2 3.75Å; I155-L160 HydrophobicContact CG2-CG 4.12Å; I155-L163 HydrophobicContact CD1-CD1 4.11Å; I155-L163 HydrophobicContact CG1-CD1 4.03Å
156H88.8Confident88.7Confident157 Ų15758.4 Ų58.473%0.72729%0.293SS*.Hα-helixtrans-68.3-45.9178.5-170.968.3000112.7R152 H153 L154R152-H156 WeakPolarHBondContact O-CB 3.02Å; R152-H156 PolarHBondContact O-N 3.45Å; H153-H156 PolarHBondContact O-N 3.38Å; L154-H156 VanDerWaalsContact C-N 3.26Å; L154-H156 PolarHBondContact O-N 2.99Å
157E85.4Confident88.8Confident119 Ų11957.1 Ų57.156%0.55628%0.28SS*.Hα-helixtrans-81.4-40.6-175-69.7-66.1140.100113.6H153 L154H153-E157 WeakPolarHBondContact NE2-CG 3.23Å; H153-E157 WeakPolarHBondContact O-CG 3.42Å; H153-E157 PolarHBondContact O-N 2.79Å; L154-E157 PolarHBondContact O-N 3.47Å
158E83.1Confident88.7Confident36 Ų3655.5 Ų55.517%0.16827%0.273CS..Hα-helixtrans-113.7-8-172.4-59.7-175.4-161.500113.9R134 L154 R165R134-E158 IonicContact CZ-OE1 2.66Å; R134-E158 IonicContact CZ-OE2 2.76Å; R134-E158 IonicContact NH1-OE1 3.84Å; R134-E158 PolarHBondContact NH1-OE1 3.12Å; R134-E158 IonicContact NH1-OE2 2.85Å; R134-E158 IonicContact NH2-OE1 2.77Å; R134-E158 PolarHBondContact NH2-OE1 3.11Å; R134-E158 IonicContact NH2-OE2 2.97Å; R134-E158 PolarHBondContact NH2-OE2 2.66Å; L154-E158 HydrophobicContact CD1-CB 3.68Å; L154-E158 VanDerWaalsContact CD1-CD 3.42Å; L154-E158 HydrophobicContact CD1-CG 3.82Å; L154-E158 WeakPolarHBondContact CD1-OE2 3.24Å; L154-E158 PolarHBondContact O-N 3.07Å; E158-R165 IonicContact OE2-CZ 3.76Å; E158-R165 IonicContact OE2-NE 3.13Å; E158-R165 PolarHBondContact OE2-NE 3.02Å; E158-R165 IonicContact OE2-NH1 2.75Å; E158-R165 PolarHBondContact OE2-NH1 3.48Å; E158-R165 IonicContact OE2-NH2 2.86Å; E158-R165 PolarHBondContact OE2-NH2 3Å; E158-R165 VanDerWaalsContact OE2-NH2 3.08Å
159G85.4Confident88.6Confident30 Ų3049.1 Ų49.131%0.30924%0.239SC..  trans79.9171-172.800000113.5I155 L161 G162I155-G159 WeakPolarHBondContact O-CA 3.23Å; I155-G159 PolarHBondContact O-N 3.15Å; G159-L161 VanDerWaalsContact C-N 3.27Å; G159-L161 PolarHBondContact O-N 3.31Å; G159-G162 PolarHBondContact O-N 2.95Å
160L86.5Confident88.5Confident111 Ų11147 Ų4758%0.58123%0.225SC*.G310 helixtrans-57.2-37.3-178.5-71.1168.7000113.2I155 G162 L163 W164I155-L160 HydrophobicContact CD1-CD2 3.85Å; I155-L160 HydrophobicContact CG1-CD2 3.99Å; I155-L160 HydrophobicContact CG2-CD2 3.75Å; I155-L160 HydrophobicContact CG2-CG 4.12Å; L160-G162 PolarHBondContact O-N 2.95Å; L160-L163 WeakPolarHBondContact O-CB 3.36Å; L160-L163 PolarHBondContact O-N 3.21Å; L160-W164 WeakPolarHBondContact O-CZ3 3.48Å
161L85.1Confident88.5Confident60 Ų6048.5 Ų48.531%0.31423%0.233SC..G310 helixtrans-67.8-14.9179.9-62.3179.8000113.4G159 L163 W164 I287 F289 L292G159-L161 VanDerWaalsContact C-N 3.27Å; G159-L161 PolarHBondContact O-N 3.31Å; L161-L163 PolarHBondContact O-N 2.81Å; L161-W164 PolarHBondContact O-N 3.27Å; L161-I287 WeakPolarHBondContact CD1-O 3.23Å; L161-F289 HydrophobicContact CD2-CD2 3.73Å; L161-L292 HydrophobicContact CD2-CD2 4.35Å
162G84.9Confident88.4Confident2 Ų249 Ų492%0.02124%0.236CC..G310 helixtrans-60-27.1171.900000113.2G159 L160 W164 R165G159-G162 PolarHBondContact O-N 2.95Å; L160-G162 PolarHBondContact O-N 2.95Å; G162-W164 VanDerWaalsContact C-N 3.27Å; G162-W164 PolarHBondContact O-N 3.26Å; G162-R165 WeakPolarHBondContact O-CG 3.26Å; G162-R165 PolarHBondContact O-N 3.28Å
163L90.3Very high88.2Confident15 Ų1539.9 Ų39.98%0.07920%0.203CC..G310 helixtrans-70.2-18.7177.4-71.7165.7000113.7P127 V130 M131 L154 I155 L160 L161P127-L163 VanDerWaalsContact CA-O 3.23Å; P127-L163 WeakPolarHBondContact CA-O 3.44Å; P127-L163 HydrophobicContact CB-CB 4Å; P127-L163 HydrophobicContact CB-CD2 4.16Å; P127-L163 HydrophobicContact CG-CB 4.19Å; V130-L163 VanDerWaalsContact CG2-O 3.25Å; V130-L163 WeakPolarHBondContact CG2-O 3.49Å; M131-L163 HydrophobicContact CE-CD2 4.32Å; M131-L163 HydrophobicContact CG-CD2 4.34Å; L154-L163 HydrophobicContact CD2-CB 4.44Å; L154-L163 HydrophobicContact CD2-CD2 3.38Å; L154-L163 HydrophobicContact CD2-CG 3.72Å; L154-L163 HydrophobicContact CG-CD2 4.46Å; I155-L163 HydrophobicContact CD1-CD1 4.11Å; I155-L163 HydrophobicContact CG1-CD1 4.03Å; L160-L163 WeakPolarHBondContact O-CB 3.36Å; L160-L163 PolarHBondContact O-N 3.21Å; L161-L163 PolarHBondContact O-N 2.81Å
164W91.5Very high88Confident61 Ų6138.7 Ų38.723%0.23120%0.2CC..G310 helixtrans-104.819.6-179.7-75.3-83.8000112.9T123 P127 L160 L161 G162 G166 L167 L292 Q296T123-W164 PolarHBondContact O-NE1 3.26Å; P127-W164 HydrophobicContact CG-CD2 4.29Å; P127-W164 HydrophobicContact CG-CZ2 3.92Å; L160-W164 WeakPolarHBondContact O-CZ3 3.48Å; L161-W164 PolarHBondContact O-N 3.27Å; G162-W164 VanDerWaalsContact C-N 3.27Å; G162-W164 PolarHBondContact O-N 3.26Å; W164-G166 PolarHBondContact O-N 3.2Å; W164-L167 HydrophobicContact CB-CD2 4.42Å; W164-L167 VanDerWaalsContact O-CB 3.29Å; W164-L167 WeakPolarHBondContact O-CB 3.47Å; W164-L167 PolarHBondContact O-N 3.22Å; W164-L292 HydrophobicContact CB-CD2 4.12Å; W164-Q296 PolarHBondContact O-NE2 3.07Å; W164-Q296 PolarHBondContact O-OE1 3.49Å
165R86.5Confident87.9Confident10 Ų1043.4 Ų43.44%0.03823%0.229CC..THydrogen-bonded Turntrans-67.9129.4175.2-72.7-178.9-177.4-151.92.8110V130 E158 G162 E261 R263V130-R165 WeakPolarHBondContact CG2-O 3.38Å; E158-R165 IonicContact OE2-CZ 3.76Å; E158-R165 IonicContact OE2-NE 3.13Å; E158-R165 PolarHBondContact OE2-NE 3.02Å; E158-R165 IonicContact OE2-NH1 2.75Å; E158-R165 PolarHBondContact OE2-NH1 3.48Å; E158-R165 IonicContact OE2-NH2 2.86Å; E158-R165 PolarHBondContact OE2-NH2 3Å; E158-R165 VanDerWaalsContact OE2-NH2 3.08Å; G162-R165 WeakPolarHBondContact O-CG 3.26Å; G162-R165 PolarHBondContact O-N 3.28Å; R165-E261 VanDerWaalsContact O-CG 3.31Å; R165-E261 WeakPolarHBondContact O-CG 3.3Å; R165-R263 PolarHBondContact NH1-O 2.96Å
166G86.1Confident87.9Confident0 Ų043 Ų430%023%0.229CC..THydrogen-bonded Turntrans97.2-5.3-176.600000113.9W164 G168 P169 C170W164-G166 PolarHBondContact O-N 3.2Å; G166-G168 PolarHBondContact O-N 2.87Å; G166-P169 WeakPolarHBondContact O-CD 3.4Å; G166-P169 VanDerWaalsContact O-CG 3.25Å; G166-P169 WeakPolarHBondContact O-CG 3.25Å; G166-C170 WeakPolarHBondContact O-CB 3.2Å; G166-C170 PolarHBondContact O-N 3.11Å; G166-C170 VanDerWaalsContact O-N 3.12Å
167L88.9Confident88Confident0 Ų039.5 Ų39.50%021%0.213CC..Hα-helixtrans-59.8-43.5176.2-17360.7000112.2T123 E126 W164 C170 L171 H293T123-L167 HydrophobicContact CG2-CD2 4.11Å; E126-L167 HydrophobicContact CB-CD1 4.21Å; E126-L167 HydrophobicContact CG-CB 4.19Å; E126-L167 HydrophobicContact CG-CD1 4.23Å; E126-L167 PolarHBondContact OE1-N 3.18Å; W164-L167 HydrophobicContact CB-CD2 4.42Å; W164-L167 VanDerWaalsContact O-CB 3.29Å; W164-L167 WeakPolarHBondContact O-CB 3.47Å; W164-L167 PolarHBondContact O-N 3.22Å; L167-C170 VanDerWaalsContact O-CB 3.31Å; L167-C170 WeakPolarHBondContact O-CB 3.22Å; L167-C170 PolarHBondContact O-N 3.48Å; L167-L171 HydrophobicContact CD1-CD1 4.14Å; L167-L171 HydrophobicContact CD1-CD2 3.91Å; L167-L171 HydrophobicContact CD1-CG 3.93Å; L167-L171 HydrophobicContact CD2-CD1 4.49Å; L167-L171 HydrophobicContact CG-CD1 3.91Å; L167-L171 HydrophobicContact CG-CG 4.09Å; L167-L171 VanDerWaalsContact O-CG 3.3Å; L167-L171 WeakPolarHBondContact O-CG 3.43Å; L167-L171 PolarHBondContact O-N 3.49Å; L167-H293 WeakPolarHBondContact CD2-CE1 3.22Å
168G88.3Confident88.1Confident1 Ų136.8 Ų36.81%0.0121%0.205CC..Hα-helixtrans-50-62.6177.800000114G166 C170 L171 I172G166-G168 PolarHBondContact O-N 2.87Å; G168-C170 VanDerWaalsContact C-N 3.27Å; G168-C170 PolarHBondContact O-N 3.29Å; G168-L171 PolarHBondContact O-N 2.88Å; G168-I172 WeakPolarHBondContact O-CG1 3.48Å; G168-I172 PolarHBondContact O-N 3.04Å; G168-I172 VanDerWaalsContact O-N 3.1Å
169P89.2Confident88.5Confident0 Ų038.8 Ų38.80%022%0.22CC..Hα-helixtrans-64-32.717823.6-29.9000112.1G166 I172 S173 L253 K257 L260 S300G166-P169 WeakPolarHBondContact O-CD 3.4Å; G166-P169 VanDerWaalsContact O-CG 3.25Å; G166-P169 WeakPolarHBondContact O-CG 3.25Å; P169-I172 PolarHBondContact O-N 3.4Å; P169-S173 WeakPolarHBondContact O-CB 3.22Å; P169-S173 PolarHBondContact O-N 3.32Å; P169-S173 PolarHBondContact O-OG 3.33Å; P169-L253 HydrophobicContact CB-CD2 4.44Å; P169-K257 HydrophobicContact CB-CB 4.22Å; P169-K257 HydrophobicContact CG-CB 3.85Å; P169-K257 HydrophobicContact CG-CG 4.27Å; P169-L260 HydrophobicContact CG-CD1 3.86Å; P169-S300 WeakPolarHBondContact CB-OG 2.94Å; P169-S300 WeakPolarHBondContact CD-OG 3.36Å; P169-S300 VanDerWaalsContact CG-OG 3.3Å; P169-S300 WeakPolarHBondContact CG-OG 3.2Å
170C90.4Very high88.9Confident16 Ų1638.5 Ų38.511%0.10821%0.212CC..Hα-helixtrans-56.9-51.7173.3-167.50000111.3G166 L167 G168 S173 V174 K257G166-C170 WeakPolarHBondContact O-CB 3.2Å; G166-C170 PolarHBondContact O-N 3.11Å; G166-C170 VanDerWaalsContact O-N 3.12Å; L167-C170 VanDerWaalsContact O-CB 3.31Å; L167-C170 WeakPolarHBondContact O-CB 3.22Å; L167-C170 PolarHBondContact O-N 3.48Å; G168-C170 VanDerWaalsContact C-N 3.27Å; G168-C170 PolarHBondContact O-N 3.29Å; C170-S173 PolarHBondContact O-N 3.31Å; C170-S173 PolarHBondContact O-OG 3Å; C170-V174 WeakPolarHBondContact O-CG2 2.98Å; C170-V174 PolarHBondContact O-N 2.85Å; C170-K257 HydrophobicContact CB-CD 4.1Å; C170-K257 PolarHBondContact SG-NZ 2.87Å; C170-K257 VanDerWaalsContact SG-NZ 3.38Å
171L90.7Very high89.1Confident31 Ų3137.2 Ų37.216%0.16220%0.2CC..Hα-helixtrans-68-40-177.7-58.7177.5000112.3L119 L167 G168 S173 V174 H293L119-L171 HydrophobicContact CD2-CB 4.15Å; L119-L171 HydrophobicContact CD2-CD1 4.33Å; L119-L171 HydrophobicContact CD2-CD2 3.59Å; L119-L171 HydrophobicContact CD2-CG 4.19Å; L167-L171 HydrophobicContact CD1-CD1 4.14Å; L167-L171 HydrophobicContact CD1-CD2 3.91Å; L167-L171 HydrophobicContact CD1-CG 3.93Å; L167-L171 HydrophobicContact CD2-CD1 4.49Å; L167-L171 HydrophobicContact CG-CD1 3.91Å; L167-L171 HydrophobicContact CG-CG 4.09Å; L167-L171 VanDerWaalsContact O-CG 3.3Å; L167-L171 WeakPolarHBondContact O-CG 3.43Å; L167-L171 PolarHBondContact O-N 3.49Å; G168-L171 PolarHBondContact O-N 2.88Å; L171-S173 PolarHBondContact O-N 3.33Å; L171-V174 PolarHBondContact O-N 2.72Å; L171-H293 WeakPolarHBondContact CD1-ND1 3.45Å
172I90.6Very high89.5Confident54 Ų5440.4 Ų40.428%0.27721%0.212SC..Hα-helixtrans-62-37.1175.6-63170000110.6G168 P169 V174 P176 L253 V297 F301G168-I172 WeakPolarHBondContact O-CG1 3.48Å; G168-I172 PolarHBondContact O-N 3.04Å; G168-I172 VanDerWaalsContact O-N 3.1Å; P169-I172 PolarHBondContact O-N 3.4Å; I172-V174 VanDerWaalsContact C-N 3.29Å; I172-V174 PolarHBondContact O-N 2.88Å; I172-P176 WeakPolarHBondContact O-CD 3.13Å; I172-L253 HydrophobicContact CG2-CD1 4.01Å; I172-V297 HydrophobicContact CD1-CB 3.89Å; I172-V297 HydrophobicContact CD1-CG1 3.42Å; I172-V297 VanDerWaalsContact CD1-CG1 3.42Å; I172-V297 HydrophobicContact CD1-CG2 3.51Å; I172-V297 HydrophobicContact CG1-CG2 4.08Å; I172-F301 HydrophobicContact CD1-CE2 4.41Å
173S90Very high89.9Confident8 Ų844.6 Ų44.66%0.05624%0.237CC..Hα-helixtrans-68.6-25-176.474.10000114P169 C170 L171 V175 P176 Q177 V250P169-S173 WeakPolarHBondContact O-CB 3.22Å; P169-S173 PolarHBondContact O-N 3.32Å; P169-S173 PolarHBondContact O-OG 3.33Å; C170-S173 PolarHBondContact O-N 3.31Å; C170-S173 PolarHBondContact O-OG 3Å; L171-S173 PolarHBondContact O-N 3.33Å; S173-V175 PolarHBondContact O-N 3.45Å; S173-P176 WeakPolarHBondContact O-CD 3.43Å; S173-Q177 WeakPolarHBondContact O-CB 3.49Å; S173-Q177 PolarHBondContact O-N 3.06Å; S173-V250 VanDerWaalsContact CB-CG1 3.46Å
174V86.9Confident90.1Very high42 Ų4245.3 Ų45.326%0.25524%0.242SC..Hα-helixtrans-59.5-49-176.1176.50000111.8C170 L171 I172 Q177 T178C170-V174 WeakPolarHBondContact O-CG2 2.98Å; C170-V174 PolarHBondContact O-N 2.85Å; L171-V174 PolarHBondContact O-N 2.72Å; I172-V174 VanDerWaalsContact C-N 3.29Å; I172-V174 PolarHBondContact O-N 2.88Å; V174-Q177 PolarHBondContact O-N 3.44Å; V174-T178 VanDerWaalsContact O-CB 3.29Å; V174-T178 WeakPolarHBondContact O-CB 3.43Å; V174-T178 PolarHBondContact O-N 3.43Å; V174-T178 PolarHBondContact O-OG1 2.98Å
175V86.2Confident90.1Very high100 Ų10045.2 Ų45.261%0.60624%0.242SC*.Hα-helixtrans-65.8-54.6-174.71740000111.1S173 Q177 T178 T179S173-V175 PolarHBondContact O-N 3.45Å; V175-Q177 VanDerWaalsContact C-N 3.31Å; V175-Q177 PolarHBondContact O-N 2.89Å; V175-T178 PolarHBondContact O-N 2.88Å; V175-T179 WeakPolarHBondContact O-CB 3.35Å; V175-T179 PolarHBondContact O-N 3.08Å; V175-T179 PolarHBondContact O-OG1 3.1Å
176P91.5Very high90.4Very high49 Ų4947.9 Ų47.932%0.31826%0.255SS..Hα-helixtrans-58.9-40.2176.8-23.834.7000113I172 S173 T178 V180 V250I172-P176 WeakPolarHBondContact O-CD 3.13Å; S173-P176 WeakPolarHBondContact O-CD 3.43Å; P176-T178 PolarHBondContact O-N 3.23Å; P176-V180 WeakPolarHBondContact O-CB 3.29Å; P176-V180 WeakPolarHBondContact O-CG2 3.31Å; P176-V180 PolarHBondContact O-N 3.14Å; P176-V250 HydrophobicContact CB-CG2 3.95Å
177Q90.7Very high90.7Very high84 Ų8453.7 Ų53.739%0.39328%0.282SS..Hα-helixtrans-60.8-47.8179.3-175.6172.9-19.200111.1S173 V174 V175 Y181 A246 V250S173-Q177 WeakPolarHBondContact O-CB 3.49Å; S173-Q177 PolarHBondContact O-N 3.06Å; V174-Q177 PolarHBondContact O-N 3.44Å; V175-Q177 VanDerWaalsContact C-N 3.31Å; V175-Q177 PolarHBondContact O-N 2.89Å; Q177-Y181 VanDerWaalsContact O-CB 3.28Å; Q177-Y181 WeakPolarHBondContact O-CB 3.36Å; Q177-Y181 PolarHBondContact O-N 2.97Å; Q177-A246 HydrophobicContact CG-CB 4.29Å; Q177-A246 WeakPolarHBondContact O-CB 3.09Å; Q177-V250 HydrophobicContact CB-CG2 3.93Å
178T87.8Confident90.9Very high62 Ų6255.9 Ų55.938%0.3829%0.294SS..Hα-helixtrans-68-45.1-177.9-54.90000111V174 V175 P176 V180 Y181 F182V174-T178 VanDerWaalsContact O-CB 3.29Å; V174-T178 WeakPolarHBondContact O-CB 3.43Å; V174-T178 PolarHBondContact O-N 3.43Å; V174-T178 PolarHBondContact O-OG1 2.98Å; V175-T178 PolarHBondContact O-N 2.88Å; P176-T178 PolarHBondContact O-N 3.23Å; T178-V180 PolarHBondContact O-N 2.93Å; T178-Y181 PolarHBondContact O-N 2.7Å; T178-F182 HydrophobicContact CG2-CD2 3.56Å; T178-F182 HydrophobicContact CG2-CE2 3.42Å; T178-F182 VanDerWaalsContact CG2-CE2 3.42Å; T178-F182 VanDerWaalsContact O-CD2 3.24Å; T178-F182 WeakPolarHBondContact O-CD2 3.49Å; T178-F182 PolarHBondContact O-N 3.04Å
179T90.2Very high91Very high79 Ų7959.5 Ų59.549%0.48531%0.309SS..Hα-helixtrans-59.3-48.6178-61.50000111.6V175 T183V175-T179 WeakPolarHBondContact O-CB 3.35Å; V175-T179 PolarHBondContact O-N 3.08Å; V175-T179 PolarHBondContact O-OG1 3.1Å; T179-T183 VanDerWaalsContact O-CB 3.27Å; T179-T183 WeakPolarHBondContact O-CB 3.45Å; T179-T183 PolarHBondContact O-N 2.87Å; T179-T183 PolarHBondContact O-OG1 3.41Å
180V93.9Very high91.1Very high24 Ų2466.4 Ų66.415%0.14534%0.335CS..Hα-helixtrans-64.7-45.1179.5174.70000110.6P176 T178 F182 T183 V184 A246 I249P176-V180 WeakPolarHBondContact O-CB 3.29Å; P176-V180 WeakPolarHBondContact O-CG2 3.31Å; P176-V180 PolarHBondContact O-N 3.14Å; T178-V180 PolarHBondContact O-N 2.93Å; V180-F182 PolarHBondContact O-N 2.86Å; V180-T183 PolarHBondContact O-N 3.34Å; V180-V184 HydrophobicContact CG1-CG2 3.98Å; V180-V184 WeakPolarHBondContact O-CB 3.16Å; V180-V184 VanDerWaalsContact O-CG2 3.24Å; V180-V184 WeakPolarHBondContact O-CG2 3.31Å; V180-V184 PolarHBondContact O-N 3.44Å; V180-A246 HydrophobicContact CB-CB 4.02Å; V180-A246 HydrophobicContact CG1-CB 3.91Å; V180-I249 HydrophobicContact CG1-CD1 3.89Å; V180-I249 HydrophobicContact CG2-CD1 3.79Å; V180-I249 HydrophobicContact CG2-CG2 4.35Å
181Y92.4Very high91Very high83 Ų8368.5 Ų68.533%0.32535%0.35SS..Hα-helixtrans-54.9-53.1178.9176.3-93.9000111.5Q177 T178 Y185 S242Q177-Y181 VanDerWaalsContact O-CB 3.28Å; Q177-Y181 WeakPolarHBondContact O-CB 3.36Å; Q177-Y181 PolarHBondContact O-N 2.97Å; T178-Y181 PolarHBondContact O-N 2.7Å; Y181-Y185 WeakPolarHBondContact O-CB 2.88Å; Y181-Y185 PolarHBondContact O-N 3.45Å; Y181-S242 VanDerWaalsContact CD2-OG 3.27Å; Y181-S242 WeakPolarHBondContact CD2-OG 3.4Å; Y181-S242 WeakPolarHBondContact CE2-OG 3.3Å
182F92.3Very high90.8Very high128 Ų12869.1 Ų69.156%0.56135%0.352SS*.Hα-helixtrans-67.8-41.8-178.3-78.2-63.6000112.7T178 V180 V184 Y185 E186T178-F182 HydrophobicContact CG2-CD2 3.56Å; T178-F182 HydrophobicContact CG2-CE2 3.42Å; T178-F182 VanDerWaalsContact CG2-CE2 3.42Å; T178-F182 VanDerWaalsContact O-CD2 3.24Å; T178-F182 WeakPolarHBondContact O-CD2 3.49Å; T178-F182 PolarHBondContact O-N 3.04Å; V180-F182 PolarHBondContact O-N 2.86Å; F182-V184 PolarHBondContact O-N 3.26Å; F182-Y185 PolarHBondContact O-N 2.81Å; F182-E186 VanDerWaalsContact O-CB 3.25Å; F182-E186 WeakPolarHBondContact O-CB 3.45Å; F182-E186 PolarHBondContact O-N 3.36Å
183T93.7Very high90.7Very high89 Ų8969.2 Ų69.255%0.54635%0.352SS..Hα-helixtrans-62.4-46.9-179.9-57.20000111.1T179 V180 Q187T179-T183 VanDerWaalsContact O-CB 3.27Å; T179-T183 WeakPolarHBondContact O-CB 3.45Å; T179-T183 PolarHBondContact O-N 2.87Å; T179-T183 PolarHBondContact O-OG1 3.41Å; V180-T183 PolarHBondContact O-N 3.34Å; T183-Q187 WeakPolarHBondContact O-CB 3.43Å; T183-Q187 PolarHBondContact O-N 3.47Å
184V94.2Very high90.5Very high31 Ų3172.6 Ų72.619%0.18837%0.373CS..Hα-helixtrans-67.5-44.4179.1174.50000110.6V180 F182 E186 Q187 L188 F241 L245V180-V184 HydrophobicContact CG1-CG2 3.98Å; V180-V184 WeakPolarHBondContact O-CB 3.16Å; V180-V184 VanDerWaalsContact O-CG2 3.24Å; V180-V184 WeakPolarHBondContact O-CG2 3.31Å; V180-V184 PolarHBondContact O-N 3.44Å; F182-V184 PolarHBondContact O-N 3.26Å; V184-E186 PolarHBondContact O-N 2.92Å; V184-Q187 PolarHBondContact O-N 3.23Å; V184-L188 HydrophobicContact CG1-CD1 3.91Å; V184-L188 HydrophobicContact CG1-CG 4.36Å; V184-L188 VanDerWaalsContact O-CG 3.27Å; V184-L188 WeakPolarHBondContact O-CG 3.42Å; V184-L188 PolarHBondContact O-N 3.45Å; V184-F241 HydrophobicContact CG1-CD1 4.3Å; V184-L245 HydrophobicContact CG1-CD1 3.93Å; V184-L245 HydrophobicContact CG2-CD1 4.25Å
185Y92.5Very high90.4Very high58 Ų5877.2 Ų77.223%0.22739%0.39CS..Hα-helixtrans-60.2-46.1179.2-175.9-93.4000111.9Y181 F182 L188 K189 A238Y181-Y185 WeakPolarHBondContact O-CB 2.88Å; Y181-Y185 PolarHBondContact O-N 3.45Å; F182-Y185 PolarHBondContact O-N 2.81Å; Y185-L188 PolarHBondContact O-N 3.31Å; Y185-K189 WeakPolarHBondContact O-CB 2.91Å; Y185-K189 PolarHBondContact O-N 3.38Å; Y185-A238 HydrophobicContact CD2-CB 4.19Å; Y185-A238 HydrophobicContact CE2-CB 4.15Å
186E92Very high90.2Very high67 Ų6775.3 Ų75.331%0.31337%0.373SS..Hα-helixtrans-66.2-39.6179-17860.8-167.500111.7F182 V184 L188 K189 R190F182-E186 VanDerWaalsContact O-CB 3.25Å; F182-E186 WeakPolarHBondContact O-CB 3.45Å; F182-E186 PolarHBondContact O-N 3.36Å; V184-E186 PolarHBondContact O-N 2.92Å; E186-L188 PolarHBondContact O-N 2.98Å; E186-K189 PolarHBondContact O-N 3.31Å; E186-R190 WeakPolarHBondContact O-CB 3.27Å; E186-R190 VanDerWaalsContact O-CG 3.3Å; E186-R190 WeakPolarHBondContact O-CG 3.3Å; E186-R190 PolarHBondContact O-N 3.14Å; E186-R190 IonicContact OE1-CZ 3.05Å; E186-R190 IonicContact OE1-NE 3.24Å; E186-R190 PolarHBondContact OE1-NE 3.05Å; E186-R190 IonicContact OE1-NH2 3.26Å; E186-R190 PolarHBondContact OE1-NH2 3.41Å
187Q93.3Very high89.7Confident122 Ų12275.4 Ų75.457%0.5738%0.375SS*.Hα-helixtrans-64.3-41.8176.7-174.160.818.900112.2T183 V184 R190 S191T183-Q187 WeakPolarHBondContact O-CB 3.43Å; T183-Q187 PolarHBondContact O-N 3.47Å; V184-Q187 PolarHBondContact O-N 3.23Å; Q187-R190 PolarHBondContact O-N 2.89Å; Q187-S191 PolarHBondContact O-N 3.41Å; Q187-S191 PolarHBondContact O-OG 2.94Å
188L92.6Very high89Confident46 Ų4678.9 Ų78.924%0.24139%0.389CS..Hα-helixtrans-65-42.1174.9-68.8170.3000111.4V184 Y185 E186 S191 H192 F234 A238 F241V184-L188 HydrophobicContact CG1-CD1 3.91Å; V184-L188 HydrophobicContact CG1-CG 4.36Å; V184-L188 VanDerWaalsContact O-CG 3.27Å; V184-L188 WeakPolarHBondContact O-CG 3.42Å; V184-L188 PolarHBondContact O-N 3.45Å; Y185-L188 PolarHBondContact O-N 3.31Å; E186-L188 PolarHBondContact O-N 2.98Å; L188-S191 PolarHBondContact O-N 3.47Å; L188-S191 PolarHBondContact O-OG 3.46Å; L188-H192 WeakPolarHBondContact O-CB 3.48Å; L188-H192 PolarHBondContact O-N 2.83Å; L188-F234 HydrophobicContact CB-CZ 4.21Å; L188-F234 WeakPolarHBondContact O-CZ 3.29Å; L188-A238 HydrophobicContact CB-CB 4.22Å; L188-A238 HydrophobicContact CD1-CB 4.01Å; L188-F241 HydrophobicContact CD1-CD1 3.91Å
189K90.6Very high88.2Confident76 Ų7682.7 Ų82.733%0.3340%0.402SS..Hα-helixtrans-61.3-46.3177.7-176.8-176.5174.4-1670110.9Y185 E186 H192 I193 L230 F234Y185-K189 WeakPolarHBondContact O-CB 2.91Å; Y185-K189 PolarHBondContact O-N 3.38Å; E186-K189 PolarHBondContact O-N 3.31Å; K189-H192 PolarHBondContact O-N 3.43Å; K189-I193 HydrophobicContact CG-CD1 4.02Å; K189-I193 VanDerWaalsContact O-CG1 3.31Å; K189-I193 WeakPolarHBondContact O-CG1 3.16Å; K189-I193 PolarHBondContact O-N 3.42Å; K189-L230 HydrophobicContact CG-CD2 4.23Å; K189-F234 HydrophobicContact CB-CE1 4.4Å
190R90.8Very high86.7Confident145 Ų14582.8 Ų82.855%0.54741%0.406SS..Hα-helixtrans-62-46176.9-73176.2-174.8-168.70.3112E186 Q187 H192 I193 V194E186-R190 WeakPolarHBondContact O-CB 3.27Å; E186-R190 VanDerWaalsContact O-CG 3.3Å; E186-R190 WeakPolarHBondContact O-CG 3.3Å; E186-R190 PolarHBondContact O-N 3.14Å; E186-R190 IonicContact OE1-CZ 3.05Å; E186-R190 IonicContact OE1-NE 3.24Å; E186-R190 PolarHBondContact OE1-NE 3.05Å; E186-R190 IonicContact OE1-NH2 3.26Å; E186-R190 PolarHBondContact OE1-NH2 3.41Å; Q187-R190 PolarHBondContact O-N 2.89Å; R190-H192 VanDerWaalsContact C-N 3.31Å; R190-H192 PolarHBondContact O-N 2.94Å; R190-I193 PolarHBondContact O-N 3.38Å; R190-V194 VanDerWaalsContact O-CG2 3.31Å; R190-V194 WeakPolarHBondContact O-CG2 3.3Å; R190-V194 PolarHBondContact O-N 2.8Å
191S89.1Confident84.6Confident61 Ų6188.4 Ų88.443%0.42743%0.434SS..Hα-helixtrans-63.5-38.2179.267.10000112.1Q187 L188 V194 F195Q187-S191 PolarHBondContact O-N 3.41Å; Q187-S191 PolarHBondContact O-OG 2.94Å; L188-S191 PolarHBondContact O-N 3.47Å; L188-S191 PolarHBondContact O-OG 3.46Å; S191-V194 PolarHBondContact O-N 3.45Å; S191-F195 WeakPolarHBondContact O-CB 3.28Å; S191-F195 PolarHBondContact O-N 3.02Å
192H86.3Confident82.3Confident44 Ų4489.4 Ų89.420%0.20445%0.451CS..Hα-helixtrans-66.3-43.1176.6-169.8-87.6000112.8L188 K189 R190 F195 K196 D231 F234L188-H192 WeakPolarHBondContact O-CB 3.48Å; L188-H192 PolarHBondContact O-N 2.83Å; K189-H192 PolarHBondContact O-N 3.43Å; R190-H192 VanDerWaalsContact C-N 3.31Å; R190-H192 PolarHBondContact O-N 2.94Å; H192-F195 PolarHBondContact O-N 3.42Å; H192-K196 WeakPolarHBondContact O-CB 3.25Å; H192-K196 PolarHBondContact O-N 3.06Å; H192-D231 IonicContact CE1-OD2 3.18Å; H192-D231 PolarHBondContact CE1-OD2 3.1Å; H192-D231 IonicContact NE2-OD2 3.43Å; H192-F234 HydrophobicContact CB-CD2 4.04Å; H192-F234 HydrophobicContact CB-CE1 4.35Å; H192-F234 HydrophobicContact CB-CE2 3.44Å; H192-F234 VanDerWaalsContact CB-CE2 3.44Å; H192-F234 HydrophobicContact CB-CZ 3.62Å; H192-F234 AromaticContact CD2-CD2 3.19Å; H192-F234 WeakPolarHBondContact CD2-CD2 3.37Å; H192-F234 AromaticContact CD2-CE2 3.48Å; H192-F234 VanDerWaalsContact CD2-CE2 3.48Å; H192-F234 WeakPolarHBondContact CD2-CE2 3.31Å; H192-F234 AromaticContact CD2-CG 3.94Å; H192-F234 AromaticContact CG-CD2 3.57Å; H192-F234 AromaticContact CG-CE2 3.53Å; H192-F234 AromaticContact NE2-CD2 3.69Å
193I87Confident80Confident55 Ų5589.4 Ų89.428%0.28246%0.461SS..Hα-helixtrans-63.1-43.8176.8-67.9166.4000110.6K189 R190 F195 K196 S197 L230K189-I193 HydrophobicContact CG-CD1 4.02Å; K189-I193 VanDerWaalsContact O-CG1 3.31Å; K189-I193 WeakPolarHBondContact O-CG1 3.16Å; K189-I193 PolarHBondContact O-N 3.42Å; R190-I193 PolarHBondContact O-N 3.38Å; I193-F195 VanDerWaalsContact C-N 3.32Å; I193-F195 PolarHBondContact O-N 3.17Å; I193-K196 PolarHBondContact O-N 3.24Å; I193-S197 WeakPolarHBondContact O-CB 3.29Å; I193-S197 PolarHBondContact O-N 2.92Å; I193-S197 PolarHBondContact O-OG 2.84Å; I193-L230 HydrophobicContact CG1-CD1 4.28Å
194V87.2Confident77.2Confident80 Ų8095 Ų9549%0.48548%0.477SS..Hα-helixtrans-65-35.9177.2172.30000111.9R190 S191 S197 K198R190-V194 VanDerWaalsContact O-CG2 3.31Å; R190-V194 WeakPolarHBondContact O-CG2 3.3Å; R190-V194 PolarHBondContact O-N 2.8Å; S191-V194 PolarHBondContact O-N 3.45Å; V194-S197 PolarHBondContact O-OG 2.7Å; V194-K198 WeakPolarHBondContact O-CG 3.35Å; V194-K198 PolarHBondContact O-N 3.48Å
195F84.3Confident74.4Confident139 Ų139101.3 Ų101.361%0.6151%0.505SS*.Hα-helixtrans-67.4-47.7175.5-173.6-93.8000111.3S191 H192 I193 S197 K198 E199S191-F195 WeakPolarHBondContact O-CB 3.28Å; S191-F195 PolarHBondContact O-N 3.02Å; H192-F195 PolarHBondContact O-N 3.42Å; I193-F195 VanDerWaalsContact C-N 3.32Å; I193-F195 PolarHBondContact O-N 3.17Å; F195-S197 VanDerWaalsContact C-N 3.32Å; F195-S197 PolarHBondContact O-N 3.29Å; F195-K198 PolarHBondContact O-N 3.05Å; F195-E199 PolarHBondContact O-N 2.9Å
196K82.7Confident71.4Confident60 Ų60108.1 Ų108.126%0.26154%0.535SS..Hα-helixtrans-63.2-36179.1-163.6165.8-170.1161.90112.3H192 I193 E199 S200 Q229 D231H192-K196 WeakPolarHBondContact O-CB 3.25Å; H192-K196 PolarHBondContact O-N 3.06Å; I193-K196 PolarHBondContact O-N 3.24Å; K196-E199 PolarHBondContact O-N 3.49Å; K196-S200 PolarHBondContact O-N 2.98Å; K196-S200 PolarHBondContact O-OG 3.44Å; K196-Q229 PolarHBondContact NZ-O 2.89Å; K196-D231 IonicContact NZ-OD1 3.44Å; K196-D231 PolarHBondContact NZ-OD1 3.2Å; K196-D231 VanDerWaalsContact NZ-OD1 3.14Å; K196-D231 IonicContact NZ-OD2 2.81Å; K196-D231 PolarHBondContact NZ-OD2 2.91Å
197S80.4Confident68.5Low51 Ų51110 Ų11036%0.35756%0.556SS.*Hα-helixtrans-67.9-36177.871.30000113.1I193 V194 F195 E199 S200I193-S197 WeakPolarHBondContact O-CB 3.29Å; I193-S197 PolarHBondContact O-N 2.92Å; I193-S197 PolarHBondContact O-OG 2.84Å; V194-S197 PolarHBondContact O-OG 2.7Å; F195-S197 VanDerWaalsContact C-N 3.32Å; F195-S197 PolarHBondContact O-N 3.29Å; S197-E199 VanDerWaalsContact C-N 3.32Å; S197-E199 PolarHBondContact O-N 2.71Å; S197-S200 WeakPolarHBondContact CA-OG 3.48Å; S197-S200 PolarHBondContact O-N 3.41Å; S197-S200 PolarHBondContact O-OG 3.35Å
198K75.6Confident65.6Low156 Ų156108.9 Ų108.968%0.67857%0.568SS**Hα-helixtrans-65.4-35.4174.9-76.3-178.4178.5-175.70112.5V194 F195 S200V194-K198 WeakPolarHBondContact O-CG 3.35Å; V194-K198 PolarHBondContact O-N 3.48Å; F195-K198 PolarHBondContact O-N 3.05Å; K198-S200 VanDerWaalsContact C-N 3.34Å
199E71.4Confident62.7Low143 Ų143111.4 Ų111.467%0.66859%0.589SS**Hα-helixtrans-72.3-29.9-179.9-156.1165.2-159.500112.1F195 K196 S197 I201F195-E199 PolarHBondContact O-N 2.9Å; K196-E199 PolarHBondContact O-N 3.49Å; S197-E199 VanDerWaalsContact C-N 3.32Å; S197-E199 PolarHBondContact O-N 2.71Å; E199-I201 VanDerWaalsContact C-N 3.27Å; E199-I201 PolarHBondContact O-N 3.24Å
200S58.7Low59.7Low81 Ų81114.9 Ų114.957%0.56661%0.611SS**THydrogen-bonded Turntrans-78.1817849.80000116.1K196 S197 K198 P202K196-S200 PolarHBondContact O-N 2.98Å; K196-S200 PolarHBondContact O-OG 3.44Å; S197-S200 WeakPolarHBondContact CA-OG 3.48Å; S197-S200 PolarHBondContact O-N 3.41Å; S197-S200 PolarHBondContact O-OG 3.35Å; K198-S200 VanDerWaalsContact C-N 3.34Å; S200-P202 WeakPolarHBondContact O-CD 3.4Å
201I50Low56.8Low141 Ų141115.9 Ų115.972%0.72363%0.627SS**  trans-105.177.4171.8-49.4172000110.4E199E199-I201 VanDerWaalsContact C-N 3.27Å; E199-I201 PolarHBondContact O-N 3.24Å
202P43Very low53.7Low105 Ų105119.5 Ų119.568%0.68264%0.641SS**  trans-82.8122.1163.831.4-28.6000109.9S200 K204S200-P202 WeakPolarHBondContact O-CD 3.4Å; P202-K204 PolarHBondContact O-N 3.27Å
203V44.2Very low50.8Low128 Ų128125.5 Ų125.578%0.77668%0.675SS**  trans-5.291.2162.2-171.40000114.4H205V203-H205 PolarHBondContact O-N 3.33Å; V203-H205 VanDerWaalsContact O-N 3.11Å
204K35.3Very low47.9Very low205 Ų205129 Ų12989%0.89170%0.699SS**  trans-75.8102.6164.9-157.9173.5-174.2-179.80107.4P202 K206P202-K204 PolarHBondContact O-N 3.27Å; K204-K206 PolarHBondContact O-N 3.39Å
205H34.9Very low44.8Very low165 Ų165130.8 Ų130.876%0.76472%0.715SS**  trans-49.5133.9173.5-116.3-98.2000110.3V203 S207V203-H205 PolarHBondContact O-N 3.33Å; V203-H205 VanDerWaalsContact O-N 3.11Å; H205-S207 PolarHBondContact O-N 3.2Å; H205-S207 VanDerWaalsContact O-N 3.12Å
206K30.6Very low41.8Very low200 Ų200132.8 Ų132.887%0.8773%0.726SS**  trans-47.5105.1173.9-161178.2-169.8179.60111K204K204-K206 PolarHBondContact O-N 3.39Å
207S31.2Very low38.9Very low108 Ų108138.9 Ų138.976%0.75576%0.755SS**  trans-131.286.9156.361.70000107.5H205H205-S207 PolarHBondContact O-N 3.2Å; H205-S207 VanDerWaalsContact O-N 3.12Å
208A32.4Very low36.1Very low97 Ų97141.2 Ų141.280%0.80277%0.772SS**  trans-80110.5169.500000108.3
209S31.3Very low33.6Very low100 Ų100138.7 Ų138.770%0.69977%0.773SS**  trans-154.188.9154.953.30000104.4
210L27.9Very low31.4Very low148 Ų148140 Ų14078%0.77578%0.784SS**  43.890.297.9-86.3150.2000110.1
211D28.3Very low29.9Very low166 Ų166144.5 Ų144.589%0.88880%0.796SS**  trans-149.2109.5134.6-85.8-33.2000107
212N24.1Very low28.8Very low137 Ų137143 Ų14373%0.73379%0.794SS**  trans-73126.5167.2-71.7-37.9000106.4
213D26.6Very low28Very low170 Ų170145 Ų14591%0.90980%0.799SS**  trans-150.5131144.3-91.5-36000111.1
214V25.2Very low27.4Very low130 Ų130149.5 Ų149.579%0.78880%0.802SS**  trans-87.9130.3-172.1168.90000108.7
215S23.2Very low27.3Very low117 Ų117147.5 Ų147.582%0.81880%0.795SS**  trans-163.7114.113733.70000110.4
216H21.7Very low27.3Very low181 Ų181144.7 Ų144.784%0.83879%0.792SS**  trans-55.1126.9166.6-88.1-107.9000110.6
217E20.9Very low27.8Very low187 Ų187144.5 Ų144.587%0.87479%0.794SS**  trans-152.3139.8140.9-153.5142.116600112.2
218S21.1Very low28.8Very low101 Ų101143.5 Ų143.571%0.70678%0.777SS**  trans-38137.3-176.853.70000118.1
219S24.1Very low29.9Very low102 Ų102147.2 Ų147.271%0.71378%0.778SS**  -164.4130.1120.127.90000109.4E221S219-E221 PolarHBondContact O-N 3.46Å
220L24.7Very low31.6Very low172 Ų172144.3 Ų144.390%0.90175%0.754SS**  trans-6088.2163.6-83.991.2000107.6T222L220-T222 PolarHBondContact O-N 2.86Å
221E26.6Very low34Very low175 Ų175140.7 Ų140.782%0.81874%0.735SS**  trans-6987.2162.7-107168.6163.500106.6S219 D223S219-E221 PolarHBondContact O-N 3.46Å; E221-D223 PolarHBondContact O-N 3.36Å
222T27.1Very low36.2Very low109 Ų109141.5 Ų141.567%0.66973%0.726SS**  trans-45.9113.1158.1-60.30000105.6L220 R224L220-T222 PolarHBondContact O-N 2.86Å; T222-R224 PolarHBondContact O-N 3.07Å
223D27.7Very low38.9Very low148 Ų148139.1 Ų139.179%0.79171%0.711SS**  trans-52.776.3174.7-78.9-50.4000109.8E221 H225E221-D223 PolarHBondContact O-N 3.36Å; D223-H225 PolarHBondContact O-N 2.92Å
224R29.9Very low41.8Very low221 Ų221132.6 Ų132.683%0.83467%0.674SS**  trans-72.492.9164.3-106.2-172.9-73.3-135.8-2.3103.2T222 P226T222-R224 PolarHBondContact O-N 3.07Å; R224-P226 VanDerWaalsContact O-CD 3.3Å; R224-P226 WeakPolarHBondContact O-CD 3.41Å
225H33.9Very low44.6Very low164 Ų164128.8 Ų128.876%0.75965%0.652SS**  trans-33.4108.3166.6-67.3-66.5000108D223 H227D223-H225 PolarHBondContact O-N 2.92Å; H225-H227 PolarHBondContact O-N 3.48Å; H225-H227 VanDerWaalsContact O-N 3.1Å
226P35.4Very low47.6Very low106 Ų106125.5 Ų125.569%0.68863%0.625SS**  trans-55.1129.617720.3-28.9000104.9R224 Q228R224-P226 VanDerWaalsContact O-CD 3.3Å; R224-P226 WeakPolarHBondContact O-CD 3.41Å; P226-Q228 PolarHBondContact O-N 3.43Å
227H41.5Very low50.7Low196 Ų196126 Ų12691%0.90762%0.62SS**  trans-61.577.3177.3-72.9-86.1000107.7H225 Q229H225-H227 PolarHBondContact O-N 3.48Å; H225-H227 VanDerWaalsContact O-N 3.1Å; H227-Q229 PolarHBondContact O-N 2.84Å
228Q51.3Low53.9Low86 Ų86117.3 Ų117.340%0.40258%0.58SS.*  trans-70.1103.3-175-159.8167.74.600103.9P226 L230P226-Q228 PolarHBondContact O-N 3.43Å; Q228-L230 WeakPolarHBondContact O-CD1 3.5Å; Q228-L230 PolarHBondContact O-N 2.99Å
229Q56.2Low57Low175 Ų175113.2 Ų113.282%0.81855%0.553SS**  trans-58.3101.1-174.6-165.8170.20.900107.4K196 H227K196-Q229 PolarHBondContact NZ-O 2.89Å; H227-Q229 PolarHBondContact O-N 2.84Å
230L66.8Low60.1Low39 Ų39109.7 Ų109.720%0.20453%0.533CS..  trans-61.7140.4171.4-101.561000107.2K189 I193 Q228 W232 F234K189-L230 HydrophobicContact CG-CD2 4.23Å; I193-L230 HydrophobicContact CG1-CD1 4.28Å; Q228-L230 WeakPolarHBondContact O-CD1 3.5Å; Q228-L230 PolarHBondContact O-N 2.99Å; L230-W232 PolarHBondContact O-N 3.19Å; L230-F234 HydrophobicContact CB-CD1 4.5Å; L230-F234 HydrophobicContact CD2-CD1 3.34Å; L230-F234 HydrophobicContact CD2-CE1 3.52Å; L230-F234 HydrophobicContact CD2-CG 4.47Å; L230-F234 HydrophobicContact CG-CD1 3.91Å; L230-F234 HydrophobicContact CG-CE1 4.38Å
231D78.2Confident63.2Low72 Ų72106.8 Ų106.839%0.38551%0.514SS..  trans-57.9135.5176.3-55-62.8000108.7H192 K196 H233 F234 P235H192-D231 IonicContact CE1-OD2 3.18Å; H192-D231 PolarHBondContact CE1-OD2 3.1Å; H192-D231 IonicContact NE2-OD2 3.43Å; K196-D231 IonicContact NZ-OD1 3.44Å; K196-D231 PolarHBondContact NZ-OD1 3.2Å; K196-D231 VanDerWaalsContact NZ-OD1 3.14Å; K196-D231 IonicContact NZ-OD2 2.81Å; K196-D231 PolarHBondContact NZ-OD2 2.91Å; D231-H233 PolarHBondContact O-N 2.71Å; D231-F234 WeakPolarHBondContact O-CB 3.13Å; D231-F234 PolarHBondContact O-N 3.49Å; D231-P235 WeakPolarHBondContact O-CD 3.22Å
232W75Confident66.3Low183 Ų18398.4 Ų98.469%0.69348%0.475SS*.THydrogen-bonded Turntrans-59.6-26.4-166.769.7-97.3000113.3L230L230-W232 PolarHBondContact O-N 3.19Å
233H79.8Confident69.3Low88 Ų8894.5 Ų94.541%0.40746%0.456SS..Hα-helixtrans-74.9-27.3176.7-31.2-93.4000113.2D231 L236 W237D231-H233 PolarHBondContact O-N 2.71Å; H233-L236 VanDerWaalsContact O-CB 3.31Å; H233-L236 WeakPolarHBondContact O-CB 3.32Å; H233-L236 PolarHBondContact O-N 2.94Å; H233-W237 PolarHBondContact O-N 3.28Å; H233-W237 VanDerWaalsContact O-N 3.11Å
234F86.8Confident72.4Confident32 Ų3289.3 Ų89.314%0.1443%0.428CS..Hα-helixtrans-64.4-48.9-171.7170.2-87.9000112.4L188 K189 H192 L230 D231 L236 W237 A238L188-F234 HydrophobicContact CB-CZ 4.21Å; L188-F234 WeakPolarHBondContact O-CZ 3.29Å; K189-F234 HydrophobicContact CB-CE1 4.4Å; H192-F234 HydrophobicContact CB-CD2 4.04Å; H192-F234 HydrophobicContact CB-CE1 4.35Å; H192-F234 HydrophobicContact CB-CE2 3.44Å; H192-F234 VanDerWaalsContact CB-CE2 3.44Å; H192-F234 HydrophobicContact CB-CZ 3.62Å; H192-F234 AromaticContact CD2-CD2 3.19Å; H192-F234 WeakPolarHBondContact CD2-CD2 3.37Å; H192-F234 AromaticContact CD2-CE2 3.48Å; H192-F234 VanDerWaalsContact CD2-CE2 3.48Å; H192-F234 WeakPolarHBondContact CD2-CE2 3.31Å; H192-F234 AromaticContact CD2-CG 3.94Å; H192-F234 AromaticContact CG-CD2 3.57Å; H192-F234 AromaticContact CG-CE2 3.53Å; H192-F234 AromaticContact NE2-CD2 3.69Å; L230-F234 HydrophobicContact CB-CD1 4.5Å; L230-F234 HydrophobicContact CD2-CD1 3.34Å; L230-F234 HydrophobicContact CD2-CE1 3.52Å; L230-F234 HydrophobicContact CD2-CG 4.47Å; L230-F234 HydrophobicContact CG-CD1 3.91Å; L230-F234 HydrophobicContact CG-CE1 4.38Å; D231-F234 WeakPolarHBondContact O-CB 3.13Å; D231-F234 PolarHBondContact O-N 3.49Å; F234-L236 PolarHBondContact O-N 3.36Å; F234-W237 PolarHBondContact O-N 2.94Å; F234-A238 HydrophobicContact CD1-CB 4.42Å; F234-A238 HydrophobicContact CE1-CB 3.93Å; F234-A238 HydrophobicContact CE2-CB 4.15Å; F234-A238 HydrophobicContact CZ-CB 3.77Å; F234-A238 VanDerWaalsContact O-CB 3.25Å; F234-A238 WeakPolarHBondContact O-CB 3.26Å; F234-A238 PolarHBondContact O-N 3.06Å
235P85.8Confident75.4Confident50 Ų5081.8 Ų81.833%0.32540%0.404SS..Hα-helixtrans-57.1-33.1176-25.334.4000112.8D231 G239D231-P235 WeakPolarHBondContact O-CD 3.22Å; P235-G239 WeakPolarHBondContact O-CA 3.12Å; P235-G239 PolarHBondContact O-N 3.26Å
236L84.5Confident78.2Confident49 Ų4974 Ų7426%0.25737%0.368SS..Hα-helixtrans-65.6-51.6178-17564.3000111.7H233 F234 G240 T331 F335H233-L236 VanDerWaalsContact O-CB 3.31Å; H233-L236 WeakPolarHBondContact O-CB 3.32Å; H233-L236 PolarHBondContact O-N 2.94Å; F234-L236 PolarHBondContact O-N 3.36Å; L236-G240 PolarHBondContact O-N 3.07Å; L236-T331 HydrophobicContact CD1-CG2 3.36Å; L236-T331 HydrophobicContact CG-CG2 4.18Å; L236-F335 HydrophobicContact CD1-CD2 3.57Å; L236-F335 HydrophobicContact CD1-CE2 3.07Å; L236-F335 HydrophobicContact CD1-CZ 3.71Å; L236-F335 HydrophobicContact CG-CE2 4.42Å
237W87.1Confident80.8Confident192 Ų19271.1 Ų71.173%0.72734%0.344SS*.Hα-helixtrans-69.7-43.8179.3-77.1105.9000112.3H233 F234 G240 F241H233-W237 PolarHBondContact O-N 3.28Å; H233-W237 VanDerWaalsContact O-N 3.11Å; F234-W237 PolarHBondContact O-N 2.94Å; W237-G240 PolarHBondContact O-N 2.91Å; W237-F241 VanDerWaalsContact O-CB 3.26Å; W237-F241 WeakPolarHBondContact O-CB 3.16Å; W237-F241 PolarHBondContact O-N 2.88Å
238A88.1Confident83.3Confident4 Ų463.2 Ų63.23%0.03331%0.31CS..Hα-helixtrans-63-44.9178.100000111.4Y185 L188 F234 S242Y185-A238 HydrophobicContact CD2-CB 4.19Å; Y185-A238 HydrophobicContact CE2-CB 4.15Å; L188-A238 HydrophobicContact CB-CB 4.22Å; L188-A238 HydrophobicContact CD1-CB 4.01Å; F234-A238 HydrophobicContact CD1-CB 4.42Å; F234-A238 HydrophobicContact CE1-CB 3.93Å; F234-A238 HydrophobicContact CE2-CB 4.15Å; F234-A238 HydrophobicContact CZ-CB 3.77Å; F234-A238 VanDerWaalsContact O-CB 3.25Å; F234-A238 WeakPolarHBondContact O-CB 3.26Å; F234-A238 PolarHBondContact O-N 3.06Å; A238-S242 VanDerWaalsContact O-CB 3.26Å; A238-S242 WeakPolarHBondContact O-CB 3.25Å; A238-S242 PolarHBondContact O-N 3.4Å; A238-S242 PolarHBondContact O-OG 3.38Å; A238-S242 VanDerWaalsContact O-OG 3.07Å
239G87Confident85.3Confident14 Ų1463.9 Ų63.914%0.14432%0.315CS..Hα-helixtrans-67.2-40.117600000113.1P235 S242 G243P235-G239 WeakPolarHBondContact O-CA 3.12Å; P235-G239 PolarHBondContact O-N 3.26Å; G239-S242 WeakPolarHBondContact CA-OG 3.02Å; G239-S242 PolarHBondContact O-OG 2.94Å; G239-S242 VanDerWaalsContact O-OG 3.09Å; G239-G243 PolarHBondContact O-N 2.96Å
240G88.3Confident87.1Confident29 Ų2955.8 Ų55.830%0.29928%0.278SS..Hα-helixtrans-63.6-46.1175.300000112.4L236 W237 L244L236-G240 PolarHBondContact O-N 3.07Å; W237-G240 PolarHBondContact O-N 2.91Å; G240-L244 WeakPolarHBondContact O-CB 3.27Å; G240-L244 PolarHBondContact O-N 3.12Å
241F91.2Very high88.4Confident110 Ų11053.9 Ų53.948%0.48227%0.268SS..Hα-helixtrans-69.4-44179-177-101000112.4V184 L188 W237 G243 L244 L245V184-F241 HydrophobicContact CG1-CD1 4.3Å; L188-F241 HydrophobicContact CD1-CD1 3.91Å; W237-F241 VanDerWaalsContact O-CB 3.26Å; W237-F241 WeakPolarHBondContact O-CB 3.16Å; W237-F241 PolarHBondContact O-N 2.88Å; F241-G243 VanDerWaalsContact C-N 3.31Å; F241-G243 PolarHBondContact O-N 3.39Å; F241-L244 PolarHBondContact O-N 3.22Å; F241-L245 HydrophobicContact CD1-CD1 3.79Å; F241-L245 HydrophobicContact CD1-CG 4.4Å; F241-L245 HydrophobicContact CE1-CD1 3.21Å; F241-L245 HydrophobicContact CE1-CG 4.05Å; F241-L245 HydrophobicContact CE2-CD1 4.41Å; F241-L245 HydrophobicContact CE2-CG 4.47Å; F241-L245 HydrophobicContact CZ-CD1 3.57Å; F241-L245 HydrophobicContact CZ-CG 4.08Å; F241-L245 PolarHBondContact O-N 2.88Å
242S91.4Very high89.1Confident0 Ų051.5 Ų51.50%026%0.256CS..Hα-helixtrans-62.1-40.417569.20000111.6Y181 A238 G239 L245 A246Y181-S242 VanDerWaalsContact CD2-OG 3.27Å; Y181-S242 WeakPolarHBondContact CD2-OG 3.4Å; Y181-S242 WeakPolarHBondContact CE2-OG 3.3Å; A238-S242 VanDerWaalsContact O-CB 3.26Å; A238-S242 WeakPolarHBondContact O-CB 3.25Å; A238-S242 PolarHBondContact O-N 3.4Å; A238-S242 PolarHBondContact O-OG 3.38Å; A238-S242 VanDerWaalsContact O-OG 3.07Å; G239-S242 WeakPolarHBondContact CA-OG 3.02Å; G239-S242 PolarHBondContact O-OG 2.94Å; G239-S242 VanDerWaalsContact O-OG 3.09Å; S242-L245 PolarHBondContact O-N 2.89Å; S242-A246 VanDerWaalsContact O-CB 3.28Å; S242-A246 WeakPolarHBondContact O-CB 3.49Å; S242-A246 PolarHBondContact O-N 3.22Å
243G90Very high90Very high26 Ų2644 Ų4427%0.26823%0.229SC..Hα-helixtrans-62.4-43.3174.200000112.7G239 F241 K247G239-G243 PolarHBondContact O-N 2.96Å; F241-G243 VanDerWaalsContact C-N 3.31Å; F241-G243 PolarHBondContact O-N 3.39Å; G243-K247 VanDerWaalsContact O-CB 3.24Å; G243-K247 WeakPolarHBondContact O-CB 3.48Å; G243-K247 PolarHBondContact O-N 3.46Å
244L91.6Very high90.6Very high40 Ų4041 Ų4121%0.20922%0.217CC..Hα-helixtrans-66-42.5177.3-175.562.7000111.9G240 F241 K247 T248 A324G240-L244 WeakPolarHBondContact O-CB 3.27Å; G240-L244 PolarHBondContact O-N 3.12Å; F241-L244 PolarHBondContact O-N 3.22Å; L244-K247 PolarHBondContact O-N 3.26Å; L244-T248 WeakPolarHBondContact O-CB 3.28Å; L244-T248 PolarHBondContact O-N 3.12Å; L244-T248 PolarHBondContact O-OG1 3.15Å; L244-A324 HydrophobicContact CD1-CB 3.7Å
245L92.8Very high90.8Very high62 Ų6239.5 Ų39.533%0.32521%0.21SC..Hα-helixtrans-64.9-46.5175.9-79.8179.9000112.1V184 F241 S242 K247 T248 I249V184-L245 HydrophobicContact CG1-CD1 3.93Å; V184-L245 HydrophobicContact CG2-CD1 4.25Å; F241-L245 HydrophobicContact CD1-CD1 3.79Å; F241-L245 HydrophobicContact CD1-CG 4.4Å; F241-L245 HydrophobicContact CE1-CD1 3.21Å; F241-L245 HydrophobicContact CE1-CG 4.05Å; F241-L245 HydrophobicContact CE2-CD1 4.41Å; F241-L245 HydrophobicContact CE2-CG 4.47Å; F241-L245 HydrophobicContact CZ-CD1 3.57Å; F241-L245 HydrophobicContact CZ-CG 4.08Å; F241-L245 PolarHBondContact O-N 2.88Å; S242-L245 PolarHBondContact O-N 2.89Å; L245-K247 VanDerWaalsContact C-N 3.3Å; L245-K247 PolarHBondContact O-N 3.24Å; L245-T248 WeakPolarHBondContact O-CB 3.37Å; L245-T248 PolarHBondContact O-N 3.38Å; L245-I249 PolarHBondContact O-N 2.93Å
246A92.4Very high91.1Very high1 Ų137.1 Ų37.11%0.00820%0.195CC..Hα-helixtrans-56.6-46.7175.300000111.4Q177 V180 S242 T248 I249 V250Q177-A246 HydrophobicContact CG-CB 4.29Å; Q177-A246 WeakPolarHBondContact O-CB 3.09Å; V180-A246 HydrophobicContact CB-CB 4.02Å; V180-A246 HydrophobicContact CG1-CB 3.91Å; S242-A246 VanDerWaalsContact O-CB 3.28Å; S242-A246 WeakPolarHBondContact O-CB 3.49Å; S242-A246 PolarHBondContact O-N 3.22Å; A246-T248 VanDerWaalsContact C-N 3.26Å; A246-T248 PolarHBondContact O-N 2.93Å; A246-I249 PolarHBondContact O-N 2.94Å; A246-V250 WeakPolarHBondContact O-CB 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.46Å; A246-V250 PolarHBondContact O-N 2.61Å; A246-V250 VanDerWaalsContact O-N 3.1Å
247K91.8Very high91.4Very high45 Ų4535.5 Ų35.520%0.19619%0.186CC..Hα-helixtrans-64.5-30.4176.7-164.2-179.6-164.9-172.30112.8G243 L244 L245 Y251 S323G243-K247 VanDerWaalsContact O-CB 3.24Å; G243-K247 WeakPolarHBondContact O-CB 3.48Å; G243-K247 PolarHBondContact O-N 3.46Å; L244-K247 PolarHBondContact O-N 3.26Å; L245-K247 VanDerWaalsContact C-N 3.3Å; L245-K247 PolarHBondContact O-N 3.24Å; K247-Y251 WeakPolarHBondContact O-CA 3.1Å; K247-Y251 VanDerWaalsContact O-CB 3.28Å; K247-Y251 WeakPolarHBondContact O-CB 3.34Å; K247-Y251 PolarHBondContact O-N 3.41Å; K247-S323 WeakPolarHBondContact CE-OG 3.42Å; K247-S323 PolarHBondContact NZ-O 2.94Å; K247-S323 PolarHBondContact NZ-OG 3.19Å
248T93.9Very high91.7Very high31 Ų3126.8 Ų26.819%0.1915%0.153CC..Hα-helixtrans-70.6-47.7177.6-59.50000110.8L244 L245 A246 V250 Y251 Y317 W320L244-T248 WeakPolarHBondContact O-CB 3.28Å; L244-T248 PolarHBondContact O-N 3.12Å; L244-T248 PolarHBondContact O-OG1 3.15Å; L245-T248 WeakPolarHBondContact O-CB 3.37Å; L245-T248 PolarHBondContact O-N 3.38Å; A246-T248 VanDerWaalsContact C-N 3.26Å; A246-T248 PolarHBondContact O-N 2.93Å; T248-V250 VanDerWaalsContact C-N 3.27Å; T248-V250 PolarHBondContact O-N 3.49Å; T248-Y251 VanDerWaalsContact O-CB 3.25Å; T248-Y251 WeakPolarHBondContact O-CB 3.24Å; T248-Y251 PolarHBondContact O-N 2.92Å; T248-Y317 HydrophobicContact CG2-CE1 3.96Å; T248-Y317 VanDerWaalsContact O-CE1 3.31Å; T248-Y317 WeakPolarHBondContact O-CE1 3.24Å; T248-W320 PolarHBondContact OG1-NE1 3.46Å
249I93.1Very high91.7Very high100 Ų10028 Ų2851%0.51316%0.156SC..Hα-helixtrans-62.3-38.6178.3-67.3-176.5000111.4V180 L245 A246 Y251 P252V180-I249 HydrophobicContact CG1-CD1 3.89Å; V180-I249 HydrophobicContact CG2-CD1 3.79Å; V180-I249 HydrophobicContact CG2-CG2 4.35Å; L245-I249 PolarHBondContact O-N 2.93Å; A246-I249 PolarHBondContact O-N 2.94Å; I249-Y251 VanDerWaalsContact C-N 3.34Å; I249-P252 WeakPolarHBondContact O-CD 3.47Å
250V93Very high91.7Very high4 Ų427.3 Ų27.32%0.02415%0.15CC..Hα-helixtrans-85.9-9.4-177.71760000113S173 P176 Q177 A246 T248 P252 L253 D254S173-V250 VanDerWaalsContact CB-CG1 3.46Å; P176-V250 HydrophobicContact CB-CG2 3.95Å; Q177-V250 HydrophobicContact CB-CG2 3.93Å; A246-V250 WeakPolarHBondContact O-CB 3.31Å; A246-V250 WeakPolarHBondContact O-CG2 3.46Å; A246-V250 PolarHBondContact O-N 2.61Å; A246-V250 VanDerWaalsContact O-N 3.1Å; T248-V250 VanDerWaalsContact C-N 3.27Å; T248-V250 PolarHBondContact O-N 3.49Å; V250-P252 VanDerWaalsContact C-N 3.32Å; V250-P252 VanDerWaalsContact O-N 3.13Å; V250-L253 HydrophobicContact CG1-CB 4.41Å; V250-L253 WeakPolarHBondContact O-CB 3.29Å; V250-L253 PolarHBondContact O-N 3.05Å; V250-D254 PolarHBondContact O-N 2.87Å
251Y94Very high91.8Very high0 Ų026 Ų260%014%0.135CC..Hα-helixtrans-51.8-39.4-174.1-159.5-92.4000114.9Q33 K247 T248 I249 L253 D254 L255 L316 Y317 K318 G319 W320Q33-Y251 WeakPolarHBondContact CG-OH 3.32Å; Q33-Y251 PolarHBondContact NE2-OH 3.27Å; Q33-Y251 VanDerWaalsContact NE2-OH 3.08Å; K247-Y251 WeakPolarHBondContact O-CA 3.1Å; K247-Y251 VanDerWaalsContact O-CB 3.28Å; K247-Y251 WeakPolarHBondContact O-CB 3.34Å; K247-Y251 PolarHBondContact O-N 3.41Å; T248-Y251 VanDerWaalsContact O-CB 3.25Å; T248-Y251 WeakPolarHBondContact O-CB 3.24Å; T248-Y251 PolarHBondContact O-N 2.92Å; I249-Y251 VanDerWaalsContact C-N 3.34Å; Y251-L253 VanDerWaalsContact C-N 3.32Å; Y251-L253 PolarHBondContact O-N 2.72Å; Y251-D254 WeakPolarHBondContact O-CA 3.38Å; Y251-D254 WeakPolarHBondContact O-CB 3.15Å; Y251-D254 PolarHBondContact O-N 3.1Å; Y251-D254 VanDerWaalsContact O-N 3.12Å; Y251-L255 PolarHBondContact O-N 2.87Å; Y251-L316 WeakPolarHBondContact CD1-O 3.45Å; Y251-Y317 HydrophobicContact CD1-CD1 4.09Å; Y251-Y317 HydrophobicContact CD1-CG 4.5Å; Y251-Y317 HydrophobicContact CG-CD1 4.31Å; Y251-K318 WeakPolarHBondContact CE1-O 3.21Å; Y251-K318 PolarHBondContact OH-O 2.98Å; Y251-G319 VanDerWaalsContact OH-CA 3.28Å; Y251-G319 WeakPolarHBondContact OH-CA 3.41Å; Y251-G319 PolarHBondContact OH-O 3.49Å; Y251-W320 HydrophobicContact CD1-CB 4.49Å; Y251-W320 HydrophobicContact CE1-CB 4.25Å; Y251-W320 HydrophobicContact CE2-CB 4.33Å; Y251-W320 PolarHBondContact OH-N 2.98Å
252P94.3Very high91.6Very high22 Ų2221 Ų2114%0.14311%0.114CC..Hα-helixtrans-58.6-41.7175.7-26.136.6000112.8I249 V250 D254 L255 A256 L304 L316 Y317I249-P252 WeakPolarHBondContact O-CD 3.47Å; V250-P252 VanDerWaalsContact C-N 3.32Å; V250-P252 VanDerWaalsContact O-N 3.13Å; P252-D254 VanDerWaalsContact C-N 3.3Å; P252-D254 PolarHBondContact O-N 3.11Å; P252-L255 WeakPolarHBondContact O-CB 3.44Å; P252-L255 PolarHBondContact O-N 3.45Å; P252-A256 PolarHBondContact O-N 2.59Å; P252-L304 HydrophobicContact CB-CD2 3.86Å; P252-L304 VanDerWaalsContact O-CD2 3.3Å; P252-L304 WeakPolarHBondContact O-CD2 3.25Å; P252-L316 HydrophobicContact CB-CB 4.32Å; P252-L316 HydrophobicContact CB-CD2 4.48Å; P252-L316 HydrophobicContact CG-CB 4.31Å; P252-Y317 HydrophobicContact CG-CE2 4.31Å
253L93Very high91Very high24 Ų2421.7 Ų21.713%0.12612%0.116CC..Hα-helixtrans-65.8-36.9176.1-68.9171000111.4P169 I172 V250 Y251 A256 K257 L304P169-L253 HydrophobicContact CB-CD2 4.44Å; I172-L253 HydrophobicContact CG2-CD1 4.01Å; V250-L253 HydrophobicContact CG1-CB 4.41Å; V250-L253 WeakPolarHBondContact O-CB 3.29Å; V250-L253 PolarHBondContact O-N 3.05Å; Y251-L253 VanDerWaalsContact C-N 3.32Å; Y251-L253 PolarHBondContact O-N 2.72Å; L253-A256 PolarHBondContact O-N 2.96Å; L253-K257 VanDerWaalsContact O-CB 3.29Å; L253-K257 WeakPolarHBondContact O-CB 3.27Å; L253-K257 PolarHBondContact O-N 3.26Å; L253-L304 HydrophobicContact CD2-CD1 4.1Å
254D92.1Very high90.4Very high27 Ų2722.3 Ų22.314%0.14412%0.123CC..Hα-helixtrans-59.5-45.6173.2-121.539.1000111.1K29 V250 Y251 P252 K257 K258K29-D254 IonicContact NZ-OD2 3.68Å; K29-D254 PolarHBondContact NZ-OD2 3.46Å; V250-D254 PolarHBondContact O-N 2.87Å; Y251-D254 WeakPolarHBondContact O-CA 3.38Å; Y251-D254 WeakPolarHBondContact O-CB 3.15Å; Y251-D254 PolarHBondContact O-N 3.1Å; Y251-D254 VanDerWaalsContact O-N 3.12Å; P252-D254 VanDerWaalsContact C-N 3.3Å; P252-D254 PolarHBondContact O-N 3.11Å; D254-K257 WeakPolarHBondContact O-CB 3.39Å; D254-K257 PolarHBondContact O-N 3.34Å; D254-K258 WeakPolarHBondContact O-CG 3.16Å; D254-K258 PolarHBondContact O-N 3.31Å; D254-K258 VanDerWaalsContact O-N 3.09Å
255L91.9Very high89.8Confident0 Ų020.7 Ų20.70%011%0.114CC..Hα-helixtrans-62.4-48.6175.6179.170.9000111.3Q33 Y251 P252 K257 K258 R259 I307 G315 L316Q33-L255 VanDerWaalsContact CA-CD1 3.43Å; Q33-L255 HydrophobicContact CB-CD1 3.63Å; Q33-L255 HydrophobicContact CG-CD1 3.93Å; Q33-L255 WeakPolarHBondContact O-CD1 3.28Å; Y251-L255 PolarHBondContact O-N 2.87Å; P252-L255 WeakPolarHBondContact O-CB 3.44Å; P252-L255 PolarHBondContact O-N 3.45Å; L255-K257 VanDerWaalsContact C-N 3.33Å; L255-K257 PolarHBondContact O-N 3.42Å; L255-K258 PolarHBondContact O-N 3.44Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 3.11Å; L255-I307 HydrophobicContact CD2-CD1 4.01Å; L255-I307 HydrophobicContact CD2-CG2 4.4Å; L255-I307 HydrophobicContact CG-CD1 4.46Å; L255-G315 VanDerWaalsContact CD2-O 3.22Å; L255-G315 WeakPolarHBondContact CD2-O 3.34Å; L255-L316 HydrophobicContact CD2-CD2 4.49Å; L255-L316 WeakPolarHBondContact CD2-O 3.3Å
256A90.6Very high88.9Confident0 Ų021 Ų210%011%0.114CC..Hα-helixtrans-58.6-47.5177.600000110.5P252 L253 K258 R259 L260 L304P252-A256 PolarHBondContact O-N 2.59Å; L253-A256 PolarHBondContact O-N 2.96Å; A256-K258 PolarHBondContact O-N 2.99Å; A256-R259 PolarHBondContact O-N 3.22Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 3.26Å; A256-L260 PolarHBondContact O-N 2.86Å; A256-L304 HydrophobicContact CB-CD2 3.92Å; A256-L304 HydrophobicContact CB-CG 4.01Å
257K91.8Very high88.1Confident15 Ų1528.8 Ų28.87%0.06515%0.148CC..Hα-helixtrans-49.8-56.8175.3-176-172.9-171.7-173.80111E126 D129 P169 C170 L253 D254 L255 R259 L260 E261E126-K257 VanDerWaalsContact CD-CE 3.49Å; E126-K257 WeakPolarHBondContact OE1-CE 3.34Å; E126-K257 IonicContact OE1-NZ 3.08Å; E126-K257 PolarHBondContact OE1-NZ 2.96Å; E126-K257 VanDerWaalsContact OE2-CE 3.27Å; E126-K257 WeakPolarHBondContact OE2-CE 3.29Å; E126-K257 IonicContact OE2-NZ 2.78Å; E126-K257 PolarHBondContact OE2-NZ 2.84Å; D129-K257 WeakPolarHBondContact OD2-CE 3.48Å; D129-K257 IonicContact OD2-NZ 2.97Å; D129-K257 PolarHBondContact OD2-NZ 3.01Å; P169-K257 HydrophobicContact CB-CB 4.22Å; P169-K257 HydrophobicContact CG-CB 3.85Å; P169-K257 HydrophobicContact CG-CG 4.27Å; C170-K257 HydrophobicContact CB-CD 4.1Å; C170-K257 PolarHBondContact SG-NZ 2.87Å; C170-K257 VanDerWaalsContact SG-NZ 3.38Å; L253-K257 VanDerWaalsContact O-CB 3.29Å; L253-K257 WeakPolarHBondContact O-CB 3.27Å; L253-K257 PolarHBondContact O-N 3.26Å; D254-K257 WeakPolarHBondContact O-CB 3.39Å; D254-K257 PolarHBondContact O-N 3.34Å; L255-K257 VanDerWaalsContact C-N 3.33Å; L255-K257 PolarHBondContact O-N 3.42Å; K257-R259 VanDerWaalsContact C-N 3.31Å; K257-R259 PolarHBondContact O-N 2.88Å; K257-L260 WeakPolarHBondContact O-CB 3.13Å; K257-L260 PolarHBondContact O-N 3.39Å; K257-E261 WeakPolarHBondContact CE-OE1 3.39Å; K257-E261 HydrophobicContact CG-CG 4.49Å; K257-E261 WeakPolarHBondContact CG-OE1 3.35Å; K257-E261 IonicContact NZ-OE1 3.89Å; K257-E261 WeakPolarHBondContact O-CG 3.22Å; K257-E261 PolarHBondContact O-N 3.26Å
258K92.9Very high87.3Confident9 Ų926.7 Ų26.74%0.03914%0.139CC..Hα-helixtrans-62.6-35.4-177.7-62.8-46.9177.9-1730113.5Q33 L34 D129 T133 D254 L255 A256 E261Q33-K258 HydrophobicContact CB-CB 4.38Å; L34-K258 HydrophobicContact CD2-CB 4.28Å; L34-K258 VanDerWaalsContact CD2-O 3.31Å; L34-K258 WeakPolarHBondContact CD2-O 3.1Å; D129-K258 IonicContact OD1-NZ 3.74Å; D129-K258 PolarHBondContact OD1-NZ 2.95Å; D129-K258 IonicContact OD2-NZ 2.87Å; D129-K258 PolarHBondContact OD2-NZ 3.4Å; T133-K258 HydrophobicContact CG2-CB 4.49Å; T133-K258 HydrophobicContact CG2-CD 4.15Å; T133-K258 WeakPolarHBondContact OG1-CD 3.42Å; T133-K258 PolarHBondContact OG1-NZ 3.26Å; D254-K258 WeakPolarHBondContact O-CG 3.16Å; D254-K258 PolarHBondContact O-N 3.31Å; D254-K258 VanDerWaalsContact O-N 3.09Å; L255-K258 PolarHBondContact O-N 3.44Å; A256-K258 PolarHBondContact O-N 2.99Å; K258-E261 WeakPolarHBondContact CD-OE2 3.3Å; K258-E261 IonicContact NZ-OE1 3.03Å; K258-E261 PolarHBondContact NZ-OE1 3.28Å; K258-E261 IonicContact NZ-OE2 2.84Å; K258-E261 PolarHBondContact NZ-OE2 3.12Å
259R89.1Confident86.4Confident28 Ų2825.5 Ų25.511%0.10613%0.131CC..Hα-helixtrans-69.4-35173.3-70.2-179.5173.8-148.33.4112.6Q33 Q35 L255 A256 K257 I307Q33-R259 PolarHBondContact O-NE 3.23Å; Q33-R259 VanDerWaalsContact O-NE 3.1Å; Q35-R259 PolarHBondContact O-NH2 3.49Å; L255-R259 WeakPolarHBondContact O-CG 3.48Å; L255-R259 PolarHBondContact O-N 3.11Å; A256-R259 PolarHBondContact O-N 3.22Å; K257-R259 VanDerWaalsContact C-N 3.31Å; K257-R259 PolarHBondContact O-N 2.88Å; R259-I307 VanDerWaalsContact NH1-CG1 3.28Å
260L87.3Confident85.2Confident1 Ų126.4 Ų26.41%0.00514%0.136CC..Hα-helixtrans-66.7-39.8175.1-67.2-162.3000112.9P169 A256 K257 I262 R263 A299 S300P169-L260 HydrophobicContact CG-CD1 3.86Å; A256-L260 VanDerWaalsContact O-CG 3.28Å; A256-L260 WeakPolarHBondContact O-CG 3.26Å; A256-L260 PolarHBondContact O-N 2.86Å; K257-L260 WeakPolarHBondContact O-CB 3.13Å; K257-L260 PolarHBondContact O-N 3.39Å; L260-I262 PolarHBondContact O-N 2.7Å; L260-R263 WeakPolarHBondContact O-CB 3.03Å; L260-R263 WeakPolarHBondContact O-CG 3.22Å; L260-R263 PolarHBondContact O-N 3.09Å; L260-A299 HydrophobicContact CD2-CB 4.46Å; L260-S300 VanDerWaalsContact CD1-OG 3.3Å; L260-S300 WeakPolarHBondContact CD1-OG 3.36Å
261E89.9Confident84.2Confident0 Ų028.8 Ų28.80%015%0.15CC..Hα-helixtrans-61.9-27.8-177.6-70.2171.2-176.600112.9V130 T133 R134 R165 K257 K258V130-E261 HydrophobicContact CG2-CB 4.4Å; V130-E261 HydrophobicContact CG2-CG 3.99Å; T133-E261 WeakPolarHBondContact CB-OE2 3.31Å; T133-E261 HydrophobicContact CG2-CB 4.15Å; T133-E261 VanDerWaalsContact CG2-OE2 3.26Å; T133-E261 WeakPolarHBondContact CG2-OE2 3.34Å; T133-E261 PolarHBondContact OG1-OE2 2.94Å; R134-E261 PolarHBondContact NE-O 3.45Å; R134-E261 PolarHBondContact NH2-O 2.92Å; R165-E261 VanDerWaalsContact O-CG 3.31Å; R165-E261 WeakPolarHBondContact O-CG 3.3Å; K257-E261 WeakPolarHBondContact CE-OE1 3.39Å; K257-E261 HydrophobicContact CG-CG 4.49Å; K257-E261 WeakPolarHBondContact CG-OE1 3.35Å; K257-E261 IonicContact NZ-OE1 3.89Å; K257-E261 WeakPolarHBondContact O-CG 3.22Å; K257-E261 PolarHBondContact O-N 3.26Å; K258-E261 WeakPolarHBondContact CD-OE2 3.3Å; K258-E261 IonicContact NZ-OE1 3.03Å; K258-E261 PolarHBondContact NZ-OE1 3.28Å; K258-E261 IonicContact NZ-OE2 2.84Å; K258-E261 PolarHBondContact NZ-OE2 3.12Å
262I87.1Confident83Confident5 Ų528.8 Ų28.83%0.02615%0.151CC..THydrogen-bonded Turntrans-89.1-11.4-178.9-62.2-154.2000113.8L34 T133 A137 L260 G264 F265 R269L34-I262 HydrophobicContact CD1-CD1 3.2Å; L34-I262 HydrophobicContact CD1-CG1 4.44Å; L34-I262 HydrophobicContact CD2-CB 4.46Å; L34-I262 HydrophobicContact CD2-CD1 3.25Å; L34-I262 HydrophobicContact CD2-CG1 3.79Å; L34-I262 HydrophobicContact CG-CD1 3.74Å; T133-I262 HydrophobicContact CG2-CD1 3.89Å; T133-I262 HydrophobicContact CG2-CG1 3.74Å; A137-I262 HydrophobicContact CB-CD1 3.12Å; A137-I262 HydrophobicContact CB-CG1 4.39Å; L260-I262 PolarHBondContact O-N 2.7Å; I262-G264 PolarHBondContact O-N 2.87Å; I262-F265 HydrophobicContact CG2-CB 4.5Å; I262-F265 WeakPolarHBondContact O-CA 3.36Å; I262-F265 VanDerWaalsContact O-CB 3.28Å; I262-F265 WeakPolarHBondContact O-CB 3.21Å; I262-F265 PolarHBondContact O-N 3.44Å; I262-R269 HydrophobicContact CG2-CG 4.5Å
263R78.9Confident81.6Confident15 Ų1528.9 Ų28.96%0.05716%0.156CC..THydrogen-bonded Turntrans-52.4137.9179.8-70.6-177.5173.9-171.94.4110.4R134 R165 L260 F265 Y279 A299R134-R263 PolarHBondContact NH2-O 2.93Å; R165-R263 PolarHBondContact NH1-O 2.96Å; L260-R263 WeakPolarHBondContact O-CB 3.03Å; L260-R263 WeakPolarHBondContact O-CG 3.22Å; L260-R263 PolarHBondContact O-N 3.09Å; R263-F265 PolarHBondContact O-N 2.89Å; R263-Y279 VanDerWaalsContact CZ-CG 3.4Å; R263-Y279 VanDerWaalsContact NH2-CD2 3.35Å; R263-A299 PolarHBondContact NH2-O 2.88Å
264G76.6Confident80.4Confident39 Ų3931.5 Ų31.540%0.40217%0.167SC..THydrogen-bonded Turntrans82.9-13.1-174.900000114.9I262I262-G264 PolarHBondContact O-N 2.87Å
265F80.3Confident79.2Confident7 Ų732.8 Ų32.83%0.03117%0.174CC..  trans-108.430.1-179-162.8-121000113.1R134 Q138 I143 Y144 I262 R263 K267 A268R134-F265 HydrophobicContact CB-CD1 4.01Å; R134-F265 HydrophobicContact CB-CE1 4.06Å; R134-F265 HydrophobicContact CG-CD1 4.07Å; R134-F265 HydrophobicContact CG-CG 4.44Å; Q138-F265 HydrophobicContact CG-CE1 3.58Å; Q138-F265 HydrophobicContact CG-CZ 3.72Å; I143-F265 HydrophobicContact CB-CE2 3.81Å; I143-F265 HydrophobicContact CB-CZ 3.97Å; I143-F265 HydrophobicContact CD1-CD2 4.39Å; I143-F265 HydrophobicContact CD1-CE2 3.79Å; I143-F265 HydrophobicContact CD1-CZ 4.31Å; I143-F265 HydrophobicContact CG1-CE2 4.23Å; I143-F265 HydrophobicContact CG1-CZ 4.41Å; I143-F265 HydrophobicContact CG2-CE2 3.97Å; Y144-F265 HydrophobicContact CD1-CE2 4.16Å; Y144-F265 HydrophobicContact CD1-CZ 4.3Å; Y144-F265 HydrophobicContact CD2-CE1 4.42Å; Y144-F265 HydrophobicContact CD2-CE2 4.21Å; Y144-F265 AromaticContact CD2-CZ 3.74Å; Y144-F265 HydrophobicContact CD2-CZ 3.74Å; Y144-F265 HydrophobicContact CE1-CD2 4.3Å; Y144-F265 AromaticContact CE1-CE2 3.47Å; Y144-F265 HydrophobicContact CE1-CE2 3.47Å; Y144-F265 VanDerWaalsContact CE1-CE2 3.47Å; Y144-F265 AromaticContact CE1-CZ 3.97Å; Y144-F265 HydrophobicContact CE1-CZ 3.97Å; Y144-F265 HydrophobicContact CE2-CD2 4.24Å; Y144-F265 AromaticContact CE2-CE1 3.99Å; Y144-F265 HydrophobicContact CE2-CE1 3.99Å; Y144-F265 AromaticContact CE2-CE2 3.57Å; Y144-F265 HydrophobicContact CE2-CE2 3.57Å; Y144-F265 AromaticContact CE2-CZ 3.4Å; Y144-F265 HydrophobicContact CE2-CZ 3.4Å; Y144-F265 HydrophobicContact CG-CE2 4.5Å; Y144-F265 HydrophobicContact CG-CZ 4.2Å; Y144-F265 AromaticContact CZ-CD2 3.71Å; Y144-F265 AromaticContact CZ-CE2 3.14Å; Y144-F265 AromaticContact CZ-CZ 3.54Å; Y144-F265 VanDerWaalsContact OH-CD2 3.29Å; Y144-F265 WeakPolarHBondContact OH-CD2 3.23Å; Y144-F265 VanDerWaalsContact OH-CE2 3.26Å; Y144-F265 WeakPolarHBondContact OH-CE2 3.14Å; I262-F265 HydrophobicContact CG2-CB 4.5Å; I262-F265 WeakPolarHBondContact O-CA 3.36Å; I262-F265 VanDerWaalsContact O-CB 3.28Å; I262-F265 WeakPolarHBondContact O-CB 3.21Å; I262-F265 PolarHBondContact O-N 3.44Å; R263-F265 PolarHBondContact O-N 2.89Å; F265-K267 PolarHBondContact O-N 3.35Å; F265-A268 HydrophobicContact CD1-CB 3.76Å; F265-A268 HydrophobicContact CD2-CB 4.33Å; F265-A268 HydrophobicContact CE1-CB 3.31Å; F265-A268 HydrophobicContact CE2-CB 3.92Å; F265-A268 HydrophobicContact CG-CB 4.26Å; F265-A268 HydrophobicContact CZ-CB 3.4Å; F265-A268 VanDerWaalsContact CZ-CB 3.4Å; F265-A268 PolarHBondContact O-N 2.93Å
266E74Confident78Confident67 Ų6734.9 Ų34.931%0.31319%0.187SC..G310 helixtrans-67.9-32.6-175.3-72.7162.9-15500112.9A268 R269 L270 L275E266-A268 PolarHBondContact O-N 3.39Å; E266-R269 WeakPolarHBondContact O-CA 3.33Å; E266-R269 WeakPolarHBondContact O-CB 3.4Å; E266-R269 PolarHBondContact O-N 3.46Å; E266-L270 PolarHBondContact O-N 3.39Å; E266-L275 HydrophobicContact CB-CD1 4.42Å; E266-L275 HydrophobicContact CB-CD2 3.79Å; E266-L275 HydrophobicContact CG-CD2 4.1Å; E266-L275 WeakPolarHBondContact O-CD2 3.26Å
267K73.8Confident76.6Confident166 Ų16643 Ų4372%0.72222%0.222SC*.G310 helixtrans-57.5-34.7179.1-67.5-179.5-178.81750112.8I143 F265 R269I143-K267 HydrophobicContact CD1-CB 4.02Å; F265-K267 PolarHBondContact O-N 3.35Å; K267-R269 PolarHBondContact O-N 3.04Å
268A75.1Confident74.9Confident1 Ų143.4 Ų43.41%0.00823%0.231CC..G310 helixtrans-70.8-17.7177.200000113.4Q138 I143 F265 E266Q138-A268 HydrophobicContact CG-CB 4.13Å; I143-A268 HydrophobicContact CD1-CB 3.61Å; I143-A268 HydrophobicContact CG1-CB 3.91Å; F265-A268 HydrophobicContact CD1-CB 3.76Å; F265-A268 HydrophobicContact CD2-CB 4.33Å; F265-A268 HydrophobicContact CE1-CB 3.31Å; F265-A268 HydrophobicContact CE2-CB 3.92Å; F265-A268 HydrophobicContact CG-CB 4.26Å; F265-A268 HydrophobicContact CZ-CB 3.4Å; F265-A268 VanDerWaalsContact CZ-CB 3.4Å; F265-A268 PolarHBondContact O-N 2.93Å; E266-A268 PolarHBondContact O-N 3.39Å
269R76.2Confident73.1Confident5 Ų545.7 Ų45.72%0.01924%0.24CC..G310 helixtrans-100.71.1-176.4-71.6-167.460.3-176.7-3.2113.8L34 A137 I262 E266 K267 T271 F272 L275L34-R269 VanDerWaalsContact O-CZ 3.3Å; L34-R269 PolarHBondContact O-NH1 3.23Å; L34-R269 PolarHBondContact O-NH2 3.1Å; A137-R269 HydrophobicContact CB-CG 4.49Å; I262-R269 HydrophobicContact CG2-CG 4.5Å; E266-R269 WeakPolarHBondContact O-CA 3.33Å; E266-R269 WeakPolarHBondContact O-CB 3.4Å; E266-R269 PolarHBondContact O-N 3.46Å; K267-R269 PolarHBondContact O-N 3.04Å; R269-T271 PolarHBondContact O-N 3.01Å; R269-F272 CarbonylContact O-C 3.54Å; R269-F272 WeakPolarHBondContact O-CA 3.1Å; R269-F272 PolarHBondContact O-N 3.36Å; R269-L275 HydrophobicContact CB-CD2 3.89Å
270L68.3Low71.3Confident120 Ų12048.8 Ų48.863%0.62826%0.262SS*.THydrogen-bonded Turntrans-57-26.4178.2-72.3168.7000113.2E266 L275E266-L270 PolarHBondContact O-N 3.39Å; L270-L275 HydrophobicContact CD2-CD1 3.7Å
271T70.8Confident69.8Low53 Ų5352.9 Ų52.933%0.32528%0.284SS..THydrogen-bonded Turntrans-87.3-8.4174.256.90000113.7N141 R269N141-T271 HydrophobicContact CB-CG2 4.48Å; R269-T271 PolarHBondContact O-N 3.01Å
272F69.6Low67.9Low1 Ų156.7 Ų56.70%0.00431%0.311CS..SBendtrans-118.982.4-169.2-175.7-91.9000110.4R31 L34 Y46 Y47 R269R31-F272 HydrophobicContact CB-CE2 4.14Å; R31-F272 HydrophobicContact CB-CZ 3.72Å; R31-F272 HydrophobicContact CG-CE2 3.85Å; R31-F272 HydrophobicContact CG-CZ 3.76Å; L34-F272 HydrophobicContact CB-CE1 4.27Å; Y46-F272 HydrophobicContact CD1-CD2 4.08Å; Y46-F272 HydrophobicContact CD1-CE2 4.01Å; Y46-F272 AromaticContact CE1-CD2 3.56Å; Y46-F272 HydrophobicContact CE1-CD2 3.56Å; Y46-F272 AromaticContact CE1-CE2 3.69Å; Y46-F272 HydrophobicContact CE1-CE2 3.69Å; Y46-F272 HydrophobicContact CE1-CG 4.46Å; Y47-F272 HydrophobicContact CD2-CE2 4.44Å; Y47-F272 HydrophobicContact CD2-CZ 4.33Å; Y47-F272 HydrophobicContact CE2-CD2 4.47Å; Y47-F272 AromaticContact CE2-CE2 3.35Å; Y47-F272 HydrophobicContact CE2-CE2 3.35Å; Y47-F272 AromaticContact CE2-CZ 3.55Å; Y47-F272 HydrophobicContact CE2-CZ 3.55Å; Y47-F272 AromaticContact CZ-CE2 3.77Å; Y47-F272 WeakPolarHBondContact OH-CE2 3.39Å; R269-F272 CarbonylContact O-C 3.54Å; R269-F272 WeakPolarHBondContact O-CA 3.1Å; R269-F272 PolarHBondContact O-N 3.36Å
273G64.8Low66.6Low24 Ų2458.7 Ų58.725%0.24732%0.323CS..SBendtrans58.7-162.617700000115E37E37-G273 VanDerWaalsContact OE1-C 3.24Å; E37-G273 WeakPolarHBondContact OE1-CA 3.44Å
274E67.8Low65.7Low79 Ų7959 Ų5937%0.36932%0.324SS..PPolyproline II helixtrans-74.3141.2178.4-71.3-174.117800111.3V36 E37V36-E274 HydrophobicContact CB-CB 4.34Å; V36-E274 WeakPolarHBondContact CG2-O 3.31Å; E37-E274 HydrophobicContact CG-CB 3.91Å; E37-E274 HydrophobicContact CG-CG 3.7Å; E37-E274 PolarHBondContact OE1-N 3.45Å
275L66.5Low65Low54 Ų5464.5 Ų64.528%0.28334%0.337SS..PPolyproline II helixtrans-78.3142.2170.9-68.7172.1000109.7E266 R269 L270 K277E266-L275 HydrophobicContact CB-CD1 4.42Å; E266-L275 HydrophobicContact CB-CD2 3.79Å; E266-L275 HydrophobicContact CG-CD2 4.1Å; E266-L275 WeakPolarHBondContact O-CD2 3.26Å; R269-L275 HydrophobicContact CB-CD2 3.89Å; L270-L275 HydrophobicContact CD2-CD1 3.7Å; L275-K277 PolarHBondContact O-N 3.01Å
276P66.5Low64.1Low43 Ų4371.6 Ų71.628%0.27938%0.375SS..PPolyproline II helixtrans-59.5128.517424.3-31.2000109.6V36 G278V36-P276 HydrophobicContact CG2-CB 4.17Å; P276-G278 VanDerWaalsContact C-N 3.28Å; P276-G278 PolarHBondContact O-N 3.33Å
277K61.5Low63.8Low170 Ų17069.2 Ų69.274%0.73937%0.365SS*.SBendtrans-73.8-18.5-175.8-68178.2-176.8168.10113.5L275L275-K277 PolarHBondContact O-N 3.01Å
278G55.7Low63.8Low25 Ų2567.6 Ų67.626%0.25836%0.364SS..  trans-107162.6179.100000114.2P276P276-G278 VanDerWaalsContact C-N 3.28Å; P276-G278 PolarHBondContact O-N 3.33Å
279Y56.4Low63.8Low56 Ų5672 Ų7222%0.2238%0.383CS..  trans92.282.3163.9-44.8-66.8000118.4R263 Y302 C303 D306R263-Y279 VanDerWaalsContact CZ-CG 3.4Å; R263-Y279 VanDerWaalsContact NH2-CD2 3.35Å; Y279-Y302 PolarHBondContact OH-O 3.34Å; Y279-C303 HydrophobicContact CE2-CB 4.26Å; Y279-C303 WeakPolarHBondContact OH-CA 3.18Å; Y279-C303 PolarHBondContact OH-N 3.48Å; Y279-D306 WeakPolarHBondContact OH-CB 3.36Å; Y279-D306 PolarHBondContact OH-OD2 2.83Å
280T50.4Low63.7Low94 Ų9480.9 Ų80.958%0.57742%0.422SS*.  trans-61.8136177.350.80000113.8S282 T283T280-S282 WeakPolarHBondContact CB-OG 3.43Å; T280-S282 PolarHBondContact O-N 3.03Å; T280-S282 PolarHBondContact OG1-OG 2.98Å; T280-S282 VanDerWaalsContact OG1-OG 3.1Å; T280-T283 PolarHBondContact O-N 2.72Å; T280-T283 VanDerWaalsContact O-N 3.13Å; T280-T283 PolarHBondContact O-OG1 3.37Å
281L54.7Low64.1Low87 Ų8784 Ų8446%0.45543%0.425SS..G310 helixtrans-50.2-28.1170.6-173.969000112.9T283 Y284L281-T283 PolarHBondContact O-N 3.27Å; L281-T283 VanDerWaalsContact O-N 3.15Å; L281-Y284 PolarHBondContact O-N 3.45Å
282S51.9Low64.4Low80 Ų8081.7 Ų81.756%0.55941%0.411SS*.G310 helixtrans-60.4-22.7-179.762.50000113.8T280 Y284 K285T280-S282 WeakPolarHBondContact CB-OG 3.43Å; T280-S282 PolarHBondContact O-N 3.03Å; T280-S282 PolarHBondContact OG1-OG 2.98Å; T280-S282 VanDerWaalsContact OG1-OG 3.1Å; S282-Y284 PolarHBondContact O-N 3.39Å; S282-Y284 VanDerWaalsContact O-N 3.1Å; S282-K285 PolarHBondContact O-N 2.65Å
283T59.4Low64.8Low47 Ų4784 Ų8429%0.28842%0.422SS..G310 helixtrans-60.8-22.5178.9-53.40000112.9T280 L281 I287T280-T283 PolarHBondContact O-N 2.72Å; T280-T283 VanDerWaalsContact O-N 3.13Å; T280-T283 PolarHBondContact O-OG1 3.37Å; L281-T283 PolarHBondContact O-N 3.27Å; L281-T283 VanDerWaalsContact O-N 3.15Å; T283-I287 WeakPolarHBondContact O-CD1 3.39Å
284Y59.9Low65.5Low22 Ų2286.7 Ų86.79%0.08644%0.436CS..THydrogen-bonded Turntrans-115.1-12.4-178.5-61.3-73.3000114.5L281 S282 N286 L292 Q296 A299L281-Y284 PolarHBondContact O-N 3.45Å; S282-Y284 PolarHBondContact O-N 3.39Å; S282-Y284 VanDerWaalsContact O-N 3.1Å; Y284-N286 PolarHBondContact O-N 3.37Å; Y284-L292 HydrophobicContact CD1-CD1 3.94Å; Y284-L292 HydrophobicContact CE1-CD1 4.37Å; Y284-Q296 HydrophobicContact CD1-CG 4.49Å; Y284-Q296 HydrophobicContact CE1-CG 3.45Å; Y284-Q296 VanDerWaalsContact CE1-CG 3.45Å; Y284-A299 VanDerWaalsContact OH-CB 3.25Å; Y284-A299 WeakPolarHBondContact OH-CB 3.28Å
285K61.8Low66Low154 Ų15487.2 Ų87.267%0.6744%0.437SS*.THydrogen-bonded Turntrans-66128.4178-162.7171.8-178.41770108.6S282S282-K285 PolarHBondContact O-N 2.65Å
286N62.1Low66.8Low156 Ų15684.7 Ų84.783%0.83442%0.423SS*.THydrogen-bonded Turntrans68.840.5178.1-53.3-22.1000116.4Y284Y284-N286 PolarHBondContact O-N 3.37Å
287I65.9Low67.7Low17 Ų1784.3 Ų84.39%0.08742%0.42CS..  trans-116.3130.2-176.3-54.2-159.4000112.4L161 T283 R291 K295L161-I287 WeakPolarHBondContact CD1-O 3.23Å; T283-I287 WeakPolarHBondContact O-CD1 3.39Å; I287-R291 HydrophobicContact CG2-CB 4.02Å; I287-K295 HydrophobicContact CD1-CD 3.29Å
288N74.3Confident68.8Low132 Ų13282.4 Ų82.471%0.70641%0.412SS*.  trans-69.6144.5174-65.9-15.7000111.4K290 R291 L292N288-K290 PolarHBondContact O-N 3.02Å; N288-R291 PolarHBondContact O-N 2.91Å; N288-L292 PolarHBondContact O-N 3.44Å
289F74.6Confident70.2Confident94 Ų9481.5 Ų81.541%0.41240%0.402SS..Hα-helixtrans-48.3-40.4-179.2-168-97.1000113.4T123 L161 R291 L292 H293T123-F289 HydrophobicContact CG2-CZ 4.49Å; L161-F289 HydrophobicContact CD2-CD2 3.73Å; F289-R291 VanDerWaalsContact C-N 3.32Å; F289-R291 PolarHBondContact O-N 3.28Å; F289-L292 HydrophobicContact CD2-CD2 4.22Å; F289-L292 HydrophobicContact CE2-CD2 4.38Å; F289-L292 WeakPolarHBondContact O-CB 3.42Å; F289-L292 PolarHBondContact O-N 2.98Å; F289-H293 AromaticContact CE1-NE2 3.99Å
290K74.1Confident71.6Confident191 Ų19178.9 Ų78.983%0.8339%0.392SS*.Hα-helixtrans-60.7-34.3179.2-166174.4-175.8177.20114.1N288N288-K290 PolarHBondContact O-N 3.02Å
291R77.9Confident73.4Confident186 Ų18679.2 Ų79.270%0.70239%0.386SS*.Hα-helixtrans-90.2-8.1177.5-74.2-172.7176.9-178-0.7112.9I287 N288 F289 H293 K295I287-R291 HydrophobicContact CG2-CB 4.02Å; N288-R291 PolarHBondContact O-N 2.91Å; F289-R291 VanDerWaalsContact C-N 3.32Å; F289-R291 PolarHBondContact O-N 3.28Å; R291-H293 PolarHBondContact O-N 3.1Å; R291-K295 PolarHBondContact O-N 3.22Å
292L77.7Confident74.8Confident4 Ų482.1 Ų82.12%0.02139%0.392CS..Hα-helixtrans-59.2-49.1-178-174.366.3000110.9L161 W164 Y284 N288 F289 K295 Q296L161-L292 HydrophobicContact CD2-CD2 4.35Å; W164-L292 HydrophobicContact CB-CD2 4.12Å; Y284-L292 HydrophobicContact CD1-CD1 3.94Å; Y284-L292 HydrophobicContact CE1-CD1 4.37Å; N288-L292 PolarHBondContact O-N 3.44Å; F289-L292 HydrophobicContact CD2-CD2 4.22Å; F289-L292 HydrophobicContact CE2-CD2 4.38Å; F289-L292 WeakPolarHBondContact O-CB 3.42Å; F289-L292 PolarHBondContact O-N 2.98Å; L292-K295 PolarHBondContact O-N 2.82Å; L292-Q296 HydrophobicContact CD1-CG 4.41Å; L292-Q296 HydrophobicContact CG-CG 4.43Å; L292-Q296 VanDerWaalsContact O-CG 3.32Å; L292-Q296 WeakPolarHBondContact O-CG 3.28Å; L292-Q296 PolarHBondContact O-N 3.33Å
293H76.2Confident76.4Confident50 Ų5078.5 Ų78.523%0.23137%0.366CS..Hα-helixtrans-57-57.2-177.8-63-87.2000112L167 L171 F289 R291 K295 Q296 V297L167-H293 WeakPolarHBondContact CD2-CE1 3.22Å; L171-H293 WeakPolarHBondContact CD1-ND1 3.45Å; F289-H293 AromaticContact CE1-NE2 3.99Å; R291-H293 PolarHBondContact O-N 3.1Å; H293-K295 VanDerWaalsContact C-N 3.3Å; H293-K295 PolarHBondContact O-N 2.85Å; H293-Q296 PolarHBondContact O-N 3.28Å; H293-V297 WeakPolarHBondContact O-CG2 3.42Å; H293-V297 PolarHBondContact O-N 3.02Å
294C79.7Confident77.9Confident80 Ų8077.4 Ų77.454%0.54136%0.359SS..Hα-helixtrans-56.7-43.3-178.3-62.50000112V297 F298C294-V297 WeakPolarHBondContact O-CB 3.39Å; C294-V297 PolarHBondContact O-N 3.31Å; C294-F298 WeakPolarHBondContact O-CD2 3.48Å; C294-F298 PolarHBondContact O-N 3.14Å
295K80Confident79.3Confident90 Ų9080.4 Ų80.439%0.39138%0.376SS..Hα-helixtrans-68.2-36.3178-76.8-166.3179.3-164.40113.2I287 R291 L292 H293 V297 F298 A299I287-K295 HydrophobicContact CD1-CD 3.29Å; R291-K295 PolarHBondContact O-N 3.22Å; L292-K295 PolarHBondContact O-N 2.82Å; H293-K295 VanDerWaalsContact C-N 3.3Å; H293-K295 PolarHBondContact O-N 2.85Å; K295-V297 VanDerWaalsContact C-N 3.31Å; K295-F298 PolarHBondContact O-N 2.83Å; K295-A299 WeakPolarHBondContact O-CB 3.16Å; K295-A299 PolarHBondContact O-N 3Å
296Q83Confident80.4Confident0 Ų075.3 Ų75.30%036%0.356CS..Hα-helixtrans-65.2-37.1172.6-71.8-171.814.300112.2W164 Y284 L292 H293 A299 S300W164-Q296 PolarHBondContact O-NE2 3.07Å; W164-Q296 PolarHBondContact O-OE1 3.49Å; Y284-Q296 HydrophobicContact CD1-CG 4.49Å; Y284-Q296 HydrophobicContact CE1-CG 3.45Å; Y284-Q296 VanDerWaalsContact CE1-CG 3.45Å; L292-Q296 HydrophobicContact CD1-CG 4.41Å; L292-Q296 HydrophobicContact CG-CG 4.43Å; L292-Q296 VanDerWaalsContact O-CG 3.32Å; L292-Q296 WeakPolarHBondContact O-CG 3.28Å; L292-Q296 PolarHBondContact O-N 3.33Å; H293-Q296 PolarHBondContact O-N 3.28Å; Q296-A299 PolarHBondContact O-N 3.38Å; Q296-S300 WeakPolarHBondContact O-CB 3.29Å; Q296-S300 PolarHBondContact O-N 2.83Å; Q296-S300 PolarHBondContact O-OG 2.94Å
297V85.2Confident81.6Confident35 Ų3568 Ų6821%0.21232%0.316CS..Hα-helixtrans-60.2-54.9173171.60000110.5I172 H293 C294 K295 A299 S300 F301I172-V297 HydrophobicContact CD1-CB 3.89Å; I172-V297 HydrophobicContact CD1-CG1 3.42Å; I172-V297 VanDerWaalsContact CD1-CG1 3.42Å; I172-V297 HydrophobicContact CD1-CG2 3.51Å; I172-V297 HydrophobicContact CG1-CG2 4.08Å; H293-V297 WeakPolarHBondContact O-CG2 3.42Å; H293-V297 PolarHBondContact O-N 3.02Å; C294-V297 WeakPolarHBondContact O-CB 3.39Å; C294-V297 PolarHBondContact O-N 3.31Å; K295-V297 VanDerWaalsContact C-N 3.31Å; V297-A299 VanDerWaalsContact C-N 3.32Å; V297-A299 PolarHBondContact O-N 3.18Å; V297-S300 VanDerWaalsContact O-CB 3.3Å; V297-S300 WeakPolarHBondContact O-CB 3.44Å; V297-S300 PolarHBondContact O-N 3.07Å; V297-F301 HydrophobicContact CG1-CD2 3.74Å; V297-F301 HydrophobicContact CG1-CE2 3.37Å; V297-F301 WeakPolarHBondContact O-CD2 3.35Å; V297-F301 PolarHBondContact O-N 3.44Å
298F85.1Confident82.7Confident130 Ų13072.1 Ų72.157%0.5733%0.334SS*.Hα-helixtrans-58-44.7176.9-77.5-68.1000112.1C294 K295 S300 F301 Y302C294-F298 WeakPolarHBondContact O-CD2 3.48Å; C294-F298 PolarHBondContact O-N 3.14Å; K295-F298 PolarHBondContact O-N 2.83Å; F298-S300 PolarHBondContact O-N 3.4Å; F298-F301 PolarHBondContact O-N 3.01Å; F298-F301 VanDerWaalsContact O-N 3.15Å; F298-Y302 HydrophobicContact CB-CE2 4.46Å; F298-Y302 WeakPolarHBondContact O-CD2 3.45Å; F298-Y302 PolarHBondContact O-N 2.86Å
299A83.2Confident83.3Confident7 Ų773.8 Ų73.86%0.05834%0.335CS..Hα-helixtrans-60-33.1176.500000113.2L260 R263 Y284 K295 Q296 V297 C303L260-A299 HydrophobicContact CD2-CB 4.46Å; R263-A299 PolarHBondContact NH2-O 2.88Å; Y284-A299 VanDerWaalsContact OH-CB 3.25Å; Y284-A299 WeakPolarHBondContact OH-CB 3.28Å; K295-A299 WeakPolarHBondContact O-CB 3.16Å; K295-A299 PolarHBondContact O-N 3Å; Q296-A299 PolarHBondContact O-N 3.38Å; V297-A299 VanDerWaalsContact C-N 3.32Å; V297-A299 PolarHBondContact O-N 3.18Å; A299-C303 VanDerWaalsContact O-CB 3.29Å; A299-C303 WeakPolarHBondContact O-CB 3.24Å; A299-C303 PolarHBondContact O-N 3.47Å
300S85.7Confident83.8Confident1 Ų173.5 Ų73.51%0.00734%0.335CS..Hα-helixtrans-68.1-46.2174.4-54.80000110.8P169 L260 Q296 V297 F298 C303 L304P169-S300 WeakPolarHBondContact CB-OG 2.94Å; P169-S300 WeakPolarHBondContact CD-OG 3.36Å; P169-S300 VanDerWaalsContact CG-OG 3.3Å; P169-S300 WeakPolarHBondContact CG-OG 3.2Å; L260-S300 VanDerWaalsContact CD1-OG 3.3Å; L260-S300 WeakPolarHBondContact CD1-OG 3.36Å; Q296-S300 WeakPolarHBondContact O-CB 3.29Å; Q296-S300 PolarHBondContact O-N 2.83Å; Q296-S300 PolarHBondContact O-OG 2.94Å; V297-S300 VanDerWaalsContact O-CB 3.3Å; V297-S300 WeakPolarHBondContact O-CB 3.44Å; V297-S300 PolarHBondContact O-N 3.07Å; F298-S300 PolarHBondContact O-N 3.4Å; S300-C303 WeakPolarHBondContact O-CB 3.49Å; S300-C303 PolarHBondContact O-N 2.98Å; S300-L304 WeakPolarHBondContact O-CG 3.25Å; S300-L304 PolarHBondContact O-N 2.95Å
301F88.2Confident84.2Confident100 Ų10066.1 Ų66.144%0.43930%0.303SS..Hα-helixtrans-61.8-45177.5-74.9-64.3000112.1I172 V297 F298 C303 L304 I305I172-F301 HydrophobicContact CD1-CE2 4.41Å; V297-F301 HydrophobicContact CG1-CD2 3.74Å; V297-F301 HydrophobicContact CG1-CE2 3.37Å; V297-F301 WeakPolarHBondContact O-CD2 3.35Å; V297-F301 PolarHBondContact O-N 3.44Å; F298-F301 PolarHBondContact O-N 3.01Å; F298-F301 VanDerWaalsContact O-N 3.15Å; F301-C303 VanDerWaalsContact C-N 3.31Å; F301-C303 PolarHBondContact O-N 2.72Å; F301-L304 PolarHBondContact O-N 3.47Å; F301-I305 VanDerWaalsContact O-CG1 3.29Å; F301-I305 WeakPolarHBondContact O-CG1 3.31Å; F301-I305 PolarHBondContact O-N 2.91Å
302Y85.6Confident84.7Confident148 Ų14858.6 Ų58.658%0.5828%0.284SS*.Hα-helixtrans-60.2-42.6173.8-76-68.7000111.6Y279 F298 L304 I305 D306Y279-Y302 PolarHBondContact OH-O 3.34Å; F298-Y302 HydrophobicContact CB-CE2 4.46Å; F298-Y302 WeakPolarHBondContact O-CD2 3.45Å; F298-Y302 PolarHBondContact O-N 2.86Å; Y302-L304 VanDerWaalsContact C-N 3.33Å; Y302-L304 PolarHBondContact O-N 2.99Å; Y302-I305 PolarHBondContact O-N 3.4Å; Y302-D306 VanDerWaalsContact O-CB 3.31Å; Y302-D306 WeakPolarHBondContact O-CB 3.2Å; Y302-D306 PolarHBondContact O-N 3.4Å
303C85.9Confident85.2Confident4 Ų464 Ų643%0.02731%0.311CS..Hα-helixtrans-57.7-44.1175.3-167.80000112.4Y279 A299 S300 F301 I307Y279-C303 HydrophobicContact CE2-CB 4.26Å; Y279-C303 WeakPolarHBondContact OH-CA 3.18Å; Y279-C303 PolarHBondContact OH-N 3.48Å; A299-C303 VanDerWaalsContact O-CB 3.29Å; A299-C303 WeakPolarHBondContact O-CB 3.24Å; A299-C303 PolarHBondContact O-N 3.47Å; S300-C303 WeakPolarHBondContact O-CB 3.49Å; S300-C303 PolarHBondContact O-N 2.98Å; F301-C303 VanDerWaalsContact C-N 3.31Å; F301-C303 PolarHBondContact O-N 2.72Å; C303-I307 VanDerWaalsContact O-CD1 3.31Å; C303-I307 WeakPolarHBondContact O-CD1 3.12Å; C303-I307 WeakPolarHBondContact O-CG1 3.25Å; C303-I307 PolarHBondContact O-N 3.21Å; C303-I307 VanDerWaalsContact O-N 3.1Å
304L90.1Very high85.7Confident25 Ų2568.2 Ų68.213%0.13133%0.327CS..Hα-helixtrans-67.1-44.5178.6-71.2173.2000112.4P252 L253 A256 S300 F301 Y302 D306 I307 F308 L316P252-L304 HydrophobicContact CB-CD2 3.86Å; P252-L304 VanDerWaalsContact O-CD2 3.3Å; P252-L304 WeakPolarHBondContact O-CD2 3.25Å; L253-L304 HydrophobicContact CD2-CD1 4.1Å; A256-L304 HydrophobicContact CB-CD2 3.92Å; A256-L304 HydrophobicContact CB-CG 4.01Å; S300-L304 WeakPolarHBondContact O-CG 3.25Å; S300-L304 PolarHBondContact O-N 2.95Å; F301-L304 PolarHBondContact O-N 3.47Å; Y302-L304 VanDerWaalsContact C-N 3.33Å; Y302-L304 PolarHBondContact O-N 2.99Å; L304-D306 VanDerWaalsContact C-N 3.31Å; L304-D306 PolarHBondContact O-N 2.85Å; L304-I307 PolarHBondContact O-N 3.02Å; L304-F308 VanDerWaalsContact O-CB 3.29Å; L304-F308 WeakPolarHBondContact O-CB 3.42Å; L304-F308 PolarHBondContact O-N 2.69Å; L304-L316 HydrophobicContact CD2-CD2 3.65Å
305I89.2Confident86Confident85 Ų8564.4 Ų64.444%0.43630%0.301SS..Hα-helixtrans-63.1-41.5179.9-70167.3000110.5F301 Y302 F308 K309F301-I305 VanDerWaalsContact O-CG1 3.29Å; F301-I305 WeakPolarHBondContact O-CG1 3.31Å; F301-I305 PolarHBondContact O-N 2.91Å; Y302-I305 PolarHBondContact O-N 3.4Å; I305-F308 PolarHBondContact O-N 2.94Å; I305-K309 HydrophobicContact CG2-CD 4.02Å; I305-K309 HydrophobicContact CG2-CG 4.42Å; I305-K309 WeakPolarHBondContact O-CB 3.34Å; I305-K309 VanDerWaalsContact O-CG 3.27Å; I305-K309 WeakPolarHBondContact O-CG 3.34Å; I305-K309 PolarHBondContact O-N 3.25Å
306D85.3Confident86.4Confident47 Ų4760.9 Ų60.925%0.25129%0.286SS..Hα-helixtrans-64.6-47.4178-168.655.4000111.6Y279 Y302 L304 F308 K309 E310Y279-D306 WeakPolarHBondContact OH-CB 3.36Å; Y279-D306 PolarHBondContact OH-OD2 2.83Å; Y302-D306 VanDerWaalsContact O-CB 3.31Å; Y302-D306 WeakPolarHBondContact O-CB 3.2Å; Y302-D306 PolarHBondContact O-N 3.4Å; L304-D306 VanDerWaalsContact C-N 3.31Å; L304-D306 PolarHBondContact O-N 2.85Å; D306-F308 VanDerWaalsContact C-N 3.29Å; D306-F308 PolarHBondContact O-N 3.25Å; D306-K309 PolarHBondContact O-N 2.95Å; D306-K309 VanDerWaalsContact O-N 3.14Å; D306-E310 WeakPolarHBondContact O-CG 3.25Å; D306-E310 PolarHBondContact O-N 2.81Å
307I86.7Confident86.9Confident1 Ų165 Ų651%0.00530%0.302CS..Hα-helixtrans-59.5-42.9175.1-65.5165.3000111.1L255 R259 C303 L304 K309 H311 L316L255-I307 HydrophobicContact CD2-CD1 4.01Å; L255-I307 HydrophobicContact CD2-CG2 4.4Å; L255-I307 HydrophobicContact CG-CD1 4.46Å; R259-I307 VanDerWaalsContact NH1-CG1 3.28Å; C303-I307 VanDerWaalsContact O-CD1 3.31Å; C303-I307 WeakPolarHBondContact O-CD1 3.12Å; C303-I307 WeakPolarHBondContact O-CG1 3.25Å; C303-I307 PolarHBondContact O-N 3.21Å; C303-I307 VanDerWaalsContact O-N 3.1Å; L304-I307 PolarHBondContact O-N 3.02Å; I307-K309 VanDerWaalsContact C-N 3.35Å; I307-H311 WeakPolarHBondContact O-CA 3.26Å; I307-H311 WeakPolarHBondContact O-CB 3.16Å; I307-H311 PolarHBondContact O-N 3.28Å; I307-L316 HydrophobicContact CB-CD2 3.98Å; I307-L316 HydrophobicContact CG2-CD2 3.7Å; I307-L316 HydrophobicContact CG2-CG 4.26Å
308F89.4Confident87.1Confident105 Ų10563.4 Ų63.446%0.46129%0.293SS..Hα-helixtrans-65.4-38.7178.5-179.1-94000111.8L304 I305 D306 G312 L313 L316L304-F308 VanDerWaalsContact O-CB 3.29Å; L304-F308 WeakPolarHBondContact O-CB 3.42Å; L304-F308 PolarHBondContact O-N 2.69Å; I305-F308 PolarHBondContact O-N 2.94Å; D306-F308 VanDerWaalsContact C-N 3.29Å; D306-F308 PolarHBondContact O-N 3.25Å; F308-G312 WeakPolarHBondContact O-CA 3.27Å; F308-G312 PolarHBondContact O-N 2.96Å; F308-L313 HydrophobicContact CD2-CD2 3.95Å; F308-L313 HydrophobicContact CD2-CG 4.32Å; F308-L313 HydrophobicContact CE2-CD2 3.53Å; F308-L313 HydrophobicContact CE2-CG 3.71Å; F308-L316 HydrophobicContact CB-CD1 4.46Å; F308-L316 HydrophobicContact CD2-CD1 4.11Å
309K87.5Confident87.2Confident166 Ų16657.4 Ų57.472%0.72227%0.267SS*.Hα-helixtrans-70-41.2177.1-77.1178.6177.5-174.70112.6I305 D306 I307I305-K309 HydrophobicContact CG2-CD 4.02Å; I305-K309 HydrophobicContact CG2-CG 4.42Å; I305-K309 WeakPolarHBondContact O-CB 3.34Å; I305-K309 VanDerWaalsContact O-CG 3.27Å; I305-K309 WeakPolarHBondContact O-CG 3.34Å; I305-K309 PolarHBondContact O-N 3.25Å; D306-K309 PolarHBondContact O-N 2.95Å; D306-K309 VanDerWaalsContact O-N 3.14Å; I307-K309 VanDerWaalsContact C-N 3.35Å
310E83.7Confident87.6Confident89 Ų8961.2 Ų61.242%0.41628%0.28SS..Hα-helixtrans-81-38.9-177-68.2-167149.500113.1D306D306-E310 WeakPolarHBondContact O-CG 3.25Å; D306-E310 PolarHBondContact O-N 2.81Å
311H83.6Confident87.9Confident36 Ų3666.4 Ų66.417%0.16731%0.307CS..Hα-helixtrans-123.4-1.8-169.5-57.1-73.8000114.3V36 D38 I307 G315 K318V36-H311 PolarHBondContact O-CE1 2.99Å; V36-H311 PolarHBondContact O-NE2 3.39Å; V36-H311 VanDerWaalsContact O-NE2 3.07Å; D38-H311 IonicContact OD1-CE1 2.8Å; D38-H311 IonicContact OD1-CG 2.93Å; D38-H311 IonicContact OD1-ND1 3.45Å; D38-H311 PolarHBondContact OD1-ND1 2.88Å; I307-H311 WeakPolarHBondContact O-CA 3.26Å; I307-H311 WeakPolarHBondContact O-CB 3.16Å; I307-H311 PolarHBondContact O-N 3.28Å; H311-G315 PolarHBondContact O-N 2.98Å; H311-K318 PolarHBondContact ND1-NZ 3.3Å
312G87.1Confident88.1Confident28 Ų2861.8 Ų61.829%0.28929%0.287SS..Hα-helixtrans66.2-162.7-175.500000113.8F308 Y314 G315F308-G312 WeakPolarHBondContact O-CA 3.27Å; F308-G312 PolarHBondContact O-N 2.96Å; G312-Y314 VanDerWaalsContact C-N 3.31Å; G312-Y314 PolarHBondContact O-N 3.07Å; G312-G315 PolarHBondContact O-N 3.14Å
313L87.6Confident88.3Confident116 Ų11654.8 Ų54.861%0.60726%0.26SS*.Hα-helixtrans-62.1-35.8179.3-73.9172.5000113F308 G315 L316 Y317F308-L313 HydrophobicContact CD2-CD2 3.95Å; F308-L313 HydrophobicContact CD2-CG 4.32Å; F308-L313 HydrophobicContact CE2-CD2 3.53Å; F308-L313 HydrophobicContact CE2-CG 3.71Å; L313-G315 PolarHBondContact O-N 3.42Å; L313-L316 HydrophobicContact CD2-CD1 4.43Å; L313-L316 WeakPolarHBondContact O-CB 3.14Å; L313-L316 PolarHBondContact O-N 2.97Å; L313-L316 VanDerWaalsContact O-N 3.11Å; L313-Y317 WeakPolarHBondContact O-CD2 3.24Å
314Y86.8Confident88.6Confident140 Ų14055.2 Ų55.255%0.54926%0.263SS..Hα-helixtrans-63.5-33-179.2-173-99.5000112I39 G312 L316 Y317I39-Y314 HydrophobicContact CB-CE1 4.3Å; I39-Y314 HydrophobicContact CD1-CE1 4.49Å; G312-Y314 VanDerWaalsContact C-N 3.31Å; G312-Y314 PolarHBondContact O-N 3.07Å; Y314-L316 VanDerWaalsContact C-N 3.26Å; Y314-L316 PolarHBondContact O-N 3.44Å; Y314-Y317 PolarHBondContact O-N 2.93Å
315G86Confident88.8Confident0 Ų057.6 Ų57.60%028%0.276CS..Hα-helixtrans-58.3-35.2173.900000114L255 H311 G312 L313 Y317 K318L255-G315 VanDerWaalsContact CD2-O 3.22Å; L255-G315 WeakPolarHBondContact CD2-O 3.34Å; H311-G315 PolarHBondContact O-N 2.98Å; G312-G315 PolarHBondContact O-N 3.14Å; L313-G315 PolarHBondContact O-N 3.42Å; G315-Y317 VanDerWaalsContact C-N 3.28Å; G315-Y317 PolarHBondContact O-N 3.34Å; G315-K318 WeakPolarHBondContact O-CG 3.43Å
316L90.1Very high88.9Confident16 Ų1655 Ų558%0.08426%0.262CS..Hα-helixtrans-72.8-19-178.7-64.5176.4000113.6Y251 P252 L255 L304 I307 F308 L313 Y314Y251-L316 WeakPolarHBondContact CD1-O 3.45Å; P252-L316 HydrophobicContact CB-CB 4.32Å; P252-L316 HydrophobicContact CB-CD2 4.48Å; P252-L316 HydrophobicContact CG-CB 4.31Å; L255-L316 HydrophobicContact CD2-CD2 4.49Å; L255-L316 WeakPolarHBondContact CD2-O 3.3Å; L304-L316 HydrophobicContact CD2-CD2 3.65Å; I307-L316 HydrophobicContact CB-CD2 3.98Å; I307-L316 HydrophobicContact CG2-CD2 3.7Å; I307-L316 HydrophobicContact CG2-CG 4.26Å; F308-L316 HydrophobicContact CB-CD1 4.46Å; F308-L316 HydrophobicContact CD2-CD1 4.11Å; L313-L316 HydrophobicContact CD2-CD1 4.43Å; L313-L316 WeakPolarHBondContact O-CB 3.14Å; L313-L316 PolarHBondContact O-N 2.97Å; L313-L316 VanDerWaalsContact O-N 3.11Å; Y314-L316 VanDerWaalsContact C-N 3.26Å; Y314-L316 PolarHBondContact O-N 3.44Å
317Y92.7Very high89Confident87 Ų8754 Ų5434%0.34126%0.26SS..THydrogen-bonded Turntrans-108.817.4-178-70.4-92.9000113.2T248 Y251 P252 L313 Y314 G315 G319 W320T248-Y317 HydrophobicContact CG2-CE1 3.96Å; T248-Y317 VanDerWaalsContact O-CE1 3.31Å; T248-Y317 WeakPolarHBondContact O-CE1 3.24Å; Y251-Y317 HydrophobicContact CD1-CD1 4.09Å; Y251-Y317 HydrophobicContact CD1-CG 4.5Å; Y251-Y317 HydrophobicContact CG-CD1 4.31Å; P252-Y317 HydrophobicContact CG-CE2 4.31Å; L313-Y317 WeakPolarHBondContact O-CD2 3.24Å; Y314-Y317 PolarHBondContact O-N 2.93Å; G315-Y317 VanDerWaalsContact C-N 3.28Å; G315-Y317 PolarHBondContact O-N 3.34Å; Y317-G319 PolarHBondContact O-N 3.39Å; Y317-W320 HydrophobicContact CD1-CB 4.5Å; Y317-W320 HydrophobicContact CD1-CG 4.45Å; Y317-W320 VanDerWaalsContact O-CB 3.26Å; Y317-W320 WeakPolarHBondContact O-CB 3.22Å; Y317-W320 PolarHBondContact O-N 2.89Å
318K88.6Confident89Confident1 Ų158.3 Ų58.30%0.00429%0.286CS..THydrogen-bonded Turntrans-60118.3174.7-74.8178.5175.8173.80110.6Q33 V36 E37 D38 I39 Y251 H311 G315Q33-K318 WeakPolarHBondContact CG-O 3.36Å; V36-K318 PolarHBondContact O-NZ 3.42Å; E37-K318 WeakPolarHBondContact O-CE 3.27Å; E37-K318 PolarHBondContact O-NZ 2.82Å; D38-K318 IonicContact OD1-NZ 2.7Å; D38-K318 PolarHBondContact OD1-NZ 2.92Å; I39-K318 HydrophobicContact CD1-CB 4.36Å; I39-K318 HydrophobicContact CD1-CG 3.99Å; I39-K318 HydrophobicContact CG1-CG 4.49Å; Y251-K318 WeakPolarHBondContact CE1-O 3.21Å; Y251-K318 PolarHBondContact OH-O 2.98Å; H311-K318 PolarHBondContact ND1-NZ 3.3Å; G315-K318 WeakPolarHBondContact O-CG 3.43Å
319G88.2Confident89.1Confident4 Ų456.4 Ų56.44%0.04128%0.28CS..THydrogen-bonded Turntrans90.28.9-17700000114.9F32 Y251 Y317 P322 S323F32-G319 VanDerWaalsContact CB-CA 3.47Å; Y251-G319 VanDerWaalsContact OH-CA 3.28Å; Y251-G319 WeakPolarHBondContact OH-CA 3.41Å; Y251-G319 PolarHBondContact OH-O 3.49Å; Y317-G319 PolarHBondContact O-N 3.39Å; G319-P322 WeakPolarHBondContact O-CD 3.47Å; G319-P322 VanDerWaalsContact O-CG 3.28Å; G319-P322 WeakPolarHBondContact O-CG 3.46Å; G319-S323 WeakPolarHBondContact O-CB 3.31Å; G319-S323 PolarHBondContact O-N 3.33Å
320W92.1Very high89.2Confident86 Ų8650.2 Ų50.233%0.32626%0.256SS..Hα-helixtrans-64-41177.5178.689.6000111.9T248 Y251 Y317 S323 A324T248-W320 PolarHBondContact OG1-NE1 3.46Å; Y251-W320 HydrophobicContact CD1-CB 4.49Å; Y251-W320 HydrophobicContact CE1-CB 4.25Å; Y251-W320 HydrophobicContact CE2-CB 4.33Å; Y251-W320 PolarHBondContact OH-N 2.98Å; Y317-W320 HydrophobicContact CD1-CB 4.5Å; Y317-W320 HydrophobicContact CD1-CG 4.45Å; Y317-W320 VanDerWaalsContact O-CB 3.26Å; Y317-W320 WeakPolarHBondContact O-CB 3.22Å; Y317-W320 PolarHBondContact O-N 2.89Å; W320-S323 CarbonylContact O-C 3.54Å; W320-S323 WeakPolarHBondContact O-CA 3.19Å; W320-S323 VanDerWaalsContact O-CB 3.23Å; W320-S323 WeakPolarHBondContact O-CB 3.19Å; W320-S323 PolarHBondContact O-N 3.01Å; W320-S323 VanDerWaalsContact O-N 3.07Å; W320-A324 HydrophobicContact CD2-CB 4.42Å; W320-A324 HydrophobicContact CE3-CB 4.47Å; W320-A324 HydrophobicContact CH2-CB 4.2Å; W320-A324 HydrophobicContact CZ2-CB 4.14Å; W320-A324 HydrophobicContact CZ3-CB 4.36Å; W320-A324 WeakPolarHBondContact O-CB 3.33Å; W320-A324 PolarHBondContact O-N 3.35Å
321I91.7Very high89.3Confident110 Ų11048.2 Ų48.256%0.56425%0.25SS*.Hα-helixtrans-55.8-56.4178.8-60.7172.8000112.5S323 A324 L325I321-S323 PolarHBondContact O-N 3.5Å; I321-A324 PolarHBondContact O-N 3.49Å; I321-L325 WeakPolarHBondContact O-CB 3.37Å; I321-L325 PolarHBondContact O-N 2.95Å
322P91.9Very high89.4Confident4 Ų448.6 Ų48.63%0.02626%0.264CS..Hα-helixtrans-61.9-30.7176.420.5-30.9000112.5I28 K29 F32 L50 G319 K326I28-P322 HydrophobicContact CG2-CB 4.21Å; I28-P322 HydrophobicContact CG2-CG 4.37Å; K29-P322 HydrophobicContact CB-CB 4.19Å; K29-P322 HydrophobicContact CB-CG 4.25Å; F32-P322 HydrophobicContact CD2-CG 4.37Å; L50-P322 HydrophobicContact CD1-CB 3.76Å; L50-P322 HydrophobicContact CD1-CG 4.33Å; G319-P322 WeakPolarHBondContact O-CD 3.47Å; G319-P322 VanDerWaalsContact O-CG 3.28Å; G319-P322 WeakPolarHBondContact O-CG 3.46Å; P322-K326 VanDerWaalsContact O-CB 3.23Å; P322-K326 WeakPolarHBondContact O-CB 3.39Å; P322-K326 PolarHBondContact O-N 3.33Å
323S91.1Very high89.6Confident1 Ų149.2 Ų49.21%0.00726%0.261CS..Hα-helixtrans-67.1-40.1176.2-177.30000113.2K247 G319 W320 I321 A327K247-S323 WeakPolarHBondContact CE-OG 3.42Å; K247-S323 PolarHBondContact NZ-O 2.94Å; K247-S323 PolarHBondContact NZ-OG 3.19Å; G319-S323 WeakPolarHBondContact O-CB 3.31Å; G319-S323 PolarHBondContact O-N 3.33Å; W320-S323 CarbonylContact O-C 3.54Å; W320-S323 WeakPolarHBondContact O-CA 3.19Å; W320-S323 VanDerWaalsContact O-CB 3.23Å; W320-S323 WeakPolarHBondContact O-CB 3.19Å; W320-S323 PolarHBondContact O-N 3.01Å; W320-S323 VanDerWaalsContact O-N 3.07Å; I321-S323 PolarHBondContact O-N 3.5Å; S323-A327 PolarHBondContact O-N 3.36Å; S323-A327 VanDerWaalsContact O-N 3.15Å
324A92.2Very high89.6Confident12 Ų1248 Ų4810%0.09925%0.252CS..Hα-helixtrans-70.4-49.8176.900000110.6L244 W320 I321 K326 A327 T328L244-A324 HydrophobicContact CD1-CB 3.7Å; W320-A324 HydrophobicContact CD2-CB 4.42Å; W320-A324 HydrophobicContact CE3-CB 4.47Å; W320-A324 HydrophobicContact CH2-CB 4.2Å; W320-A324 HydrophobicContact CZ2-CB 4.14Å; W320-A324 HydrophobicContact CZ3-CB 4.36Å; W320-A324 WeakPolarHBondContact O-CB 3.33Å; W320-A324 PolarHBondContact O-N 3.35Å; I321-A324 PolarHBondContact O-N 3.49Å; A324-K326 VanDerWaalsContact C-N 3.28Å; A324-K326 PolarHBondContact O-N 2.95Å; A324-A327 WeakPolarHBondContact O-CB 3.17Å; A324-A327 PolarHBondContact O-N 3.38Å; A324-T328 PolarHBondContact O-N 3.39Å; A324-T328 PolarHBondContact O-OG1 3.4Å
325L92.5Very high89.6Confident76 Ų7646.4 Ų46.440%0.39825%0.249SC..Hα-helixtrans-55.8-44.8176.3-179.861.9000111.5L25 L50 I321 A327 L329L25-L325 HydrophobicContact CD1-CD2 4.33Å; L25-L325 HydrophobicContact CD1-CG 4.12Å; L25-L325 HydrophobicContact CD2-CD2 3.79Å; L25-L325 HydrophobicContact CD2-CG 4.41Å; L50-L325 HydrophobicContact CD2-CD2 3.75Å; I321-L325 WeakPolarHBondContact O-CB 3.37Å; I321-L325 PolarHBondContact O-N 2.95Å; L325-A327 PolarHBondContact O-N 2.93Å; L325-L329 VanDerWaalsContact O-CB 3.23Å; L325-L329 WeakPolarHBondContact O-CB 3.37Å; L325-L329 PolarHBondContact O-N 3.31Å
326K91.7Very high89.8Confident31 Ų3152.8 Ų52.814%0.13527%0.273CS..Hα-helixtrans-58.9-46.9174.3176.4-178.1167-174.30111.6L25 D26 P322 A324 L329 T330L25-K326 HydrophobicContact CB-CB 4.1Å; L25-K326 HydrophobicContact CD1-CB 4.16Å; D26-K326 WeakPolarHBondContact OD1-CD 3.19Å; D26-K326 WeakPolarHBondContact OD1-CE 3.37Å; D26-K326 IonicContact OD1-NZ 2.71Å; D26-K326 PolarHBondContact OD1-NZ 3.03Å; D26-K326 WeakPolarHBondContact OD2-CE 3.27Å; D26-K326 IonicContact OD2-NZ 3.51Å; D26-K326 PolarHBondContact OD2-NZ 3.18Å; P322-K326 VanDerWaalsContact O-CB 3.23Å; P322-K326 WeakPolarHBondContact O-CB 3.39Å; P322-K326 PolarHBondContact O-N 3.33Å; A324-K326 VanDerWaalsContact C-N 3.28Å; A324-K326 PolarHBondContact O-N 2.95Å; K326-L329 PolarHBondContact O-N 2.95Å; K326-T330 VanDerWaalsContact O-CB 3.24Å; K326-T330 WeakPolarHBondContact O-CB 3.48Å; K326-T330 PolarHBondContact O-N 3.03Å; K326-T330 PolarHBondContact O-OG1 3.07Å
327A88.6Confident89.9Confident26 Ų2653.3 Ų53.322%0.21528%0.275CS..Hα-helixtrans-59.4-49.9-176.300000110.8S323 A324 L325 L329 T330 T331S323-A327 PolarHBondContact O-N 3.36Å; S323-A327 VanDerWaalsContact O-N 3.15Å; A324-A327 WeakPolarHBondContact O-CB 3.17Å; A324-A327 PolarHBondContact O-N 3.38Å; L325-A327 PolarHBondContact O-N 2.93Å; A327-L329 PolarHBondContact O-N 3.48Å; A327-T330 PolarHBondContact O-N 3.04Å; A327-T331 PolarHBondContact O-N 3.26Å; A327-T331 VanDerWaalsContact O-N 3.11Å; A327-T331 PolarHBondContact O-OG1 3.32Å; A327-T331 VanDerWaalsContact O-OG1 3.12Å
328T86.6Confident89.8Confident90 Ų9052.7 Ų52.755%0.55227%0.274SS*.Hα-helixtrans-58.7-46.7176.8-51.60000111.9A324 T331 G332A324-T328 PolarHBondContact O-N 3.39Å; A324-T328 PolarHBondContact O-OG1 3.4Å; T328-T331 PolarHBondContact O-N 3.47Å; T328-G332 PolarHBondContact O-N 3.36Å
329L90.3Very high89.9Confident66 Ų6657.9 Ų57.935%0.34630%0.298SS..Hα-helixtrans-69-39-177.9-171.8152.6000112.2T22 L25 L325 K326 A327 G332 L333T22-L329 HydrophobicContact CG2-CD2 3.34Å; L25-L329 HydrophobicContact CD1-CD1 4.24Å; L325-L329 VanDerWaalsContact O-CB 3.23Å; L325-L329 WeakPolarHBondContact O-CB 3.37Å; L325-L329 PolarHBondContact O-N 3.31Å; K326-L329 PolarHBondContact O-N 2.95Å; A327-L329 PolarHBondContact O-N 3.48Å; L329-G332 PolarHBondContact O-N 3.43Å; L329-L333 HydrophobicContact CD2-CD1 3.33Å; L329-L333 HydrophobicContact CD2-CG 3.89Å; L329-L333 HydrophobicContact CG-CD1 4.23Å; L329-L333 HydrophobicContact CG-CG 4.37Å; L329-L333 WeakPolarHBondContact O-CB 3.37Å; L329-L333 WeakPolarHBondContact O-CG 3.35Å; L329-L333 PolarHBondContact O-N 2.98Å
330T90.6Very high90Very high36 Ų3662.1 Ų62.122%0.22132%0.317CS..Hα-helixtrans-61.4-46.5177.5-57.50000110.2V18 K326 A327 M334V18-T330 HydrophobicContact CG1-CG2 3.79Å; K326-T330 VanDerWaalsContact O-CB 3.24Å; K326-T330 WeakPolarHBondContact O-CB 3.48Å; K326-T330 PolarHBondContact O-N 3.03Å; K326-T330 PolarHBondContact O-OG1 3.07Å; A327-T330 PolarHBondContact O-N 3.04Å; T330-M334 WeakPolarHBondContact O-CB 3.25Å; T330-M334 PolarHBondContact O-N 3.49Å
331T84.4Confident90.1Very high46 Ų4660.4 Ų60.428%0.28231%0.311SS..Hα-helixtrans-59.3-50.6178.2-59.10000111.1L236 A327 T328 M334 F335L236-T331 HydrophobicContact CD1-CG2 3.36Å; L236-T331 HydrophobicContact CG-CG2 4.18Å; A327-T331 PolarHBondContact O-N 3.26Å; A327-T331 VanDerWaalsContact O-N 3.11Å; A327-T331 PolarHBondContact O-OG1 3.32Å; A327-T331 VanDerWaalsContact O-OG1 3.12Å; T328-T331 PolarHBondContact O-N 3.47Å; T331-M334 PolarHBondContact O-N 2.91Å; T331-F335 HydrophobicContact CG2-CE2 4.47Å; T331-F335 WeakPolarHBondContact O-CD2 3.2Å
332G85.9Confident90Very high44 Ų4456.2 Ų56.245%0.45429%0.291SS..Hα-helixtrans-62.6-46.1179.900000113.8T328 L329 M334 W336T328-G332 PolarHBondContact O-N 3.36Å; L329-G332 PolarHBondContact O-N 3.43Å; G332-M334 VanDerWaalsContact C-N 3.34Å; G332-M334 PolarHBondContact O-N 3.39Å; G332-W336 PolarHBondContact O-N 2.59Å
333L91.2Very high89.9Confident42 Ų4258.9 Ų58.922%0.2231%0.309CS..Hα-helixtrans-68.6-32.5-179.2-69.8-171.8000112.9V18 L21 L329 W336 F337V18-L333 HydrophobicContact CG1-CB 4.28Å; V18-L333 HydrophobicContact CG2-CB 3.88Å; L21-L333 HydrophobicContact CB-CD1 4.22Å; L21-L333 HydrophobicContact CD1-CD1 4.08Å; L329-L333 HydrophobicContact CD2-CD1 3.33Å; L329-L333 HydrophobicContact CD2-CG 3.89Å; L329-L333 HydrophobicContact CG-CD1 4.23Å; L329-L333 HydrophobicContact CG-CG 4.37Å; L329-L333 WeakPolarHBondContact O-CB 3.37Å; L329-L333 WeakPolarHBondContact O-CG 3.35Å; L329-L333 PolarHBondContact O-N 2.98Å; L333-W336 HydrophobicContact CD2-CE3 4.42Å; L333-W336 PolarHBondContact O-N 2.81Å; L333-F337 HydrophobicContact CB-CD2 4.18Å; L333-F337 HydrophobicContact CB-CE2 4.41Å; L333-F337 HydrophobicContact CD1-CE2 4.5Å; L333-F337 HydrophobicContact CD2-CE2 4.22Å; L333-F337 WeakPolarHBondContact O-CB 3.33Å; L333-F337 VanDerWaalsContact O-CD2 3.31Å; L333-F337 WeakPolarHBondContact O-CD2 3.49Å; L333-F337 PolarHBondContact O-N 3.1Å
334M88.6Confident89.8Confident89 Ų8963.9 Ų63.944%0.43834%0.335SS..Hα-helixtrans-63.6-45.5-177.9-167168.9-14300112.3V18 T330 T331 G332 F338V18-M334 HydrophobicContact CG2-CB 4.35Å; T330-M334 WeakPolarHBondContact O-CB 3.25Å; T330-M334 PolarHBondContact O-N 3.49Å; T331-M334 PolarHBondContact O-N 2.91Å; G332-M334 VanDerWaalsContact C-N 3.34Å; G332-M334 PolarHBondContact O-N 3.39Å; M334-F338 WeakPolarHBondContact O-CB 3.43Å; M334-F338 PolarHBondContact O-N 2.91Å
335F85.8Confident89.7Confident108 Ų10864.6 Ų64.647%0.47434%0.337SS..Hα-helixtrans-65.1-47.4174.5-76.9-83.4000111.4L236 T331 F337 F338 E339L236-F335 HydrophobicContact CD1-CD2 3.57Å; L236-F335 HydrophobicContact CD1-CE2 3.07Å; L236-F335 HydrophobicContact CD1-CZ 3.71Å; L236-F335 HydrophobicContact CG-CE2 4.42Å; T331-F335 HydrophobicContact CG2-CE2 4.47Å; T331-F335 WeakPolarHBondContact O-CD2 3.2Å; F335-F337 PolarHBondContact O-N 3.18Å; F335-F338 PolarHBondContact O-N 3.37Å; F335-E339 WeakPolarHBondContact O-CG 3.39Å; F335-E339 PolarHBondContact O-N 3.26Å
336W90.3Very high89.4Confident133 Ų13364.6 Ų64.650%0.50434%0.344SS..Hα-helixtrans-58.5-51-178.6-175.567.3000112.4G332 L333 F338 E339 Q340G332-W336 PolarHBondContact O-N 2.59Å; L333-W336 HydrophobicContact CD2-CE3 4.42Å; L333-W336 PolarHBondContact O-N 2.81Å; W336-F338 VanDerWaalsContact C-N 3.35Å; W336-F338 PolarHBondContact O-N 2.89Å; W336-E339 PolarHBondContact O-N 2.78Å; W336-Q340 HydrophobicContact CD2-CG 4.4Å; W336-Q340 HydrophobicContact CZ2-CG 4.31Å; W336-Q340 WeakPolarHBondContact O-CG 3.31Å; W336-Q340 PolarHBondContact O-N 3.27Å
337F92.7Very high88.9Confident28 Ų2872.7 Ų72.712%0.12338%0.375CS..Hα-helixtrans-67.2-34.9178.6-83.7-70.3000113T17 V18 L21 L333 F335 E339 Q340 Y341T17-F337 HydrophobicContact CG2-CD1 3.93Å; T17-F337 HydrophobicContact CG2-CD2 4.25Å; T17-F337 HydrophobicContact CG2-CE1 3.61Å; T17-F337 HydrophobicContact CG2-CE2 3.97Å; T17-F337 HydrophobicContact CG2-CG 4.24Å; T17-F337 HydrophobicContact CG2-CZ 3.61Å; V18-F337 HydrophobicContact CG2-CD2 3.95Å; L21-F337 HydrophobicContact CD1-CD2 4.48Å; L21-F337 HydrophobicContact CD1-CE2 3.34Å; L21-F337 HydrophobicContact CD1-CZ 3.49Å; L21-F337 VanDerWaalsContact CD1-CZ 3.49Å; L333-F337 HydrophobicContact CB-CD2 4.18Å; L333-F337 HydrophobicContact CB-CE2 4.41Å; L333-F337 HydrophobicContact CD1-CE2 4.5Å; L333-F337 HydrophobicContact CD2-CE2 4.22Å; L333-F337 WeakPolarHBondContact O-CB 3.33Å; L333-F337 VanDerWaalsContact O-CD2 3.31Å; L333-F337 WeakPolarHBondContact O-CD2 3.49Å; L333-F337 PolarHBondContact O-N 3.1Å; F335-F337 PolarHBondContact O-N 3.18Å; F337-E339 VanDerWaalsContact C-N 3.33Å; F337-E339 PolarHBondContact O-N 3.01Å; F337-Q340 PolarHBondContact O-N 3.18Å; F337-Y341 HydrophobicContact CB-CD2 4.26Å; F337-Y341 HydrophobicContact CB-CE2 4.05Å; F337-Y341 AromaticContact CD1-CE2 3.92Å; F337-Y341 HydrophobicContact CD1-CE2 3.92Å; F337-Y341 HydrophobicContact CG-CE2 4.36Å; F337-Y341 WeakPolarHBondContact O-CB 3.4Å; F337-Y341 WeakPolarHBondContact O-CD2 3.4Å; F337-Y341 PolarHBondContact O-N 3.22Å
338F90.6Very high87.9Confident74 Ų7477.3 Ų77.333%0.32540%0.404SS..Hα-helixtrans-60.7-44.2175.5176.7-98.1000111.4A10 M334 F335 W336 S342A10-F338 HydrophobicContact CB-CD2 4.14Å; A10-F338 HydrophobicContact CB-CE2 4.06Å; M334-F338 WeakPolarHBondContact O-CB 3.43Å; M334-F338 PolarHBondContact O-N 2.91Å; F335-F338 PolarHBondContact O-N 3.37Å; W336-F338 VanDerWaalsContact C-N 3.35Å; W336-F338 PolarHBondContact O-N 2.89Å; F338-S342 VanDerWaalsContact O-CB 3.25Å; F338-S342 WeakPolarHBondContact O-CB 3.42Å; F338-S342 PolarHBondContact O-N 3.46Å; F338-S342 PolarHBondContact O-OG 2.94Å
339E90.3Very high88Confident110 Ų11076.7 Ų76.751%0.51440%0.397SS..Hα-helixtrans-64-45.8176-71.7176.5-179.900111.8F335 W336 F337 Y341 S342 C343F335-E339 WeakPolarHBondContact O-CG 3.39Å; F335-E339 PolarHBondContact O-N 3.26Å; W336-E339 PolarHBondContact O-N 2.78Å; F337-E339 VanDerWaalsContact C-N 3.33Å; F337-E339 PolarHBondContact O-N 3.01Å; E339-Y341 PolarHBondContact O-N 3.4Å; E339-S342 PolarHBondContact O-N 2.86Å; E339-C343 VanDerWaalsContact O-CB 3.22Å; E339-C343 WeakPolarHBondContact O-CB 3.3Å; E339-C343 PolarHBondContact O-N 3.5Å
340Q91.9Very high87.9Confident93 Ų9377.3 Ų77.344%0.43540%0.4SS..Hα-helixtrans-60.4-46178.4-65.6-50.7-51.900111.9W336 F337 C343 L344W336-Q340 HydrophobicContact CD2-CG 4.4Å; W336-Q340 HydrophobicContact CZ2-CG 4.31Å; W336-Q340 WeakPolarHBondContact O-CG 3.31Å; W336-Q340 PolarHBondContact O-N 3.27Å; F337-Q340 PolarHBondContact O-N 3.18Å; Q340-C343 PolarHBondContact O-N 2.84Å; Q340-L344 WeakPolarHBondContact O-CB 3.42Å; Q340-L344 PolarHBondContact O-N 3.47Å
341Y92.4Very high87.7Confident49 Ų4979.6 Ų79.619%0.19241%0.41CS..Hα-helixtrans-69.8-37.6178.1-68.2-48.9000112.6L13 T17 F337 E339 C343 L344 L345L13-Y341 HydrophobicContact CB-CD1 4.49Å; L13-Y341 HydrophobicContact CB-CD2 3.75Å; L13-Y341 HydrophobicContact CB-CE1 4.48Å; L13-Y341 HydrophobicContact CB-CE2 3.74Å; L13-Y341 HydrophobicContact CB-CG 4.16Å; L13-Y341 HydrophobicContact CD1-CD1 4.39Å; T17-Y341 PolarHBondContact OG1-OH 3.28Å; F337-Y341 HydrophobicContact CB-CD2 4.26Å; F337-Y341 HydrophobicContact CB-CE2 4.05Å; F337-Y341 AromaticContact CD1-CE2 3.92Å; F337-Y341 HydrophobicContact CD1-CE2 3.92Å; F337-Y341 HydrophobicContact CG-CE2 4.36Å; F337-Y341 WeakPolarHBondContact O-CB 3.4Å; F337-Y341 WeakPolarHBondContact O-CD2 3.4Å; F337-Y341 PolarHBondContact O-N 3.22Å; E339-Y341 PolarHBondContact O-N 3.4Å; Y341-C343 VanDerWaalsContact C-N 3.32Å; Y341-C343 PolarHBondContact O-N 3.37Å; Y341-L344 PolarHBondContact O-N 2.95Å; Y341-L345 VanDerWaalsContact O-CB 3.32Å; Y341-L345 WeakPolarHBondContact O-CB 3.27Å; Y341-L345 VanDerWaalsContact O-CG 3.23Å; Y341-L345 WeakPolarHBondContact O-CG 3.49Å; Y341-L345 PolarHBondContact O-N 2.6Å
342S89.5Confident87.9Confident22 Ų2281.5 Ų81.515%0.15442%0.417CS..Hα-helixtrans-64.5-39.8176.2-59.80000111.4A10 F338 E339 S346A10-S342 WeakPolarHBondContact CB-OG 3.31Å; F338-S342 VanDerWaalsContact O-CB 3.25Å; F338-S342 WeakPolarHBondContact O-CB 3.42Å; F338-S342 PolarHBondContact O-N 3.46Å; F338-S342 PolarHBondContact O-OG 2.94Å; E339-S342 PolarHBondContact O-N 2.86Å; S342-S346 WeakPolarHBondContact O-CB 3.3Å; S342-S346 PolarHBondContact O-N 3Å; S342-S346 PolarHBondContact O-OG 3.11Å
343C89.9Confident88Confident60 Ų6083.9 Ų83.941%0.40542%0.415SS..Hα-helixtrans-63.6-51.8174.5-168.40000110.8E339 Q340 Y341 L345 S346 Y347E339-C343 VanDerWaalsContact O-CB 3.22Å; E339-C343 WeakPolarHBondContact O-CB 3.3Å; E339-C343 PolarHBondContact O-N 3.5Å; Q340-C343 PolarHBondContact O-N 2.84Å; Y341-C343 VanDerWaalsContact C-N 3.32Å; Y341-C343 PolarHBondContact O-N 3.37Å; C343-L345 PolarHBondContact O-N 2.93Å; C343-S346 WeakPolarHBondContact O-CB 3.46Å; C343-S346 PolarHBondContact O-N 3.36Å; C343-Y347 WeakPolarHBondContact O-CD2 3.01Å; C343-Y347 PolarHBondContact O-N 3.03Å; C343-Y347 VanDerWaalsContact SG-CE2 3.56Å
344L90.6Very high87.8Confident106 Ų10686.7 Ų86.756%0.55543%0.428SS*.Hα-helixtrans-57-45.9177.8-175.169.6000112.3Q340 Y341 S346 Y347 C348Q340-L344 WeakPolarHBondContact O-CB 3.42Å; Q340-L344 PolarHBondContact O-N 3.47Å; Y341-L344 PolarHBondContact O-N 2.95Å; L344-S346 PolarHBondContact O-N 2.84Å; L344-Y347 PolarHBondContact O-N 2.8Å; L344-C348 PolarHBondContact O-N 3.42Å
345L89.4Confident87.8Confident27 Ų2786.5 Ų86.514%0.14143%0.427CS..Hα-helixtrans-72.5-13.8177.5-67.7176.2000113.3M1 K6 I9 A10 Y341 C343M1-L345 HydrophobicContact CE-CB 4.16Å; M1-L345 HydrophobicContact CE-CD1 4.39Å; M1-L345 HydrophobicContact CE-CD2 3.94Å; M1-L345 HydrophobicContact CE-CG 4.4Å; K6-L345 WeakPolarHBondContact CD-O 3.44Å; K6-L345 WeakPolarHBondContact CE-O 3.39Å; K6-L345 PolarHBondContact NZ-O 3.04Å; K6-L345 WeakPolarHBondContact O-CD1 3.48Å; I9-L345 HydrophobicContact CB-CD1 3.97Å; I9-L345 HydrophobicContact CG2-CD1 3.79Å; A10-L345 HydrophobicContact CB-CD1 4.09Å; Y341-L345 VanDerWaalsContact O-CB 3.32Å; Y341-L345 WeakPolarHBondContact O-CB 3.27Å; Y341-L345 VanDerWaalsContact O-CG 3.23Å; Y341-L345 WeakPolarHBondContact O-CG 3.49Å; Y341-L345 PolarHBondContact O-N 2.6Å; C343-L345 PolarHBondContact O-N 2.93Å
346S85.9Confident87.9Confident77 Ų7784.8 Ų84.854%0.53842%0.424SS..Hα-helixtrans-80.7-30.2173.7-64.90000111.8S342 C343 L344S342-S346 WeakPolarHBondContact O-CB 3.3Å; S342-S346 PolarHBondContact O-N 3Å; S342-S346 PolarHBondContact O-OG 3.11Å; C343-S346 WeakPolarHBondContact O-CB 3.46Å; C343-S346 PolarHBondContact O-N 3.36Å; L344-S346 PolarHBondContact O-N 2.84Å
347Y81.4Confident87.7Confident200 Ų20080.8 Ų80.878%0.78442%0.417SS*.Hα-helixtrans-75.3-24.4172.3-71.1-72.4000113.5C343 L344C343-Y347 WeakPolarHBondContact O-CD2 3.01Å; C343-Y347 PolarHBondContact O-N 3.03Å; C343-Y347 VanDerWaalsContact SG-CE2 3.56Å; L344-Y347 PolarHBondContact O-N 2.8Å
348C68.2Low87.3Confident124 Ų12485.6 Ų85.684%0.83844%0.444SS*.  trans-88.60170.5-61.90000112.5K6 L344K6-C348 PolarHBondContact NZ-OXT 3.12Å; L344-C348 PolarHBondContact O-N 3.42Å

Retrieved 348 of 348 residues in 78 ms (Link to these results)

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