A0A087YBG9_POEFO Loading...

Transmembrane protein 182

AlphaFold DB , UniProt , Accession A0A087YBG9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 246 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
1M53.5Low85.5Confident211 Ų21186.7 Ų86.7100%1.03948%0.48SS*.  0-500-142.6169.3167.800113.2L3 V5M1-L3 PolarHBondContact O-N 3.28Å; M1-V5 WeakPolarHBondContact O-CG2 3.35Å; M1-V5 PolarHBondContact O-N 3.2Å
2K79.3Confident86.4Confident193 Ų19385.5 Ų85.584%0.83948%0.477SS*.Hα-helixtrans-60.2-38.5-178.5-69.3-178.7176.51790115.5A6K2-A6 PolarHBondContact O-N 3.29Å; K2-A6 VanDerWaalsContact O-N 3.14Å
3L81.3Confident87.2Confident66 Ų6682.8 Ų82.835%0.34646%0.457SS..Hα-helixtrans-69.3-43.6-177.9-172.766.6000113M1 V5 A6 L7 I238 T241 V242M1-L3 PolarHBondContact O-N 3.28Å; L3-V5 VanDerWaalsContact C-N 3.32Å; L3-V5 PolarHBondContact O-N 3.4Å; L3-A6 PolarHBondContact O-N 3.24Å; L3-L7 WeakPolarHBondContact O-CB 3.33Å; L3-L7 PolarHBondContact O-N 3.46Å; L3-I238 HydrophobicContact CD1-CG2 4.21Å; L3-T241 HydrophobicContact CD1-CG2 4.04Å; L3-V242 HydrophobicContact CD2-CG2 4.18Å
4S83.9Confident87.9Confident92 Ų9277.2 Ų77.264%0.64343%0.428SS*.Hα-helixtrans-63.8-39.2-179.6-166.50000111.9L7 C8S4-L7 PolarHBondContact O-N 3.14Å; S4-C8 PolarHBondContact O-N 2.76Å
5V88.5Confident88.6Confident75 Ų7576.3 Ų76.346%0.45543%0.434SS..Hα-helixtrans-64-46.3174.1176.40000111.1M1 L3 L7 C8 F9M1-V5 WeakPolarHBondContact O-CG2 3.35Å; M1-V5 PolarHBondContact O-N 3.2Å; L3-V5 VanDerWaalsContact C-N 3.32Å; L3-V5 PolarHBondContact O-N 3.4Å; V5-L7 VanDerWaalsContact C-N 3.29Å; V5-L7 PolarHBondContact O-N 3.24Å; V5-C8 WeakPolarHBondContact O-CB 3.42Å; V5-C8 PolarHBondContact O-N 2.88Å; V5-F9 HydrophobicContact CG1-CD2 3.78Å; V5-F9 HydrophobicContact CG1-CE2 3.53Å; V5-F9 VanDerWaalsContact O-CD2 3.23Å; V5-F9 WeakPolarHBondContact O-CD2 3.41Å; V5-F9 PolarHBondContact O-N 3.31Å; V5-F9 VanDerWaalsContact O-N 3.07Å
6A88.3Confident89.2Confident35 Ų3575.5 Ų75.529%0.28943%0.428SS..Hα-helixtrans-60.8-38.5176.600000112.4K2 L3 F9 A10 I238K2-A6 PolarHBondContact O-N 3.29Å; K2-A6 VanDerWaalsContact O-N 3.14Å; L3-A6 PolarHBondContact O-N 3.24Å; A6-F9 PolarHBondContact O-N 3.12Å; A6-A10 WeakPolarHBondContact O-CB 3.43Å; A6-A10 PolarHBondContact O-N 2.92Å; A6-I238 HydrophobicContact CB-CD1 4.45Å; A6-I238 HydrophobicContact CB-CG1 4.46Å
7L90.1Very high89.6Confident52 Ų5271.1 Ų71.127%0.27240%0.402SS..Hα-helixtrans-66.1-38.9177.6-140.5126.2000112.1L3 S4 V5 G11 Y162 I238L3-L7 WeakPolarHBondContact O-CB 3.33Å; L3-L7 PolarHBondContact O-N 3.46Å; S4-L7 PolarHBondContact O-N 3.14Å; V5-L7 VanDerWaalsContact C-N 3.29Å; V5-L7 PolarHBondContact O-N 3.24Å; L7-G11 PolarHBondContact O-N 3.5Å; L7-Y162 HydrophobicContact CD1-CE1 4.07Å; L7-Y162 HydrophobicContact CD2-CE1 4.39Å; L7-Y162 HydrophobicContact CG-CE1 4.34Å; L7-I238 HydrophobicContact CD1-CG2 3.75Å; L7-I238 HydrophobicContact CG-CD1 4.46Å
8C91.9Very high90.1Very high83 Ų8367.9 Ų67.956%0.56139%0.387SS*.Hα-helixtrans-61.6-50.3173.4-175.40000111.3S4 V5 A10 G11 V12S4-C8 PolarHBondContact O-N 2.76Å; V5-C8 WeakPolarHBondContact O-CB 3.42Å; V5-C8 PolarHBondContact O-N 2.88Å; C8-A10 PolarHBondContact O-N 3.32Å; C8-G11 PolarHBondContact O-N 3.02Å; C8-V12 WeakPolarHBondContact O-CG2 3.47Å; C8-V12 PolarHBondContact O-N 2.92Å
9F93.9Very high90.5Very high114 Ų11466.8 Ų66.850%0.539%0.387SS..Hα-helixtrans-60.4-45.5176.8-79.1-68.4000112.5V5 A6 G11 V12 F13V5-F9 HydrophobicContact CG1-CD2 3.78Å; V5-F9 HydrophobicContact CG1-CE2 3.53Å; V5-F9 VanDerWaalsContact O-CD2 3.23Å; V5-F9 WeakPolarHBondContact O-CD2 3.41Å; V5-F9 PolarHBondContact O-N 3.31Å; V5-F9 VanDerWaalsContact O-N 3.07Å; A6-F9 PolarHBondContact O-N 3.12Å; F9-G11 VanDerWaalsContact C-N 3.3Å; F9-G11 PolarHBondContact O-N 3.45Å; F9-V12 PolarHBondContact O-N 2.84Å; F9-F13 HydrophobicContact CB-CE2 4.32Å; F9-F13 HydrophobicContact CD1-CE2 4.44Å; F9-F13 HydrophobicContact CD1-CZ 4.14Å; F9-F13 WeakPolarHBondContact O-CB 3.49Å; F9-F13 WeakPolarHBondContact O-CD2 3.45Å; F9-F13 VanDerWaalsContact O-CG 3.28Å; F9-F13 WeakPolarHBondContact O-CG 3.46Å; F9-F13 PolarHBondContact O-N 2.83Å
10A94.6Very high90.8Very high0 Ų065.7 Ų65.70%038%0.377CS..Hα-helixtrans-60.8-41.3176.700000111.6A6 C8 G14 L234 F235 I238A6-A10 WeakPolarHBondContact O-CB 3.43Å; A6-A10 PolarHBondContact O-N 2.92Å; C8-A10 PolarHBondContact O-N 3.32Å; A10-G14 PolarHBondContact O-N 3.44Å; A10-L234 HydrophobicContact CB-CB 3.76Å; A10-L234 HydrophobicContact CB-CD1 4.24Å; A10-F235 VanDerWaalsContact C-CZ 3.42Å; A10-F235 HydrophobicContact CB-CD1 3.84Å; A10-F235 HydrophobicContact CB-CE1 3.5Å; A10-F235 VanDerWaalsContact CB-CE1 3.5Å; A10-F235 HydrophobicContact CB-CE2 4.34Å; A10-F235 HydrophobicContact CB-CG 4.38Å; A10-F235 HydrophobicContact CB-CZ 3.77Å; A10-F235 VanDerWaalsContact O-CZ 3.27Å; A10-F235 WeakPolarHBondContact O-CZ 3.36Å; A10-I238 HydrophobicContact CB-CD1 3.62Å
11G95Very high91.1Very high33 Ų3362.6 Ų62.634%0.3436%0.359SS..Hα-helixtrans-61.8-48.5175.200000113L7 C8 F9 G14 A15L7-G11 PolarHBondContact O-N 3.5Å; C8-G11 PolarHBondContact O-N 3.02Å; F9-G11 VanDerWaalsContact C-N 3.3Å; F9-G11 PolarHBondContact O-N 3.45Å; G11-G14 PolarHBondContact O-N 3.45Å; G11-A15 WeakPolarHBondContact O-CB 3.49Å; G11-A15 PolarHBondContact O-N 3.04Å
12V96.7Very high93.1Very high72 Ų7256.4 Ų56.444%0.43633%0.327SS..Hα-helixtrans-63.1-47.1178.6172.20000111C8 F9 G14 A15 L16C8-V12 WeakPolarHBondContact O-CG2 3.47Å; C8-V12 PolarHBondContact O-N 2.92Å; F9-V12 PolarHBondContact O-N 2.84Å; V12-G14 PolarHBondContact O-N 2.91Å; V12-A15 PolarHBondContact O-N 3.27Å; V12-L16 HydrophobicContact CG1-CD1 4.01Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 WeakPolarHBondContact O-CG 3.48Å; V12-L16 PolarHBondContact O-N 3.46Å
13F97.2Very high93.9Very high51 Ų5150.9 Ų50.922%0.22431%0.306CS..Hα-helixtrans-65.7-38.9177.3-62.6-26.1000112F9 L16 G17 F227 L230 A231 L234F9-F13 HydrophobicContact CB-CE2 4.32Å; F9-F13 HydrophobicContact CD1-CE2 4.44Å; F9-F13 HydrophobicContact CD1-CZ 4.14Å; F9-F13 WeakPolarHBondContact O-CB 3.49Å; F9-F13 WeakPolarHBondContact O-CD2 3.45Å; F9-F13 VanDerWaalsContact O-CG 3.28Å; F9-F13 WeakPolarHBondContact O-CG 3.46Å; F9-F13 PolarHBondContact O-N 2.83Å; F13-L16 PolarHBondContact O-N 3.24Å; F13-G17 PolarHBondContact O-N 3.14Å; F13-F227 HydrophobicContact CB-CD1 4.15Å; F13-F227 AromaticContact CD1-CD1 3.8Å; F13-F227 HydrophobicContact CD1-CD1 3.8Å; F13-F227 AromaticContact CD1-CE1 3.78Å; F13-F227 HydrophobicContact CD1-CE1 3.78Å; F13-F227 HydrophobicContact CE1-CE1 4.11Å; F13-F227 HydrophobicContact CG-CD1 4.14Å; F13-L230 HydrophobicContact CD2-CD2 3.64Å; F13-L230 HydrophobicContact CD2-CG 4.03Å; F13-L230 HydrophobicContact CE2-CD2 3.7Å; F13-L230 HydrophobicContact CE2-CG 4.4Å; F13-L230 HydrophobicContact CG-CD2 4.3Å; F13-L230 HydrophobicContact CZ-CD2 4.39Å; F13-A231 HydrophobicContact CB-CB 4.12Å; F13-L234 HydrophobicContact CD2-CD1 3.73Å; F13-L234 HydrophobicContact CE2-CD1 4.19Å
14G96.9Very high94.5Very high4 Ų447.7 Ų47.74%0.04129%0.289CS..Hα-helixtrans-61.8-44.1174.400000112A10 G11 V12 G17 A18 F169A10-G14 PolarHBondContact O-N 3.44Å; G11-G14 PolarHBondContact O-N 3.45Å; V12-G14 PolarHBondContact O-N 2.91Å; G14-G17 PolarHBondContact O-N 3.22Å; G14-A18 WeakPolarHBondContact O-CB 3.43Å; G14-A18 PolarHBondContact O-N 3.38Å; G14-F169 WeakPolarHBondContact O-CE1 3.4Å
15A97.5Very high94.9Very high63 Ų6345.3 Ų45.352%0.52127%0.267SS..Hα-helixtrans-64.8-44.7177.200000112.2G11 V12 A18 A19G11-A15 WeakPolarHBondContact O-CB 3.49Å; G11-A15 PolarHBondContact O-N 3.04Å; V12-A15 PolarHBondContact O-N 3.27Å; A15-A18 PolarHBondContact O-N 3.2Å; A15-A19 VanDerWaalsContact O-CB 3.29Å; A15-A19 WeakPolarHBondContact O-CB 3.31Å; A15-A19 PolarHBondContact O-N 3.33Å
16L97.9Very high94.8Very high64 Ų6444.3 Ų44.334%0.33527%0.272SS..Hα-helixtrans-62.3-46.6175.3-72.5172.8000111.4V12 F13 A18 A19 F20 F227V12-L16 HydrophobicContact CG1-CD1 4.01Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CB 3.34Å; V12-L16 WeakPolarHBondContact O-CG 3.48Å; V12-L16 PolarHBondContact O-N 3.46Å; F13-L16 PolarHBondContact O-N 3.24Å; L16-A18 PolarHBondContact O-N 3.03Å; L16-A19 PolarHBondContact O-N 2.82Å; L16-F20 HydrophobicContact CB-CD2 4.41Å; L16-F20 HydrophobicContact CB-CE2 4.35Å; L16-F20 HydrophobicContact CD2-CE2 4.21Å; L16-F20 WeakPolarHBondContact O-CD2 3.38Å; L16-F20 PolarHBondContact O-N 3.44Å; L16-F227 HydrophobicContact CB-CD2 4.27Å; L16-F227 HydrophobicContact CB-CG 4.27Å; L16-F227 HydrophobicContact CD1-CE1 4.33Å; L16-F227 HydrophobicContact CD1-CZ 4.31Å
17G97.3Very high94.7Very high0 Ų044.9 Ų44.90%027%0.272CS..Hα-helixtrans-57-48.8176.700000112F13 G14 F20 I21F13-G17 PolarHBondContact O-N 3.14Å; G14-G17 PolarHBondContact O-N 3.22Å; G17-F20 PolarHBondContact O-N 3.44Å; G17-I21 WeakPolarHBondContact O-CB 3.34Å; G17-I21 VanDerWaalsContact O-CG1 3.27Å; G17-I21 WeakPolarHBondContact O-CG1 3.4Å; G17-I21 PolarHBondContact O-N 3.45Å
18A97.8Very high94.1Very high15 Ų1542.9 Ų42.912%0.12426%0.262CS..Hα-helixtrans-61.6-46.5176.300000112.2G14 A15 L16 F20 I21 F22 V143G14-A18 WeakPolarHBondContact O-CB 3.43Å; G14-A18 PolarHBondContact O-N 3.38Å; A15-A18 PolarHBondContact O-N 3.2Å; L16-A18 PolarHBondContact O-N 3.03Å; A18-F20 PolarHBondContact O-N 2.88Å; A18-I21 PolarHBondContact O-N 3.04Å; A18-F22 HydrophobicContact CB-CE2 4.04Å; A18-F22 WeakPolarHBondContact O-CD2 3.42Å; A18-F22 VanDerWaalsContact O-CG 3.28Å; A18-F22 WeakPolarHBondContact O-CG 3.22Å; A18-F22 PolarHBondContact O-N 3.07Å; A18-V143 HydrophobicContact CB-CG2 3.73Å
19A97.7Very high93.6Very high46 Ų4645.2 Ų45.238%0.3826%0.26SS..Hα-helixtrans-59.8-47179.500000112A15 L16 F22 L23A15-A19 VanDerWaalsContact O-CB 3.29Å; A15-A19 WeakPolarHBondContact O-CB 3.31Å; A15-A19 PolarHBondContact O-N 3.33Å; L16-A19 PolarHBondContact O-N 2.82Å; A19-F22 PolarHBondContact O-N 3.42Å; A19-L23 WeakPolarHBondContact O-CB 3.23Å; A19-L23 VanDerWaalsContact O-CG 3.27Å; A19-L23 WeakPolarHBondContact O-CG 3.41Å; A19-L23 PolarHBondContact O-N 3.43Å
20F97.3Very high93.2Very high45 Ų4539.8 Ų39.820%0.19724%0.236CC..Hα-helixtrans-67.9-35.9178.8-74.6-60.1000112.8L16 G17 A18 L23 S24 F220 I223 F227L16-F20 HydrophobicContact CB-CD2 4.41Å; L16-F20 HydrophobicContact CB-CE2 4.35Å; L16-F20 HydrophobicContact CD2-CE2 4.21Å; L16-F20 WeakPolarHBondContact O-CD2 3.38Å; L16-F20 PolarHBondContact O-N 3.44Å; G17-F20 PolarHBondContact O-N 3.44Å; A18-F20 PolarHBondContact O-N 2.88Å; F20-L23 HydrophobicContact CD1-CD1 4.29Å; F20-L23 PolarHBondContact O-N 3.3Å; F20-S24 WeakPolarHBondContact O-CB 3.28Å; F20-S24 PolarHBondContact O-N 2.91Å; F20-F220 HydrophobicContact CD1-CB 4.27Å; F20-F220 AromaticContact CD1-CD1 3.67Å; F20-F220 HydrophobicContact CD1-CD1 3.67Å; F20-F220 HydrophobicContact CD1-CE1 4.28Å; F20-F220 HydrophobicContact CD1-CG 4.16Å; F20-F220 AromaticContact CE1-CD1 3.89Å; F20-F220 HydrophobicContact CE1-CD1 3.89Å; F20-F220 HydrophobicContact CE1-CE1 4.11Å; F20-I223 HydrophobicContact CD1-CG2 4.43Å; F20-I223 HydrophobicContact CD2-CB 4.42Å; F20-I223 HydrophobicContact CD2-CG2 3.56Å; F20-I223 HydrophobicContact CE1-CG2 4.47Å; F20-I223 HydrophobicContact CE2-CG2 3.61Å; F20-I223 HydrophobicContact CG-CB 4.42Å; F20-I223 HydrophobicContact CG-CG2 4.01Å; F20-I223 HydrophobicContact CZ-CG2 4.09Å; F20-F227 HydrophobicContact CD2-CD2 4.24Å; F20-F227 HydrophobicContact CE2-CD2 4.37Å; F20-F227 HydrophobicContact CE2-CE2 4.27Å
21I96.6Very high92.5Very high0 Ų040 Ų400%024%0.237CC..Hα-helixtrans-64.4-43.8172.9-70.5171.1000110.7G17 A18 S24 F25 V140 V143 S172 A228G17-I21 WeakPolarHBondContact O-CB 3.34Å; G17-I21 VanDerWaalsContact O-CG1 3.27Å; G17-I21 WeakPolarHBondContact O-CG1 3.4Å; G17-I21 PolarHBondContact O-N 3.45Å; A18-I21 PolarHBondContact O-N 3.04Å; I21-S24 PolarHBondContact O-N 3.31Å; I21-F25 WeakPolarHBondContact O-CB 3.45Å; I21-F25 PolarHBondContact O-N 2.91Å; I21-V140 HydrophobicContact CG2-CG2 4.06Å; I21-V143 HydrophobicContact CG2-CG1 4.11Å; I21-S172 WeakPolarHBondContact CD1-OG 3.35Å; I21-A228 HydrophobicContact CD1-CB 3.98Å
22F96.3Very high91.8Very high82 Ų8240.9 Ų40.936%0.3623%0.234SC..Hα-helixtrans-67.1-39.3176-64.5-38.8000113A18 A19 F25 G26 V140 V143 T144A18-F22 HydrophobicContact CB-CE2 4.04Å; A18-F22 WeakPolarHBondContact O-CD2 3.42Å; A18-F22 VanDerWaalsContact O-CG 3.28Å; A18-F22 WeakPolarHBondContact O-CG 3.22Å; A18-F22 PolarHBondContact O-N 3.07Å; A19-F22 PolarHBondContact O-N 3.42Å; F22-F25 PolarHBondContact O-N 3.29Å; F22-G26 WeakPolarHBondContact O-CA 3.35Å; F22-G26 PolarHBondContact O-N 2.87Å; F22-V140 HydrophobicContact CD1-CG1 4.23Å; F22-V140 HydrophobicContact CE1-CG1 3.98Å; F22-V143 HydrophobicContact CE1-CG1 3.8Å; F22-V143 HydrophobicContact CZ-CG1 3.89Å; F22-T144 HydrophobicContact CE1-CG2 3.52Å; F22-T144 HydrophobicContact CZ-CG2 3.37Å
23L94.9Very high90.6Very high76 Ų7637.6 Ų37.640%0.39821%0.214SC..Hα-helixtrans-62.7-46.4174.5-75.7169.1000110.2A19 F20 F25 G26 T27 F220A19-L23 WeakPolarHBondContact O-CB 3.23Å; A19-L23 VanDerWaalsContact O-CG 3.27Å; A19-L23 WeakPolarHBondContact O-CG 3.41Å; A19-L23 PolarHBondContact O-N 3.43Å; F20-L23 HydrophobicContact CD1-CD1 4.29Å; F20-L23 PolarHBondContact O-N 3.3Å; L23-F25 VanDerWaalsContact C-N 3.33Å; L23-F25 PolarHBondContact O-N 3.42Å; L23-G26 PolarHBondContact O-N 3.13Å; L23-T27 HydrophobicContact CD2-CG2 4.38Å; L23-T27 VanDerWaalsContact O-CB 3.27Å; L23-T27 WeakPolarHBondContact O-CB 3.44Å; L23-T27 VanDerWaalsContact O-CG2 3.27Å; L23-T27 WeakPolarHBondContact O-CG2 3.39Å; L23-T27 PolarHBondContact O-N 2.92Å; L23-T27 PolarHBondContact O-OG1 3.35Å; L23-F220 HydrophobicContact CB-CD2 3.94Å; L23-F220 HydrophobicContact CB-CE2 4.35Å; L23-F220 HydrophobicContact CB-CG 4.47Å
24S93.3Very high89.2Confident0 Ų036.1 Ų36.10%021%0.21CC..Hα-helixtrans-57.9-44.8177.2-178.40000112.3F20 I21 W30 M176 S217 A221F20-S24 WeakPolarHBondContact O-CB 3.28Å; F20-S24 PolarHBondContact O-N 2.91Å; I21-S24 PolarHBondContact O-N 3.31Å; S24-W30 PolarHBondContact O-NE1 3.19Å; S24-W30 WeakPolarHBondContact OG-CZ2 3.26Å; S24-M176 WeakPolarHBondContact OG-CE 3.34Å; S24-S217 WeakPolarHBondContact CB-O 2.9Å; S24-S217 WeakPolarHBondContact O-CB 3.47Å; S24-S217 PolarHBondContact OG-O 2.95Å; S24-A221 WeakPolarHBondContact OG-CB 3.33Å
25F92.2Very high87.8Confident42 Ų4237.5 Ų37.518%0.18422%0.215CC..Hα-helixtrans-70.4-48177.5173.6-110.3000113.2I21 F22 L23 F71 F72 M136 L137 V140I21-F25 WeakPolarHBondContact O-CB 3.45Å; I21-F25 PolarHBondContact O-N 2.91Å; F22-F25 PolarHBondContact O-N 3.29Å; L23-F25 VanDerWaalsContact C-N 3.33Å; L23-F25 PolarHBondContact O-N 3.42Å; F25-F71 HydrophobicContact CE2-CD1 4.47Å; F25-F71 HydrophobicContact CE2-CE1 4.17Å; F25-F71 HydrophobicContact CE2-CZ 4.25Å; F25-F72 HydrophobicContact CD2-CE2 4.25Å; F25-F72 HydrophobicContact CD2-CZ 4.4Å; F25-F72 HydrophobicContact CE1-CE2 4.37Å; F25-F72 HydrophobicContact CE1-CZ 4.15Å; F25-F72 AromaticContact CE2-CE2 3.81Å; F25-F72 HydrophobicContact CE2-CE2 3.81Å; F25-F72 AromaticContact CE2-CZ 3.53Å; F25-F72 HydrophobicContact CE2-CZ 3.53Å; F25-F72 AromaticContact CZ-CE2 3.92Å; F25-F72 HydrophobicContact CZ-CE2 3.92Å; F25-F72 AromaticContact CZ-CZ 3.41Å; F25-F72 HydrophobicContact CZ-CZ 3.41Å; F25-F72 VanDerWaalsContact CZ-CZ 3.41Å; F25-M136 HydrophobicContact CB-SD 4.38Å; F25-M136 HydrophobicContact CD2-CG 4.14Å; F25-M136 HydrophobicContact CD2-SD 3.74Å; F25-L137 HydrophobicContact CE2-CD2 3.67Å; F25-L137 HydrophobicContact CZ-CD2 3.87Å; F25-V140 HydrophobicContact CB-CG2 3.89Å; F25-V140 HydrophobicContact CD1-CG1 4.35Å; F25-V140 HydrophobicContact CD1-CG2 4.17Å; F25-V140 HydrophobicContact CD2-CG2 4.02Å; F25-V140 HydrophobicContact CE1-CG1 4.39Å; F25-V140 HydrophobicContact CG-CG2 3.77Å
26G87.8Confident86.4Confident54 Ų5436.9 Ų36.956%0.55721%0.205SC*.Hα-helixtrans-84.1-29.1-168.400000114.6F22 L23 D28F22-G26 WeakPolarHBondContact O-CA 3.35Å; F22-G26 PolarHBondContact O-N 2.87Å; L23-G26 PolarHBondContact O-N 3.13Å; G26-D28 VanDerWaalsContact C-N 3.27Å
27T84.9Confident84.6Confident46 Ų4636.4 Ų36.428%0.28221%0.207SC..Hα-helixtrans-71.5-30.2175.457.30000110.5L23 Y29 S217L23-T27 HydrophobicContact CD2-CG2 4.38Å; L23-T27 VanDerWaalsContact O-CB 3.27Å; L23-T27 WeakPolarHBondContact O-CB 3.44Å; L23-T27 VanDerWaalsContact O-CG2 3.27Å; L23-T27 WeakPolarHBondContact O-CG2 3.39Å; L23-T27 PolarHBondContact O-N 2.92Å; L23-T27 PolarHBondContact O-OG1 3.35Å; T27-Y29 VanDerWaalsContact C-CD2 3.48Å; T27-Y29 WeakPolarHBondContact O-CD2 3.31Å; T27-Y29 WeakPolarHBondContact O-CE2 3.43Å; T27-Y29 PolarHBondContact O-N 3.07Å; T27-S217 PolarHBondContact OG1-OG 2.86Å
28D78.4Confident82.7Confident10 Ų1040.2 Ų40.25%0.05323%0.227CC..  trans67.215.3175.4-153.537.7000114.1G26 W30 H68 G70 F71 F72 W73G26-D28 VanDerWaalsContact C-N 3.27Å; D28-W30 PolarHBondContact O-N 3.24Å; D28-H68 PolarHBondContact O-NE2 3.44Å; D28-G70 WeakPolarHBondContact O-CA 3.38Å; D28-G70 WeakPolarHBondContact OD1-CA 3.39Å; D28-F71 WeakPolarHBondContact OD1-CA 3.19Å; D28-F71 WeakPolarHBondContact OD1-CB 3.48Å; D28-F71 PolarHBondContact OD1-N 3.01Å; D28-F72 HydrophobicContact CB-CD2 4.39Å; D28-F72 VanDerWaalsContact CG-N 3.27Å; D28-F72 PolarHBondContact OD1-N 3.43Å; D28-F72 WeakPolarHBondContact OD2-CA 3.3Å; D28-F72 WeakPolarHBondContact OD2-CB 3.47Å; D28-F72 PolarHBondContact OD2-N 2.94Å; D28-W73 PolarHBondContact OD2-N 3.41Å
29Y81.5Confident80.5Confident132 Ų13244.5 Ų44.552%0.51825%0.254SS..  trans-100.174.8-178.3-61.1-97.8000113.5T27 H68 S215 S217T27-Y29 VanDerWaalsContact C-CD2 3.48Å; T27-Y29 WeakPolarHBondContact O-CD2 3.31Å; T27-Y29 WeakPolarHBondContact O-CE2 3.43Å; T27-Y29 PolarHBondContact O-N 3.07Å; Y29-H68 WeakPolarHBondContact CA-CE1 3.26Å; Y29-H68 WeakPolarHBondContact CA-NE2 3.08Å; Y29-H68 VanDerWaalsContact CB-CE1 3.42Å; Y29-H68 WeakPolarHBondContact CB-CE1 3.06Å; Y29-H68 AromaticContact CD1-CD2 3.43Å; Y29-H68 VanDerWaalsContact CD1-CD2 3.43Å; Y29-H68 WeakPolarHBondContact CD1-CD2 3.47Å; Y29-H68 AromaticContact CD1-CE1 3.12Å; Y29-H68 WeakPolarHBondContact CD1-CE1 3.22Å; Y29-H68 AromaticContact CD1-CG 3.79Å; Y29-H68 AromaticContact CD1-ND1 3.58Å; Y29-H68 AromaticContact CD1-NE2 2.96Å; Y29-H68 WeakPolarHBondContact CD1-NE2 3.19Å; Y29-H68 AromaticContact CE1-CD2 3.61Å; Y29-H68 AromaticContact CE1-NE2 3.62Å; Y29-H68 AromaticContact CG-CE1 3.58Å; Y29-H68 AromaticContact CG-NE2 3.37Å; Y29-S215 CarbonylContact O-C 3.51Å; Y29-S215 WeakPolarHBondContact O-CB 3.12Å; Y29-S217 VanDerWaalsContact C-CB 3.4Å; Y29-S217 WeakPolarHBondContact CA-OG 3.49Å; Y29-S217 WeakPolarHBondContact CB-OG 2.77Å; Y29-S217 PolarHBondContact N-OG 3.43Å; Y29-S217 WeakPolarHBondContact O-CB 3.34Å; Y29-S217 PolarHBondContact O-N 3.34Å; Y29-S217 PolarHBondContact O-OG 2.91Å
30W85.3Confident78Confident0 Ų050.9 Ų50.90%028%0.276CS..  trans-90.1-39.6-175.8-79.173.4000113.7S24 D28 Y69 W132 M136 M176 V180 S215 F218 A221S24-W30 PolarHBondContact O-NE1 3.19Å; S24-W30 WeakPolarHBondContact OG-CZ2 3.26Å; D28-W30 PolarHBondContact O-N 3.24Å; W30-Y69 PolarHBondContact N-O 3.01Å; W30-W132 HydrophobicContact CD2-CH2 4.16Å; W30-W132 AromaticContact CD2-CZ3 3.78Å; W30-W132 HydrophobicContact CD2-CZ3 3.78Å; W30-W132 HydrophobicContact CE3-CH2 4.46Å; W30-W132 AromaticContact CE3-CZ3 3.78Å; W30-W132 HydrophobicContact CE3-CZ3 3.78Å; W30-W132 HydrophobicContact CG-CH2 4.16Å; W30-W132 HydrophobicContact CG-CZ3 4.27Å; W30-W132 HydrophobicContact CH2-CZ3 4.36Å; W30-W132 HydrophobicContact CZ2-CZ3 4.36Å; W30-W132 HydrophobicContact CZ3-CZ3 4.09Å; W30-M136 HydrophobicContact CD2-CE 4.3Å; W30-M136 VanDerWaalsContact CE2-CE 3.48Å; W30-M136 HydrophobicContact CH2-CE 3.59Å; W30-M136 HydrophobicContact CZ2-CE 3.07Å; W30-M136 HydrophobicContact CZ2-SD 4.05Å; W30-M136 HydrophobicContact CZ3-CE 4.37Å; W30-M176 HydrophobicContact CH2-CE 3.75Å; W30-M176 HydrophobicContact CZ2-CE 3.67Å; W30-V180 HydrophobicContact CH2-CG2 4.08Å; W30-V180 HydrophobicContact CZ3-CG2 4.07Å; W30-S215 PolarHBondContact O-N 3.02Å; W30-F218 HydrophobicContact CE3-CB 4.19Å; W30-F218 AromaticContact CE3-CD2 3.73Å; W30-F218 HydrophobicContact CE3-CD2 3.73Å; W30-F218 HydrophobicContact CE3-CG 4.45Å; W30-F218 AromaticContact CZ3-CD2 3.73Å; W30-F218 HydrophobicContact CZ3-CD2 3.73Å; W30-F218 HydrophobicContact CZ3-CE2 4.44Å; W30-A221 HydrophobicContact CH2-CB 3.49Å; W30-A221 VanDerWaalsContact CH2-CB 3.49Å; W30-A221 HydrophobicContact CZ2-CB 4.04Å; W30-A221 HydrophobicContact CZ3-CB 4.22Å
31L80.4Confident75.4Confident6 Ų652.8 Ų52.83%0.03129%0.288CS..EExtended strand (participates in β ladder)trans-139.6140.5-175.1-169.682.7000110.8H68 Y69 L187 L212 Y214L31-H68 PolarHBondContact O-CE1 3.47Å; L31-H68 VanDerWaalsContact O-CE1 3.26Å; L31-H68 PolarHBondContact O-ND1 3.35Å; L31-H68 VanDerWaalsContact O-ND1 3.14Å; L31-Y69 HydrophobicContact CB-CD1 4.47Å; L31-Y69 PolarHBondContact N-O 3.38Å; L31-Y69 PolarHBondContact O-N 3.04Å; L31-L187 HydrophobicContact CD1-CD1 3.65Å; L31-L187 HydrophobicContact CD2-CD1 4.16Å; L31-L187 HydrophobicContact CD2-CD2 4.02Å; L31-L187 HydrophobicContact CG-CD1 4.5Å; L31-L212 HydrophobicContact CD1-CD2 3.89Å; L31-L212 HydrophobicContact CD2-CD2 3.5Å; L31-L212 VanDerWaalsContact CD2-CD2 3.5Å; L31-L212 HydrophobicContact CG-CD2 3.8Å; L31-Y214 HydrophobicContact CD1-CD1 4.25Å; L31-Y214 HydrophobicContact CD1-CE1 4.38Å
32L80Confident72.8Confident50 Ų5061.8 Ų61.826%0.26233%0.327SS..EExtended strand (participates in β ladder)trans-119.9124.8172.3-176.172.2000107.3L67 L212 S213 S215L32-L67 CarbonylContact C-O 3.49Å; L32-L212 CarbonylContact O-C 3.56Å; L32-S213 PolarHBondContact N-O 2.58Å; L32-S213 PolarHBondContact O-N 2.99Å; L32-S215 WeakPolarHBondContact CB-OG 3.43Å; L32-S215 PolarHBondContact N-OG 2.85Å
33A71.4Confident70.2Confident3 Ų364.9 Ų64.93%0.02535%0.347CS..EExtended strand (participates in β ladder)trans-115.5141.1170.100000108.8S66 L67 N211 L212A33-S66 CarbonylContact O-C 3.52Å; A33-L67 HydrophobicContact CB-CB 4.1Å; A33-L67 HydrophobicContact CB-CD2 4.3Å; A33-L67 HydrophobicContact CB-CG 4.45Å; A33-L67 PolarHBondContact N-O 3.26Å; A33-L67 PolarHBondContact O-N 2.86Å; A33-N211 CarbonylContact C-O 3.58Å; A33-N211 VanDerWaalsContact CA-O 3.24Å; A33-N211 WeakPolarHBondContact CA-O 3.35Å; A33-L212 HydrophobicContact CB-CD2 4.04Å; A33-L212 HydrophobicContact CB-CG 4.35Å
34S68.6Low67.7Low21 Ų2163.7 Ų63.715%0.14735%0.346CS..EExtended strand (participates in β ladder)trans-122.5128170.161.50000108.9N211S34-N211 PolarHBondContact N-O 2.9Å; S34-N211 PolarHBondContact O-N 3.49Å
35Q66.8Low65.1Low32 Ų3272.6 Ų72.615%0.1538%0.384CS..EExtended strand (participates in β ladder)trans-108.8133.8-179.3-61.4177.919.200109.5V65 F208 T209 L210Q35-V65 PolarHBondContact N-O 2.93Å; Q35-V65 PolarHBondContact O-N 3.42Å; Q35-V65 VanDerWaalsContact O-N 3.12Å; Q35-F208 HydrophobicContact CB-CE2 4.01Å; Q35-F208 HydrophobicContact CB-CZ 4.19Å; Q35-F208 HydrophobicContact CG-CE2 4.14Å; Q35-F208 HydrophobicContact CG-CZ 3.82Å; Q35-T209 WeakPolarHBondContact CA-O 3.24Å; Q35-L210 HydrophobicContact CG-CD1 4.11Å; Q35-L210 HydrophobicContact CG-CG 4.22Å
36T67.2Low62.7Low50 Ų5077.2 Ų77.231%0.30741%0.411SS..EExtended strand (participates in β ladder)trans-128.3134173.4390000109.8I64 T209T36-I64 HydrophobicContact CG2-CB 4.31Å; T36-I64 HydrophobicContact CG2-CG1 3.68Å; T36-I64 HydrophobicContact CG2-CG2 4.37Å; T36-T209 PolarHBondContact N-O 3.18Å; T36-T209 PolarHBondContact O-N 3.46Å; T36-T209 PolarHBondContact O-OG1 3Å; T36-T209 PolarHBondContact OG1-OG1 3.3Å
37C61.5Low60.3Low54 Ų5478.7 Ų78.737%0.36541%0.413SS..EExtended strand (participates in β ladder)trans-133.9109.3174.1169.60000106.3C205C37-C205 HydrophobicContact CB-CB 4.01Å; C37-C205 WeakPolarHBondContact CB-SG 3.12Å; C37-C205 WeakPolarHBondContact SG-CB 3.39Å; C37-C205 CovalentContact SG-SG 2.03Å; C37-C205 PolarHBondContact SG-SG 3.42Å
38D57.5Low58.1Low80 Ų8079.7 Ų79.743%0.42842%0.416SS..  trans-110.3105.2174.1-171.3-0.4000108.4E40 N41D38-E40 PolarHBondContact O-N 2.86Å; D38-E40 VanDerWaalsContact O-N 3.15Å; D38-E40 PolarHBondContact OD1-N 3.36Å; D38-N41 HydrophobicContact CB-CB 4.49Å
39P50.2Low56.1Low106 Ų10682.8 Ų82.869%0.68844%0.435SS*.THydrogen-bonded Turntrans-69.8-5.5-175.127.6-33.6000114.3
40E45.9Very low54.2Low179 Ų17980.1 Ų80.184%0.83643%0.429SS*.THydrogen-bonded Turntrans-103.5-5.9-177.2-73.4-168.8152.800115D38D38-E40 PolarHBondContact O-N 2.86Å; D38-E40 VanDerWaalsContact O-N 3.15Å; D38-E40 PolarHBondContact OD1-N 3.36Å
41N43.3Very low51.8Low85 Ų8582.5 Ų82.546%0.45544%0.444SS..  trans-111.983.1-169.4-159.71.8000113.6D38 D43D38-N41 HydrophobicContact CB-CB 4.49Å; N41-D43 PolarHBondContact O-N 2.97Å
42K40.6Very low49.6Very low190 Ų19087.2 Ų87.283%0.82647%0.468SS*.THydrogen-bonded Turntrans-67.74.1-177.3-66-174.8177.6179.60116.3
43D42.7Very low47.6Very low147 Ų14786.7 Ų86.779%0.78647%0.471SS*.THydrogen-bonded Turntrans-119.730.1-172.4-82.3-32.7000113.3N41 K45N41-D43 PolarHBondContact O-N 2.97Å; D43-K45 PolarHBondContact O-N 2.9Å
44S41.3Very low45.6Very low51 Ų5193 Ų9336%0.35751%0.509SS..  trans-82.6110.3174.996.60000111.4
45K38.8Very low43.7Very low187 Ų18798.5 Ų98.581%0.81354%0.537SS*.  trans-71.8139.7172.6-78-178.7178.4176.10110.8D43 S47D43-K45 PolarHBondContact O-N 2.9Å; K45-S47 PolarHBondContact O-N 3.44Å; K45-S47 VanDerWaalsContact O-N 3.15Å
46D42Very low42.3Very low139 Ų139100.8 Ų100.874%0.74355%0.553SS**  trans-43.6109.1173.7-151.527.4000112.1
47S37.3Very low40.5Very low85 Ų85102 Ų10259%0.59457%0.568SS**  trans-152.292.4169.654.50000111.4K45 T49K45-S47 PolarHBondContact O-N 3.44Å; K45-S47 VanDerWaalsContact O-N 3.15Å; S47-T49 PolarHBondContact O-N 3.04Å
48L39.3Very low39.1Very low66 Ų66106.9 Ų106.935%0.34659%0.585SS.*  trans-71.799.3155.1177.473.4000107.1I50 V193 I197 L212L48-I50 HydrophobicContact CD1-CG1 4.49Å; L48-I50 HydrophobicContact CD2-CD1 4.26Å; L48-I50 HydrophobicContact CD2-CG1 4.37Å; L48-I50 HydrophobicContact CG-CG1 4.23Å; L48-V193 HydrophobicContact CD1-CG1 4.11Å; L48-I197 HydrophobicContact CD1-CD1 4.2Å; L48-L212 HydrophobicContact CD1-CD1 4.3Å
49T36.7Very low37.8Very low75 Ų75109.3 Ų109.346%0.4660%0.598SS.*  trans-95.2122.9167.26.10000108.4S47 N211S47-T49 PolarHBondContact O-N 3.04Å; T49-N211 PolarHBondContact O-OD1 3.44Å
50I40.9Very low37.1Very low77 Ų77112.5 Ų112.540%0.39560%0.604SS.*EExtended strand (participates in β ladder)trans-103.2107168.9-59.4177.5000106.3L48 L212 Y214L48-I50 HydrophobicContact CD1-CG1 4.49Å; L48-I50 HydrophobicContact CD2-CD1 4.26Å; L48-I50 HydrophobicContact CD2-CG1 4.37Å; L48-I50 HydrophobicContact CG-CG1 4.23Å; I50-L212 WeakPolarHBondContact CA-O 3.26Å; I50-L212 HydrophobicContact CG1-CB 4.34Å; I50-Y214 HydrophobicContact CG2-CE2 4.14Å
51T35.5Very low36.6Very low49 Ų49109.8 Ų109.830%0.30160%0.604SS.*EExtended strand (participates in β ladder)trans-112.1152.2-177.150.10000111.2L212 S213T51-L212 PolarHBondContact N-O 3.17Å; T51-S213 WeakPolarHBondContact O-CA 3.48Å; T51-S213 WeakPolarHBondContact O-CB 3.43Å; T51-S213 PolarHBondContact O-OG 2.77Å; T51-S213 PolarHBondContact OG1-OG 3.5Å; T51-S213 VanDerWaalsContact OG1-OG 3.08Å
52L34Very low36.5Very low106 Ų106108 Ų10856%0.55561%0.606SS**EExtended strand (participates in β ladder)trans-66.9136.4165-100138.2000108.4V54 V219L52-V54 PolarHBondContact O-N 3Å; L52-V219 HydrophobicContact CD2-CG2 4.18Å
53A38Very low37.2Very low39 Ų39105.1 Ų105.132%0.32259%0.593SS.*THydrogen-bonded Turntrans-64.315.1-171.100000115.8D55 Y214A53-D55 VanDerWaalsContact C-N 3.28Å; A53-Y214 WeakPolarHBondContact CB-O 2.96Å; A53-Y214 PolarHBondContact N-O 3.34Å
54V29.9Very low38Very low134 Ų134101.4 Ų101.481%0.81257%0.573SS**THydrogen-bonded Turntrans-76.9-14.5177.6179.70000111.7L52L52-V54 PolarHBondContact O-N 3Å
55D27.7Very low39Very low137 Ų137100.4 Ų100.473%0.73357%0.565SS**  trans-134.649.5-167.7-149.712000115.1A53 A57A53-D55 VanDerWaalsContact C-N 3.28Å; D55-A57 PolarHBondContact O-N 3.39Å
56V37.6Very low40.5Very low80 Ų8093.6 Ų93.649%0.48554%0.541SS..  trans-9594.1169.2-175.30000109.3H58V56-H58 PolarHBondContact O-N 3.38Å
57A30Very low41.9Very low76 Ų7687.4 Ų87.463%0.62851%0.507SS*.  trans-60.9128.8171.400000111.2D55 N59D55-A57 PolarHBondContact O-N 3.39Å; A57-N59 PolarHBondContact O-N 3.31Å
58H32.8Very low43.8Very low156 Ų15684.4 Ų84.472%0.72248%0.484SS*.  trans-75.981.3-179.2-172.6-60000111V56V56-H58 PolarHBondContact O-N 3.38Å
59N30.3Very low45.5Very low132 Ų13281.7 Ų81.771%0.70647%0.469SS*.  trans-94.3121.6172.9-95.5-15000112.2A57 S61A57-N59 PolarHBondContact O-N 3.31Å; N59-S61 PolarHBondContact O-N 2.91Å
60Q35.5Very low47.4Very low173 Ų17378.1 Ų78.181%0.80845%0.447SS*.THydrogen-bonded Turntrans-84.821.8-165.3-77.1-176.9-18.900116.2
61S33.7Very low49Very low121 Ų12175.1 Ų75.185%0.84643%0.431SS*.THydrogen-bonded Turntrans-117.75.6-167-156.30000117.5N59N59-S61 PolarHBondContact O-N 2.91Å
62G41.8Very low51Low47 Ų4776.1 Ų76.149%0.48543%0.432SS..SBendtrans-132.6159.7177.700000112.9I64G62-I64 PolarHBondContact O-N 3.36Å
63K54.5Low53.1Low130 Ų13077.5 Ų77.557%0.56543%0.43SS*.  trans-73.969.4174-142.5-178.1-156.6-171.20109V65 P80K63-V65 PolarHBondContact O-N 2.95Å; K63-P80 HydrophobicContact CD-CG 4.09Å; K63-P80 VanDerWaalsContact NZ-CG 3.33Å
64I59.8Low54.9Low70 Ų7076.2 Ų76.236%0.35942%0.417SS..  trans-71.7120.7-176-55.3170.5000109.1T36 G62T36-I64 HydrophobicContact CG2-CB 4.31Å; T36-I64 HydrophobicContact CG2-CG1 3.68Å; T36-I64 HydrophobicContact CG2-CG2 4.37Å; G62-I64 PolarHBondContact O-N 3.36Å
65V64Low57.1Low30 Ų3071.1 Ų71.118%0.18239%0.387CS..EExtended strand (participates in β ladder)trans-104.1116168.4-178.90000108Q35 K63 Y76 I79Q35-V65 PolarHBondContact N-O 2.93Å; Q35-V65 PolarHBondContact O-N 3.42Å; Q35-V65 VanDerWaalsContact O-N 3.12Å; K63-V65 PolarHBondContact O-N 2.95Å; V65-Y76 HydrophobicContact CG1-CD1 4.41Å; V65-I79 HydrophobicContact CG1-CG1 4.18Å
66S68.3Low59.3Low44 Ų4466.3 Ų66.331%0.30836%0.359SS..EExtended strand (participates in β ladder)trans-91.5122.2174.9-58.40000109.4A33 Y76 S77A33-S66 CarbonylContact O-C 3.52Å; S66-Y76 CarbonylContact O-C 3.59Å; S66-S77 PolarHBondContact N-O 3.27Å; S66-S77 PolarHBondContact O-N 3.42Å
67L72.4Confident60.8Low8 Ų864.1 Ų64.14%0.04235%0.347CS..EExtended strand (participates in β ladder)trans-102.4128.8174.8172.362.1000109.1L32 A33 I74 Y76L32-L67 CarbonylContact C-O 3.49Å; A33-L67 HydrophobicContact CB-CB 4.1Å; A33-L67 HydrophobicContact CB-CD2 4.3Å; A33-L67 HydrophobicContact CB-CG 4.45Å; A33-L67 PolarHBondContact N-O 3.26Å; A33-L67 PolarHBondContact O-N 2.86Å; L67-I74 HydrophobicContact CD1-CG2 3.38Å; L67-Y76 HydrophobicContact CD1-CD1 3.8Å; L67-Y76 HydrophobicContact CD1-CD2 4.39Å; L67-Y76 HydrophobicContact CD1-CE1 3.49Å; L67-Y76 VanDerWaalsContact CD1-CE1 3.49Å; L67-Y76 HydrophobicContact CD1-CE2 4.1Å; L67-Y76 HydrophobicContact CD1-CG 4.22Å; L67-Y76 HydrophobicContact CG-CE1 4.42Å
68H76.9Confident62.1Low23 Ų2361.6 Ų61.611%0.10633%0.328CS..EExtended strand (participates in β ladder)trans-113.6127.4175.2-173.157.5000109.5D28 Y29 L31 I74 C75D28-H68 PolarHBondContact O-NE2 3.44Å; Y29-H68 WeakPolarHBondContact CA-CE1 3.26Å; Y29-H68 WeakPolarHBondContact CA-NE2 3.08Å; Y29-H68 VanDerWaalsContact CB-CE1 3.42Å; Y29-H68 WeakPolarHBondContact CB-CE1 3.06Å; Y29-H68 AromaticContact CD1-CD2 3.43Å; Y29-H68 VanDerWaalsContact CD1-CD2 3.43Å; Y29-H68 WeakPolarHBondContact CD1-CD2 3.47Å; Y29-H68 AromaticContact CD1-CE1 3.12Å; Y29-H68 WeakPolarHBondContact CD1-CE1 3.22Å; Y29-H68 AromaticContact CD1-CG 3.79Å; Y29-H68 AromaticContact CD1-ND1 3.58Å; Y29-H68 AromaticContact CD1-NE2 2.96Å; Y29-H68 WeakPolarHBondContact CD1-NE2 3.19Å; Y29-H68 AromaticContact CE1-CD2 3.61Å; Y29-H68 AromaticContact CE1-NE2 3.62Å; Y29-H68 AromaticContact CG-CE1 3.58Å; Y29-H68 AromaticContact CG-NE2 3.37Å; L31-H68 PolarHBondContact O-CE1 3.47Å; L31-H68 VanDerWaalsContact O-CE1 3.26Å; L31-H68 PolarHBondContact O-ND1 3.35Å; L31-H68 VanDerWaalsContact O-ND1 3.14Å; H68-I74 CarbonylContact O-C 3.5Å; H68-I74 WeakPolarHBondContact O-CA 3.46Å; H68-C75 HydrophobicContact CB-CB 4.26Å; H68-C75 PolarHBondContact N-O 3.07Å; H68-C75 PolarHBondContact O-N 3Å
69Y75.9Confident63.2Low8 Ų856.5 Ų56.53%0.03131%0.306CS..EExtended strand (participates in β ladder)trans-121.1119.8-176.2-177.8-80000110.7W30 L31 I74 P109 W132 R133 W186W30-Y69 PolarHBondContact N-O 3.01Å; L31-Y69 HydrophobicContact CB-CD1 4.47Å; L31-Y69 PolarHBondContact N-O 3.38Å; L31-Y69 PolarHBondContact O-N 3.04Å; Y69-I74 HydrophobicContact CD2-CD1 3.71Å; Y69-I74 HydrophobicContact CD2-CG1 3.61Å; Y69-I74 HydrophobicContact CE2-CD1 3.61Å; Y69-I74 HydrophobicContact CE2-CG1 3.89Å; Y69-I74 HydrophobicContact CG-CG1 4.47Å; Y69-P109 WeakPolarHBondContact CE2-O 3.25Å; Y69-W132 HydrophobicContact CE1-CZ2 4.3Å; Y69-R133 PolarHBondContact OH-NH2 2.86Å; Y69-W186 HydrophobicContact CE1-CH2 4.05Å; Y69-W186 AromaticContact CE1-CZ3 3.97Å; Y69-W186 HydrophobicContact CE1-CZ3 3.97Å; Y69-W186 HydrophobicContact CE2-CH2 4.25Å; Y69-W186 AromaticContact CZ-CH2 3.69Å; Y69-W186 WeakPolarHBondContact OH-CH2 3.35Å
70G76.1Confident63.8Low0 Ų051.8 Ų51.80%028%0.283CS..  trans-115.1178.3175.400000114D28 W73D28-G70 WeakPolarHBondContact O-CA 3.38Å; D28-G70 WeakPolarHBondContact OD1-CA 3.39Å; G70-W73 WeakPolarHBondContact CA-O 3.39Å; G70-W73 PolarHBondContact N-O 3.5Å
71F75Confident64.1Low14 Ų1448.1 Ų48.16%0.06127%0.268CS..SBendtrans-61.7-47.8164.3-178.8-77.9000112.5F25 D28 W132 R133 M136 L137F25-F71 HydrophobicContact CE2-CD1 4.47Å; F25-F71 HydrophobicContact CE2-CE1 4.17Å; F25-F71 HydrophobicContact CE2-CZ 4.25Å; D28-F71 WeakPolarHBondContact OD1-CA 3.19Å; D28-F71 WeakPolarHBondContact OD1-CB 3.48Å; D28-F71 PolarHBondContact OD1-N 3.01Å; F71-W132 HydrophobicContact CB-CH2 4.22Å; F71-W132 HydrophobicContact CD2-CH2 4.36Å; F71-R133 HydrophobicContact CD2-CB 3.91Å; F71-R133 HydrophobicContact CD2-CG 3.66Å; F71-R133 HydrophobicContact CE2-CB 3.3Å; F71-R133 HydrophobicContact CE2-CG 3.61Å; F71-R133 WeakPolarHBondContact CE2-O 3.48Å; F71-R133 HydrophobicContact CG-CG 4.42Å; F71-R133 HydrophobicContact CZ-CB 3.8Å; F71-R133 HydrophobicContact CZ-CG 4.25Å; F71-R133 PolarHBondContact O-NE 3.09Å; F71-M136 HydrophobicContact CD2-CB 4.5Å; F71-M136 HydrophobicContact CD2-CE 4Å; F71-M136 HydrophobicContact CD2-SD 3.59Å; F71-M136 VanDerWaalsContact CD2-SD 3.59Å; F71-M136 HydrophobicContact CE2-CB 4.11Å; F71-M136 HydrophobicContact CE2-CG 4.49Å; F71-M136 HydrophobicContact CE2-SD 4Å; F71-M136 HydrophobicContact CG-SD 4.32Å; F71-L137 HydrophobicContact CE2-CG 4.44Å; F71-L137 HydrophobicContact CZ-CD1 4.13Å; F71-L137 HydrophobicContact CZ-CD2 3.95Å; F71-L137 HydrophobicContact CZ-CG 3.82Å
72F77.9Confident64.4Low71 Ų7147.2 Ų47.231%0.31125%0.254SS..SBendtrans-96.7-39.4-175.9-62-78.9000113F25 D28 P104 G105F25-F72 HydrophobicContact CD2-CE2 4.25Å; F25-F72 HydrophobicContact CD2-CZ 4.4Å; F25-F72 HydrophobicContact CE1-CE2 4.37Å; F25-F72 HydrophobicContact CE1-CZ 4.15Å; F25-F72 AromaticContact CE2-CE2 3.81Å; F25-F72 HydrophobicContact CE2-CE2 3.81Å; F25-F72 AromaticContact CE2-CZ 3.53Å; F25-F72 HydrophobicContact CE2-CZ 3.53Å; F25-F72 AromaticContact CZ-CE2 3.92Å; F25-F72 HydrophobicContact CZ-CE2 3.92Å; F25-F72 AromaticContact CZ-CZ 3.41Å; F25-F72 HydrophobicContact CZ-CZ 3.41Å; F25-F72 VanDerWaalsContact CZ-CZ 3.41Å; D28-F72 HydrophobicContact CB-CD2 4.39Å; D28-F72 VanDerWaalsContact CG-N 3.27Å; D28-F72 PolarHBondContact OD1-N 3.43Å; D28-F72 WeakPolarHBondContact OD2-CA 3.3Å; D28-F72 WeakPolarHBondContact OD2-CB 3.47Å; D28-F72 PolarHBondContact OD2-N 2.94Å; F72-P104 CarbonylContact O-C 3.6Å; F72-P104 WeakPolarHBondContact O-CA 3.35Å; F72-G105 PolarHBondContact O-N 2.89Å
73W77.6Confident64.4Low135 Ų13553.1 Ų53.151%0.51127%0.266SS..EExtended strand (participates in β ladder)trans-127.8145.3-168.8-5896.2000112.4D28 G70 C102 Y103 P104D28-W73 PolarHBondContact OD2-N 3.41Å; G70-W73 WeakPolarHBondContact CA-O 3.39Å; G70-W73 PolarHBondContact N-O 3.5Å; W73-C102 HydrophobicContact CE3-CB 4.24Å; W73-Y103 WeakPolarHBondContact CA-O 3.27Å; W73-P104 HydrophobicContact CZ3-CG 4.39Å
74I76.2Confident63.7Low11 Ų1151.4 Ų51.46%0.05626%0.259CS..EExtended strand (participates in β ladder)trans-115.5119.9166.1-60.9172.6000106.5L67 H68 Y69 Y76 C102 Y103 S108L67-I74 HydrophobicContact CD1-CG2 3.38Å; H68-I74 CarbonylContact O-C 3.5Å; H68-I74 WeakPolarHBondContact O-CA 3.46Å; Y69-I74 HydrophobicContact CD2-CD1 3.71Å; Y69-I74 HydrophobicContact CD2-CG1 3.61Å; Y69-I74 HydrophobicContact CE2-CD1 3.61Å; Y69-I74 HydrophobicContact CE2-CG1 3.89Å; Y69-I74 HydrophobicContact CG-CG1 4.47Å; I74-Y76 HydrophobicContact CG2-CE2 3.96Å; I74-C102 CarbonylContact O-C 3.58Å; I74-C102 VanDerWaalsContact O-CA 3.25Å; I74-C102 WeakPolarHBondContact O-CA 3.45Å; I74-Y103 PolarHBondContact N-O 3.33Å; I74-Y103 PolarHBondContact O-N 3.4Å; I74-S108 WeakPolarHBondContact CD1-O 3.28Å
75C76.2Confident62.8Low28 Ų2851.8 Ų51.819%0.18926%0.261CS..EExtended strand (participates in β ladder)trans-120.7127.1-175.4-66.40000111.8H68 L101 C102H68-C75 HydrophobicContact CB-CB 4.26Å; H68-C75 PolarHBondContact N-O 3.07Å; H68-C75 PolarHBondContact O-N 3Å; C75-L101 CarbonylContact C-O 3.52Å; C75-L101 VanDerWaalsContact CA-O 3.31Å; C75-L101 WeakPolarHBondContact CA-O 3.39Å; C75-C102 HydrophobicContact CB-CB 4.17Å; C75-C102 WeakPolarHBondContact CB-SG 3.38Å; C75-C102 WeakPolarHBondContact SG-CB 3.41Å; C75-C102 CovalentContact SG-SG 2.04Å; C75-C102 PolarHBondContact SG-SG 3.45Å
76Y72.5Confident61.7Low36 Ų3658.3 Ų58.314%0.14130%0.295CS..EExtended strand (participates in β ladder)trans-97.7140.1173.3-60-95.9000110.1V65 S66 L67 I74 I79 K100 L101 Y103 P111V65-Y76 HydrophobicContact CG1-CD1 4.41Å; S66-Y76 CarbonylContact O-C 3.59Å; L67-Y76 HydrophobicContact CD1-CD1 3.8Å; L67-Y76 HydrophobicContact CD1-CD2 4.39Å; L67-Y76 HydrophobicContact CD1-CE1 3.49Å; L67-Y76 VanDerWaalsContact CD1-CE1 3.49Å; L67-Y76 HydrophobicContact CD1-CE2 4.1Å; L67-Y76 HydrophobicContact CD1-CG 4.22Å; L67-Y76 HydrophobicContact CG-CE1 4.42Å; I74-Y76 HydrophobicContact CG2-CE2 3.96Å; Y76-I79 HydrophobicContact CD1-CD1 4.44Å; Y76-I79 HydrophobicContact CG-CD1 4.04Å; Y76-K100 CarbonylContact O-C 3.57Å; Y76-K100 VanDerWaalsContact O-CA 3.27Å; Y76-K100 WeakPolarHBondContact O-CA 3.34Å; Y76-L101 PolarHBondContact N-O 2.99Å; Y76-L101 PolarHBondContact O-N 3.18Å; Y76-Y103 HydrophobicContact CD2-CD2 4.18Å; Y76-Y103 HydrophobicContact CD2-CE2 4.22Å; Y76-Y103 AromaticContact CE2-CD2 3.96Å; Y76-Y103 HydrophobicContact CE2-CD2 3.96Å; Y76-Y103 HydrophobicContact CE2-CE2 4.2Å; Y76-P111 HydrophobicContact CE1-CG 4.45Å; Y76-P111 WeakPolarHBondContact OH-CB 3.12Å; Y76-P111 WeakPolarHBondContact OH-CD 3.47Å; Y76-P111 WeakPolarHBondContact OH-CG 3.36Å
77S69.4Low60.3Low34 Ų3466 Ų6624%0.23832%0.319CS..EExtended strand (participates in β ladder)trans-133.6134.3174.4-163.30000109.8S66S66-S77 PolarHBondContact N-O 3.27Å; S66-S77 PolarHBondContact O-N 3.42Å
78G58.2Low58.6Low22 Ų2268.8 Ų68.823%0.22734%0.336CS..EExtended strand (participates in β ladder)trans98.110.9179.400000115.1P80G78-P80 WeakPolarHBondContact O-CD 3.17Å
79I54.2Low56.7Low49 Ų4971.4 Ų71.425%0.25137%0.37SS..EExtended strand (participates in β ladder)trans-68.7126.3175.3-56.8177.9000109.5V65 Y76V65-I79 HydrophobicContact CG1-CG1 4.18Å; Y76-I79 HydrophobicContact CD1-CD1 4.44Å; Y76-I79 HydrophobicContact CG-CD1 4.04Å
80P44Very low55Low34 Ų3474.5 Ų74.522%0.22140%0.397CS..  trans-73.6135.5174.135.4-40000110.4K63 G78 D82K63-P80 HydrophobicContact CD-CG 4.09Å; K63-P80 VanDerWaalsContact NZ-CG 3.33Å; G78-P80 WeakPolarHBondContact O-CD 3.17Å; P80-D82 WeakPolarHBondContact CB-OD1 3.39Å; P80-D82 WeakPolarHBondContact CG-OD1 3.2Å; P80-D82 PolarHBondContact O-N 2.97Å
81L40.8Very low53.2Low95 Ų9581 Ų8150%0.49743%0.43SS..THydrogen-bonded Turntrans-61.2-14.8-168.8-171.465.3000114.6L85L81-L85 HydrophobicContact CG-CD1 4.27Å
82D41.5Very low51.5Low103 Ų10385.5 Ų85.555%0.55146%0.464SS*.THydrogen-bonded Turntrans-73-31.6-173.861.1-53.9000114.3P80P80-D82 WeakPolarHBondContact CB-OD1 3.39Å; P80-D82 WeakPolarHBondContact CG-OD1 3.2Å; P80-D82 PolarHBondContact O-N 2.97Å
83K40.3Very low49.3Very low170 Ų17087.2 Ų87.274%0.73948%0.484SS*.THydrogen-bonded Turntrans-79.1-21.2175.9-83.1-173.3-179.1-175.50113.9
84F40.9Very low47.1Very low94 Ų9491.2 Ų91.241%0.41250%0.499SS..THydrogen-bonded Turntrans-82.3-32.2-177.1-176.4-103.1000112.7N86 Y87 T88F84-N86 PolarHBondContact O-N 2.85Å; F84-N86 VanDerWaalsContact O-N 3.12Å; F84-Y87 PolarHBondContact O-N 3.3Å; F84-T88 WeakPolarHBondContact CE1-OG1 3.32Å
85L40.7Very low44.9Very low78 Ų78100.2 Ų100.241%0.40854%0.538SS..THydrogen-bonded Turntrans-67.6-9.3-177.9-88.8159.3000115.1L81 Y87L81-L85 HydrophobicContact CG-CD1 4.27Å; L85-Y87 VanDerWaalsContact C-N 3.33Å
86N40.2Very low43Very low167 Ų167109.7 Ų109.789%0.89358%0.576SS**THydrogen-bonded Turntrans-81-10.3171.3-105.2-0.5000113.7F84F84-N86 PolarHBondContact O-N 2.85Å; F84-N86 VanDerWaalsContact O-N 3.12Å
87Y38.7Very low41.3Very low207 Ų207112.5 Ų112.581%0.81260%0.601SS**THydrogen-bonded Turntrans-105-25.1178.9-168-104.6000113.3F84 L85F84-Y87 PolarHBondContact O-N 3.3Å; L85-Y87 VanDerWaalsContact C-N 3.33Å
88T38.5Very low40.5Very low65 Ų65114.5 Ų114.540%0.39962%0.615SS.*SBendtrans-137.196.417943.10000110.2F84 A90F84-T88 WeakPolarHBondContact CE1-OG1 3.32Å; T88-A90 PolarHBondContact O-N 3.01Å
89G36.6Very low40.4Very low79 Ų79116.8 Ų116.881%0.81463%0.625SS**  trans-69.692173.800000111.1
90A39.5Very low41Very low72 Ų72122.7 Ų122.760%0.59565%0.648SS**  trans176154.1147.700000111.3T88T88-A90 PolarHBondContact O-N 3.01Å
91I39.4Very low42.2Very low136 Ų136123.5 Ų123.570%0.69765%0.651SS**  trans9674.7168-43.5163.4000114
92S37.5Very low43.8Very low110 Ų110121.8 Ų121.877%0.76965%0.646SS**  trans-62.9143.9149.854.30000110
93S32.2Very low45.3Very low106 Ų106122.7 Ų122.774%0.74164%0.642SS**  trans9752166.173.40000119.4
94W30.9Very low46.7Very low219 Ų219116.9 Ų116.983%0.8362%0.622SS**  trans-135.2134.2153.7-74.688.8000112.6
95K30.8Very low47.7Very low201 Ų201112.4 Ų112.487%0.87460%0.603SS**  trans-44.2141.6-179.7-86170.7171.1171.80113.1S97K95-S97 PolarHBondContact O-N 3.38Å
96K36.3Very low48.8Very low226 Ų226115.9 Ų115.998%0.98361%0.612SS**  trans-40.688.9165.5-170.5170.1-175.8175.50112.1
97S37.8Very low49.4Very low95 Ų95114.3 Ų114.366%0.66460%0.602SS**  trans-127.9126.8168.4-171.10000107.1K95 T99K95-S97 PolarHBondContact O-N 3.38Å; S97-T99 PolarHBondContact O-N 2.89Å
98S50.6Low50Low77 Ų77106.3 Ų106.354%0.53858%0.576SS.*  trans-54.2109.4175.247.70000109.5
99T57.9Low50.6Low70 Ų70104.8 Ų104.843%0.42957%0.568SS.*EExtended strand (participates in β ladder)trans-71.6138.8178.342.80000109.7S97S97-T99 PolarHBondContact O-N 2.89Å
100K65.3Low51.3Low172 Ų172102.1 Ų102.175%0.74853%0.534SS*.EExtended strand (participates in β ladder)trans-95.3125.7167.1-71.2-175.8179-179.30107.8Y76Y76-K100 CarbonylContact O-C 3.57Å; Y76-K100 VanDerWaalsContact O-CA 3.27Å; Y76-K100 WeakPolarHBondContact O-CA 3.34Å
101L69.5Low51.6Low52 Ų52101 Ų10127%0.27252%0.52SS..EExtended strand (participates in β ladder)trans-125.1122.9-178.3-170.464.8000109.2C75 Y76 Y103C75-L101 CarbonylContact C-O 3.52Å; C75-L101 VanDerWaalsContact CA-O 3.31Å; C75-L101 WeakPolarHBondContact CA-O 3.39Å; Y76-L101 PolarHBondContact N-O 2.99Å; Y76-L101 PolarHBondContact O-N 3.18Å; L101-Y103 HydrophobicContact CD2-CE2 3.66Å; L101-Y103 WeakPolarHBondContact CD2-OH 3.31Å; L101-Y103 HydrophobicContact CG-CE2 3.69Å
102C75.6Confident51.9Low59 Ų59101.4 Ų101.440%0.39952%0.52SS..EExtended strand (participates in β ladder)trans-119.7134.3-175.2-61.30000111W73 I74 C75W73-C102 HydrophobicContact CE3-CB 4.24Å; I74-C102 CarbonylContact O-C 3.58Å; I74-C102 VanDerWaalsContact O-CA 3.25Å; I74-C102 WeakPolarHBondContact O-CA 3.45Å; C75-C102 HydrophobicContact CB-CB 4.17Å; C75-C102 WeakPolarHBondContact CB-SG 3.38Å; C75-C102 WeakPolarHBondContact SG-CB 3.41Å; C75-C102 CovalentContact SG-SG 2.04Å; C75-C102 PolarHBondContact SG-SG 3.45Å
103Y71.8Confident51.9Low121 Ų12198.1 Ų98.148%0.47550%0.496SS..EExtended strand (participates in β ladder)trans-119.4152.7175.2-61.9-86000109.9W73 I74 Y76 L101 G105W73-Y103 WeakPolarHBondContact CA-O 3.27Å; I74-Y103 PolarHBondContact N-O 3.33Å; I74-Y103 PolarHBondContact O-N 3.4Å; Y76-Y103 HydrophobicContact CD2-CD2 4.18Å; Y76-Y103 HydrophobicContact CD2-CE2 4.22Å; Y76-Y103 AromaticContact CE2-CD2 3.96Å; Y76-Y103 HydrophobicContact CE2-CD2 3.96Å; Y76-Y103 HydrophobicContact CE2-CE2 4.2Å; L101-Y103 HydrophobicContact CD2-CE2 3.66Å; L101-Y103 WeakPolarHBondContact CD2-OH 3.31Å; L101-Y103 HydrophobicContact CG-CE2 3.69Å; Y103-G105 PolarHBondContact O-N 3.22Å
104P70.3Confident52.1Low49 Ų4994.8 Ų94.832%0.31848%0.477SS..EExtended strand (participates in β ladder)trans-65.1118.4173.3-13.226.9000110.4F72 W73 Y106 L107F72-P104 CarbonylContact O-C 3.6Å; F72-P104 WeakPolarHBondContact O-CA 3.35Å; W73-P104 HydrophobicContact CZ3-CG 4.39Å; P104-Y106 HydrophobicContact CB-CD1 3.9Å; P104-Y106 HydrophobicContact CB-CE1 3.31Å; P104-Y106 HydrophobicContact CG-CE1 4.49Å; P104-Y106 PolarHBondContact O-N 3.21Å; P104-L107 HydrophobicContact CB-CD1 4.3Å
105G62.5Low52.3Low0 Ų089.9 Ų89.90%047%0.474CS..THydrogen-bonded Turntrans-74.6-8.5-172.300000115.1F72 Y103 R133F72-G105 PolarHBondContact O-N 2.89Å; Y103-G105 PolarHBondContact O-N 3.22Å; G105-R133 PolarHBondContact O-NH2 3.46Å
106Y62.2Low52.9Low151 Ų15183.3 Ų83.359%0.59245%0.451SS*.THydrogen-bonded Turntrans-81.7-13.5-177.358.9-93.2000114.7P104P104-Y106 HydrophobicContact CB-CD1 3.9Å; P104-Y106 HydrophobicContact CB-CE1 3.31Å; P104-Y106 HydrophobicContact CG-CE1 4.49Å; P104-Y106 PolarHBondContact O-N 3.21Å
107L53.7Low53.1Low134 Ų13480.2 Ų80.270%0.70245%0.445SS*.SBendtrans-90.9-20.4178-80.7100.5000114.6P104P104-L107 HydrophobicContact CB-CD1 4.3Å
108S51.2Low53.4Low38 Ų3878.2 Ų78.227%0.26643%0.431SS..  trans-153.9126.6-179.5-165.10000111.6I74 F110I74-S108 WeakPolarHBondContact CD1-O 3.28Å; S108-F110 PolarHBondContact OG-O 3.34Å
109P51.2Low53.2Low34 Ų3479.6 Ų79.622%0.22144%0.436CS..SBendtrans-70.9-27.4-174.922.8-28.6000114Y69 I126 W186Y69-P109 WeakPolarHBondContact CE2-O 3.25Å; P109-I126 HydrophobicContact CG-CG1 4.12Å; P109-W186 HydrophobicContact CB-CZ2 3.81Å
110F50.6Low52.7Low23 Ų2381.7 Ų81.710%0.10145%0.449CS..SBendtrans-148.6155.2175.7-97-95000108.8S108 E112 W186 V192 V193 F196S108-F110 PolarHBondContact OG-O 3.34Å; F110-E112 PolarHBondContact O-N 3.49Å; F110-W186 HydrophobicContact CE2-CH2 4.44Å; F110-V192 HydrophobicContact CD2-CG1 4.05Å; F110-V192 HydrophobicContact CE2-CG1 4.29Å; F110-V193 HydrophobicContact CZ-CG2 4.31Å; F110-F196 HydrophobicContact CD1-CD1 4.21Å; F110-F196 HydrophobicContact CD1-CD2 4.27Å; F110-F196 HydrophobicContact CD1-CE1 4.39Å; F110-F196 HydrophobicContact CD1-CE2 4.45Å; F110-F196 HydrophobicContact CD1-CG 4.15Å; F110-F196 HydrophobicContact CE1-CD1 4.35Å
111P46.9Very low51.9Low48 Ų4880 Ų8031%0.31244%0.444SS..  trans-61.6100171.425.4-32.5000109.8Y76 P113 F196Y76-P111 HydrophobicContact CE1-CG 4.45Å; Y76-P111 WeakPolarHBondContact OH-CB 3.12Å; Y76-P111 WeakPolarHBondContact OH-CD 3.47Å; Y76-P111 WeakPolarHBondContact OH-CG 3.36Å; P111-P113 WeakPolarHBondContact O-CD 3.44Å; P111-F196 HydrophobicContact CG-CE2 4.3Å; P111-F196 HydrophobicContact CG-CZ 4.21Å; P111-F196 WeakPolarHBondContact O-CE2 3.27Å
112E44.7Very low51.1Low145 Ų14581 Ų8168%0.67845%0.449SS*.  trans-62.9122.4-175-161.1170.5-178.600111.1F110 G114F110-E112 PolarHBondContact O-N 3.49Å; E112-G114 PolarHBondContact O-N 3.41Å; E112-G114 VanDerWaalsContact O-N 3.1Å
113P38.3Very low50.2Low41 Ų4182.4 Ų82.427%0.26645%0.453SS..  trans-83.766166.733-26.1000109.7P111 E199P111-P113 WeakPolarHBondContact O-CD 3.44Å; P113-E199 HydrophobicContact CG-CB 4.39Å; P113-E199 WeakPolarHBondContact CG-OE2 3.32Å
114G35.4Very low49.7Very low35 Ų3579.6 Ų79.636%0.36145%0.448SS..SBendtrans66.1175.8169.200000115.9E112 T116E112-G114 PolarHBondContact O-N 3.41Å; E112-G114 VanDerWaalsContact O-N 3.1Å; G114-T116 PolarHBondContact O-N 2.85Å; G114-T116 VanDerWaalsContact O-N 3.11Å
115P36Very low49.2Very low116 Ų11677.7 Ų77.775%0.75344%0.437SS*.  trans-78.6101.6-167.831.2-31.7000110.5
116T42.2Very low49.4Very low63 Ų6382.2 Ų82.239%0.38746%0.46SS..  trans-90.7130.716445.50000109G114 S118 E199G114-T116 PolarHBondContact O-N 2.85Å; G114-T116 VanDerWaalsContact O-N 3.11Å; T116-S118 PolarHBondContact O-N 3.36Å; T116-E199 PolarHBondContact OG1-OE1 2.95Å
117N40.5Very low49.8Very low161 Ų16179.1 Ų79.186%0.86145%0.453SS*.SBendtrans-77.237.8-163.7-63.1-45.3000114.1
118S45.2Very low50.4Low53 Ų5376.8 Ų76.837%0.37144%0.436SS..  trans-111.664.8-174.443.80000112.3T116 T120 D122T116-S118 PolarHBondContact O-N 3.36Å; S118-T120 PolarHBondContact O-N 3.16Å; S118-D122 VanDerWaalsContact O-OD2 3.11Å
119T47Very low51.3Low107 Ų10775.1 Ų75.166%0.65643%0.425SS*.THydrogen-bonded Turntrans-57.81.8-171.354.30000117.8N123T119-N123 PolarHBondContact O-ND2 3.49Å
120T47.7Very low52.5Low113 Ų11374.9 Ų74.969%0.69343%0.428SS*.THydrogen-bonded Turntrans-107-39.9-174.4-37.70000113.3S118 T124S118-T120 PolarHBondContact O-N 3.16Å; T120-T124 PolarHBondContact O-OG1 3.44Å
121E48.2Very low54Low137 Ų13778.4 Ų78.464%0.6444%0.444SS*.Hα-helixtrans-78.9-36-178.9-68.8-176.3157.900112.2N123 T124 A125E121-N123 VanDerWaalsContact C-N 3.3Å; E121-N123 PolarHBondContact O-N 3.45Å; E121-T124 PolarHBondContact O-N 3.5Å; E121-T124 PolarHBondContact O-OG1 2.91Å; E121-A125 PolarHBondContact O-N 3.33Å
122D52.9Low55.9Low72 Ų7276.1 Ų76.139%0.38543%0.429SS..Hα-helixtrans-63.4-37.3178.7-58.8-38.6000112.1S118 T124 A125 I126S118-D122 VanDerWaalsContact O-OD2 3.11Å; D122-T124 PolarHBondContact O-N 3.36Å; D122-A125 PolarHBondContact O-N 2.86Å; D122-I126 WeakPolarHBondContact O-CD1 3.41Å; D122-I126 VanDerWaalsContact O-CG1 3.29Å; D122-I126 WeakPolarHBondContact O-CG1 3.26Å; D122-I126 PolarHBondContact O-N 3.45Å; D122-I126 VanDerWaalsContact O-N 3.17Å
123N56.6Low57.9Low90 Ų9070.7 Ų70.748%0.48140%0.402SS..Hα-helixtrans-66-39.2179.5-81.8-29.1000112T119 E121 I127T119-N123 PolarHBondContact O-ND2 3.49Å; E121-N123 VanDerWaalsContact C-N 3.3Å; E121-N123 PolarHBondContact O-N 3.45Å; N123-I127 WeakPolarHBondContact O-CB 3.35Å; N123-I127 VanDerWaalsContact O-CD1 3.26Å; N123-I127 WeakPolarHBondContact O-CD1 3.4Å; N123-I127 WeakPolarHBondContact O-CG1 3.28Å; N123-I127 PolarHBondContact O-N 2.95Å; N123-I127 VanDerWaalsContact O-N 3.11Å
124T60.4Low60.4Low61 Ų6172.9 Ų72.937%0.37441%0.411SS..Hα-helixtrans-67-40.6176.630.80000112.3T120 E121 D122 I126 I127 Y128T120-T124 PolarHBondContact O-OG1 3.44Å; E121-T124 PolarHBondContact O-N 3.5Å; E121-T124 PolarHBondContact O-OG1 2.91Å; D122-T124 PolarHBondContact O-N 3.36Å; T124-I126 PolarHBondContact O-N 2.84Å; T124-I127 PolarHBondContact O-N 2.84Å; T124-Y128 VanDerWaalsContact O-CD2 3.29Å; T124-Y128 WeakPolarHBondContact O-CD2 3.09Å; T124-Y128 PolarHBondContact O-N 3.4Å; T124-Y128 VanDerWaalsContact O-N 3.12Å
125A60.3Low63.1Low10 Ų1073.8 Ų73.88%0.08341%0.405CS..Hα-helixtrans-63.2-40.6177.900000112.6E121 D122 G129 W186 V192E121-A125 PolarHBondContact O-N 3.33Å; D122-A125 PolarHBondContact O-N 2.86Å; A125-G129 PolarHBondContact O-N 2.85Å; A125-G129 VanDerWaalsContact O-N 3.1Å; A125-W186 PolarHBondContact O-NE1 3.1Å; A125-V192 HydrophobicContact CB-CG2 3.66Å
126I66.3Low65.9Low95 Ų9568.2 Ų68.249%0.48737%0.369SS..Hα-helixtrans-66.9-42.5177.8-65.9164.7000111.1P109 D122 T124 G129 G130P109-I126 HydrophobicContact CG-CG1 4.12Å; D122-I126 WeakPolarHBondContact O-CD1 3.41Å; D122-I126 VanDerWaalsContact O-CG1 3.29Å; D122-I126 WeakPolarHBondContact O-CG1 3.26Å; D122-I126 PolarHBondContact O-N 3.45Å; D122-I126 VanDerWaalsContact O-N 3.17Å; T124-I126 PolarHBondContact O-N 2.84Å; I126-G129 PolarHBondContact O-N 3.45Å; I126-G130 PolarHBondContact O-N 2.92Å
127I69.6Low68.4Low86 Ų8669.2 Ų69.244%0.44137%0.371SS..Hα-helixtrans-64-48.1-178-72.1167.6000111.2N123 T124 G129 G130 F131N123-I127 WeakPolarHBondContact O-CB 3.35Å; N123-I127 VanDerWaalsContact O-CD1 3.26Å; N123-I127 WeakPolarHBondContact O-CD1 3.4Å; N123-I127 WeakPolarHBondContact O-CG1 3.28Å; N123-I127 PolarHBondContact O-N 2.95Å; N123-I127 VanDerWaalsContact O-N 3.11Å; T124-I127 PolarHBondContact O-N 2.84Å; I127-G129 VanDerWaalsContact C-N 3.35Å; I127-G129 PolarHBondContact O-N 3.36Å; I127-G130 PolarHBondContact O-N 2.93Å; I127-G130 VanDerWaalsContact O-N 3.17Å; I127-F131 HydrophobicContact CG2-CD2 3.53Å; I127-F131 HydrophobicContact CG2-CE2 3.2Å; I127-F131 HydrophobicContact CG2-CZ 4.31Å; I127-F131 WeakPolarHBondContact O-CD2 3.29Å; I127-F131 PolarHBondContact O-N 3.23Å
128Y68Low71.1Confident84 Ų8464.6 Ų64.633%0.32935%0.346SS..Hα-helixtrans-65.9-38.2177.6-83.4-101.8000112T124 G130 F131 W132 M182 V185 L190T124-Y128 VanDerWaalsContact O-CD2 3.29Å; T124-Y128 WeakPolarHBondContact O-CD2 3.09Å; T124-Y128 PolarHBondContact O-N 3.4Å; T124-Y128 VanDerWaalsContact O-N 3.12Å; Y128-G130 VanDerWaalsContact C-N 3.26Å; Y128-G130 PolarHBondContact O-N 3.28Å; Y128-F131 PolarHBondContact O-N 2.88Å; Y128-W132 PolarHBondContact O-N 2.89Å; Y128-M182 HydrophobicContact CD1-CE 3.23Å; Y128-M182 HydrophobicContact CD1-SD 3.99Å; Y128-M182 HydrophobicContact CE1-CE 3.49Å; Y128-M182 VanDerWaalsContact CE1-CE 3.49Å; Y128-M182 HydrophobicContact CE1-SD 3.94Å; Y128-M182 HydrophobicContact CG-CE 4.11Å; Y128-V185 HydrophobicContact CE1-CG1 4.46Å; Y128-L190 HydrophobicContact CD2-CD1 3.96Å; Y128-L190 HydrophobicContact CG-CD1 3.87Å
129G69.1Low73.5Confident4 Ų462 Ų624%0.04133%0.328CS..Hα-helixtrans-62.1-28.1172.300000113.9A125 I126 I127 W132A125-G129 PolarHBondContact O-N 2.85Å; A125-G129 VanDerWaalsContact O-N 3.1Å; I126-G129 PolarHBondContact O-N 3.45Å; I127-G129 VanDerWaalsContact C-N 3.35Å; I127-G129 PolarHBondContact O-N 3.36Å; G129-W132 VanDerWaalsContact C-CD1 3.48Å; G129-W132 PolarHBondContact O-NE1 3.42Å
130G76.6Confident75.9Confident28 Ų2857.9 Ų57.929%0.28930%0.302SS..Hα-helixtrans-78.8-43.6172.400000113.2I126 I127 Y128 W132 R133 I134I126-G130 PolarHBondContact O-N 2.92Å; I127-G130 PolarHBondContact O-N 2.93Å; I127-G130 VanDerWaalsContact O-N 3.17Å; Y128-G130 VanDerWaalsContact C-N 3.26Å; Y128-G130 PolarHBondContact O-N 3.28Å; G130-W132 PolarHBondContact O-N 2.92Å; G130-R133 WeakPolarHBondContact O-CB 3.36Å; G130-R133 PolarHBondContact O-N 2.88Å; G130-I134 PolarHBondContact O-N 2.91Å
131F81.4Confident78.3Confident98 Ų9855.2 Ų55.243%0.4329%0.292SS..Hα-helixtrans-66.4-40.4-172.6-80.5-58.5000114.3I127 Y128 R133 I134 F135 M182I127-F131 HydrophobicContact CG2-CD2 3.53Å; I127-F131 HydrophobicContact CG2-CE2 3.2Å; I127-F131 HydrophobicContact CG2-CZ 4.31Å; I127-F131 WeakPolarHBondContact O-CD2 3.29Å; I127-F131 PolarHBondContact O-N 3.23Å; Y128-F131 PolarHBondContact O-N 2.88Å; F131-R133 PolarHBondContact O-N 3.28Å; F131-I134 HydrophobicContact CD1-CD1 4.33Å; F131-I134 PolarHBondContact O-N 3.1Å; F131-F135 PolarHBondContact O-N 2.83Å; F131-F135 VanDerWaalsContact O-N 3.1Å; F131-M182 HydrophobicContact CB-CE 4.07Å
132W86.8Confident80.7Confident0 Ų049.1 Ų49.10%027%0.265CS..Hα-helixtrans-61.1-32178.281.5-79.9000111.6W30 Y69 F71 Y128 G129 G130 M136 A179 M182 H183W30-W132 HydrophobicContact CD2-CH2 4.16Å; W30-W132 AromaticContact CD2-CZ3 3.78Å; W30-W132 HydrophobicContact CD2-CZ3 3.78Å; W30-W132 HydrophobicContact CE3-CH2 4.46Å; W30-W132 AromaticContact CE3-CZ3 3.78Å; W30-W132 HydrophobicContact CE3-CZ3 3.78Å; W30-W132 HydrophobicContact CG-CH2 4.16Å; W30-W132 HydrophobicContact CG-CZ3 4.27Å; W30-W132 HydrophobicContact CH2-CZ3 4.36Å; W30-W132 HydrophobicContact CZ2-CZ3 4.36Å; W30-W132 HydrophobicContact CZ3-CZ3 4.09Å; Y69-W132 HydrophobicContact CE1-CZ2 4.3Å; F71-W132 HydrophobicContact CB-CH2 4.22Å; F71-W132 HydrophobicContact CD2-CH2 4.36Å; Y128-W132 PolarHBondContact O-N 2.89Å; G129-W132 VanDerWaalsContact C-CD1 3.48Å; G129-W132 PolarHBondContact O-NE1 3.42Å; G130-W132 PolarHBondContact O-N 2.92Å; W132-M136 HydrophobicContact CE3-CE 3.62Å; W132-M136 HydrophobicContact CH2-CE 4Å; W132-M136 HydrophobicContact CZ3-CE 3.16Å; W132-M136 PolarHBondContact O-N 3.2Å; W132-A179 WeakPolarHBondContact O-CB 3.5Å; W132-M182 HydrophobicContact CB-CB 3.91Å; W132-H183 HydrophobicContact CD2-CB 4.15Å; W132-H183 AromaticContact CD2-ND1 3.98Å; W132-H183 AromaticContact CE2-ND1 3.94Å; W132-H183 HydrophobicContact CE3-CB 3.93Å; W132-H183 AromaticContact CE3-ND1 3.99Å; W132-H183 HydrophobicContact CG-CB 4.37Å; W132-H183 AromaticContact CZ3-ND1 3.96Å
133R86.8Confident82.9Confident30 Ų3045.8 Ų45.811%0.11325%0.247CC..Hα-helixtrans-68.4-43.3176.9-63.7-177177.4143.3-7.8112.3Y69 F71 G105 G130 F131 F135 M136 L137Y69-R133 PolarHBondContact OH-NH2 2.86Å; F71-R133 HydrophobicContact CD2-CB 3.91Å; F71-R133 HydrophobicContact CD2-CG 3.66Å; F71-R133 HydrophobicContact CE2-CB 3.3Å; F71-R133 HydrophobicContact CE2-CG 3.61Å; F71-R133 WeakPolarHBondContact CE2-O 3.48Å; F71-R133 HydrophobicContact CG-CG 4.42Å; F71-R133 HydrophobicContact CZ-CB 3.8Å; F71-R133 HydrophobicContact CZ-CG 4.25Å; F71-R133 PolarHBondContact O-NE 3.09Å; G105-R133 PolarHBondContact O-NH2 3.46Å; G130-R133 WeakPolarHBondContact O-CB 3.36Å; G130-R133 PolarHBondContact O-N 2.88Å; F131-R133 PolarHBondContact O-N 3.28Å; R133-F135 VanDerWaalsContact C-N 3.35Å; R133-F135 PolarHBondContact O-N 3.49Å; R133-M136 PolarHBondContact O-N 2.92Å; R133-L137 WeakPolarHBondContact O-CG 3.35Å; R133-L137 PolarHBondContact O-N 3Å
134I90.6Very high84.8Confident87 Ų8744.7 Ų44.745%0.44624%0.244SC..Hα-helixtrans-60.9-46177.3-64.3169.9000110.4G130 F131 M136 L137 I138G130-I134 PolarHBondContact O-N 2.91Å; F131-I134 HydrophobicContact CD1-CD1 4.33Å; F131-I134 PolarHBondContact O-N 3.1Å; I134-M136 VanDerWaalsContact C-N 3.31Å; I134-M136 PolarHBondContact O-N 3.49Å; I134-L137 PolarHBondContact O-N 3.46Å; I134-I138 HydrophobicContact CG2-CD1 3.95Å; I134-I138 WeakPolarHBondContact O-CG1 3.42Å; I134-I138 PolarHBondContact O-N 3.05Å
135F93.9Very high86.6Confident54 Ų5446.3 Ų46.324%0.23725%0.25CC..Hα-helixtrans-62.9-37.4177.6-66.5-26.6000112.8F131 R133 I138 S139 F175 C178 A179 M182F131-F135 PolarHBondContact O-N 2.83Å; F131-F135 VanDerWaalsContact O-N 3.1Å; R133-F135 VanDerWaalsContact C-N 3.35Å; R133-F135 PolarHBondContact O-N 3.49Å; F135-I138 HydrophobicContact CD1-CD1 4.39Å; F135-I138 PolarHBondContact O-N 3.32Å; F135-S139 PolarHBondContact O-N 2.85Å; F135-F175 HydrophobicContact CB-CD1 4.26Å; F135-F175 AromaticContact CD1-CD1 3.61Å; F135-F175 HydrophobicContact CD1-CD1 3.61Å; F135-F175 AromaticContact CD1-CE1 3.84Å; F135-F175 HydrophobicContact CD1-CE1 3.84Å; F135-F175 HydrophobicContact CE1-CD1 4.23Å; F135-F175 HydrophobicContact CE1-CE1 4.04Å; F135-F175 HydrophobicContact CG-CD1 4.1Å; F135-C178 HydrophobicContact CD2-CB 3.87Å; F135-C178 HydrophobicContact CE2-CB 4.24Å; F135-C178 HydrophobicContact CG-CB 4.44Å; F135-A179 HydrophobicContact CB-CB 3.99Å; F135-M182 HydrophobicContact CD2-CG 4.44Å; F135-M182 HydrophobicContact CE2-CG 4.31Å
136M93.2Very high88.3Confident0 Ų045.8 Ų45.80%025%0.246CC..Hα-helixtrans-62.3-43.9173.6-170.2-177-58.300112.1F25 W30 F71 W132 R133 I134 I138 S139 V140 M176 A179F25-M136 HydrophobicContact CB-SD 4.38Å; F25-M136 HydrophobicContact CD2-CG 4.14Å; F25-M136 HydrophobicContact CD2-SD 3.74Å; W30-M136 HydrophobicContact CD2-CE 4.3Å; W30-M136 VanDerWaalsContact CE2-CE 3.48Å; W30-M136 HydrophobicContact CH2-CE 3.59Å; W30-M136 HydrophobicContact CZ2-CE 3.07Å; W30-M136 HydrophobicContact CZ2-SD 4.05Å; W30-M136 HydrophobicContact CZ3-CE 4.37Å; F71-M136 HydrophobicContact CD2-CB 4.5Å; F71-M136 HydrophobicContact CD2-CE 4Å; F71-M136 HydrophobicContact CD2-SD 3.59Å; F71-M136 VanDerWaalsContact CD2-SD 3.59Å; F71-M136 HydrophobicContact CE2-CB 4.11Å; F71-M136 HydrophobicContact CE2-CG 4.49Å; F71-M136 HydrophobicContact CE2-SD 4Å; F71-M136 HydrophobicContact CG-SD 4.32Å; W132-M136 HydrophobicContact CE3-CE 3.62Å; W132-M136 HydrophobicContact CH2-CE 4Å; W132-M136 HydrophobicContact CZ3-CE 3.16Å; W132-M136 PolarHBondContact O-N 3.2Å; R133-M136 PolarHBondContact O-N 2.92Å; I134-M136 VanDerWaalsContact C-N 3.31Å; I134-M136 PolarHBondContact O-N 3.49Å; M136-I138 PolarHBondContact O-N 2.98Å; M136-S139 WeakPolarHBondContact O-CB 3.38Å; M136-S139 PolarHBondContact O-N 3.28Å; M136-V140 WeakPolarHBondContact O-CG2 3.44Å; M136-V140 PolarHBondContact O-N 2.88Å; M136-M176 HydrophobicContact CE-CE 4.4Å; M136-M176 HydrophobicContact CG-CE 4.16Å; M136-M176 HydrophobicContact CG-SD 3.99Å; M136-A179 HydrophobicContact CB-CB 4.34Å
137L94.6Very high89.8Confident83 Ų8342.2 Ų42.244%0.43523%0.232SC..Hα-helixtrans-62.5-42.2176.8-69.4173.1000112.2F25 F71 R133 I134 S139 V140 A141F25-L137 HydrophobicContact CE2-CD2 3.67Å; F25-L137 HydrophobicContact CZ-CD2 3.87Å; F71-L137 HydrophobicContact CE2-CG 4.44Å; F71-L137 HydrophobicContact CZ-CD1 4.13Å; F71-L137 HydrophobicContact CZ-CD2 3.95Å; F71-L137 HydrophobicContact CZ-CG 3.82Å; R133-L137 WeakPolarHBondContact O-CG 3.35Å; R133-L137 PolarHBondContact O-N 3Å; I134-L137 PolarHBondContact O-N 3.46Å; L137-S139 VanDerWaalsContact C-N 3.29Å; L137-S139 PolarHBondContact O-N 3Å; L137-V140 PolarHBondContact O-N 3.46Å; L137-A141 WeakPolarHBondContact O-CB 3.27Å; L137-A141 PolarHBondContact O-N 3.12Å
138I96.9Very high91Very high64 Ų6444.2 Ų44.233%0.32824%0.238SC..Hα-helixtrans-61.1-41.6175.2-65.9168.3000110.2I134 F135 M136 A141 A142 F175I134-I138 HydrophobicContact CG2-CD1 3.95Å; I134-I138 WeakPolarHBondContact O-CG1 3.42Å; I134-I138 PolarHBondContact O-N 3.05Å; F135-I138 HydrophobicContact CD1-CD1 4.39Å; F135-I138 PolarHBondContact O-N 3.32Å; M136-I138 PolarHBondContact O-N 2.98Å; I138-A141 PolarHBondContact O-N 3.39Å; I138-A142 VanDerWaalsContact O-CB 3.26Å; I138-A142 WeakPolarHBondContact O-CB 3.46Å; I138-A142 PolarHBondContact O-N 2.83Å; I138-F175 HydrophobicContact CB-CD1 4.47Å; I138-F175 HydrophobicContact CB-CD2 4.49Å; I138-F175 HydrophobicContact CB-CG 4.3Å; I138-F175 HydrophobicContact CD1-CD1 4.5Å; I138-F175 HydrophobicContact CD1-CE1 4.26Å; I138-F175 HydrophobicContact CG2-CB 4.38Å; I138-F175 HydrophobicContact CG2-CD1 4.16Å; I138-F175 HydrophobicContact CG2-CD2 3.49Å; I138-F175 VanDerWaalsContact CG2-CD2 3.49Å; I138-F175 HydrophobicContact CG2-CE1 4.31Å; I138-F175 HydrophobicContact CG2-CE2 3.68Å; I138-F175 HydrophobicContact CG2-CG 3.76Å; I138-F175 HydrophobicContact CG2-CZ 4.09Å
139S97.2Very high92.3Very high0 Ų042 Ų420%023%0.231CC..Hα-helixtrans-60.1-48.7175.9172.60000112.4F135 M136 L137 A141 A142 V143 S172F135-S139 PolarHBondContact O-N 2.85Å; M136-S139 WeakPolarHBondContact O-CB 3.38Å; M136-S139 PolarHBondContact O-N 3.28Å; L137-S139 VanDerWaalsContact C-N 3.29Å; L137-S139 PolarHBondContact O-N 3Å; S139-A141 PolarHBondContact O-N 3.26Å; S139-A142 PolarHBondContact O-N 3.33Å; S139-V143 PolarHBondContact O-N 3.26Å; S139-S172 WeakPolarHBondContact O-CB 3.36Å; S139-S172 PolarHBondContact O-OG 2.8Å; S139-S172 VanDerWaalsContact O-OG 3.1Å; S139-S172 PolarHBondContact OG-O 3.44Å; S139-S172 VanDerWaalsContact OG-O 3.09Å; S139-S172 PolarHBondContact OG-OG 3.46Å
140V97.4Very high93.5Very high19 Ų1942.8 Ų42.812%0.11524%0.235CC..Hα-helixtrans-62.6-42.3179.6172.60000111.2I21 F22 F25 M136 L137 V143 T144I21-V140 HydrophobicContact CG2-CG2 4.06Å; F22-V140 HydrophobicContact CD1-CG1 4.23Å; F22-V140 HydrophobicContact CE1-CG1 3.98Å; F25-V140 HydrophobicContact CB-CG2 3.89Å; F25-V140 HydrophobicContact CD1-CG1 4.35Å; F25-V140 HydrophobicContact CD1-CG2 4.17Å; F25-V140 HydrophobicContact CD2-CG2 4.02Å; F25-V140 HydrophobicContact CE1-CG1 4.39Å; F25-V140 HydrophobicContact CG-CG2 3.77Å; M136-V140 WeakPolarHBondContact O-CG2 3.44Å; M136-V140 PolarHBondContact O-N 2.88Å; L137-V140 PolarHBondContact O-N 3.46Å; V140-V143 WeakPolarHBondContact O-CG1 3.11Å; V140-T144 WeakPolarHBondContact O-CB 3.28Å; V140-T144 WeakPolarHBondContact O-CG2 3.26Å; V140-T144 PolarHBondContact O-N 3.13Å; V140-T144 VanDerWaalsContact O-N 3.09Å; V140-T144 PolarHBondContact O-OG1 3.48Å
141A98.1Very high94.3Very high57 Ų5747.4 Ų47.447%0.47125%0.251SS..Hα-helixtrans-65.2-40.5175.100000112.3L137 I138 S139 T144 L145L137-A141 WeakPolarHBondContact O-CB 3.27Å; L137-A141 PolarHBondContact O-N 3.12Å; I138-A141 PolarHBondContact O-N 3.39Å; S139-A141 PolarHBondContact O-N 3.26Å; A141-T144 WeakPolarHBondContact CA-OG1 3.44Å; A141-T144 PolarHBondContact O-OG1 2.84Å; A141-L145 WeakPolarHBondContact O-CB 3.44Å; A141-L145 PolarHBondContact O-N 3.47Å; A141-L145 VanDerWaalsContact O-N 3.12Å
142A98.1Very high94.7Very high10 Ų1044.1 Ų44.18%0.08324%0.241CC..Hα-helixtrans-67.1-43.2178.200000112I138 S139 G146 T171I138-A142 VanDerWaalsContact O-CB 3.26Å; I138-A142 WeakPolarHBondContact O-CB 3.46Å; I138-A142 PolarHBondContact O-N 2.83Å; S139-A142 PolarHBondContact O-N 3.33Å; A142-G146 PolarHBondContact O-N 3.21Å; A142-T171 HydrophobicContact CB-CG2 4.48Å
143V98.1Very high94.8Very high1 Ų144.1 Ų44.11%0.00624%0.241CC..Hα-helixtrans-71-35.4-179.574.50000112.5A18 I21 F22 S139 V140 G147 F169A18-V143 HydrophobicContact CB-CG2 3.73Å; I21-V143 HydrophobicContact CG2-CG1 4.11Å; F22-V143 HydrophobicContact CE1-CG1 3.8Å; F22-V143 HydrophobicContact CZ-CG1 3.89Å; S139-V143 PolarHBondContact O-N 3.26Å; V140-V143 WeakPolarHBondContact O-CG1 3.11Å; V143-G147 PolarHBondContact O-N 3.43Å; V143-F169 HydrophobicContact CG2-CD1 4.11Å; V143-F169 HydrophobicContact CG2-CE1 3.64Å; V143-F169 HydrophobicContact CG2-CZ 3.99Å
144T98Very high94.5Very high68 Ų6845.7 Ų45.742%0.41726%0.26SS..Hα-helixtrans-63.4-51.3174.242.20000111.2F22 V140 A141 G146 G147 F148F22-T144 HydrophobicContact CE1-CG2 3.52Å; F22-T144 HydrophobicContact CZ-CG2 3.37Å; V140-T144 WeakPolarHBondContact O-CB 3.28Å; V140-T144 WeakPolarHBondContact O-CG2 3.26Å; V140-T144 PolarHBondContact O-N 3.13Å; V140-T144 VanDerWaalsContact O-N 3.09Å; V140-T144 PolarHBondContact O-OG1 3.48Å; A141-T144 WeakPolarHBondContact CA-OG1 3.44Å; A141-T144 PolarHBondContact O-OG1 2.84Å; T144-G146 PolarHBondContact O-N 3.29Å; T144-G147 PolarHBondContact O-N 3.37Å; T144-F148 PolarHBondContact O-N 3.45Å
145L97.6Very high94.2Very high94 Ų9446.2 Ų46.249%0.49227%0.269SS..Hα-helixtrans-63.9-42178-175.763.1000111.4A141 F148 L149 L168A141-L145 WeakPolarHBondContact O-CB 3.44Å; A141-L145 PolarHBondContact O-N 3.47Å; A141-L145 VanDerWaalsContact O-N 3.12Å; L145-F148 PolarHBondContact O-N 3.28Å; L145-L149 WeakPolarHBondContact O-CG 3.19Å; L145-L149 PolarHBondContact O-N 2.89Å; L145-L168 HydrophobicContact CB-CD1 3.97Å; L145-L168 HydrophobicContact CD2-CD1 3.76Å; L145-L168 HydrophobicContact CG-CD1 3.61Å
146G96.9Very high93.5Very high0 Ų050.8 Ų50.80%029%0.289CS..Hα-helixtrans-59.8-46.9176.100000112.4A142 T144 F148 L149 I150A142-G146 PolarHBondContact O-N 3.21Å; T144-G146 PolarHBondContact O-N 3.29Å; G146-F148 PolarHBondContact O-N 3.46Å; G146-L149 PolarHBondContact O-N 3.46Å; G146-I150 WeakPolarHBondContact O-CG1 3.47Å; G146-I150 PolarHBondContact O-N 3.2Å
147G95.9Very high93Very high20 Ų2054 Ų5421%0.20632%0.316CS..Hα-helixtrans-57.9-46175.300000112.3V143 T144 L149 I150 I151V143-G147 PolarHBondContact O-N 3.43Å; T144-G147 PolarHBondContact O-N 3.37Å; G147-L149 PolarHBondContact O-N 3.12Å; G147-I150 PolarHBondContact O-N 3.45Å; G147-I151 VanDerWaalsContact O-CG1 3.31Å; G147-I151 WeakPolarHBondContact O-CG1 3.42Å; G147-I151 PolarHBondContact O-N 3.49Å
148F95.7Very high92.6Very high128 Ų12851.9 Ų51.956%0.56131%0.308SS*.Hα-helixtrans-59.3-47.5176.2-178.6-100.8000112.1T144 L145 G146 I150 I151 C152T144-F148 PolarHBondContact O-N 3.45Å; L145-F148 PolarHBondContact O-N 3.28Å; G146-F148 PolarHBondContact O-N 3.46Å; F148-I150 VanDerWaalsContact C-N 3.33Å; F148-I150 PolarHBondContact O-N 2.97Å; F148-I151 PolarHBondContact O-N 3.32Å; F148-C152 PolarHBondContact O-N 2.9Å; F148-C152 PolarHBondContact O-SG 2.93Å; F148-C152 VanDerWaalsContact O-SG 3.33Å
149L95.3Very high92.3Very high36 Ų3651.5 Ų51.519%0.18830%0.304CS..Hα-helixtrans-61-39.7178.1-67.3-176.5000112.6L145 G146 G147 C152 A153 L161 A164 L168L145-L149 WeakPolarHBondContact O-CG 3.19Å; L145-L149 PolarHBondContact O-N 2.89Å; G146-L149 PolarHBondContact O-N 3.46Å; G147-L149 PolarHBondContact O-N 3.12Å; L149-C152 PolarHBondContact O-N 2.85Å; L149-A153 WeakPolarHBondContact O-CB 3.37Å; L149-A153 PolarHBondContact O-N 3.44Å; L149-L161 HydrophobicContact CD2-CD2 4Å; L149-A164 HydrophobicContact CD1-CB 3.85Å; L149-L168 HydrophobicContact CD1-CD1 3.66Å
150I94.2Very high92.1Very high22 Ų2255 Ų5511%0.11333%0.328CS..Hα-helixtrans-67.3-41.4177.5-66.8-57.7000111.5G146 G147 F148 C152 A153 A154 Y162 F169 F235G146-I150 WeakPolarHBondContact O-CG1 3.47Å; G146-I150 PolarHBondContact O-N 3.2Å; G147-I150 PolarHBondContact O-N 3.45Å; F148-I150 VanDerWaalsContact C-N 3.33Å; F148-I150 PolarHBondContact O-N 2.97Å; I150-C152 VanDerWaalsContact C-N 3.29Å; I150-C152 PolarHBondContact O-N 3.26Å; I150-A153 VanDerWaalsContact O-CB 3.31Å; I150-A153 WeakPolarHBondContact O-CB 3.3Å; I150-A153 PolarHBondContact O-N 3.46Å; I150-A154 PolarHBondContact O-N 3.02Å; I150-Y162 HydrophobicContact CD1-CD1 4.04Å; I150-F169 HydrophobicContact CG1-CE2 4.34Å; I150-F235 HydrophobicContact CD1-CB 4.06Å; I150-F235 HydrophobicContact CD1-CD1 3.72Å; I150-F235 HydrophobicContact CD1-CD2 3.91Å; I150-F235 HydrophobicContact CD1-CE1 4.1Å; I150-F235 HydrophobicContact CD1-CE2 4.27Å; I150-F235 HydrophobicContact CD1-CG 3.63Å; I150-F235 HydrophobicContact CD1-CZ 4.37Å; I150-F235 HydrophobicContact CG1-CD1 4.44Å; I150-F235 HydrophobicContact CG1-CD2 4.09Å; I150-F235 HydrophobicContact CG1-CE1 4.4Å; I150-F235 HydrophobicContact CG1-CE2 4.05Å; I150-F235 HydrophobicContact CG1-CG 4.3Å; I150-F235 HydrophobicContact CG1-CZ 4.22Å; I150-F235 HydrophobicContact CG2-CD1 4.35Å; I150-F235 HydrophobicContact CG2-CE1 3.63Å; I150-F235 HydrophobicContact CG2-CE2 4.21Å; I150-F235 HydrophobicContact CG2-CZ 3.56Å
151I93.3Very high91.9Very high124 Ų12456 Ų5664%0.63633%0.332SS*.Hα-helixtrans-60.6-42.9175.2-68.3165.2000110.1G147 F148 A153 A154 P155G147-I151 VanDerWaalsContact O-CG1 3.31Å; G147-I151 WeakPolarHBondContact O-CG1 3.42Å; G147-I151 PolarHBondContact O-N 3.49Å; F148-I151 PolarHBondContact O-N 3.32Å; I151-A153 VanDerWaalsContact C-N 3.3Å; I151-A153 PolarHBondContact O-N 3.33Å; I151-A154 PolarHBondContact O-N 2.86Å; I151-P155 WeakPolarHBondContact O-CD 3.35Å
152C90.8Very high91.7Very high30 Ų3053.8 Ų53.820%0.20331%0.312CS..Hα-helixtrans-67.5-28173.9-63.50000112.8F148 L149 I150 A154 P155 F156 L161F148-C152 PolarHBondContact O-N 2.9Å; F148-C152 PolarHBondContact O-SG 2.93Å; F148-C152 VanDerWaalsContact O-SG 3.33Å; L149-C152 PolarHBondContact O-N 2.85Å; I150-C152 VanDerWaalsContact C-N 3.29Å; I150-C152 PolarHBondContact O-N 3.26Å; C152-A154 VanDerWaalsContact C-N 3.27Å; C152-A154 PolarHBondContact O-N 3.37Å; C152-P155 VanDerWaalsContact O-CD 3.22Å; C152-P155 WeakPolarHBondContact O-CD 3.4Å; C152-P155 WeakPolarHBondContact O-CG 3.38Å; C152-F156 HydrophobicContact CB-CD2 4.45Å; C152-F156 WeakPolarHBondContact O-CD2 3.29Å; C152-L161 HydrophobicContact CB-CD1 4.25Å
153A88.1Confident91.6Very high0 Ų057.5 Ų57.50%033%0.326CS..Hα-helixtrans-66-29.1-179.700000113L149 I150 I151 A157 L161 Y162L149-A153 WeakPolarHBondContact O-CB 3.37Å; L149-A153 PolarHBondContact O-N 3.44Å; I150-A153 VanDerWaalsContact O-CB 3.31Å; I150-A153 WeakPolarHBondContact O-CB 3.3Å; I150-A153 PolarHBondContact O-N 3.46Å; I151-A153 VanDerWaalsContact C-N 3.3Å; I151-A153 PolarHBondContact O-N 3.33Å; A153-A157 WeakPolarHBondContact O-CA 3.37Å; A153-A157 PolarHBondContact O-N 2.84Å; A153-L161 HydrophobicContact CB-CB 3.58Å; A153-L161 HydrophobicContact CB-CD1 4.47Å; A153-Y162 HydrophobicContact CB-CD1 3.82Å; A153-Y162 HydrophobicContact CB-CD2 3.94Å; A153-Y162 HydrophobicContact CB-CE1 3.66Å; A153-Y162 HydrophobicContact CB-CE2 3.78Å; A153-Y162 HydrophobicContact CB-CG 3.95Å
154A81.3Confident91.5Very high62 Ų6259.7 Ų59.751%0.51234%0.344SS..Hα-helixtrans-62.5-54.2-178.900000113.8I150 I151 C152I150-A154 PolarHBondContact O-N 3.02Å; I151-A154 PolarHBondContact O-N 2.86Å; C152-A154 VanDerWaalsContact C-N 3.27Å; C152-A154 PolarHBondContact O-N 3.37Å
155P83.7Confident91.4Very high98 Ų9856.5 Ų56.564%0.63633%0.325SS*.Hα-helixtrans-70.6-33.2178.326.8-35.7000113.4I151 C152I151-P155 WeakPolarHBondContact O-CD 3.35Å; C152-P155 VanDerWaalsContact O-CD 3.22Å; C152-P155 WeakPolarHBondContact O-CD 3.4Å; C152-P155 WeakPolarHBondContact O-CG 3.38Å
156F79.8Confident91.4Very high151 Ų15152 Ų5266%0.66230%0.301SS*.Hα-helixtrans-88.8-6.7-174.7-63.5-60.2000114.1C152 S158 L161C152-F156 HydrophobicContact CB-CD2 4.45Å; C152-F156 WeakPolarHBondContact O-CD2 3.29Å; F156-S158 PolarHBondContact O-N 3.5Å; F156-L161 HydrophobicContact CB-CD1 4.38Å; F156-L161 HydrophobicContact CD2-CD1 4.29Å
157A81.1Confident91.4Very high68 Ų6853.1 Ų53.156%0.56231%0.312SS*.THydrogen-bonded Turntrans4727.9-175.600000114A153 H159A153-A157 WeakPolarHBondContact O-CA 3.37Å; A153-A157 PolarHBondContact O-N 2.84Å; A157-H159 PolarHBondContact O-N 2.86Å
158S87.6Confident91.5Very high38 Ų3854.1 Ų54.127%0.26631%0.313SS..  trans-85.3117.9-170.5176.50000111.2F156 C160 L161 Y162F156-S158 PolarHBondContact O-N 3.5Å; S158-C160 PolarHBondContact O-N 3.24Å; S158-C160 PolarHBondContact OG-N 3.43Å; S158-L161 PolarHBondContact O-N 2.9Å; S158-Y162 WeakPolarHBondContact O-CD2 3.39Å; S158-Y162 PolarHBondContact O-N 2.96Å
159H90.3Very high91.6Very high56 Ų5648.2 Ų48.226%0.25929%0.287SS..Hα-helixtrans-61.2-30.1176.574.1-91.6000113A157 K163 G239 V242 K243A157-H159 PolarHBondContact O-N 2.86Å; H159-K163 WeakPolarHBondContact O-CG 3.41Å; H159-K163 PolarHBondContact O-N 2.98Å; H159-K163 VanDerWaalsContact O-N 3.13Å; H159-G239 WeakPolarHBondContact CB-O 3Å; H159-V242 HydrophobicContact CB-CB 4.1Å; H159-V242 HydrophobicContact CB-CG1 3.96Å; H159-K243 HydrophobicContact CB-CB 4.03Å
160C92.6Very high91.7Very high73 Ų7348.7 Ų48.749%0.49329%0.289SS..Hα-helixtrans-66.2-41.2177.1-680000111.6S158 K163 A164S158-C160 PolarHBondContact O-N 3.24Å; S158-C160 PolarHBondContact OG-N 3.43Å; C160-K163 PolarHBondContact O-N 3.48Å; C160-A164 WeakPolarHBondContact O-CB 3.5Å; C160-A164 PolarHBondContact O-N 3.09Å
161L93.3Very high91.9Very high40 Ų4050.4 Ų50.421%0.20930%0.301CS..Hα-helixtrans-66.9-41.9179.1-70.1175.5000111.7L149 C152 A153 F156 S158 K163 A164 G165L149-L161 HydrophobicContact CD2-CD2 4Å; C152-L161 HydrophobicContact CB-CD1 4.25Å; A153-L161 HydrophobicContact CB-CB 3.58Å; A153-L161 HydrophobicContact CB-CD1 4.47Å; F156-L161 HydrophobicContact CB-CD1 4.38Å; F156-L161 HydrophobicContact CD2-CD1 4.29Å; S158-L161 PolarHBondContact O-N 2.9Å; L161-K163 VanDerWaalsContact C-N 3.31Å; L161-K163 PolarHBondContact O-N 3.24Å; L161-A164 PolarHBondContact O-N 3.37Å; L161-G165 PolarHBondContact O-N 3.32Å
162Y94.3Very high92.2Very high10 Ų1044.5 Ų44.54%0.03927%0.271CS..Hα-helixtrans-60.5-40.7173.4-75.5-64.7000112.3L7 I150 A153 S158 G166 F235 I238L7-Y162 HydrophobicContact CD1-CE1 4.07Å; L7-Y162 HydrophobicContact CD2-CE1 4.39Å; L7-Y162 HydrophobicContact CG-CE1 4.34Å; I150-Y162 HydrophobicContact CD1-CD1 4.04Å; A153-Y162 HydrophobicContact CB-CD1 3.82Å; A153-Y162 HydrophobicContact CB-CD2 3.94Å; A153-Y162 HydrophobicContact CB-CE1 3.66Å; A153-Y162 HydrophobicContact CB-CE2 3.78Å; A153-Y162 HydrophobicContact CB-CG 3.95Å; S158-Y162 WeakPolarHBondContact O-CD2 3.39Å; S158-Y162 PolarHBondContact O-N 2.96Å; Y162-G166 PolarHBondContact O-N 3.32Å; Y162-F235 AromaticContact CD1-CD1 4Å; Y162-F235 HydrophobicContact CD1-CD1 4Å; Y162-F235 HydrophobicContact CE1-CD1 4.46Å; Y162-I238 HydrophobicContact CD1-CG2 4.23Å; Y162-I238 HydrophobicContact CD2-CG2 4.47Å; Y162-I238 HydrophobicContact CE1-CG2 4.48Å; Y162-I238 HydrophobicContact CG-CG2 4.24Å
163K95.2Very high92.5Very high89 Ų8943 Ų4339%0.38726%0.261SS..Hα-helixtrans-70.8-43.1178.9-68.8179.496.6-1730112.5H159 C160 L161 G167 L236H159-K163 WeakPolarHBondContact O-CG 3.41Å; H159-K163 PolarHBondContact O-N 2.98Å; H159-K163 VanDerWaalsContact O-N 3.13Å; C160-K163 PolarHBondContact O-N 3.48Å; L161-K163 VanDerWaalsContact C-N 3.31Å; L161-K163 PolarHBondContact O-N 3.24Å; K163-G167 PolarHBondContact O-N 3.36Å; K163-L236 HydrophobicContact CB-CD2 4.19Å; K163-L236 HydrophobicContact CG-CD2 4.42Å; K163-L236 WeakPolarHBondContact O-CD2 3.31Å
164A96.9Very high93Very high47 Ų4748.6 Ų48.639%0.38829%0.285SS..Hα-helixtrans-64.9-48.2177.800000111.2L149 C160 L161 G167 L168L149-A164 HydrophobicContact CD1-CB 3.85Å; C160-A164 WeakPolarHBondContact O-CB 3.5Å; C160-A164 PolarHBondContact O-N 3.09Å; L161-A164 PolarHBondContact O-N 3.37Å; A164-G167 PolarHBondContact O-N 3.1Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 3.23Å
165G96.1Very high93.7Very high0 Ų048.1 Ų48.10%027%0.272CS..Hα-helixtrans-61.3-46.1176.200000112.4L161 G167 L168 F169L161-G165 PolarHBondContact O-N 3.32Å; G165-G167 VanDerWaalsContact C-N 3.33Å; G165-G167 PolarHBondContact O-N 3.47Å; G165-L168 PolarHBondContact O-N 3.23Å; G165-F169 WeakPolarHBondContact O-CD2 3.09Å; G165-F169 PolarHBondContact O-N 3.49Å
166G96.6Very high94.4Very high0 Ų043.4 Ų43.40%024%0.241CC..Hα-helixtrans-60.6-40.5175.200000113.2Y162 F169 L170 G232Y162-G166 PolarHBondContact O-N 3.32Å; G166-F169 PolarHBondContact O-N 3.48Å; G166-L170 PolarHBondContact O-N 3.21Å; G166-G232 VanDerWaalsContact O-CA 3.26Å; G166-G232 WeakPolarHBondContact O-CA 3.35Å
167G97.6Very high95.2Very high23 Ų2339.7 Ų39.724%0.23723%0.228CC..Hα-helixtrans-60.9-43.2173.200000112.6K163 A164 G165 F169 L170 T171K163-G167 PolarHBondContact O-N 3.36Å; A164-G167 PolarHBondContact O-N 3.1Å; G165-G167 VanDerWaalsContact C-N 3.33Å; G165-G167 PolarHBondContact O-N 3.47Å; G167-F169 PolarHBondContact O-N 3.18Å; G167-L170 WeakPolarHBondContact O-CB 3.12Å; G167-L170 PolarHBondContact O-N 3.04Å; G167-T171 PolarHBondContact O-N 3.25Å; G167-T171 PolarHBondContact O-OG1 3.3Å
168L98.1Very high95.8Very high41 Ų4138 Ų3822%0.21521%0.212CC..Hα-helixtrans-65.6-36.7176.4-72176000113L145 L149 A164 G165 T171 S172L145-L168 HydrophobicContact CB-CD1 3.97Å; L145-L168 HydrophobicContact CD2-CD1 3.76Å; L145-L168 HydrophobicContact CG-CD1 3.61Å; L149-L168 HydrophobicContact CD1-CD1 3.66Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 3.23Å; G165-L168 PolarHBondContact O-N 3.23Å; L168-T171 PolarHBondContact O-N 2.94Å; L168-S172 WeakPolarHBondContact O-CB 3.49Å; L168-S172 PolarHBondContact O-N 3.07Å
169F97.9Very high96.1Very high5 Ų536.2 Ų36.22%0.02220%0.199CC..Hα-helixtrans-62.4-41.2172.2-95.8-86.5000112.3G14 V143 I150 G165 G166 G167 S172 G173 A228 A231 F235G14-F169 WeakPolarHBondContact O-CE1 3.4Å; V143-F169 HydrophobicContact CG2-CD1 4.11Å; V143-F169 HydrophobicContact CG2-CE1 3.64Å; V143-F169 HydrophobicContact CG2-CZ 3.99Å; I150-F169 HydrophobicContact CG1-CE2 4.34Å; G165-F169 WeakPolarHBondContact O-CD2 3.09Å; G165-F169 PolarHBondContact O-N 3.49Å; G166-F169 PolarHBondContact O-N 3.48Å; G167-F169 PolarHBondContact O-N 3.18Å; F169-S172 PolarHBondContact O-N 3.39Å; F169-G173 PolarHBondContact O-N 3.01Å; F169-A228 HydrophobicContact CD1-CB 4.22Å; F169-A231 HydrophobicContact CD1-CB 4.32Å; F169-F235 HydrophobicContact CD2-CD2 4.49Å; F169-F235 HydrophobicContact CE2-CE2 4.46Å
170L98.1Very high96.2Very high45 Ų4533.9 Ų33.924%0.23619%0.189CC..Hα-helixtrans-63.3-46.7173.5-72-177.3000112G166 G167 S172 G173 F174 L229 L233 L236G166-L170 PolarHBondContact O-N 3.21Å; G167-L170 WeakPolarHBondContact O-CB 3.12Å; G167-L170 PolarHBondContact O-N 3.04Å; L170-S172 VanDerWaalsContact C-N 3.3Å; L170-S172 PolarHBondContact O-N 3.18Å; L170-G173 PolarHBondContact O-N 3.41Å; L170-F174 WeakPolarHBondContact O-CB 3.45Å; L170-F174 PolarHBondContact O-N 3.12Å; L170-L229 HydrophobicContact CD2-CD2 3.97Å; L170-L229 WeakPolarHBondContact CD2-O 3.31Å; L170-L233 HydrophobicContact CD1-CD2 4.4Å; L170-L233 HydrophobicContact CD2-CD2 4.26Å; L170-L233 HydrophobicContact CD2-CG 4.06Å; L170-L236 HydrophobicContact CD1-CD1 3.47Å; L170-L236 VanDerWaalsContact CD1-CD1 3.47Å; L170-L236 HydrophobicContact CG-CD1 4.5Å
171T97.9Very high96.2Very high58 Ų5834 Ų3436%0.35619%0.187SC..Hα-helixtrans-58.6-44.1177.5-60.40000110.8A142 G167 L168 F174 F175A142-T171 HydrophobicContact CB-CG2 4.48Å; G167-T171 PolarHBondContact O-N 3.25Å; G167-T171 PolarHBondContact O-OG1 3.3Å; L168-T171 PolarHBondContact O-N 2.94Å; T171-F174 PolarHBondContact O-N 3.35Å; T171-F175 HydrophobicContact CG2-CD2 3.58Å; T171-F175 HydrophobicContact CG2-CE2 3.56Å; T171-F175 VanDerWaalsContact O-CD2 3.26Å; T171-F175 WeakPolarHBondContact O-CD2 3.43Å; T171-F175 PolarHBondContact O-N 2.93Å
172S98.3Very high95.9Very high0 Ų034 Ų340%019%0.187CC..Hα-helixtrans-59.2-52174.71690000112.1I21 S139 L168 F169 L170 F174 F175 M176I21-S172 WeakPolarHBondContact CD1-OG 3.35Å; S139-S172 WeakPolarHBondContact O-CB 3.36Å; S139-S172 PolarHBondContact O-OG 2.8Å; S139-S172 VanDerWaalsContact O-OG 3.1Å; S139-S172 PolarHBondContact OG-O 3.44Å; S139-S172 VanDerWaalsContact OG-O 3.09Å; S139-S172 PolarHBondContact OG-OG 3.46Å; L168-S172 WeakPolarHBondContact O-CB 3.49Å; L168-S172 PolarHBondContact O-N 3.07Å; F169-S172 PolarHBondContact O-N 3.39Å; L170-S172 VanDerWaalsContact C-N 3.3Å; L170-S172 PolarHBondContact O-N 3.18Å; S172-F174 VanDerWaalsContact C-N 3.27Å; S172-F174 PolarHBondContact O-N 3.45Å; S172-F175 PolarHBondContact O-N 3.03Å; S172-M176 WeakPolarHBondContact O-CB 2.98Å; S172-M176 PolarHBondContact O-N 3.17Å
173G97.8Very high95.5Very high0 Ų033.6 Ų33.60%019%0.185CC..Hα-helixtrans-57.9-40.3178.600000112.6F169 L170 L177F169-G173 PolarHBondContact O-N 3.01Å; L170-G173 PolarHBondContact O-N 3.41Å; G173-L177 WeakPolarHBondContact O-CB 3.48Å; G173-L177 PolarHBondContact O-N 2.77Å
174F98Very high95.1Very high117 Ų11730.8 Ų30.851%0.51318%0.175SC..Hα-helixtrans-64.8-50.6176.3176.2-100.6000112.7L170 T171 S172 M176 L177 C178L170-F174 WeakPolarHBondContact O-CB 3.45Å; L170-F174 PolarHBondContact O-N 3.12Å; T171-F174 PolarHBondContact O-N 3.35Å; S172-F174 VanDerWaalsContact C-N 3.27Å; S172-F174 PolarHBondContact O-N 3.45Å; F174-M176 VanDerWaalsContact C-N 3.31Å; F174-M176 PolarHBondContact O-N 3.15Å; F174-L177 WeakPolarHBondContact O-CB 3.46Å; F174-L177 PolarHBondContact O-N 3.2Å; F174-C178 PolarHBondContact O-N 3.38Å; F174-C178 PolarHBondContact O-SG 3Å; F174-C178 VanDerWaalsContact O-SG 3.39Å
175F97.7Very high94.5Very high51 Ų5130.6 Ų30.622%0.22417%0.169CC..Hα-helixtrans-65.7-35.3179.1-83-70.3000112.2F135 I138 T171 S172 C178 A179F135-F175 HydrophobicContact CB-CD1 4.26Å; F135-F175 AromaticContact CD1-CD1 3.61Å; F135-F175 HydrophobicContact CD1-CD1 3.61Å; F135-F175 AromaticContact CD1-CE1 3.84Å; F135-F175 HydrophobicContact CD1-CE1 3.84Å; F135-F175 HydrophobicContact CE1-CD1 4.23Å; F135-F175 HydrophobicContact CE1-CE1 4.04Å; F135-F175 HydrophobicContact CG-CD1 4.1Å; I138-F175 HydrophobicContact CB-CD1 4.47Å; I138-F175 HydrophobicContact CB-CD2 4.49Å; I138-F175 HydrophobicContact CB-CG 4.3Å; I138-F175 HydrophobicContact CD1-CD1 4.5Å; I138-F175 HydrophobicContact CD1-CE1 4.26Å; I138-F175 HydrophobicContact CG2-CB 4.38Å; I138-F175 HydrophobicContact CG2-CD1 4.16Å; I138-F175 HydrophobicContact CG2-CD2 3.49Å; I138-F175 VanDerWaalsContact CG2-CD2 3.49Å; I138-F175 HydrophobicContact CG2-CE1 4.31Å; I138-F175 HydrophobicContact CG2-CE2 3.68Å; I138-F175 HydrophobicContact CG2-CG 3.76Å; I138-F175 HydrophobicContact CG2-CZ 4.09Å; T171-F175 HydrophobicContact CG2-CD2 3.58Å; T171-F175 HydrophobicContact CG2-CE2 3.56Å; T171-F175 VanDerWaalsContact O-CD2 3.26Å; T171-F175 WeakPolarHBondContact O-CD2 3.43Å; T171-F175 PolarHBondContact O-N 2.93Å; S172-F175 PolarHBondContact O-N 3.03Å; F175-C178 PolarHBondContact O-N 3.5Å; F175-A179 WeakPolarHBondContact O-CB 3.32Å; F175-A179 PolarHBondContact O-N 2.7Å
176M96.6Very high93.6Very high0 Ų030.7 Ų30.70%017%0.169CC..Hα-helixtrans-66-39.1173.9-160.666.7-17900111.7S24 W30 M136 S172 F174 A179 V180 A221 I225S24-M176 WeakPolarHBondContact OG-CE 3.34Å; W30-M176 HydrophobicContact CH2-CE 3.75Å; W30-M176 HydrophobicContact CZ2-CE 3.67Å; M136-M176 HydrophobicContact CE-CE 4.4Å; M136-M176 HydrophobicContact CG-CE 4.16Å; M136-M176 HydrophobicContact CG-SD 3.99Å; S172-M176 WeakPolarHBondContact O-CB 2.98Å; S172-M176 PolarHBondContact O-N 3.17Å; F174-M176 VanDerWaalsContact C-N 3.31Å; F174-M176 PolarHBondContact O-N 3.15Å; M176-A179 WeakPolarHBondContact O-CB 3.37Å; M176-A179 PolarHBondContact O-N 2.98Å; M176-V180 WeakPolarHBondContact O-CG2 3.14Å; M176-V180 PolarHBondContact O-N 2.86Å; M176-A221 HydrophobicContact CE-CB 3.61Å; M176-I225 HydrophobicContact CB-CD1 4.23Å; M176-I225 HydrophobicContact CB-CG1 3.7Å; M176-I225 HydrophobicContact CG-CD1 4.06Å; M176-I225 HydrophobicContact CG-CG1 3.76Å
177L96.7Very high92.6Very high73 Ų7331.4 Ų31.438%0.38217%0.173SC..Hα-helixtrans-61.6-47173179.365.8000111.2G173 F174 A179 V180 V181 I225G173-L177 WeakPolarHBondContact O-CB 3.48Å; G173-L177 PolarHBondContact O-N 2.77Å; F174-L177 WeakPolarHBondContact O-CB 3.46Å; F174-L177 PolarHBondContact O-N 3.2Å; L177-A179 VanDerWaalsContact C-N 3.3Å; L177-A179 PolarHBondContact O-N 3.4Å; L177-V180 PolarHBondContact O-N 2.92Å; L177-V181 HydrophobicContact CD1-CG2 4.38Å; L177-V181 WeakPolarHBondContact O-CG2 3.45Å; L177-V181 PolarHBondContact O-N 3.48Å; L177-I225 HydrophobicContact CB-CD1 4.22Å; L177-I225 HydrophobicContact CB-CG2 4.28Å; L177-I225 HydrophobicContact CD1-CD1 4.43Å
178C95.2Very high91.5Very high32 Ų3235.3 Ų35.322%0.21619%0.186CC..Hα-helixtrans-58.2-42.2174.2-68.90000111.6F135 F174 F175 V181 M182F135-C178 HydrophobicContact CD2-CB 3.87Å; F135-C178 HydrophobicContact CE2-CB 4.24Å; F135-C178 HydrophobicContact CG-CB 4.44Å; F174-C178 PolarHBondContact O-N 3.38Å; F174-C178 PolarHBondContact O-SG 3Å; F174-C178 VanDerWaalsContact O-SG 3.39Å; F175-C178 PolarHBondContact O-N 3.5Å; C178-V181 PolarHBondContact O-N 3.47Å; C178-M182 VanDerWaalsContact O-CB 3.25Å; C178-M182 WeakPolarHBondContact O-CB 3.18Å; C178-M182 WeakPolarHBondContact O-CG 3.39Å; C178-M182 PolarHBondContact O-N 3.46Å
179A93.3Very high90Very high0 Ų038.2 Ų38.20%021%0.205CC..Hα-helixtrans-60.7-45.4176.300000112W132 F135 M136 F175 M176 L177 H183W132-A179 WeakPolarHBondContact O-CB 3.5Å; F135-A179 HydrophobicContact CB-CB 3.99Å; M136-A179 HydrophobicContact CB-CB 4.34Å; F175-A179 WeakPolarHBondContact O-CB 3.32Å; F175-A179 PolarHBondContact O-N 2.7Å; M176-A179 WeakPolarHBondContact O-CB 3.37Å; M176-A179 PolarHBondContact O-N 2.98Å; L177-A179 VanDerWaalsContact C-N 3.3Å; L177-A179 PolarHBondContact O-N 3.4Å; A179-H183 VanDerWaalsContact O-CB 3.3Å; A179-H183 WeakPolarHBondContact O-CB 3.27Å; A179-H183 PolarHBondContact O-N 3.43Å
180V93Very high88.3Confident8 Ų840.5 Ų40.55%0.04822%0.217CC..Hα-helixtrans-62.4-49.2177167.50000111.3W30 M176 L177 M182 H183 V184 F218 A221 L222 I225W30-V180 HydrophobicContact CH2-CG2 4.08Å; W30-V180 HydrophobicContact CZ3-CG2 4.07Å; M176-V180 WeakPolarHBondContact O-CG2 3.14Å; M176-V180 PolarHBondContact O-N 2.86Å; L177-V180 PolarHBondContact O-N 2.92Å; V180-M182 VanDerWaalsContact C-N 3.35Å; V180-M182 PolarHBondContact O-N 3.47Å; V180-H183 PolarHBondContact O-N 2.83Å; V180-V184 WeakPolarHBondContact O-CG2 3.44Å; V180-V184 PolarHBondContact O-N 2.77Å; V180-F218 HydrophobicContact CG1-CE2 3.76Å; V180-F218 HydrophobicContact CG1-CZ 3.84Å; V180-A221 HydrophobicContact CG2-CB 3.8Å; V180-L222 HydrophobicContact CG1-CD2 3.88Å; V180-I225 HydrophobicContact CB-CD1 4.49Å; V180-I225 HydrophobicContact CG2-CD1 3.91Å
181V91.9Very high86.6Confident76 Ų7642.4 Ų42.446%0.46123%0.227SC..Hα-helixtrans-60.9-46.6179.6171.80000110.5L177 C178 H183 V184 V185L177-V181 HydrophobicContact CD1-CG2 4.38Å; L177-V181 WeakPolarHBondContact O-CG2 3.45Å; L177-V181 PolarHBondContact O-N 3.48Å; C178-V181 PolarHBondContact O-N 3.47Å; V181-H183 VanDerWaalsContact C-N 3.33Å; V181-H183 PolarHBondContact O-N 3.33Å; V181-V184 PolarHBondContact O-N 2.95Å; V181-V185 HydrophobicContact CG1-CG2 4.2Å; V181-V185 WeakPolarHBondContact O-CB 3.29Å; V181-V185 VanDerWaalsContact O-CG2 3.28Å; V181-V185 WeakPolarHBondContact O-CG2 3.26Å; V181-V185 PolarHBondContact O-N 3.05Å
182M87.9Confident85.1Confident40 Ų4040.9 Ų40.920%0.19722%0.218CC..Hα-helixtrans-62.5-39.7178.1-71.2-69.2-74.300112Y128 F131 W132 F135 C178 V180 V185 W186Y128-M182 HydrophobicContact CD1-CE 3.23Å; Y128-M182 HydrophobicContact CD1-SD 3.99Å; Y128-M182 HydrophobicContact CE1-CE 3.49Å; Y128-M182 VanDerWaalsContact CE1-CE 3.49Å; Y128-M182 HydrophobicContact CE1-SD 3.94Å; Y128-M182 HydrophobicContact CG-CE 4.11Å; F131-M182 HydrophobicContact CB-CE 4.07Å; W132-M182 HydrophobicContact CB-CB 3.91Å; F135-M182 HydrophobicContact CD2-CG 4.44Å; F135-M182 HydrophobicContact CE2-CG 4.31Å; C178-M182 VanDerWaalsContact O-CB 3.25Å; C178-M182 WeakPolarHBondContact O-CB 3.18Å; C178-M182 WeakPolarHBondContact O-CG 3.39Å; C178-M182 PolarHBondContact O-N 3.46Å; V180-M182 VanDerWaalsContact C-N 3.35Å; V180-M182 PolarHBondContact O-N 3.47Å; M182-V185 PolarHBondContact O-N 2.79Å; M182-W186 WeakPolarHBondContact O-CB 3.42Å; M182-W186 PolarHBondContact O-N 2.97Å
183H85.3Confident83.6Confident0 Ų041.2 Ų41.20%022%0.22CC..Hα-helixtrans-62.8-43175.2-179.674.1000112W132 A179 V180 V181 L187W132-H183 HydrophobicContact CD2-CB 4.15Å; W132-H183 AromaticContact CD2-ND1 3.98Å; W132-H183 AromaticContact CE2-ND1 3.94Å; W132-H183 HydrophobicContact CE3-CB 3.93Å; W132-H183 AromaticContact CE3-ND1 3.99Å; W132-H183 HydrophobicContact CG-CB 4.37Å; W132-H183 AromaticContact CZ3-ND1 3.96Å; A179-H183 VanDerWaalsContact O-CB 3.3Å; A179-H183 WeakPolarHBondContact O-CB 3.27Å; A179-H183 PolarHBondContact O-N 3.43Å; V180-H183 PolarHBondContact O-N 2.83Å; V181-H183 VanDerWaalsContact C-N 3.33Å; V181-H183 PolarHBondContact O-N 3.33Å; H183-L187 WeakPolarHBondContact NE2-CD1 2.99Å; H183-L187 WeakPolarHBondContact O-CG 3.02Å; H183-L187 PolarHBondContact O-N 2.9Å; H183-L187 VanDerWaalsContact O-N 3.15Å
184V86.1Confident82.2Confident30 Ų3043.3 Ų43.318%0.18223%0.229CC..Hα-helixtrans-67.4-45.8177.5174.20000111.2V180 V181 W186 L187 Q188 Y214 F218V180-V184 WeakPolarHBondContact O-CG2 3.44Å; V180-V184 PolarHBondContact O-N 2.77Å; V181-V184 PolarHBondContact O-N 2.95Å; V184-W186 VanDerWaalsContact C-N 3.31Å; V184-W186 PolarHBondContact O-N 3Å; V184-L187 PolarHBondContact O-N 2.91Å; V184-Q188 HydrophobicContact CG1-CG 4.18Å; V184-Q188 WeakPolarHBondContact O-CB 3.18Å; V184-Q188 WeakPolarHBondContact O-CG 3.44Å; V184-Q188 PolarHBondContact O-N 3.32Å; V184-Y214 HydrophobicContact CG2-CE1 4.45Å; V184-F218 HydrophobicContact CG2-CE2 3.81Å; V184-F218 HydrophobicContact CG2-CZ 3.76Å
185V84.1Confident80.7Confident44 Ų4440.5 Ų40.527%0.26722%0.222SC..Hα-helixtrans-60.6-43.1176.8169.10000110.5Y128 V181 M182 L187 Q188 V189 L190Y128-V185 HydrophobicContact CE1-CG1 4.46Å; V181-V185 HydrophobicContact CG1-CG2 4.2Å; V181-V185 WeakPolarHBondContact O-CB 3.29Å; V181-V185 VanDerWaalsContact O-CG2 3.28Å; V181-V185 WeakPolarHBondContact O-CG2 3.26Å; V181-V185 PolarHBondContact O-N 3.05Å; M182-V185 PolarHBondContact O-N 2.79Å; V185-L187 VanDerWaalsContact C-N 3.3Å; V185-L187 PolarHBondContact O-N 3.15Å; V185-Q188 PolarHBondContact O-N 3.37Å; V185-V189 HydrophobicContact CB-CG2 4.36Å; V185-V189 HydrophobicContact CG1-CB 3.94Å; V185-V189 HydrophobicContact CG1-CG1 4.47Å; V185-V189 HydrophobicContact CG1-CG2 4.02Å; V185-V189 HydrophobicContact CG2-CG2 4.43Å; V185-V189 WeakPolarHBondContact O-CA 3.35Å; V185-V189 VanDerWaalsContact O-CB 3.26Å; V185-V189 WeakPolarHBondContact O-CB 2.86Å; V185-V189 PolarHBondContact O-N 3.38Å; V185-L190 PolarHBondContact O-N 3.48Å
186W78.3Confident79.2Confident1 Ų138.6 Ų38.60%0.00421%0.214CC..Hα-helixtrans-58.1-41.6176.3173.367.4000112.3Y69 P109 F110 A125 M182 V184Y69-W186 HydrophobicContact CE1-CH2 4.05Å; Y69-W186 AromaticContact CE1-CZ3 3.97Å; Y69-W186 HydrophobicContact CE1-CZ3 3.97Å; Y69-W186 HydrophobicContact CE2-CH2 4.25Å; Y69-W186 AromaticContact CZ-CH2 3.69Å; Y69-W186 WeakPolarHBondContact OH-CH2 3.35Å; P109-W186 HydrophobicContact CB-CZ2 3.81Å; F110-W186 HydrophobicContact CE2-CH2 4.44Å; A125-W186 PolarHBondContact O-NE1 3.1Å; M182-W186 WeakPolarHBondContact O-CB 3.42Å; M182-W186 PolarHBondContact O-N 2.97Å; V184-W186 VanDerWaalsContact C-N 3.31Å; V184-W186 PolarHBondContact O-N 3Å
187L74.4Confident77.8Confident15 Ų1539 Ų398%0.07922%0.216CC..Hα-helixtrans-78.2-38.2179.5-70.7173.1000114.1L31 H183 V184 V185 V193 Y214L31-L187 HydrophobicContact CD1-CD1 3.65Å; L31-L187 HydrophobicContact CD2-CD1 4.16Å; L31-L187 HydrophobicContact CD2-CD2 4.02Å; L31-L187 HydrophobicContact CG-CD1 4.5Å; H183-L187 WeakPolarHBondContact NE2-CD1 2.99Å; H183-L187 WeakPolarHBondContact O-CG 3.02Å; H183-L187 PolarHBondContact O-N 2.9Å; H183-L187 VanDerWaalsContact O-N 3.15Å; V184-L187 PolarHBondContact O-N 2.91Å; V185-L187 VanDerWaalsContact C-N 3.3Å; V185-L187 PolarHBondContact O-N 3.15Å; L187-V193 HydrophobicContact CD2-CG2 4.47Å; L187-Y214 HydrophobicContact CD1-CE1 4.1Å
188Q74.1Confident76.4Confident106 Ų10639.7 Ų39.750%0.49522%0.22SC..Hα-helixtrans-98.5-31.8-169.9-65.6-177.6-2.700114V184 V185 Y214V184-Q188 HydrophobicContact CG1-CG 4.18Å; V184-Q188 WeakPolarHBondContact O-CB 3.18Å; V184-Q188 WeakPolarHBondContact O-CG 3.44Å; V184-Q188 PolarHBondContact O-N 3.32Å; V185-Q188 PolarHBondContact O-N 3.37Å; Q188-Y214 PolarHBondContact NE2-OH 3.49Å; Q188-Y214 VanDerWaalsContact NE2-OH 3.12Å
189V67.3Low75.1Confident102 Ų10240.8 Ų40.862%0.61822%0.222SC*.THydrogen-bonded Turntrans-100.3-33.9-170.2-179.90000112V185 D191V185-V189 HydrophobicContact CB-CG2 4.36Å; V185-V189 HydrophobicContact CG1-CB 3.94Å; V185-V189 HydrophobicContact CG1-CG1 4.47Å; V185-V189 HydrophobicContact CG1-CG2 4.02Å; V185-V189 HydrophobicContact CG2-CG2 4.43Å; V185-V189 WeakPolarHBondContact O-CA 3.35Å; V185-V189 VanDerWaalsContact O-CB 3.26Å; V185-V189 WeakPolarHBondContact O-CB 2.86Å; V185-V189 PolarHBondContact O-N 3.38Å; V189-D191 PolarHBondContact O-N 3.3Å
190L61.8Low73.7Confident52 Ų5242.3 Ų42.327%0.27223%0.229SC..SBendtrans-82.95.2-178.4-65178.8000113.6Y128 V185 V192Y128-L190 HydrophobicContact CD2-CD1 3.96Å; Y128-L190 HydrophobicContact CG-CD1 3.87Å; V185-L190 PolarHBondContact O-N 3.48Å; L190-V192 HydrophobicContact CB-CG2 3.73Å; L190-V192 PolarHBondContact O-N 2.94Å
191D64Low72.6Confident86 Ų8646.2 Ų46.246%0.4624%0.243SC..  trans49.516.3177.5-146.529.9000115.8V189 V193 Q194 T195V189-D191 PolarHBondContact O-N 3.3Å; D191-V193 PolarHBondContact O-N 3.28Å; D191-Q194 PolarHBondContact O-N 3.37Å; D191-Q194 WeakPolarHBondContact OD1-CB 2.98Å; D191-Q194 WeakPolarHBondContact OD1-CG 3.3Å; D191-T195 PolarHBondContact O-N 3.17Å; D191-T195 PolarHBondContact O-OG1 3.11Å
192V65.6Low71.5Confident26 Ų2647 Ų4716%0.15826%0.258CS..Hα-helixtrans-54.6-35.8-175.4-1790000110.8F110 A125 L190 F196F110-V192 HydrophobicContact CD2-CG1 4.05Å; F110-V192 HydrophobicContact CE2-CG1 4.29Å; A125-V192 HydrophobicContact CB-CG2 3.66Å; L190-V192 HydrophobicContact CB-CG2 3.73Å; L190-V192 PolarHBondContact O-N 2.94Å; V192-F196 WeakPolarHBondContact O-CB 3.02Å; V192-F196 PolarHBondContact O-N 3.19Å
193V67.4Low70.3Confident6 Ų648.3 Ų48.34%0.03627%0.27CS..Hα-helixtrans-67.3-45.9177.5173.80000111.8L48 F110 L187 D191 F196 I197 L210 L212L48-V193 HydrophobicContact CD1-CG1 4.11Å; F110-V193 HydrophobicContact CZ-CG2 4.31Å; L187-V193 HydrophobicContact CD2-CG2 4.47Å; D191-V193 PolarHBondContact O-N 3.28Å; V193-F196 PolarHBondContact O-N 2.97Å; V193-I197 HydrophobicContact CG1-CD1 3.85Å; V193-I197 VanDerWaalsContact O-CG1 3.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.47Å; V193-I197 PolarHBondContact O-N 2.77Å; V193-L210 HydrophobicContact CG1-CD2 4.11Å; V193-L212 HydrophobicContact CB-CD1 4.13Å; V193-L212 HydrophobicContact CG1-CD1 3.3Å; V193-L212 HydrophobicContact CG2-CD1 3.69Å
194Q67.4Low69.4Low44 Ų4454.7 Ų54.721%0.20630%0.3CS..Hα-helixtrans-72.5-40.5-177.4-69.5-68.8-2.100111.8D191 F196 I197 N198D191-Q194 PolarHBondContact O-N 3.37Å; D191-Q194 WeakPolarHBondContact OD1-CB 2.98Å; D191-Q194 WeakPolarHBondContact OD1-CG 3.3Å; Q194-F196 VanDerWaalsContact C-N 3.26Å; Q194-F196 PolarHBondContact O-N 2.73Å; Q194-I197 PolarHBondContact O-N 2.74Å; Q194-N198 WeakPolarHBondContact O-CB 3.23Å; Q194-N198 VanDerWaalsContact O-CG 3.27Å; Q194-N198 PolarHBondContact O-N 3.08Å; Q194-N198 PolarHBondContact O-ND2 3.11Å
195T65.8Low68.4Low59 Ų5953.6 Ų53.636%0.36229%0.294SS..Hα-helixtrans-56.5-45.6173.6-54.40000110.3D191 I197 N198 E199D191-T195 PolarHBondContact O-N 3.17Å; D191-T195 PolarHBondContact O-OG1 3.11Å; T195-I197 PolarHBondContact O-N 2.71Å; T195-N198 PolarHBondContact O-N 3.28Å; T195-E199 WeakPolarHBondContact O-CG 3.17Å; T195-E199 PolarHBondContact O-N 2.77Å
196F66.6Low67.5Low11 Ų1156 Ų565%0.04831%0.31CS..Hα-helixtrans-61.8-43.4175.6177.7-99.1000113.5F110 P111 V192 V193 Q194 N198 E199 Q200 F208 L210F110-F196 HydrophobicContact CD1-CD1 4.21Å; F110-F196 HydrophobicContact CD1-CD2 4.27Å; F110-F196 HydrophobicContact CD1-CE1 4.39Å; F110-F196 HydrophobicContact CD1-CE2 4.45Å; F110-F196 HydrophobicContact CD1-CG 4.15Å; F110-F196 HydrophobicContact CE1-CD1 4.35Å; P111-F196 HydrophobicContact CG-CE2 4.3Å; P111-F196 HydrophobicContact CG-CZ 4.21Å; P111-F196 WeakPolarHBondContact O-CE2 3.27Å; V192-F196 WeakPolarHBondContact O-CB 3.02Å; V192-F196 PolarHBondContact O-N 3.19Å; V193-F196 PolarHBondContact O-N 2.97Å; Q194-F196 VanDerWaalsContact C-N 3.26Å; Q194-F196 PolarHBondContact O-N 2.73Å; F196-N198 VanDerWaalsContact C-N 3.33Å; F196-N198 PolarHBondContact O-N 2.79Å; F196-E199 PolarHBondContact O-N 3.21Å; F196-Q200 HydrophobicContact CE1-CG 4Å; F196-Q200 HydrophobicContact CE2-CG 4.06Å; F196-Q200 HydrophobicContact CZ-CG 3.75Å; F196-Q200 WeakPolarHBondContact O-CB 3.39Å; F196-Q200 PolarHBondContact O-N 3.02Å; F196-F208 HydrophobicContact CE1-CE1 4.27Å; F196-F208 HydrophobicContact CE1-CZ 4.09Å; F196-L210 HydrophobicContact CD1-CD1 3.99Å; F196-L210 HydrophobicContact CE1-CD1 3.95Å
197I67.9Low67Low9 Ų957.3 Ų57.35%0.04632%0.317CS..Hα-helixtrans-59.7-46.1176.4-72.8164.8000110.4L48 V193 Q194 T195 Q200 R201 F208 L210L48-I197 HydrophobicContact CD1-CD1 4.2Å; V193-I197 HydrophobicContact CG1-CD1 3.85Å; V193-I197 VanDerWaalsContact O-CG1 3.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.47Å; V193-I197 PolarHBondContact O-N 2.77Å; Q194-I197 PolarHBondContact O-N 2.74Å; T195-I197 PolarHBondContact O-N 2.71Å; I197-Q200 PolarHBondContact O-N 3.01Å; I197-R201 WeakPolarHBondContact O-CB 3.27Å; I197-R201 PolarHBondContact O-N 3.05Å; I197-F208 HydrophobicContact CB-CD1 4.42Å; I197-F208 HydrophobicContact CG1-CD1 4.27Å; I197-F208 HydrophobicContact CG1-CE1 4.03Å; I197-F208 HydrophobicContact CG2-CD1 4.22Å; I197-L210 HydrophobicContact CD1-CB 4.02Å; I197-L210 HydrophobicContact CG1-CB 3.99Å; I197-L210 HydrophobicContact CG1-CD1 4.31Å
198N67.8Low66.6Low86 Ų8657 Ų5746%0.4632%0.315SS..Hα-helixtrans-65-41.9-178-71.2-30.4000111.8Q194 T195 F196 R201 A202Q194-N198 WeakPolarHBondContact O-CB 3.23Å; Q194-N198 VanDerWaalsContact O-CG 3.27Å; Q194-N198 PolarHBondContact O-N 3.08Å; Q194-N198 PolarHBondContact O-ND2 3.11Å; T195-N198 PolarHBondContact O-N 3.28Å; F196-N198 VanDerWaalsContact C-N 3.33Å; F196-N198 PolarHBondContact O-N 2.79Å; N198-R201 PolarHBondContact O-N 3.48Å; N198-A202 WeakPolarHBondContact O-CB 3.45Å; N198-A202 PolarHBondContact O-N 3.33Å
199E66.9Low66.1Low55 Ų5554.3 Ų54.326%0.25731%0.306SS..Hα-helixtrans-64.4-44.3175.3-73.7-170.6153.400112.2P113 T116 T195 F196 R201 A202 S203P113-E199 HydrophobicContact CG-CB 4.39Å; P113-E199 WeakPolarHBondContact CG-OE2 3.32Å; T116-E199 PolarHBondContact OG1-OE1 2.95Å; T195-E199 WeakPolarHBondContact O-CG 3.17Å; T195-E199 PolarHBondContact O-N 2.77Å; F196-E199 PolarHBondContact O-N 3.21Å; E199-R201 VanDerWaalsContact C-N 3.29Å; E199-R201 PolarHBondContact O-N 2.87Å; E199-A202 PolarHBondContact O-N 3.24Å; E199-S203 WeakPolarHBondContact O-CB 2.87Å; E199-S203 PolarHBondContact O-N 2.57Å; E199-S203 PolarHBondContact O-OG 2.94Å
200Q65Low66.2Low33 Ų3349.9 Ų49.915%0.15428%0.279CS..Hα-helixtrans-63.6-36.9175.8-79.5-63.3-29.100112.3F196 I197 A202 H204 C205 F208F196-Q200 HydrophobicContact CE1-CG 4Å; F196-Q200 HydrophobicContact CE2-CG 4.06Å; F196-Q200 HydrophobicContact CZ-CG 3.75Å; F196-Q200 WeakPolarHBondContact O-CB 3.39Å; F196-Q200 PolarHBondContact O-N 3.02Å; I197-Q200 PolarHBondContact O-N 3.01Å; Q200-A202 VanDerWaalsContact C-N 3.35Å; Q200-H204 PolarHBondContact O-N 3.4Å; Q200-H204 PolarHBondContact OE1-CD2 2.91Å; Q200-C205 PolarHBondContact O-N 3.46Å; Q200-F208 HydrophobicContact CB-CD1 4.02Å; Q200-F208 HydrophobicContact CB-CD2 4.39Å; Q200-F208 HydrophobicContact CB-CE1 4.15Å; Q200-F208 HydrophobicContact CB-CG 4.14Å; Q200-F208 HydrophobicContact CB-CZ 4.39Å; Q200-F208 HydrophobicContact CG-CZ 4.42Å
201R69.4Low66.6Low90 Ų9049.3 Ų49.334%0.3428%0.276SS..Hα-helixtrans-63.5-42175.3-166.9178.4-70.6162-0.8112.1I197 N198 E199 C205 P206I197-R201 WeakPolarHBondContact O-CB 3.27Å; I197-R201 PolarHBondContact O-N 3.05Å; N198-R201 PolarHBondContact O-N 3.48Å; E199-R201 VanDerWaalsContact C-N 3.29Å; E199-R201 PolarHBondContact O-N 2.87Å; R201-C205 VanDerWaalsContact CA-O 3.3Å; R201-C205 WeakPolarHBondContact CA-O 3.47Å; R201-P206 WeakPolarHBondContact CD-O 3.48Å; R201-P206 WeakPolarHBondContact CG-O 3.37Å; R201-P206 PolarHBondContact NE-O 2.6Å
202A68.5Low67Low93 Ų9345.5 Ų45.577%0.76926%0.255SS*.Hα-helixtrans-72-34.2-179.800000113.4N198 E199 Q200N198-A202 WeakPolarHBondContact O-CB 3.45Å; N198-A202 PolarHBondContact O-N 3.33Å; E199-A202 PolarHBondContact O-N 3.24Å; Q200-A202 VanDerWaalsContact C-N 3.35Å
203S63.5Low67.6Low67 Ų6744.3 Ų44.347%0.46925%0.249SC..Hα-helixtrans-100.8-32.9-16955.80000115E199E199-S203 WeakPolarHBondContact O-CB 2.87Å; E199-S203 PolarHBondContact O-N 2.57Å; E199-S203 PolarHBondContact O-OG 2.94Å
204H65Low68.4Low134 Ų13445.3 Ų45.362%0.6225%0.252SS*.THydrogen-bonded Turntrans-132.9-39.4-167.8-69.1-72.9000115.1Q200Q200-H204 PolarHBondContact O-N 3.4Å; Q200-H204 PolarHBondContact OE1-CD2 2.91Å
205C66.3Low69.1Low7 Ų743.8 Ų43.85%0.04725%0.246CC..  trans-149.5107.8-172.5-173.30000113.8C37 Q200 R201 D207 F208C37-C205 HydrophobicContact CB-CB 4.01Å; C37-C205 WeakPolarHBondContact CB-SG 3.12Å; C37-C205 WeakPolarHBondContact SG-CB 3.39Å; C37-C205 CovalentContact SG-SG 2.03Å; C37-C205 PolarHBondContact SG-SG 3.42Å; Q200-C205 PolarHBondContact O-N 3.46Å; R201-C205 VanDerWaalsContact CA-O 3.3Å; R201-C205 WeakPolarHBondContact CA-O 3.47Å; C205-D207 VanDerWaalsContact C-N 3.26Å; C205-D207 PolarHBondContact O-N 3.2Å; C205-F208 HydrophobicContact CB-CB 4.25Å; C205-F208 WeakPolarHBondContact O-CB 3.06Å; C205-F208 PolarHBondContact O-N 3.46Å
206P65.5Low70.1Confident95 Ų9546.4 Ų46.462%0.61726%0.257SS*.THydrogen-bonded Turntrans-58.6-31.8-179.1-24.133.5000114.8R201R201-P206 WeakPolarHBondContact CD-O 3.48Å; R201-P206 WeakPolarHBondContact CG-O 3.37Å; R201-P206 PolarHBondContact NE-O 2.6Å
207D66.1Low71.3Confident28 Ų2845.9 Ų45.915%0.1526%0.255CS..THydrogen-bonded Turntrans-102.735.7-179.9-62-54.3000112.3C205 T209C205-D207 VanDerWaalsContact C-N 3.26Å; C205-D207 PolarHBondContact O-N 3.2Å; D207-T209 PolarHBondContact O-N 3.37Å
208F65.8Low72.4Confident9 Ų946.3 Ų46.34%0.03926%0.256CS..EExtended strand (participates in β ladder)trans-67124.4177.4-173.8-103.9000111.3Q35 F196 I197 Q200 C205 L210Q35-F208 HydrophobicContact CB-CE2 4.01Å; Q35-F208 HydrophobicContact CB-CZ 4.19Å; Q35-F208 HydrophobicContact CG-CE2 4.14Å; Q35-F208 HydrophobicContact CG-CZ 3.82Å; F196-F208 HydrophobicContact CE1-CE1 4.27Å; F196-F208 HydrophobicContact CE1-CZ 4.09Å; I197-F208 HydrophobicContact CB-CD1 4.42Å; I197-F208 HydrophobicContact CG1-CD1 4.27Å; I197-F208 HydrophobicContact CG1-CE1 4.03Å; I197-F208 HydrophobicContact CG2-CD1 4.22Å; Q200-F208 HydrophobicContact CB-CD1 4.02Å; Q200-F208 HydrophobicContact CB-CD2 4.39Å; Q200-F208 HydrophobicContact CB-CE1 4.15Å; Q200-F208 HydrophobicContact CB-CG 4.14Å; Q200-F208 HydrophobicContact CB-CZ 4.39Å; Q200-F208 HydrophobicContact CG-CZ 4.42Å; C205-F208 HydrophobicContact CB-CB 4.25Å; C205-F208 WeakPolarHBondContact O-CB 3.06Å; C205-F208 PolarHBondContact O-N 3.46Å; F208-L210 HydrophobicContact CE1-CB 3.85Å; F208-L210 HydrophobicContact CE1-CD1 3.9Å; F208-L210 HydrophobicContact CE1-CG 4.48Å; F208-L210 HydrophobicContact CZ-CB 4.31Å; F208-L210 HydrophobicContact CZ-CD1 4.01Å
209T65.1Low73.6Confident48 Ų4844.5 Ų44.529%0.29425%0.249SC..EExtended strand (participates in β ladder)trans-125.3131.5177.542.30000109.9Q35 T36 D207Q35-T209 WeakPolarHBondContact CA-O 3.24Å; T36-T209 PolarHBondContact N-O 3.18Å; T36-T209 PolarHBondContact O-N 3.46Å; T36-T209 PolarHBondContact O-OG1 3Å; T36-T209 PolarHBondContact OG1-OG1 3.3Å; D207-T209 PolarHBondContact O-N 3.37Å
210L68.1Low75Confident9 Ų943.8 Ų43.85%0.04725%0.245CC..EExtended strand (participates in β ladder)trans-128.8114.9-177.2-171.2153000108.8Q35 V193 F196 I197 F208 L212Q35-L210 HydrophobicContact CG-CD1 4.11Å; Q35-L210 HydrophobicContact CG-CG 4.22Å; V193-L210 HydrophobicContact CG1-CD2 4.11Å; F196-L210 HydrophobicContact CD1-CD1 3.99Å; F196-L210 HydrophobicContact CE1-CD1 3.95Å; I197-L210 HydrophobicContact CD1-CB 4.02Å; I197-L210 HydrophobicContact CG1-CB 3.99Å; I197-L210 HydrophobicContact CG1-CD1 4.31Å; F208-L210 HydrophobicContact CE1-CB 3.85Å; F208-L210 HydrophobicContact CE1-CD1 3.9Å; F208-L210 HydrophobicContact CE1-CG 4.48Å; F208-L210 HydrophobicContact CZ-CB 4.31Å; F208-L210 HydrophobicContact CZ-CD1 4.01Å; L210-L212 HydrophobicContact CD2-CD1 3.25Å; L210-L212 HydrophobicContact CD2-CD2 4.39Å; L210-L212 HydrophobicContact CD2-CG 3.44Å; L210-L212 VanDerWaalsContact CD2-CG 3.44Å
211N70.5Confident76.4Confident40 Ų4042.2 Ų42.221%0.21424%0.237CC..EExtended strand (participates in β ladder)trans-101.4128.3175.1-173.734.2000108.9A33 S34 T49A33-N211 CarbonylContact C-O 3.58Å; A33-N211 VanDerWaalsContact CA-O 3.24Å; A33-N211 WeakPolarHBondContact CA-O 3.35Å; S34-N211 PolarHBondContact N-O 2.9Å; S34-N211 PolarHBondContact O-N 3.49Å; T49-N211 PolarHBondContact O-OD1 3.44Å
212L72.2Confident77.7Confident6 Ų641.8 Ų41.83%0.03124%0.241CC..EExtended strand (participates in β ladder)trans-112.5138.5-178.9-86.9144.7000110.2L31 L32 A33 L48 I50 T51 V193 L210L31-L212 HydrophobicContact CD1-CD2 3.89Å; L31-L212 HydrophobicContact CD2-CD2 3.5Å; L31-L212 VanDerWaalsContact CD2-CD2 3.5Å; L31-L212 HydrophobicContact CG-CD2 3.8Å; L32-L212 CarbonylContact O-C 3.56Å; A33-L212 HydrophobicContact CB-CD2 4.04Å; A33-L212 HydrophobicContact CB-CG 4.35Å; L48-L212 HydrophobicContact CD1-CD1 4.3Å; I50-L212 WeakPolarHBondContact CA-O 3.26Å; I50-L212 HydrophobicContact CG1-CB 4.34Å; T51-L212 PolarHBondContact N-O 3.17Å; V193-L212 HydrophobicContact CB-CD1 4.13Å; V193-L212 HydrophobicContact CG1-CD1 3.3Å; V193-L212 HydrophobicContact CG2-CD1 3.69Å; L210-L212 HydrophobicContact CD2-CD1 3.25Å; L210-L212 HydrophobicContact CD2-CD2 4.39Å; L210-L212 HydrophobicContact CD2-CG 3.44Å; L210-L212 VanDerWaalsContact CD2-CG 3.44Å
213S79.5Confident79Confident2 Ų240.1 Ų40.11%0.01422%0.219CC..EExtended strand (participates in β ladder)trans-144.1132.5179.2-60.40000113.2L32 T51 S215L32-S213 PolarHBondContact N-O 2.58Å; L32-S213 PolarHBondContact O-N 2.99Å; T51-S213 WeakPolarHBondContact O-CA 3.48Å; T51-S213 WeakPolarHBondContact O-CB 3.43Å; T51-S213 PolarHBondContact O-OG 2.77Å; T51-S213 PolarHBondContact OG1-OG 3.5Å; T51-S213 VanDerWaalsContact OG1-OG 3.08Å; S213-S215 PolarHBondContact O-N 2.83Å
214Y82.9Confident80.6Confident27 Ų2737 Ų3711%0.10620%0.197CC..EExtended strand (participates in β ladder)trans-67.4132.9173.1-65.8-70.1000110L31 I50 A53 V184 L187 Q188 F218L31-Y214 HydrophobicContact CD1-CD1 4.25Å; L31-Y214 HydrophobicContact CD1-CE1 4.38Å; I50-Y214 HydrophobicContact CG2-CE2 4.14Å; A53-Y214 WeakPolarHBondContact CB-O 2.96Å; A53-Y214 PolarHBondContact N-O 3.34Å; V184-Y214 HydrophobicContact CG2-CE1 4.45Å; L187-Y214 HydrophobicContact CD1-CE1 4.1Å; Q188-Y214 PolarHBondContact NE2-OH 3.49Å; Q188-Y214 VanDerWaalsContact NE2-OH 3.12Å; Y214-F218 HydrophobicContact CD1-CD1 4.06Å; Y214-F218 AromaticContact CD1-CD2 3.88Å; Y214-F218 HydrophobicContact CD1-CD2 3.88Å; Y214-F218 HydrophobicContact CD1-CE1 4.21Å; Y214-F218 HydrophobicContact CD1-CE2 4.05Å; Y214-F218 AromaticContact CD1-CG 3.89Å; Y214-F218 HydrophobicContact CD1-CG 3.89Å; Y214-F218 HydrophobicContact CD1-CZ 4.21Å; Y214-F218 HydrophobicContact CE1-CD2 4.32Å; Y214-F218 HydrophobicContact CE1-CE2 4.08Å; Y214-F218 HydrophobicContact CE1-CZ 4.25Å; Y214-F218 HydrophobicContact CG-CD1 4.04Å; Y214-F218 HydrophobicContact CG-CE1 4.22Å; Y214-F218 HydrophobicContact CG-CG 4.27Å
215S83.4Confident82.2Confident12 Ų1231.1 Ų31.18%0.08417%0.17CC..  trans-96175.2-176-71.50000112.2Y29 W30 L32 S213 S217 F218Y29-S215 CarbonylContact O-C 3.51Å; Y29-S215 WeakPolarHBondContact O-CB 3.12Å; W30-S215 PolarHBondContact O-N 3.02Å; L32-S215 WeakPolarHBondContact CB-OG 3.43Å; L32-S215 PolarHBondContact N-OG 2.85Å; S213-S215 PolarHBondContact O-N 2.83Å; S215-S217 VanDerWaalsContact C-N 3.27Å; S215-S217 PolarHBondContact O-N 3.5Å; S215-F218 WeakPolarHBondContact O-CB 3.42Å; S215-F218 PolarHBondContact O-N 3.25Å; S215-F218 VanDerWaalsContact O-N 3.11Å
216L86.9Confident83.7Confident113 Ų11336.9 Ų36.959%0.59219%0.194SC*.Hα-helixtrans-58.7-34.6-171.4-148.980.5000113.3F218 V219 F220L216-F218 VanDerWaalsContact C-N 3.28Å; L216-F218 PolarHBondContact O-N 3.15Å; L216-V219 PolarHBondContact O-N 2.76Å; L216-V219 VanDerWaalsContact O-N 3.15Å; L216-F220 HydrophobicContact CB-CE2 4.33Å; L216-F220 HydrophobicContact CD2-CE1 4.17Å; L216-F220 HydrophobicContact CD2-CE2 3.46Å; L216-F220 VanDerWaalsContact CD2-CE2 3.46Å; L216-F220 HydrophobicContact CD2-CZ 3.24Å; L216-F220 HydrophobicContact CG-CD2 4.46Å; L216-F220 HydrophobicContact CG-CE1 4.18Å; L216-F220 HydrophobicContact CG-CE2 3.8Å; L216-F220 HydrophobicContact CG-CZ 3.65Å; L216-F220 WeakPolarHBondContact O-CD2 3.5Å; L216-F220 WeakPolarHBondContact O-CG 3.35Å; L216-F220 PolarHBondContact O-N 3.26Å
217S90.9Very high85.3Confident0 Ų034.2 Ų34.20%017%0.173CC..Hα-helixtrans-67-30.8-179.5-45.10000112.4S24 T27 Y29 S215 F220 A221S24-S217 WeakPolarHBondContact CB-O 2.9Å; S24-S217 WeakPolarHBondContact O-CB 3.47Å; S24-S217 PolarHBondContact OG-O 2.95Å; T27-S217 PolarHBondContact OG1-OG 2.86Å; Y29-S217 VanDerWaalsContact C-CB 3.4Å; Y29-S217 WeakPolarHBondContact CA-OG 3.49Å; Y29-S217 WeakPolarHBondContact CB-OG 2.77Å; Y29-S217 PolarHBondContact N-OG 3.43Å; Y29-S217 WeakPolarHBondContact O-CB 3.34Å; Y29-S217 PolarHBondContact O-N 3.34Å; Y29-S217 PolarHBondContact O-OG 2.91Å; S215-S217 VanDerWaalsContact C-N 3.27Å; S215-S217 PolarHBondContact O-N 3.5Å; S217-F220 PolarHBondContact O-N 3.14Å; S217-A221 PolarHBondContact O-N 3.31Å
218F91.4Very high86.8Confident18 Ų1832.9 Ų32.98%0.07917%0.166CC..Hα-helixtrans-65.1-43.7172.4-177.6-92.5000110.9W30 V180 V184 Y214 S215 L216 A221 L222W30-F218 HydrophobicContact CE3-CB 4.19Å; W30-F218 AromaticContact CE3-CD2 3.73Å; W30-F218 HydrophobicContact CE3-CD2 3.73Å; W30-F218 HydrophobicContact CE3-CG 4.45Å; W30-F218 AromaticContact CZ3-CD2 3.73Å; W30-F218 HydrophobicContact CZ3-CD2 3.73Å; W30-F218 HydrophobicContact CZ3-CE2 4.44Å; V180-F218 HydrophobicContact CG1-CE2 3.76Å; V180-F218 HydrophobicContact CG1-CZ 3.84Å; V184-F218 HydrophobicContact CG2-CE2 3.81Å; V184-F218 HydrophobicContact CG2-CZ 3.76Å; Y214-F218 HydrophobicContact CD1-CD1 4.06Å; Y214-F218 AromaticContact CD1-CD2 3.88Å; Y214-F218 HydrophobicContact CD1-CD2 3.88Å; Y214-F218 HydrophobicContact CD1-CE1 4.21Å; Y214-F218 HydrophobicContact CD1-CE2 4.05Å; Y214-F218 AromaticContact CD1-CG 3.89Å; Y214-F218 HydrophobicContact CD1-CG 3.89Å; Y214-F218 HydrophobicContact CD1-CZ 4.21Å; Y214-F218 HydrophobicContact CE1-CD2 4.32Å; Y214-F218 HydrophobicContact CE1-CE2 4.08Å; Y214-F218 HydrophobicContact CE1-CZ 4.25Å; Y214-F218 HydrophobicContact CG-CD1 4.04Å; Y214-F218 HydrophobicContact CG-CE1 4.22Å; Y214-F218 HydrophobicContact CG-CG 4.27Å; S215-F218 WeakPolarHBondContact O-CB 3.42Å; S215-F218 PolarHBondContact O-N 3.25Å; S215-F218 VanDerWaalsContact O-N 3.11Å; L216-F218 VanDerWaalsContact C-N 3.28Å; L216-F218 PolarHBondContact O-N 3.15Å; F218-A221 VanDerWaalsContact O-CB 3.31Å; F218-A221 WeakPolarHBondContact O-CB 3.44Å; F218-A221 PolarHBondContact O-N 2.75Å; F218-L222 HydrophobicContact CD1-CD1 4.26Å; F218-L222 HydrophobicContact CE1-CD1 3.83Å; F218-L222 HydrophobicContact CE1-CG 4.37Å; F218-L222 PolarHBondContact O-N 2.99Å
219V93.1Very high88.3Confident49 Ų4935.2 Ų35.230%0.29718%0.178SC..Hα-helixtrans-65-42.2177-178.30000110.9L52 L216 A221 L222 I223L52-V219 HydrophobicContact CD2-CG2 4.18Å; L216-V219 PolarHBondContact O-N 2.76Å; L216-V219 VanDerWaalsContact O-N 3.15Å; V219-A221 VanDerWaalsContact C-N 3.28Å; V219-A221 PolarHBondContact O-N 2.87Å; V219-L222 PolarHBondContact O-N 3.36Å; V219-I223 HydrophobicContact CG1-CD1 3.98Å; V219-I223 WeakPolarHBondContact O-CG1 3.33Å; V219-I223 PolarHBondContact O-N 3.46Å; V219-I223 VanDerWaalsContact O-N 3.13Å
220F95.1Very high89.8Confident40 Ų4035.5 Ų35.518%0.17518%0.178CC..Hα-helixtrans-60.4-36.3173.9-64.9-32000112.7F20 L23 L216 S217 L222 I223 G224F20-F220 HydrophobicContact CD1-CB 4.27Å; F20-F220 AromaticContact CD1-CD1 3.67Å; F20-F220 HydrophobicContact CD1-CD1 3.67Å; F20-F220 HydrophobicContact CD1-CE1 4.28Å; F20-F220 HydrophobicContact CD1-CG 4.16Å; F20-F220 AromaticContact CE1-CD1 3.89Å; F20-F220 HydrophobicContact CE1-CD1 3.89Å; F20-F220 HydrophobicContact CE1-CE1 4.11Å; L23-F220 HydrophobicContact CB-CD2 3.94Å; L23-F220 HydrophobicContact CB-CE2 4.35Å; L23-F220 HydrophobicContact CB-CG 4.47Å; L216-F220 HydrophobicContact CB-CE2 4.33Å; L216-F220 HydrophobicContact CD2-CE1 4.17Å; L216-F220 HydrophobicContact CD2-CE2 3.46Å; L216-F220 VanDerWaalsContact CD2-CE2 3.46Å; L216-F220 HydrophobicContact CD2-CZ 3.24Å; L216-F220 HydrophobicContact CG-CD2 4.46Å; L216-F220 HydrophobicContact CG-CE1 4.18Å; L216-F220 HydrophobicContact CG-CE2 3.8Å; L216-F220 HydrophobicContact CG-CZ 3.65Å; L216-F220 WeakPolarHBondContact O-CD2 3.5Å; L216-F220 WeakPolarHBondContact O-CG 3.35Å; L216-F220 PolarHBondContact O-N 3.26Å; S217-F220 PolarHBondContact O-N 3.14Å; F220-L222 PolarHBondContact O-N 3.38Å; F220-I223 PolarHBondContact O-N 3.48Å; F220-G224 PolarHBondContact O-N 2.87Å
221A95.2Very high91.2Very high0 Ų035.1 Ų35.10%018%0.176CC..Hα-helixtrans-58.2-48.3174.600000111.5S24 W30 M176 V180 S217 F218 V219 I223 G224 I225S24-A221 WeakPolarHBondContact OG-CB 3.33Å; W30-A221 HydrophobicContact CH2-CB 3.49Å; W30-A221 VanDerWaalsContact CH2-CB 3.49Å; W30-A221 HydrophobicContact CZ2-CB 4.04Å; W30-A221 HydrophobicContact CZ3-CB 4.22Å; M176-A221 HydrophobicContact CE-CB 3.61Å; V180-A221 HydrophobicContact CG2-CB 3.8Å; S217-A221 PolarHBondContact O-N 3.31Å; F218-A221 VanDerWaalsContact O-CB 3.31Å; F218-A221 WeakPolarHBondContact O-CB 3.44Å; F218-A221 PolarHBondContact O-N 2.75Å; V219-A221 VanDerWaalsContact C-N 3.28Å; V219-A221 PolarHBondContact O-N 2.87Å; A221-I223 PolarHBondContact O-N 2.89Å; A221-G224 PolarHBondContact O-N 2.96Å; A221-I225 WeakPolarHBondContact O-CD1 3.32Å; A221-I225 WeakPolarHBondContact O-CG1 3.4Å; A221-I225 PolarHBondContact O-N 2.79Å
222L95.9Very high92.5Very high80 Ų8033.2 Ų33.242%0.41917%0.166SC..Hα-helixtrans-61.2-45.6-179.5-64.8177.8000112V180 F218 V219 F220 G224 I225 F226V180-L222 HydrophobicContact CG1-CD2 3.88Å; F218-L222 HydrophobicContact CD1-CD1 4.26Å; F218-L222 HydrophobicContact CE1-CD1 3.83Å; F218-L222 HydrophobicContact CE1-CG 4.37Å; F218-L222 PolarHBondContact O-N 2.99Å; V219-L222 PolarHBondContact O-N 3.36Å; F220-L222 PolarHBondContact O-N 3.38Å; L222-G224 VanDerWaalsContact C-N 3.35Å; L222-I225 PolarHBondContact O-N 3.01Å; L222-F226 PolarHBondContact O-N 3.39Å
223I97.3Very high93.7Very high59 Ų5937.5 Ų37.530%0.30319%0.188SC..Hα-helixtrans-64.3-43.8177.3-61.9169.3000110.1F20 V219 F220 A221 I225 F226 F227F20-I223 HydrophobicContact CD1-CG2 4.43Å; F20-I223 HydrophobicContact CD2-CB 4.42Å; F20-I223 HydrophobicContact CD2-CG2 3.56Å; F20-I223 HydrophobicContact CE1-CG2 4.47Å; F20-I223 HydrophobicContact CE2-CG2 3.61Å; F20-I223 HydrophobicContact CG-CB 4.42Å; F20-I223 HydrophobicContact CG-CG2 4.01Å; F20-I223 HydrophobicContact CZ-CG2 4.09Å; V219-I223 HydrophobicContact CG1-CD1 3.98Å; V219-I223 WeakPolarHBondContact O-CG1 3.33Å; V219-I223 PolarHBondContact O-N 3.46Å; V219-I223 VanDerWaalsContact O-N 3.13Å; F220-I223 PolarHBondContact O-N 3.48Å; A221-I223 PolarHBondContact O-N 2.89Å; I223-I225 PolarHBondContact O-N 2.82Å; I223-F226 PolarHBondContact O-N 2.86Å; I223-F227 HydrophobicContact CG2-CD2 3.66Å; I223-F227 HydrophobicContact CG2-CE2 3.55Å; I223-F227 VanDerWaalsContact O-CD2 3.28Å; I223-F227 WeakPolarHBondContact O-CD2 3.4Å; I223-F227 PolarHBondContact O-N 3.21Å; I223-F227 VanDerWaalsContact O-N 3.16Å
224G97.3Very high94.4Very high0 Ų039.5 Ų39.50%020%0.199CC..Hα-helixtrans-59.8-43.6176.800000112.9F220 A221 L222 F226 F227 A228F220-G224 PolarHBondContact O-N 2.87Å; A221-G224 PolarHBondContact O-N 2.96Å; L222-G224 VanDerWaalsContact C-N 3.35Å; G224-F226 PolarHBondContact O-N 3.03Å; G224-F227 PolarHBondContact O-N 2.84Å; G224-A228 WeakPolarHBondContact O-CB 3.48Å; G224-A228 PolarHBondContact O-N 3.48Å
225I98.1Very high95Very high12 Ų1238.4 Ų38.46%0.06219%0.194CC..Hα-helixtrans-56.8-51.4175.8-71.7157.1000110.5M176 L177 V180 A221 L222 I223 F227 A228 L229M176-I225 HydrophobicContact CB-CD1 4.23Å; M176-I225 HydrophobicContact CB-CG1 3.7Å; M176-I225 HydrophobicContact CG-CD1 4.06Å; M176-I225 HydrophobicContact CG-CG1 3.76Å; L177-I225 HydrophobicContact CB-CD1 4.22Å; L177-I225 HydrophobicContact CB-CG2 4.28Å; L177-I225 HydrophobicContact CD1-CD1 4.43Å; V180-I225 HydrophobicContact CB-CD1 4.49Å; V180-I225 HydrophobicContact CG2-CD1 3.91Å; A221-I225 WeakPolarHBondContact O-CD1 3.32Å; A221-I225 WeakPolarHBondContact O-CG1 3.4Å; A221-I225 PolarHBondContact O-N 2.79Å; L222-I225 PolarHBondContact O-N 3.01Å; I223-I225 PolarHBondContact O-N 2.82Å; I225-F227 PolarHBondContact O-N 3.11Å; I225-A228 PolarHBondContact O-N 3.47Å; I225-L229 HydrophobicContact CG2-CD1 3.82Å; I225-L229 HydrophobicContact CG2-CG 4.37Å; I225-L229 WeakPolarHBondContact O-CB 3.41Å; I225-L229 VanDerWaalsContact O-CG 3.3Å; I225-L229 WeakPolarHBondContact O-CG 3.42Å; I225-L229 PolarHBondContact O-N 3.01Å
226F98Very high95.6Very high127 Ų12740.2 Ų40.256%0.55720%0.203SC*.Hα-helixtrans-57.7-51.1-178.3174.1-99.8000111.7L222 I223 G224 L229 L230L222-F226 PolarHBondContact O-N 3.39Å; I223-F226 PolarHBondContact O-N 2.86Å; G224-F226 PolarHBondContact O-N 3.03Å; F226-L229 PolarHBondContact O-N 2.84Å; F226-L230 HydrophobicContact CE1-CD2 4.26Å; F226-L230 HydrophobicContact CZ-CD2 4.32Å; F226-L230 WeakPolarHBondContact O-CB 3.44Å; F226-L230 PolarHBondContact O-N 3.35Å
227F98.1Very high95.9Very high40 Ų4039.8 Ų39.818%0.17520%0.201CC..Hα-helixtrans-68.1-37.7-179.4-76.3-61.3000112.9F13 L16 F20 I223 G224 I225 L230 A231F13-F227 HydrophobicContact CB-CD1 4.15Å; F13-F227 AromaticContact CD1-CD1 3.8Å; F13-F227 HydrophobicContact CD1-CD1 3.8Å; F13-F227 AromaticContact CD1-CE1 3.78Å; F13-F227 HydrophobicContact CD1-CE1 3.78Å; F13-F227 HydrophobicContact CE1-CE1 4.11Å; F13-F227 HydrophobicContact CG-CD1 4.14Å; L16-F227 HydrophobicContact CB-CD2 4.27Å; L16-F227 HydrophobicContact CB-CG 4.27Å; L16-F227 HydrophobicContact CD1-CE1 4.33Å; L16-F227 HydrophobicContact CD1-CZ 4.31Å; F20-F227 HydrophobicContact CD2-CD2 4.24Å; F20-F227 HydrophobicContact CE2-CD2 4.37Å; F20-F227 HydrophobicContact CE2-CE2 4.27Å; I223-F227 HydrophobicContact CG2-CD2 3.66Å; I223-F227 HydrophobicContact CG2-CE2 3.55Å; I223-F227 VanDerWaalsContact O-CD2 3.28Å; I223-F227 WeakPolarHBondContact O-CD2 3.4Å; I223-F227 PolarHBondContact O-N 3.21Å; I223-F227 VanDerWaalsContact O-N 3.16Å; G224-F227 PolarHBondContact O-N 2.84Å; I225-F227 PolarHBondContact O-N 3.11Å; F227-L230 PolarHBondContact O-N 3.21Å; F227-A231 WeakPolarHBondContact O-CB 3.48Å; F227-A231 PolarHBondContact O-N 2.99Å
228A97.9Very high95.9Very high0 Ų040.1 Ų40.10%020%0.202CC..Hα-helixtrans-64-44.1177.400000111.8I21 F169 G224 I225 G232I21-A228 HydrophobicContact CD1-CB 3.98Å; F169-A228 HydrophobicContact CD1-CB 4.22Å; G224-A228 WeakPolarHBondContact O-CB 3.48Å; G224-A228 PolarHBondContact O-N 3.48Å; I225-A228 PolarHBondContact O-N 3.47Å; A228-G232 PolarHBondContact O-N 3.01Å
229L97.9Very high95.9Very high57 Ų5739.3 Ų39.330%0.29820%0.199SC..Hα-helixtrans-65-45.6177-68.8176.1000111.6L170 I225 F226 G232 L233L170-L229 HydrophobicContact CD2-CD2 3.97Å; L170-L229 WeakPolarHBondContact CD2-O 3.31Å; I225-L229 HydrophobicContact CG2-CD1 3.82Å; I225-L229 HydrophobicContact CG2-CG 4.37Å; I225-L229 WeakPolarHBondContact O-CB 3.41Å; I225-L229 VanDerWaalsContact O-CG 3.3Å; I225-L229 WeakPolarHBondContact O-CG 3.42Å; I225-L229 PolarHBondContact O-N 3.01Å; F226-L229 PolarHBondContact O-N 2.84Å; L229-G232 PolarHBondContact O-N 2.66Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 2.96Å
230L97.3Very high95.8Very high55 Ų5544.8 Ų44.829%0.28821%0.214SC..Hα-helixtrans-62.2-46.4178.2-177.460.7000111.6F13 F226 F227 L233 L234F13-L230 HydrophobicContact CD2-CD2 3.64Å; F13-L230 HydrophobicContact CD2-CG 4.03Å; F13-L230 HydrophobicContact CE2-CD2 3.7Å; F13-L230 HydrophobicContact CE2-CG 4.4Å; F13-L230 HydrophobicContact CG-CD2 4.3Å; F13-L230 HydrophobicContact CZ-CD2 4.39Å; F226-L230 HydrophobicContact CE1-CD2 4.26Å; F226-L230 HydrophobicContact CZ-CD2 4.32Å; F226-L230 WeakPolarHBondContact O-CB 3.44Å; F226-L230 PolarHBondContact O-N 3.35Å; F227-L230 PolarHBondContact O-N 3.21Å; L230-L233 PolarHBondContact O-N 3.18Å; L230-L234 HydrophobicContact CG-CD1 4.26Å; L230-L234 VanDerWaalsContact O-CG 3.31Å; L230-L234 WeakPolarHBondContact O-CG 3.08Å; L230-L234 PolarHBondContact O-N 2.72Å
231A97Very high95.6Very high0 Ų045.4 Ų45.40%022%0.221CC..Hα-helixtrans-61.8-43.9176.700000111.7F13 F169 F227 L233 L234 F235F13-A231 HydrophobicContact CB-CB 4.12Å; F169-A231 HydrophobicContact CD1-CB 4.32Å; F227-A231 WeakPolarHBondContact O-CB 3.48Å; F227-A231 PolarHBondContact O-N 2.99Å; A231-L233 PolarHBondContact O-N 3.12Å; A231-L234 PolarHBondContact O-N 2.78Å; A231-F235 HydrophobicContact CB-CD2 4.37Å; A231-F235 HydrophobicContact CB-CE2 4.12Å; A231-F235 WeakPolarHBondContact O-CD2 3.3Å; A231-F235 WeakPolarHBondContact O-CG 3.21Å; A231-F235 PolarHBondContact O-N 3.41Å
232G96.8Very high95.2Very high0 Ų046 Ų460%023%0.225CC..Hα-helixtrans-57.8-46.7177.200000112.8G166 A228 L229 F235 L236G166-G232 VanDerWaalsContact O-CA 3.26Å; G166-G232 WeakPolarHBondContact O-CA 3.35Å; A228-G232 PolarHBondContact O-N 3.01Å; L229-G232 PolarHBondContact O-N 2.66Å; G232-F235 PolarHBondContact O-N 3.06Å; G232-L236 WeakPolarHBondContact O-CG 3.07Å; G232-L236 PolarHBondContact O-N 2.98Å; G232-L236 VanDerWaalsContact O-N 3.07Å
233L97.1Very high94.8Very high97 Ų9747.8 Ų47.851%0.50823%0.229SC..Hα-helixtrans-60.6-45.7174.5-70174.4000111.9L170 L229 L230 A231 L236 L237L170-L233 HydrophobicContact CD1-CD2 4.4Å; L170-L233 HydrophobicContact CD2-CD2 4.26Å; L170-L233 HydrophobicContact CD2-CG 4.06Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 2.96Å; L230-L233 PolarHBondContact O-N 3.18Å; A231-L233 PolarHBondContact O-N 3.12Å; L233-L236 PolarHBondContact O-N 2.86Å; L233-L237 WeakPolarHBondContact O-CG 3.2Å; L233-L237 PolarHBondContact O-N 2.9Å
234L95.6Very high94.3Very high44 Ų4450.4 Ų50.423%0.2324%0.243CC..Hα-helixtrans-62.4-44.7179.3-71171000111.8A10 F13 L230 A231 L236 L237 I238A10-L234 HydrophobicContact CB-CB 3.76Å; A10-L234 HydrophobicContact CB-CD1 4.24Å; F13-L234 HydrophobicContact CD2-CD1 3.73Å; F13-L234 HydrophobicContact CE2-CD1 4.19Å; L230-L234 HydrophobicContact CG-CD1 4.26Å; L230-L234 VanDerWaalsContact O-CG 3.31Å; L230-L234 WeakPolarHBondContact O-CG 3.08Å; L230-L234 PolarHBondContact O-N 2.72Å; A231-L234 PolarHBondContact O-N 2.78Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 3.26Å; L234-L237 PolarHBondContact O-N 3.43Å; L234-I238 WeakPolarHBondContact O-CB 3.33Å; L234-I238 WeakPolarHBondContact O-CD1 3.07Å; L234-I238 VanDerWaalsContact O-CG1 3.22Å; L234-I238 WeakPolarHBondContact O-CG1 3.25Å; L234-I238 PolarHBondContact O-N 2.99Å
235F95.4Very high93.3Very high3 Ų357.2 Ų57.21%0.01327%0.274CS..Hα-helixtrans-65-35.2177.9-72.6-52.9000112.9A10 I150 Y162 F169 A231 G232 I238 G239A10-F235 VanDerWaalsContact C-CZ 3.42Å; A10-F235 HydrophobicContact CB-CD1 3.84Å; A10-F235 HydrophobicContact CB-CE1 3.5Å; A10-F235 VanDerWaalsContact CB-CE1 3.5Å; A10-F235 HydrophobicContact CB-CE2 4.34Å; A10-F235 HydrophobicContact CB-CG 4.38Å; A10-F235 HydrophobicContact CB-CZ 3.77Å; A10-F235 VanDerWaalsContact O-CZ 3.27Å; A10-F235 WeakPolarHBondContact O-CZ 3.36Å; I150-F235 HydrophobicContact CD1-CB 4.06Å; I150-F235 HydrophobicContact CD1-CD1 3.72Å; I150-F235 HydrophobicContact CD1-CD2 3.91Å; I150-F235 HydrophobicContact CD1-CE1 4.1Å; I150-F235 HydrophobicContact CD1-CE2 4.27Å; I150-F235 HydrophobicContact CD1-CG 3.63Å; I150-F235 HydrophobicContact CD1-CZ 4.37Å; I150-F235 HydrophobicContact CG1-CD1 4.44Å; I150-F235 HydrophobicContact CG1-CD2 4.09Å; I150-F235 HydrophobicContact CG1-CE1 4.4Å; I150-F235 HydrophobicContact CG1-CE2 4.05Å; I150-F235 HydrophobicContact CG1-CG 4.3Å; I150-F235 HydrophobicContact CG1-CZ 4.22Å; I150-F235 HydrophobicContact CG2-CD1 4.35Å; I150-F235 HydrophobicContact CG2-CE1 3.63Å; I150-F235 HydrophobicContact CG2-CE2 4.21Å; I150-F235 HydrophobicContact CG2-CZ 3.56Å; Y162-F235 AromaticContact CD1-CD1 4Å; Y162-F235 HydrophobicContact CD1-CD1 4Å; Y162-F235 HydrophobicContact CE1-CD1 4.46Å; F169-F235 HydrophobicContact CD2-CD2 4.49Å; F169-F235 HydrophobicContact CE2-CE2 4.46Å; A231-F235 HydrophobicContact CB-CD2 4.37Å; A231-F235 HydrophobicContact CB-CE2 4.12Å; A231-F235 WeakPolarHBondContact O-CD2 3.3Å; A231-F235 WeakPolarHBondContact O-CG 3.21Å; A231-F235 PolarHBondContact O-N 3.41Å; G232-F235 PolarHBondContact O-N 3.06Å; F235-I238 HydrophobicContact CD1-CD1 4.34Å; F235-G239 PolarHBondContact O-N 2.65Å
236L94.7Very high91.6Very high51 Ų5166.2 Ų66.227%0.26732%0.316SS..Hα-helixtrans-64.1-43.6172-73.6174.9000112.2K163 L170 G232 L233 L234 G239 R240K163-L236 HydrophobicContact CB-CD2 4.19Å; K163-L236 HydrophobicContact CG-CD2 4.42Å; K163-L236 WeakPolarHBondContact O-CD2 3.31Å; L170-L236 HydrophobicContact CD1-CD1 3.47Å; L170-L236 VanDerWaalsContact CD1-CD1 3.47Å; L170-L236 HydrophobicContact CG-CD1 4.5Å; G232-L236 WeakPolarHBondContact O-CG 3.07Å; G232-L236 PolarHBondContact O-N 2.98Å; G232-L236 VanDerWaalsContact O-N 3.07Å; L233-L236 PolarHBondContact O-N 2.86Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 PolarHBondContact O-N 3.26Å; L236-G239 PolarHBondContact O-N 2.83Å; L236-R240 WeakPolarHBondContact O-CB 3.27Å; L236-R240 PolarHBondContact O-N 3.01Å
237L93.8Very high91.3Very high104 Ų10463.2 Ų63.255%0.54530%0.304SS..Hα-helixtrans-65.8-42.3177.2-69.5174000111.6L233 L234 R240 T241L233-L237 WeakPolarHBondContact O-CG 3.2Å; L233-L237 PolarHBondContact O-N 2.9Å; L234-L237 PolarHBondContact O-N 3.43Å; L237-R240 PolarHBondContact O-N 2.78Å; L237-T241 WeakPolarHBondContact O-CB 3.38Å; L237-T241 PolarHBondContact O-N 2.04Å; L237-T241 PolarHBondContact O-OG1 3.03Å
238I91.8Very high90.9Very high7 Ų764.4 Ų64.44%0.03631%0.31CS..Hα-helixtrans-60.6-50.2173.9-71.3163.8000109.8L3 A6 L7 A10 Y162 L234 F235 R240 T241 V242L3-I238 HydrophobicContact CD1-CG2 4.21Å; A6-I238 HydrophobicContact CB-CD1 4.45Å; A6-I238 HydrophobicContact CB-CG1 4.46Å; L7-I238 HydrophobicContact CD1-CG2 3.75Å; L7-I238 HydrophobicContact CG-CD1 4.46Å; A10-I238 HydrophobicContact CB-CD1 3.62Å; Y162-I238 HydrophobicContact CD1-CG2 4.23Å; Y162-I238 HydrophobicContact CD2-CG2 4.47Å; Y162-I238 HydrophobicContact CE1-CG2 4.48Å; Y162-I238 HydrophobicContact CG-CG2 4.24Å; L234-I238 WeakPolarHBondContact O-CB 3.33Å; L234-I238 WeakPolarHBondContact O-CD1 3.07Å; L234-I238 VanDerWaalsContact O-CG1 3.22Å; L234-I238 WeakPolarHBondContact O-CG1 3.25Å; L234-I238 PolarHBondContact O-N 2.99Å; F235-I238 HydrophobicContact CD1-CD1 4.34Å; I238-R240 VanDerWaalsContact C-N 3.28Å; I238-R240 PolarHBondContact O-N 3.29Å; I238-T241 WeakPolarHBondContact O-CA 3.47Å; I238-T241 WeakPolarHBondContact O-CB 3.21Å; I238-T241 PolarHBondContact O-N 2.03Å; I238-V242 HydrophobicContact CG2-CG2 4.29Å; I238-V242 WeakPolarHBondContact O-CG2 3.43Å; I238-V242 PolarHBondContact O-N 3.03Å
239G90.6Very high90.5Very high0 Ų068 Ų680%033%0.328CS..Hα-helixtrans-59.3-38.5177.400000112.5H159 F235 L236 K243H159-G239 WeakPolarHBondContact CB-O 3Å; F235-G239 PolarHBondContact O-N 2.65Å; L236-G239 PolarHBondContact O-N 2.83Å; G239-K243 PolarHBondContact O-N 3.1Å; G239-K243 VanDerWaalsContact O-N 3.12Å
240R91.2Very high90.1Very high164 Ų16468.6 Ų68.662%0.61933%0.329SS*.Hα-helixtrans-64-42.4172.4-174.4177.1-179.81690.1112L236 L237 I238 K243 I244L236-R240 WeakPolarHBondContact O-CB 3.27Å; L236-R240 PolarHBondContact O-N 3.01Å; L237-R240 PolarHBondContact O-N 2.78Å; I238-R240 VanDerWaalsContact C-N 3.28Å; I238-R240 PolarHBondContact O-N 3.29Å; R240-K243 PolarHBondContact O-N 3.15Å; R240-I244 HydrophobicContact CG-CD1 4.01Å; R240-I244 WeakPolarHBondContact O-CG1 3.14Å; R240-I244 PolarHBondContact O-N 2.85Å
241T89.9Confident89.6Confident54 Ų5469.5 Ų69.533%0.33133%0.332SS..Hα-helixtrans-65.7-44.2-179.9-56.50000111.2L3 L237 I238 K243 I244 H245L3-T241 HydrophobicContact CD1-CG2 4.04Å; L237-T241 WeakPolarHBondContact O-CB 3.38Å; L237-T241 PolarHBondContact O-N 2.04Å; L237-T241 PolarHBondContact O-OG1 3.03Å; I238-T241 WeakPolarHBondContact O-CA 3.47Å; I238-T241 WeakPolarHBondContact O-CB 3.21Å; I238-T241 PolarHBondContact O-N 2.03Å; T241-K243 VanDerWaalsContact C-N 3.34Å; T241-K243 PolarHBondContact O-N 3.39Å; T241-I244 PolarHBondContact O-N 2.95Å; T241-H245 PolarHBondContact O-CD2 3.12Å; T241-H245 VanDerWaalsContact O-CD2 3.28Å; T241-H245 PolarHBondContact O-N 3.39Å; T241-H245 VanDerWaalsContact O-N 3.14Å
242V87.5Confident89.1Confident11 Ų1174.1 Ų74.17%0.06735%0.354CS..Hα-helixtrans-59.3-45.8175.7175.40000110.3L3 H159 I238 I244 H245 H246L3-V242 HydrophobicContact CD2-CG2 4.18Å; H159-V242 HydrophobicContact CB-CB 4.1Å; H159-V242 HydrophobicContact CB-CG1 3.96Å; I238-V242 HydrophobicContact CG2-CG2 4.29Å; I238-V242 WeakPolarHBondContact O-CG2 3.43Å; I238-V242 PolarHBondContact O-N 3.03Å; V242-I244 PolarHBondContact O-N 2.83Å; V242-H245 PolarHBondContact O-N 3.06Å; V242-H246 WeakPolarHBondContact O-CB 3.46Å; V242-H246 PolarHBondContact O-N 2.96Å
243K88.4Confident88.6Confident119 Ų11979.4 Ų79.452%0.51738%0.379SS..Hα-helixtrans-60.2-30177.9-176.7177178.8178.10114.3H159 G239 R240 T241H159-K243 HydrophobicContact CB-CB 4.03Å; G239-K243 PolarHBondContact O-N 3.1Å; G239-K243 VanDerWaalsContact O-N 3.12Å; R240-K243 PolarHBondContact O-N 3.15Å; T241-K243 VanDerWaalsContact C-N 3.34Å; T241-K243 PolarHBondContact O-N 3.39Å
244I85Confident87.9Confident114 Ų11478.1 Ų78.159%0.58537%0.369SS*.Hα-helixtrans-83.8-32.7-177.4-68166.3000110.9R240 T241 V242R240-I244 HydrophobicContact CG-CD1 4.01Å; R240-I244 WeakPolarHBondContact O-CG1 3.14Å; R240-I244 PolarHBondContact O-N 2.85Å; T241-I244 PolarHBondContact O-N 2.95Å; V242-I244 PolarHBondContact O-N 2.83Å
245H76.7Confident87.3Confident143 Ų14380.9 Ų80.966%0.66238%0.381SS*.Hα-helixtrans-102-10.7-173.4-68-60.6000114.7T241 V242T241-H245 PolarHBondContact O-CD2 3.12Å; T241-H245 VanDerWaalsContact O-CD2 3.28Å; T241-H245 PolarHBondContact O-N 3.39Å; T241-H245 VanDerWaalsContact O-N 3.14Å; V242-H245 PolarHBondContact O-N 3.06Å
246H62.5Low86.6Confident201 Ų20188 Ų8893%0.93141%0.414SS*.  trans-135.50174.9-78.3-74.9000109.9V242V242-H246 WeakPolarHBondContact O-CB 3.46Å; V242-H246 PolarHBondContact O-N 2.96Å

Retrieved 246 of 246 residues in 103.8 ms (Link to these results)

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