A0A087Y2T0_POEFO Loading...

Elongation of very long chain fatty acids protein 6

Catalyzes the first and rate-limiting reaction of the four reactions that constitute the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process allows the addition of 2 carbons to the chain of long- and very long-chain fatty acids (VLCFAs) per cycle. Condensing enzyme that elongates fatty acids with 12, 14 and 16 carbons with higher activity toward C16:0 acyl-CoAs. Catalyzes the synthesis of unsaturated C16 long chain fatty acids and, to a lesser extent, C18:0 and those with low desaturation degree. May participate to the production of saturated and monounsaturated VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators.

AlphaFold DB , UniProt , Accession A0A087Y2T0, Species POEFO (Poecilia formosa, Amazon molly), Gene ELOVL6, Length 269 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
1M34.3Very low51.3Low247 Ų247125.8 Ų125.8100%1.21762%0.624SS**  094.30-130.6-178.3-71.300106.2
2L41.1Very low51.8Low170 Ų170127.4 Ų127.489%0.8962%0.618SS**  trans-72127.6-175.5-78.2156.3000108.8M4L2-M4 PolarHBondContact O-N 2.7Å
3Q39.9Very low52.1Low198 Ų198127.9 Ų127.993%0.92562%0.624SS**  trans-59.1104.3172.9-78.7175.2-36.900108.7
4M48.3Very low53.4Low101 Ų101125.3 Ų125.350%0.49862%0.619SS.*  trans-70.6126.9170-70.2175.354.500108.1L2 L9L2-M4 PolarHBondContact O-N 2.7Å; M4-L9 HydrophobicContact CE-CD1 4.26Å
5N59.2Low55Low109 Ų109118.1 Ų118.158%0.58359%0.587SS**  trans-65138.2178.5-156.8-4.7000109.5S7 E8 L9N5-S7 VanDerWaalsContact CG-OG 3.31Å; N5-S7 PolarHBondContact ND2-OG 3.05Å; N5-S7 PolarHBondContact O-N 3.4Å; N5-E8 PolarHBondContact O-N 3.48Å; N5-L9 PolarHBondContact O-N 3.25Å; N5-L9 VanDerWaalsContact O-N 3.17Å
6E54.8Low56.8Low163 Ų163117.6 Ų117.676%0.76258%0.58SS**Hα-helixtrans-53.7-28.8-178.3-82.5-172.514200112.8L9 Q10E6-L9 WeakPolarHBondContact O-CB 3.48Å; E6-L9 PolarHBondContact O-N 2.6Å; E6-Q10 PolarHBondContact O-N 3.35Å
7S55.6Low58.2Low33 Ų33114.8 Ų114.823%0.23158%0.576CS.*Hα-helixtrans-70.7-41.7176.451.10000113.9N5 L9 Q10 L11N5-S7 VanDerWaalsContact CG-OG 3.31Å; N5-S7 PolarHBondContact ND2-OG 3.05Å; N5-S7 PolarHBondContact O-N 3.4Å; S7-L9 VanDerWaalsContact C-N 3.25Å; S7-L9 PolarHBondContact O-N 3.13Å; S7-Q10 PolarHBondContact O-N 3.44Å; S7-L11 WeakPolarHBondContact O-CB 2.98Å; S7-L11 PolarHBondContact O-N 2.91Å
8E55.5Low59.8Low109 Ų109113.4 Ų113.451%0.50957%0.566SS.*Hα-helixtrans-64.9-34171.6-78.9-157.4137.200111.4N5 R12N5-E8 PolarHBondContact O-N 3.48Å; E8-R12 WeakPolarHBondContact O-CB 3.21Å; E8-R12 WeakPolarHBondContact O-CG 3.4Å; E8-R12 PolarHBondContact O-N 2.95Å
9L55.3Low61.3Low87 Ų87107.5 Ų107.546%0.45554%0.536SS..Hα-helixtrans-65.6-48.2175.2-170.171.5000110.7M4 N5 E6 S7 L11 R12 L13M4-L9 HydrophobicContact CE-CD1 4.26Å; N5-L9 PolarHBondContact O-N 3.25Å; N5-L9 VanDerWaalsContact O-N 3.17Å; E6-L9 WeakPolarHBondContact O-CB 3.48Å; E6-L9 PolarHBondContact O-N 2.6Å; S7-L9 VanDerWaalsContact C-N 3.25Å; S7-L9 PolarHBondContact O-N 3.13Å; L9-L11 PolarHBondContact O-N 2.87Å; L9-R12 PolarHBondContact O-N 3.37Å; L9-L13 HydrophobicContact CG-CD1 4.12Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 2.83Å
10Q59.5Low62.3Low141 Ų141104.8 Ų104.866%0.65953%0.525SS*.Hα-helixtrans-60.7-42.4176.2-77-168.2-900112.8E6 S7 L13 V14E6-Q10 PolarHBondContact O-N 3.35Å; S7-Q10 PolarHBondContact O-N 3.44Å; Q10-L13 PolarHBondContact O-N 3.23Å; Q10-V14 WeakPolarHBondContact O-CG2 2.77Å; Q10-V14 PolarHBondContact O-N 3.17Å; Q10-V14 VanDerWaalsContact O-N 3.11Å
11L61Low63.5Low26 Ų26108.7 Ų108.714%0.13653%0.534CS..Hα-helixtrans-70.8-32.8-179.3-159.7113.4000112S7 L9 A15 Y89 H92 P112 V113S7-L11 WeakPolarHBondContact O-CB 2.98Å; S7-L11 PolarHBondContact O-N 2.91Å; L9-L11 PolarHBondContact O-N 2.87Å; L11-A15 PolarHBondContact O-N 2.9Å; L11-Y89 HydrophobicContact CD1-CD2 4.02Å; L11-Y89 HydrophobicContact CD2-CD2 3.56Å; L11-Y89 HydrophobicContact CD2-CE2 3.65Å; L11-Y89 HydrophobicContact CG-CD2 4.37Å; L11-H92 HydrophobicContact CD1-CB 4.01Å; L11-P112 HydrophobicContact CD2-CG 3.56Å; L11-V113 HydrophobicContact CD2-CG2 4.26Å; L11-V113 HydrophobicContact CG-CG2 4.4Å
12R57.2Low66.2Low145 Ų14598.9 Ų98.955%0.54748%0.484SS..Hα-helixtrans-68.7-34.7168.6-80.4-174.9179.4-137.71.9113E8 L9 V14 A15 P112E8-R12 WeakPolarHBondContact O-CB 3.21Å; E8-R12 WeakPolarHBondContact O-CG 3.4Å; E8-R12 PolarHBondContact O-N 2.95Å; L9-R12 PolarHBondContact O-N 3.37Å; R12-V14 VanDerWaalsContact C-N 3.3Å; R12-V14 PolarHBondContact O-N 2.78Å; R12-A15 WeakPolarHBondContact O-CB 3.34Å; R12-A15 PolarHBondContact O-N 3.47Å; R12-P112 HydrophobicContact CG-CB 4.3Å; R12-P112 HydrophobicContact CG-CG 4.36Å
13L56.1Low68.6Low134 Ų13495.4 Ų95.470%0.70247%0.467SS*.Hα-helixtrans-69.6-28.3178.4-73.8167.2000112.6L9 Q10L9-L13 HydrophobicContact CG-CD1 4.12Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 2.83Å; Q10-L13 PolarHBondContact O-N 3.23Å
14V70.1Confident70.9Confident91 Ų9187.6 Ų87.655%0.55243%0.43SS*.SBendtrans-86.8-11.2174.91780000112.1Q10 R12 R85Q10-V14 WeakPolarHBondContact O-CG2 2.77Å; Q10-V14 PolarHBondContact O-N 3.17Å; Q10-V14 VanDerWaalsContact O-N 3.11Å; R12-V14 VanDerWaalsContact C-N 3.3Å; R12-V14 PolarHBondContact O-N 2.78Å; V14-R85 PolarHBondContact O-NH1 3.2Å; V14-R85 VanDerWaalsContact O-NH1 3.11Å; V14-R85 PolarHBondContact O-NH2 3.04Å
15A77.1Confident72.9Confident17 Ų1791.8 Ų91.814%0.1444%0.441CS..SBendtrans-76.5133.8-179.500000112.2L11 R12 T20 V113L11-A15 PolarHBondContact O-N 2.9Å; R12-A15 WeakPolarHBondContact O-CB 3.34Å; R12-A15 PolarHBondContact O-N 3.47Å; A15-T20 HydrophobicContact CB-CG2 3.51Å; A15-V113 HydrophobicContact CB-CG2 3.63Å
16F83.8Confident74.5Confident110 Ų11087.8 Ų87.848%0.48243%0.425SS..  trans-73.6153.9173.3-67.8-65.6000110.9F18 E19 T20F16-F18 HydrophobicContact CB-CD1 3.56Å; F16-F18 HydrophobicContact CB-CE1 3.34Å; F16-F18 HydrophobicContact CB-CZ 4.15Å; F16-F18 AromaticContact CD2-CE1 3.82Å; F16-F18 HydrophobicContact CD2-CE1 3.82Å; F16-F18 HydrophobicContact CD2-CZ 4.16Å; F16-F18 HydrophobicContact CG-CD1 4.37Å; F16-F18 AromaticContact CG-CE1 3.73Å; F16-F18 HydrophobicContact CG-CE1 3.73Å; F16-F18 HydrophobicContact CG-CZ 4.47Å; F16-F18 PolarHBondContact O-N 2.93Å; F16-F18 VanDerWaalsContact O-N 3.16Å; F16-E19 HydrophobicContact CB-CG 4.16Å; F16-E19 PolarHBondContact N-OE2 3.02Å; F16-E19 PolarHBondContact O-N 3.41Å; F16-T20 PolarHBondContact O-N 3.15Å; F16-T20 VanDerWaalsContact O-N 3.15Å; F16-T20 PolarHBondContact O-OG1 3.46Å
17S81.1Confident76.2Confident71 Ų7180.3 Ų80.350%0.49739%0.391SS..Hα-helixtrans-62.5-25.5-177.871.30000113.9T20 R21S17-T20 PolarHBondContact O-OG1 3.33Å; S17-R21 WeakPolarHBondContact O-CB 3.24Å; S17-R21 VanDerWaalsContact O-CG 3.26Å; S17-R21 WeakPolarHBondContact O-CG 3.34Å; S17-R21 PolarHBondContact O-N 3.28Å; S17-R21 PolarHBondContact O-NE 3.26Å; S17-R21 PolarHBondContact OG-NH2 3.45Å
18F86.8Confident78Confident90 Ų9079.4 Ų79.440%0.39538%0.384SS..Hα-helixtrans-79.5-3217673.3-92.7000112.1F16 F22 F116F16-F18 HydrophobicContact CB-CD1 3.56Å; F16-F18 HydrophobicContact CB-CE1 3.34Å; F16-F18 HydrophobicContact CB-CZ 4.15Å; F16-F18 AromaticContact CD2-CE1 3.82Å; F16-F18 HydrophobicContact CD2-CE1 3.82Å; F16-F18 HydrophobicContact CD2-CZ 4.16Å; F16-F18 HydrophobicContact CG-CD1 4.37Å; F16-F18 AromaticContact CG-CE1 3.73Å; F16-F18 HydrophobicContact CG-CE1 3.73Å; F16-F18 HydrophobicContact CG-CZ 4.47Å; F16-F18 PolarHBondContact O-N 2.93Å; F16-F18 VanDerWaalsContact O-N 3.16Å; F18-F22 PolarHBondContact O-N 3.42Å; F18-F116 HydrophobicContact CD2-CD1 4.34Å; F18-F116 HydrophobicContact CD2-CD2 4.31Å; F18-F116 HydrophobicContact CD2-CE1 4.36Å; F18-F116 HydrophobicContact CD2-CE2 4.32Å; F18-F116 HydrophobicContact CD2-CG 4.31Å; F18-F116 HydrophobicContact CD2-CZ 4.34Å; F18-F116 AromaticContact CE2-CD1 3.7Å; F18-F116 HydrophobicContact CE2-CD1 3.7Å; F18-F116 HydrophobicContact CE2-CD2 4.45Å; F18-F116 AromaticContact CE2-CE1 3.66Å; F18-F116 HydrophobicContact CE2-CE1 3.66Å; F18-F116 HydrophobicContact CE2-CE2 4.41Å; F18-F116 HydrophobicContact CE2-CG 4.11Å; F18-F116 HydrophobicContact CE2-CZ 4.03Å
19E87.8Confident79.8Confident0 Ų079.4 Ų79.40%038%0.383CS..Hα-helixtrans-69.7-43.4177.8-62.4170.4149.900110.1F16 F22 R85 P112 K115 F116 W117F16-E19 HydrophobicContact CB-CG 4.16Å; F16-E19 PolarHBondContact N-OE2 3.02Å; F16-E19 PolarHBondContact O-N 3.41Å; E19-F22 WeakPolarHBondContact O-CB 3.36Å; E19-F22 PolarHBondContact O-N 3.32Å; E19-R85 IonicContact OE1-CZ 3.6Å; E19-R85 IonicContact OE1-NE 3.45Å; E19-R85 PolarHBondContact OE1-NE 3.49Å; E19-R85 IonicContact OE1-NH2 2.64Å; E19-R85 PolarHBondContact OE1-NH2 3.16Å; E19-R85 IonicContact OE2-CZ 2.9Å; E19-R85 IonicContact OE2-NE 2.75Å; E19-R85 IonicContact OE2-NH2 3.29Å; E19-R85 PolarHBondContact OE2-NH2 3.37Å; E19-P112 CarbonylContact C-O 3.43Å; E19-K115 WeakPolarHBondContact O-CE 3.35Å; E19-F116 HydrophobicContact CG-CB 4.48Å; E19-W117 PolarHBondContact OE1-NE1 2.9Å
20T82.4Confident81.7Confident53 Ų5379.5 Ų79.533%0.32538%0.378SS..Hα-helixtrans-68.5-38.4-179.853.30000112.7A15 F16 S17 F22 P112 K115A15-T20 HydrophobicContact CB-CG2 3.51Å; F16-T20 PolarHBondContact O-N 3.15Å; F16-T20 VanDerWaalsContact O-N 3.15Å; F16-T20 PolarHBondContact O-OG1 3.46Å; S17-T20 PolarHBondContact O-OG1 3.33Å; T20-F22 VanDerWaalsContact C-N 3.33Å; T20-P112 HydrophobicContact CG2-CB 4.48Å; T20-K115 WeakPolarHBondContact O-CE 3.27Å; T20-K115 PolarHBondContact O-NZ 2.94Å
21R86.8Confident83.3Confident188 Ų18872.8 Ų72.871%0.70935%0.346SS*.THydrogen-bonded Turntrans-81.6-4.9179.4-70.1-175.3-73.8178.7-3.7114.6S17 D23S17-R21 WeakPolarHBondContact O-CB 3.24Å; S17-R21 VanDerWaalsContact O-CG 3.26Å; S17-R21 WeakPolarHBondContact O-CG 3.34Å; S17-R21 PolarHBondContact O-N 3.28Å; S17-R21 PolarHBondContact O-NE 3.26Å; S17-R21 PolarHBondContact OG-NH2 3.45Å; R21-D23 PolarHBondContact O-N 3.28Å
22F90.7Very high84.7Confident40 Ų4076.3 Ų76.318%0.17536%0.362CS..  trans-62.4130.5178.2-178.5-104.2000110.8F18 E19 T20 E24 A27 K115 F116 Y119F18-F22 PolarHBondContact O-N 3.42Å; E19-F22 WeakPolarHBondContact O-CB 3.36Å; E19-F22 PolarHBondContact O-N 3.32Å; T20-F22 VanDerWaalsContact C-N 3.33Å; F22-E24 HydrophobicContact CD1-CB 4.38Å; F22-E24 HydrophobicContact CE1-CB 4.47Å; F22-E24 PolarHBondContact O-N 2.89Å; F22-A27 HydrophobicContact CE1-CB 3.8Å; F22-A27 HydrophobicContact CZ-CB 3.6Å; F22-K115 HydrophobicContact CB-CG 4.49Å; F22-K115 HydrophobicContact CD1-CB 4.45Å; F22-K115 HydrophobicContact CD1-CG 4.06Å; F22-K115 VanDerWaalsContact O-CE 3.28Å; F22-K115 WeakPolarHBondContact O-CE 3.21Å; F22-K115 PolarHBondContact O-NZ 3.43Å; F22-F116 HydrophobicContact CB-CB 4.19Å; F22-F116 HydrophobicContact CB-CD2 4.49Å; F22-F116 HydrophobicContact CD1-CB 4.31Å; F22-F116 AromaticContact CD2-CD2 3.71Å; F22-F116 HydrophobicContact CD2-CD2 3.71Å; F22-F116 HydrophobicContact CE2-CD2 4.14Å; F22-F116 HydrophobicContact CG-CB 4.08Å; F22-F116 HydrophobicContact CG-CD2 4.1Å; F22-Y119 HydrophobicContact CE1-CD1 4.42Å; F22-Y119 HydrophobicContact CE1-CG 4.32Å; F22-Y119 AromaticContact CE2-CD1 3.86Å; F22-Y119 HydrophobicContact CE2-CD1 3.86Å; F22-Y119 HydrophobicContact CE2-CE1 4.43Å; F22-Y119 AromaticContact CZ-CD1 3.36Å; F22-Y119 HydrophobicContact CZ-CD1 3.36Å; F22-Y119 HydrophobicContact CZ-CE1 4.11Å; F22-Y119 AromaticContact CZ-CG 3.63Å; F22-Y119 HydrophobicContact CZ-CG 3.63Å
23D91.2Very high86.5Confident97 Ų9774.9 Ų74.952%0.51936%0.362SS..  trans-82.389.4176.8177.815.9000110.3R21 R25 G26 A27R21-D23 PolarHBondContact O-N 3.28Å; D23-R25 VanDerWaalsContact C-N 3.28Å; D23-R25 PolarHBondContact O-N 3.06Å; D23-R25 PolarHBondContact OD1-N 2.89Å; D23-G26 PolarHBondContact OD1-N 3.28Å; D23-G26 WeakPolarHBondContact OD2-CA 3.47Å; D23-G26 PolarHBondContact OD2-N 3.09Å; D23-A27 WeakPolarHBondContact O-CB 3.44Å; D23-A27 PolarHBondContact O-N 3.32Å; D23-A27 VanDerWaalsContact O-N 3.15Å
24E89.6Confident88.3Confident35 Ų3569.5 Ų69.516%0.16433%0.334CS..Hα-helixtrans-65.9-31.2178.369.7-74.1173.200112.9F22 A27 I28 N110 K115F22-E24 HydrophobicContact CD1-CB 4.38Å; F22-E24 HydrophobicContact CE1-CB 4.47Å; F22-E24 PolarHBondContact O-N 2.89Å; E24-A27 PolarHBondContact O-N 2.87Å; E24-I28 WeakPolarHBondContact O-CB 3.43Å; E24-I28 WeakPolarHBondContact O-CD1 3.17Å; E24-I28 WeakPolarHBondContact O-CG1 3.13Å; E24-I28 PolarHBondContact O-N 3.32Å; E24-N110 HydrophobicContact CG-CB 4.44Å; E24-N110 WeakPolarHBondContact CG-OD1 3.16Å; E24-K115 HydrophobicContact CB-CB 4.07Å; E24-K115 HydrophobicContact CB-CD 4.13Å; E24-K115 HydrophobicContact CG-CD 4.35Å; E24-K115 WeakPolarHBondContact OE2-CD 3.47Å; E24-K115 IonicContact OE2-NZ 3.42Å; E24-K115 PolarHBondContact OE2-NZ 3.36Å
25R89.8Confident89.4Confident189 Ų18968.6 Ų68.671%0.71332%0.32SS*.Hα-helixtrans-70.7-46.5-178-65.6-177.1-178-177.6-1.2110.5D23 A27 I28 Q29D23-R25 VanDerWaalsContact C-N 3.28Å; D23-R25 PolarHBondContact O-N 3.06Å; D23-R25 PolarHBondContact OD1-N 2.89Å; R25-A27 VanDerWaalsContact C-N 3.28Å; R25-A27 PolarHBondContact O-N 3.21Å; R25-I28 PolarHBondContact O-N 3.01Å; R25-Q29 WeakPolarHBondContact O-CB 3.2Å; R25-Q29 PolarHBondContact O-N 2.94Å
26G92.1Very high90.1Very high24 Ų2471.8 Ų71.825%0.24734%0.335CS..Hα-helixtrans-59.4-40.4172.800000112.1D23 Q29 W30D23-G26 PolarHBondContact OD1-N 3.28Å; D23-G26 WeakPolarHBondContact OD2-CA 3.47Å; D23-G26 PolarHBondContact OD2-N 3.09Å; G26-Q29 PolarHBondContact O-N 2.93Å; G26-W30 VanDerWaalsContact O-CB 3.31Å; G26-W30 WeakPolarHBondContact O-CB 3.18Å; G26-W30 PolarHBondContact O-N 3.47Å
27A92.1Very high90.6Very high6 Ų670.1 Ų70.15%0.0533%0.327CS..Hα-helixtrans-64.1-44.8176.400000113F22 D23 E24 R25 W30 M31 Y119F22-A27 HydrophobicContact CE1-CB 3.8Å; F22-A27 HydrophobicContact CZ-CB 3.6Å; D23-A27 WeakPolarHBondContact O-CB 3.44Å; D23-A27 PolarHBondContact O-N 3.32Å; D23-A27 VanDerWaalsContact O-N 3.15Å; E24-A27 PolarHBondContact O-N 2.87Å; R25-A27 VanDerWaalsContact C-N 3.28Å; R25-A27 PolarHBondContact O-N 3.21Å; A27-W30 PolarHBondContact O-N 3.25Å; A27-M31 WeakPolarHBondContact O-CG 3.32Å; A27-M31 PolarHBondContact O-N 2.81Å; A27-Y119 HydrophobicContact CB-CD1 4.38Å; A27-Y119 HydrophobicContact CB-CD2 3.71Å; A27-Y119 HydrophobicContact CB-CE1 4.49Å; A27-Y119 HydrophobicContact CB-CE2 3.88Å; A27-Y119 HydrophobicContact CB-CG 3.96Å
28I92.3Very high91.2Very high15 Ų1566.8 Ų66.88%0.07730%0.304CS..Hα-helixtrans-63.2-46.9176.2-69.9160000110.4E24 R25 W30 M31 Q32 Y161 M164E24-I28 WeakPolarHBondContact O-CB 3.43Å; E24-I28 WeakPolarHBondContact O-CD1 3.17Å; E24-I28 WeakPolarHBondContact O-CG1 3.13Å; E24-I28 PolarHBondContact O-N 3.32Å; R25-I28 PolarHBondContact O-N 3.01Å; I28-W30 PolarHBondContact O-N 2.96Å; I28-M31 PolarHBondContact O-N 3.38Å; I28-Q32 HydrophobicContact CG2-CG 4.44Å; I28-Q32 WeakPolarHBondContact O-CG 3.37Å; I28-Q32 PolarHBondContact O-N 3.29Å; I28-Y161 HydrophobicContact CG1-CE1 4.05Å; I28-M164 HydrophobicContact CD1-CG 4.41Å; I28-M164 HydrophobicContact CD1-SD 3.61Å; I28-M164 HydrophobicContact CG1-SD 4.39Å
29Q94.1Very high91.6Very high108 Ų10867.7 Ų67.751%0.50531%0.308SS..Hα-helixtrans-60.1-46.4177.8-177.6179.3-8.100111.2R25 G26 M31 Q32 E33R25-Q29 WeakPolarHBondContact O-CB 3.2Å; R25-Q29 PolarHBondContact O-N 2.94Å; G26-Q29 PolarHBondContact O-N 2.93Å; Q29-M31 VanDerWaalsContact C-N 3.28Å; Q29-M31 PolarHBondContact O-N 2.92Å; Q29-Q32 WeakPolarHBondContact O-CB 3.32Å; Q29-Q32 PolarHBondContact O-N 3.22Å; Q29-Q32 VanDerWaalsContact O-N 3.11Å; Q29-E33 WeakPolarHBondContact CG-OE1 3.36Å; Q29-E33 PolarHBondContact NE2-OE1 3.22Å; Q29-E33 WeakPolarHBondContact O-CG 3.32Å; Q29-E33 PolarHBondContact O-N 3.41Å
30W94.4Very high91.9Very high89 Ų8973 Ų7334%0.33734%0.335SS..Hα-helixtrans-58.2-43176.5-174.490.9000111.3G26 A27 I28 E33 N34 Y119 L123 W158G26-W30 VanDerWaalsContact O-CB 3.31Å; G26-W30 WeakPolarHBondContact O-CB 3.18Å; G26-W30 PolarHBondContact O-N 3.47Å; A27-W30 PolarHBondContact O-N 3.25Å; I28-W30 PolarHBondContact O-N 2.96Å; W30-E33 PolarHBondContact O-N 3Å; W30-N34 HydrophobicContact CD2-CB 4.16Å; W30-N34 HydrophobicContact CE3-CB 4.29Å; W30-N34 HydrophobicContact CH2-CB 4.26Å; W30-N34 HydrophobicContact CZ2-CB 4.11Å; W30-N34 HydrophobicContact CZ3-CB 4.34Å; W30-N34 PolarHBondContact NE1-ND2 3.37Å; W30-N34 WeakPolarHBondContact O-CB 3.11Å; W30-N34 PolarHBondContact O-N 3.3Å; W30-N34 PolarHBondContact O-ND2 2.78Å; W30-Y119 HydrophobicContact CE3-CE2 4.37Å; W30-L123 HydrophobicContact CH2-CD2 4.48Å; W30-L123 HydrophobicContact CZ3-CD2 4.14Å; W30-W158 AromaticContact CH2-CH2 3.73Å; W30-W158 HydrophobicContact CH2-CH2 3.73Å; W30-W158 AromaticContact CH2-CZ3 3.9Å; W30-W158 HydrophobicContact CH2-CZ3 3.9Å; W30-W158 HydrophobicContact CZ3-CH2 4.01Å; W30-W158 HydrophobicContact CZ3-CZ3 4.01Å
31M92.4Very high92.5Very high0 Ų073.7 Ų73.70%033%0.333CS..Hα-helixtrans-65-38.8176.4-74.1-61.7-48.600112.4A27 I28 Q29 E33 N34 W35 Y119 V122 W158 Y161A27-M31 WeakPolarHBondContact O-CG 3.32Å; A27-M31 PolarHBondContact O-N 2.81Å; I28-M31 PolarHBondContact O-N 3.38Å; Q29-M31 VanDerWaalsContact C-N 3.28Å; Q29-M31 PolarHBondContact O-N 2.92Å; M31-E33 VanDerWaalsContact C-N 3.31Å; M31-E33 PolarHBondContact O-N 2.86Å; M31-N34 PolarHBondContact O-N 2.89Å; M31-W35 WeakPolarHBondContact O-CA 3.26Å; M31-W35 VanDerWaalsContact O-CB 3.23Å; M31-W35 WeakPolarHBondContact O-CB 3.41Å; M31-W35 PolarHBondContact O-N 3.32Å; M31-Y119 HydrophobicContact CG-CD2 4.33Å; M31-Y119 HydrophobicContact CG-CE2 3.93Å; M31-Y119 HydrophobicContact SD-CE2 4.23Å; M31-V122 HydrophobicContact CE-CG1 3.67Å; M31-V122 HydrophobicContact SD-CG1 4.13Å; M31-W158 HydrophobicContact CE-CB 3.74Å; M31-W158 HydrophobicContact CE-CD2 3.88Å; M31-W158 HydrophobicContact CE-CE3 4.03Å; M31-W158 HydrophobicContact CE-CG 3.81Å; M31-W158 WeakPolarHBondContact CE-O 3.34Å; M31-Y161 HydrophobicContact CB-CD1 3.77Å; M31-Y161 HydrophobicContact CB-CE1 4.19Å; M31-Y161 HydrophobicContact CG-CD1 3.49Å; M31-Y161 VanDerWaalsContact CG-CD1 3.49Å; M31-Y161 HydrophobicContact CG-CE1 3.73Å; M31-Y161 HydrophobicContact CG-CG 4.49Å
32Q92Very high92.9Very high100 Ų10065.2 Ų65.247%0.46730%0.303SS..Hα-helixtrans-63.2-36.3175.6-72.9174.1-9.700112.7I28 Q29 W35 K162I28-Q32 HydrophobicContact CG2-CG 4.44Å; I28-Q32 WeakPolarHBondContact O-CG 3.37Å; I28-Q32 PolarHBondContact O-N 3.29Å; Q29-Q32 WeakPolarHBondContact O-CB 3.32Å; Q29-Q32 PolarHBondContact O-N 3.22Å; Q29-Q32 VanDerWaalsContact O-N 3.11Å; Q32-W35 VanDerWaalsContact O-CD1 3.25Å; Q32-K162 HydrophobicContact CG-CB 4.01Å; Q32-K162 PolarHBondContact NE2-O 3.33Å
33E94Very high93.2Very high115 Ų11568.4 Ų68.454%0.53733%0.325SS..Hα-helixtrans-79.9-29.6178-69.3171.8-169.800112.9Q29 W30 M31Q29-E33 WeakPolarHBondContact CG-OE1 3.36Å; Q29-E33 PolarHBondContact NE2-OE1 3.22Å; Q29-E33 WeakPolarHBondContact O-CG 3.32Å; Q29-E33 PolarHBondContact O-N 3.41Å; W30-E33 PolarHBondContact O-N 3Å; M31-E33 VanDerWaalsContact C-N 3.31Å; M31-E33 PolarHBondContact O-N 2.86Å
34N94.5Very high93.4Very high21 Ų2168.3 Ų68.311%0.11232%0.324CS..Hα-helixtrans-121.12.4-164.4-61.3-78.1000115.1W30 M31 N36 K37W30-N34 HydrophobicContact CD2-CB 4.16Å; W30-N34 HydrophobicContact CE3-CB 4.29Å; W30-N34 HydrophobicContact CH2-CB 4.26Å; W30-N34 HydrophobicContact CZ2-CB 4.11Å; W30-N34 HydrophobicContact CZ3-CB 4.34Å; W30-N34 PolarHBondContact NE1-ND2 3.37Å; W30-N34 WeakPolarHBondContact O-CB 3.11Å; W30-N34 PolarHBondContact O-N 3.3Å; W30-N34 PolarHBondContact O-ND2 2.78Å; M31-N34 PolarHBondContact O-N 2.89Å; N34-N36 PolarHBondContact O-N 2.91Å; N34-N36 VanDerWaalsContact O-N 3.1Å; N34-K37 HydrophobicContact CB-CD 4.02Å; N34-K37 HydrophobicContact CB-CG 4.43Å; N34-K37 VanDerWaalsContact O-CB 3.28Å; N34-K37 WeakPolarHBondContact O-CB 3.46Å; N34-K37 WeakPolarHBondContact O-CG 3.32Å; N34-K37 PolarHBondContact O-N 3.49Å; N34-K37 WeakPolarHBondContact OD1-CE 3.33Å; N34-K37 PolarHBondContact OD1-NZ 2.84Å
35W92.1Very high93.7Very high73 Ų7367.2 Ų67.228%0.27732%0.318SS..THydrogen-bonded Turntrans-55.4-31.8-179.869.1-83.9000112.7M31 Q32 K37 S38 F39 W158 Y159 K162M31-W35 WeakPolarHBondContact O-CA 3.26Å; M31-W35 VanDerWaalsContact O-CB 3.23Å; M31-W35 WeakPolarHBondContact O-CB 3.41Å; M31-W35 PolarHBondContact O-N 3.32Å; Q32-W35 VanDerWaalsContact O-CD1 3.25Å; W35-K37 PolarHBondContact O-N 3.38Å; W35-S38 VanDerWaalsContact O-CB 3.28Å; W35-S38 WeakPolarHBondContact O-CB 3.49Å; W35-S38 PolarHBondContact O-N 2.88Å; W35-S38 VanDerWaalsContact O-N 3.15Å; W35-S38 PolarHBondContact O-OG 3.39Å; W35-F39 HydrophobicContact CE3-CE2 4.3Å; W35-F39 HydrophobicContact CH2-CE2 4.08Å; W35-F39 AromaticContact CZ3-CE2 3.52Å; W35-F39 HydrophobicContact CZ3-CE2 3.52Å; W35-F39 HydrophobicContact CZ3-CZ 4.14Å; W35-W158 HydrophobicContact CB-CB 4.49Å; W35-Y159 HydrophobicContact CD2-CD2 4.43Å; W35-Y159 AromaticContact CE3-CD2 3.87Å; W35-Y159 HydrophobicContact CE3-CD2 3.87Å; W35-Y159 HydrophobicContact CH2-CD2 4.22Å; W35-Y159 AromaticContact CZ3-CD2 3.74Å; W35-Y159 HydrophobicContact CZ3-CD2 3.74Å; W35-Y159 HydrophobicContact CZ3-CE2 4.46Å; W35-K162 HydrophobicContact CB-CD 4.34Å; W35-K162 HydrophobicContact CD2-CD 4.12Å; W35-K162 HydrophobicContact CG-CD 3.78Å
36N92.8Very high94Very high84 Ų8459.4 Ų59.445%0.44930%0.295SS..THydrogen-bonded Turntrans-64.3-20178.164.5-5.4000113.6N34 S38 F39N34-N36 PolarHBondContact O-N 2.91Å; N34-N36 VanDerWaalsContact O-N 3.1Å; N36-S38 PolarHBondContact O-N 3.08Å; N36-F39 WeakPolarHBondContact O-CB 3.48Å; N36-F39 WeakPolarHBondContact O-CD2 3.36Å; N36-F39 PolarHBondContact O-N 3.4Å; N36-F39 VanDerWaalsContact O-N 3.1Å
37K93.1Very high94.1Very high74 Ų7461.2 Ų61.232%0.32231%0.307SS..Hα-helixtrans-62.5-22.6174.2-65.8-176.9178.2161.20112.2N34 W35 F39 M40 F41 W158N34-K37 HydrophobicContact CB-CD 4.02Å; N34-K37 HydrophobicContact CB-CG 4.43Å; N34-K37 VanDerWaalsContact O-CB 3.28Å; N34-K37 WeakPolarHBondContact O-CB 3.46Å; N34-K37 WeakPolarHBondContact O-CG 3.32Å; N34-K37 PolarHBondContact O-N 3.49Å; N34-K37 WeakPolarHBondContact OD1-CE 3.33Å; N34-K37 PolarHBondContact OD1-NZ 2.84Å; W35-K37 PolarHBondContact O-N 3.38Å; K37-F39 PolarHBondContact O-N 2.87Å; K37-M40 HydrophobicContact CB-CE 4.3Å; K37-M40 HydrophobicContact CG-CE 4.45Å; K37-M40 WeakPolarHBondContact O-CB 3.26Å; K37-M40 PolarHBondContact O-N 3.24Å; K37-M40 VanDerWaalsContact O-N 3.17Å; K37-F41 HydrophobicContact CB-CE2 4.17Å; K37-F41 VanDerWaalsContact O-CD2 3.32Å; K37-F41 WeakPolarHBondContact O-CD2 3.26Å; K37-F41 WeakPolarHBondContact O-CG 3.25Å; K37-F41 PolarHBondContact O-N 3.25Å; K37-W158 HydrophobicContact CB-CZ3 4.09Å
38S93.9Very high94.3Very high1 Ų166.3 Ų66.31%0.00733%0.333CS..Hα-helixtrans-56.3-37.8172.563.60000112.4W35 N36 F41 S42 L155W35-S38 VanDerWaalsContact O-CB 3.28Å; W35-S38 WeakPolarHBondContact O-CB 3.49Å; W35-S38 PolarHBondContact O-N 2.88Å; W35-S38 VanDerWaalsContact O-N 3.15Å; W35-S38 PolarHBondContact O-OG 3.39Å; N36-S38 PolarHBondContact O-N 3.08Å; S38-F41 PolarHBondContact O-N 3.07Å; S38-S42 PolarHBondContact O-N 3.14Å; S38-S42 PolarHBondContact O-OG 2.77Å; S38-S42 VanDerWaalsContact O-OG 3.06Å; S38-L155 WeakPolarHBondContact OG-CD2 3.46Å
39F95.4Very high94.4Very high109 Ų10965.9 Ų65.948%0.47833%0.331SS..Hα-helixtrans-63.3-45.7175.5-68.4-71.4000112.2W35 N36 K37 F41 S42 V43 L155W35-F39 HydrophobicContact CE3-CE2 4.3Å; W35-F39 HydrophobicContact CH2-CE2 4.08Å; W35-F39 AromaticContact CZ3-CE2 3.52Å; W35-F39 HydrophobicContact CZ3-CE2 3.52Å; W35-F39 HydrophobicContact CZ3-CZ 4.14Å; N36-F39 WeakPolarHBondContact O-CB 3.48Å; N36-F39 WeakPolarHBondContact O-CD2 3.36Å; N36-F39 PolarHBondContact O-N 3.4Å; N36-F39 VanDerWaalsContact O-N 3.1Å; K37-F39 PolarHBondContact O-N 2.87Å; F39-F41 VanDerWaalsContact C-N 3.33Å; F39-F41 PolarHBondContact O-N 2.83Å; F39-S42 PolarHBondContact O-N 3.21Å; F39-V43 WeakPolarHBondContact O-CG2 3.46Å; F39-V43 PolarHBondContact O-N 3.06Å; F39-L155 HydrophobicContact CB-CD2 4.49Å; F39-L155 HydrophobicContact CD1-CD1 4.43Å; F39-L155 HydrophobicContact CD1-CD2 3.57Å; F39-L155 HydrophobicContact CE1-CD1 4.32Å; F39-L155 HydrophobicContact CE1-CD2 3.86Å; F39-L155 HydrophobicContact CG-CD2 3.98Å
40M95.3Very high94.4Very high113 Ų11365.7 Ų65.756%0.55733%0.329SS*.Hα-helixtrans-60.8-44.6176.6179-171.256.900110.7K37 S42 V43 L44K37-M40 HydrophobicContact CB-CE 4.3Å; K37-M40 HydrophobicContact CG-CE 4.45Å; K37-M40 WeakPolarHBondContact O-CB 3.26Å; K37-M40 PolarHBondContact O-N 3.24Å; K37-M40 VanDerWaalsContact O-N 3.17Å; M40-S42 PolarHBondContact O-N 3Å; M40-V43 PolarHBondContact O-N 3.26Å; M40-L44 WeakPolarHBondContact O-CB 3.1Å; M40-L44 PolarHBondContact O-N 3.18Å
41F94.8Very high94.4Very high66 Ų6663.4 Ų63.429%0.28933%0.332SS..Hα-helixtrans-62-40.2175-67-41.5000112.5K37 S38 F39 Y45 L154 W158K37-F41 HydrophobicContact CB-CE2 4.17Å; K37-F41 VanDerWaalsContact O-CD2 3.32Å; K37-F41 WeakPolarHBondContact O-CD2 3.26Å; K37-F41 WeakPolarHBondContact O-CG 3.25Å; K37-F41 PolarHBondContact O-N 3.25Å; S38-F41 PolarHBondContact O-N 3.07Å; F39-F41 VanDerWaalsContact C-N 3.33Å; F39-F41 PolarHBondContact O-N 2.83Å; F41-Y45 WeakPolarHBondContact O-CB 3.06Å; F41-Y45 PolarHBondContact O-N 3.18Å; F41-L154 HydrophobicContact CB-CD2 3.85Å; F41-W158 HydrophobicContact CD2-CH2 4.22Å; F41-W158 AromaticContact CE2-CH2 3.66Å; F41-W158 HydrophobicContact CE2-CH2 3.66Å; F41-W158 HydrophobicContact CE2-CZ2 4.26Å; F41-W158 HydrophobicContact CE2-CZ3 4.17Å
42S95.3Very high94.4Very high11 Ų1164.2 Ų64.28%0.07734%0.341CS..Hα-helixtrans-64.6-42.2176-64.30000113S38 F39 M40 Y45 A46S38-S42 PolarHBondContact O-N 3.14Å; S38-S42 PolarHBondContact O-OG 2.77Å; S38-S42 VanDerWaalsContact O-OG 3.06Å; F39-S42 PolarHBondContact O-N 3.21Å; M40-S42 PolarHBondContact O-N 3Å; S42-Y45 PolarHBondContact O-N 2.6Å; S42-A46 WeakPolarHBondContact O-CB 3.22Å; S42-A46 PolarHBondContact O-N 3.48Å
43V95.6Very high94.5Very high106 Ų10662.8 Ų62.864%0.64234%0.335SS*.Hα-helixtrans-65.1-47.9176.6171.10000110.4F39 M40 Y45 A46 A47F39-V43 WeakPolarHBondContact O-CG2 3.46Å; F39-V43 PolarHBondContact O-N 3.06Å; M40-V43 PolarHBondContact O-N 3.26Å; V43-Y45 VanDerWaalsContact C-N 3.31Å; V43-Y45 PolarHBondContact O-N 2.81Å; V43-A46 PolarHBondContact O-N 2.9Å; V43-A47 WeakPolarHBondContact O-CB 3.24Å; V43-A47 PolarHBondContact O-N 3.38Å
44L95.8Very high94.6Very high95 Ų9563.5 Ų63.550%0.49734%0.337SS..Hα-helixtrans-59.2-45.3176.5177.660.5000111M40 A47 L48M40-L44 WeakPolarHBondContact O-CB 3.1Å; M40-L44 PolarHBondContact O-N 3.18Å; L44-A47 PolarHBondContact O-N 2.96Å; L44-L48 HydrophobicContact CD1-CD1 4.03Å; L44-L48 HydrophobicContact CD1-CG 4.06Å; L44-L48 HydrophobicContact CG-CD1 3.91Å; L44-L48 HydrophobicContact CG-CG 4.35Å; L44-L48 WeakPolarHBondContact O-CB 3.3Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.44Å; L44-L48 PolarHBondContact O-N 3.17Å
45Y96.1Very high94.6Very high12 Ų1267.8 Ų67.85%0.04736%0.355CS..Hα-helixtrans-57.8-49.6175.9166.7-99.1000112.2F41 S42 V43 A47 L48 V49 L129 T132 W147 I151F41-Y45 WeakPolarHBondContact O-CB 3.06Å; F41-Y45 PolarHBondContact O-N 3.18Å; S42-Y45 PolarHBondContact O-N 2.6Å; V43-Y45 VanDerWaalsContact C-N 3.31Å; V43-Y45 PolarHBondContact O-N 2.81Å; Y45-A47 VanDerWaalsContact C-N 3.33Å; Y45-A47 PolarHBondContact O-N 3.33Å; Y45-L48 PolarHBondContact O-N 3.32Å; Y45-V49 HydrophobicContact CD1-CG2 4.49Å; Y45-V49 HydrophobicContact CD2-CG2 3.95Å; Y45-V49 HydrophobicContact CE1-CG2 4.17Å; Y45-V49 HydrophobicContact CE2-CG2 3.62Å; Y45-V49 HydrophobicContact CG-CG2 4.4Å; Y45-V49 WeakPolarHBondContact O-CB 3.32Å; Y45-V49 VanDerWaalsContact O-CG2 3.23Å; Y45-V49 WeakPolarHBondContact O-CG2 3.5Å; Y45-V49 PolarHBondContact O-N 2.83Å; Y45-L129 HydrophobicContact CD1-CD2 4.48Å; Y45-L129 HydrophobicContact CD2-CB 3.75Å; Y45-L129 HydrophobicContact CD2-CD1 4.15Å; Y45-L129 HydrophobicContact CD2-CD2 3.81Å; Y45-L129 HydrophobicContact CD2-CG 4.11Å; Y45-L129 HydrophobicContact CE2-CB 4.02Å; Y45-L129 HydrophobicContact CE2-CD2 3.94Å; Y45-L129 HydrophobicContact CG-CD1 4.28Å; Y45-L129 HydrophobicContact CG-CD2 4.06Å; Y45-T132 HydrophobicContact CE2-CG2 4.16Å; Y45-T132 WeakPolarHBondContact OH-CB 3.28Å; Y45-T132 WeakPolarHBondContact OH-CG2 2.89Å; Y45-T132 PolarHBondContact OH-OG1 3.33Å; Y45-W147 HydrophobicContact CE1-CB 4.19Å; Y45-W147 VanDerWaalsContact OH-CA 3.3Å; Y45-W147 WeakPolarHBondContact OH-CA 3.44Å; Y45-W147 WeakPolarHBondContact OH-CB 3.47Å; Y45-I151 HydrophobicContact CD1-CD1 3.83Å; Y45-I151 HydrophobicContact CD1-CG1 3.5Å; Y45-I151 VanDerWaalsContact CD1-CG1 3.5Å; Y45-I151 HydrophobicContact CE1-CD1 3.9Å; Y45-I151 HydrophobicContact CE1-CG1 3.56Å
46A94.9Very high94.7Very high26 Ų2664.7 Ų64.722%0.21534%0.344CS..Hα-helixtrans-59.9-4517800000111.4S42 V43 L48 V49 F50 I151S42-A46 WeakPolarHBondContact O-CB 3.22Å; S42-A46 PolarHBondContact O-N 3.48Å; V43-A46 PolarHBondContact O-N 2.9Å; A46-L48 PolarHBondContact O-N 3.46Å; A46-V49 PolarHBondContact O-N 3.29Å; A46-F50 HydrophobicContact CB-CD2 4.47Å; A46-F50 HydrophobicContact CB-CE2 4.42Å; A46-F50 WeakPolarHBondContact O-CD2 3.32Å; A46-F50 PolarHBondContact O-N 3.07Å; A46-I151 HydrophobicContact CB-CD1 4.46Å
47A95.8Very high94.7Very high61 Ų6167.7 Ų67.750%0.50435%0.353SS..Hα-helixtrans-59.7-45.3176.500000112V43 L44 Y45 G51V43-A47 WeakPolarHBondContact O-CB 3.24Å; V43-A47 PolarHBondContact O-N 3.38Å; L44-A47 PolarHBondContact O-N 2.96Å; Y45-A47 VanDerWaalsContact C-N 3.33Å; Y45-A47 PolarHBondContact O-N 3.33Å; A47-G51 WeakPolarHBondContact O-CA 3.49Å; A47-G51 PolarHBondContact O-N 3.47Å
48L95.1Very high94.8Very high113 Ų11369.4 Ų69.459%0.59237%0.372SS*.Hα-helixtrans-66.3-37177.7-71.8174.7000112.6L44 Y45 A46 G52L44-L48 HydrophobicContact CD1-CD1 4.03Å; L44-L48 HydrophobicContact CD1-CG 4.06Å; L44-L48 HydrophobicContact CG-CD1 3.91Å; L44-L48 HydrophobicContact CG-CG 4.35Å; L44-L48 WeakPolarHBondContact O-CB 3.3Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.44Å; L44-L48 PolarHBondContact O-N 3.17Å; Y45-L48 PolarHBondContact O-N 3.32Å; A46-L48 PolarHBondContact O-N 3.46Å; L48-G52 VanDerWaalsContact O-CA 3.24Å; L48-G52 WeakPolarHBondContact O-CA 3.11Å; L48-G52 PolarHBondContact O-N 3.22Å
49V94.4Very high94.8Very high7 Ų774.2 Ų74.24%0.04239%0.39CS..Hα-helixtrans-67.7-53.2178.6168.30000110.9Y45 A46 Q53 T132 V136 L142Y45-V49 HydrophobicContact CD1-CG2 4.49Å; Y45-V49 HydrophobicContact CD2-CG2 3.95Å; Y45-V49 HydrophobicContact CE1-CG2 4.17Å; Y45-V49 HydrophobicContact CE2-CG2 3.62Å; Y45-V49 HydrophobicContact CG-CG2 4.4Å; Y45-V49 WeakPolarHBondContact O-CB 3.32Å; Y45-V49 VanDerWaalsContact O-CG2 3.23Å; Y45-V49 WeakPolarHBondContact O-CG2 3.5Å; Y45-V49 PolarHBondContact O-N 2.83Å; A46-V49 PolarHBondContact O-N 3.29Å; V49-Q53 WeakPolarHBondContact O-CB 3.28Å; V49-Q53 WeakPolarHBondContact O-CG 3.48Å; V49-Q53 PolarHBondContact O-N 3.43Å; V49-T132 HydrophobicContact CG1-CG2 4.16Å; V49-T132 HydrophobicContact CG2-CG2 3.55Å; V49-V136 HydrophobicContact CG1-CG2 4.39Å; V49-L142 HydrophobicContact CG1-CD2 3.32Å
50F93.7Very high94.7Very high104 Ų10474 Ų7446%0.45640%0.399SS..Hα-helixtrans-73.4-40-178-66.2-63.2000112.1A46 Q53 H54 W147A46-F50 HydrophobicContact CB-CD2 4.47Å; A46-F50 HydrophobicContact CB-CE2 4.42Å; A46-F50 WeakPolarHBondContact O-CD2 3.32Å; A46-F50 PolarHBondContact O-N 3.07Å; F50-Q53 PolarHBondContact O-N 3.37Å; F50-H54 PolarHBondContact O-N 3.28Å; F50-W147 HydrophobicContact CZ-CZ2 4.49Å
51G94.8Very high94.7Very high40 Ų4076.3 Ų76.341%0.41241%0.406SS..Hα-helixtrans-62.2-44.7172.200000111.7A47 Q53 H54 F55A47-G51 WeakPolarHBondContact O-CA 3.49Å; A47-G51 PolarHBondContact O-N 3.47Å; G51-Q53 PolarHBondContact O-N 2.92Å; G51-H54 PolarHBondContact O-N 2.93Å; G51-F55 VanDerWaalsContact O-CB 3.27Å; G51-F55 WeakPolarHBondContact O-CB 3.39Å; G51-F55 PolarHBondContact O-N 3.47Å
52G93.9Very high94.6Very high18 Ų1876.8 Ų76.819%0.18641%0.411CS..Hα-helixtrans-62.4-39.7175.700000112.8L48 F55 M56 V136L48-G52 VanDerWaalsContact O-CA 3.24Å; L48-G52 WeakPolarHBondContact O-CA 3.11Å; L48-G52 PolarHBondContact O-N 3.22Å; G52-F55 PolarHBondContact O-N 2.87Å; G52-M56 WeakPolarHBondContact O-CB 3.47Å; G52-M56 VanDerWaalsContact O-CG 3.3Å; G52-M56 WeakPolarHBondContact O-CG 3.18Å; G52-M56 PolarHBondContact O-N 2.89Å; G52-V136 VanDerWaalsContact C-CG1 3.4Å
53Q93.9Very high94.4Very high70 Ų7083.1 Ų83.133%0.32745%0.445SS..Hα-helixtrans-61-47172.8-79.5-175.1-24.800111.7V49 F50 G51 M56 K57 V136V49-Q53 WeakPolarHBondContact O-CB 3.28Å; V49-Q53 WeakPolarHBondContact O-CG 3.48Å; V49-Q53 PolarHBondContact O-N 3.43Å; F50-Q53 PolarHBondContact O-N 3.37Å; G51-Q53 PolarHBondContact O-N 2.92Å; Q53-M56 PolarHBondContact O-N 3.24Å; Q53-K57 WeakPolarHBondContact O-CG 3.23Å; Q53-K57 PolarHBondContact O-N 3.06Å; Q53-V136 HydrophobicContact CG-CG1 4.13Å; Q53-V136 HydrophobicContact CG-CG2 4Å
54H94.6Very high94.3Very high129 Ų12979.8 Ų79.860%0.59742%0.423SS*.Hα-helixtrans-62-46.5177.5-170.996.1000111.5F50 G51 M56 K57F50-H54 PolarHBondContact O-N 3.28Å; G51-H54 PolarHBondContact O-N 2.93Å; H54-M56 VanDerWaalsContact C-N 3.3Å; H54-M56 PolarHBondContact O-N 2.99Å; H54-K57 WeakPolarHBondContact O-CB 3.42Å; H54-K57 PolarHBondContact O-N 3.49Å; H54-K57 VanDerWaalsContact O-N 3.17Å
55F95.1Very high94.1Very high112 Ų11281.3 Ų81.349%0.49142%0.422SS..Hα-helixtrans-60-38.2177-179.4-95.8000112.5G51 G52 P58 R59G51-F55 VanDerWaalsContact O-CB 3.27Å; G51-F55 WeakPolarHBondContact O-CB 3.39Å; G51-F55 PolarHBondContact O-N 3.47Å; G52-F55 PolarHBondContact O-N 2.87Å; F55-P58 WeakPolarHBondContact O-CD 3.37Å; F55-R59 PolarHBondContact O-NH1 2.92Å
56M94.9Very high94.1Very high8 Ų886.4 Ų86.44%0.03945%0.45CS..Hα-helixtrans-78.8-14.3179.5-72.5-59.2-69.800113.4G52 Q53 H54 R59 P60 L62 V136 L137 K139G52-M56 WeakPolarHBondContact O-CB 3.47Å; G52-M56 VanDerWaalsContact O-CG 3.3Å; G52-M56 WeakPolarHBondContact O-CG 3.18Å; G52-M56 PolarHBondContact O-N 2.89Å; Q53-M56 PolarHBondContact O-N 3.24Å; H54-M56 VanDerWaalsContact C-N 3.3Å; H54-M56 PolarHBondContact O-N 2.99Å; M56-R59 HydrophobicContact CE-CB 4.27Å; M56-R59 PolarHBondContact O-N 2.9Å; M56-R59 HydrophobicContact SD-CB 4.19Å; M56-P60 WeakPolarHBondContact CE-O 3.43Å; M56-L62 HydrophobicContact CE-CG 4.09Å; M56-V136 HydrophobicContact CG-CG1 4.41Å; M56-L137 WeakPolarHBondContact CE-O 3.38Å; M56-L137 HydrophobicContact CG-CD2 4.33Å; M56-L137 HydrophobicContact SD-CD2 4.13Å; M56-K139 WeakPolarHBondContact O-CE 3.47Å; M56-K139 PolarHBondContact O-NZ 3.24Å
57K92.6Very high94.1Very high147 Ų14788.1 Ų88.164%0.63946%0.458SS*.THydrogen-bonded Turntrans-48.1-56.2-179.9-74.8179.8-176.7-177.50113Q53 H54 R59 K139Q53-K57 WeakPolarHBondContact O-CG 3.23Å; Q53-K57 PolarHBondContact O-N 3.06Å; H54-K57 WeakPolarHBondContact O-CB 3.42Å; H54-K57 PolarHBondContact O-N 3.49Å; H54-K57 VanDerWaalsContact O-N 3.17Å; K57-R59 VanDerWaalsContact C-N 3.32Å; K57-R59 PolarHBondContact O-N 3.13Å; K57-K139 PolarHBondContact O-NZ 3.14Å
58P95.6Very high94.1Very high109 Ų10986.3 Ų86.371%0.70844%0.44SS*.THydrogen-bonded Turntrans-77.6-9.4-179.131.6-37.5000114.8F55F55-P58 WeakPolarHBondContact O-CD 3.37Å
59R93.5Very high94.2Very high102 Ų10282.2 Ų82.239%0.38542%0.419SS..SBendtrans-95.6153.6-171.3-67.2-175.4170.988.6-3.5113F55 M56 K57 K139F55-R59 PolarHBondContact O-NH1 2.92Å; M56-R59 HydrophobicContact CE-CB 4.27Å; M56-R59 PolarHBondContact O-N 2.9Å; M56-R59 HydrophobicContact SD-CB 4.19Å; K57-R59 VanDerWaalsContact C-N 3.32Å; K57-R59 PolarHBondContact O-N 3.13Å; R59-K139 WeakPolarHBondContact O-CE 3.48Å; R59-K139 PolarHBondContact O-NZ 3.42Å
60P93Very high94.3Very high105 Ų10586.8 Ų86.868%0.68244%0.443SS*.PPolyproline II helixtrans-66.5158.117028.2-34.1000111.6M56M56-P60 WeakPolarHBondContact CE-O 3.43Å
61K94.3Very high94.5Very high161 Ų16185.1 Ų85.170%0.743%0.434SS*.PPolyproline II helixtrans-64.3137.8172.664.4-176.7179.2-176.40109.9K139K61-K139 HydrophobicContact CB-CB 4.28Å; K61-K139 HydrophobicContact CB-CD 4.31Å; K61-K139 HydrophobicContact CB-CG 4.28Å
62L93.3Very high94.6Very high76 Ų7683.3 Ų83.340%0.39842%0.415SS..PPolyproline II helixtrans-84.2141.8177.8-60.3-177.8000111.5M56 L64 L137M56-L62 HydrophobicContact CE-CG 4.09Å; L62-L64 HydrophobicContact CB-CD1 4.19Å; L62-L64 HydrophobicContact CB-CD2 4.35Å; L62-L64 HydrophobicContact CB-CG 3.89Å; L62-L64 PolarHBondContact O-N 3.36Å; L62-L137 HydrophobicContact CD1-CB 4.29Å; L62-L137 HydrophobicContact CD1-CD2 4.15Å; L62-L137 PolarHBondContact N-O 3.31Å; L62-L137 VanDerWaalsContact N-O 3.13Å
63N92.3Very high94.8Very high145 Ų14586.6 Ų86.678%0.77543%0.428SS*.  trans-88.482.7172.1-171.21000110.5R65N63-R65 VanDerWaalsContact C-N 3.32Å; N63-R65 PolarHBondContact O-N 3.4Å; N63-R65 WeakPolarHBondContact OD1-CB 3.29Å; N63-R65 PolarHBondContact OD1-N 3.2Å
64L92.8Very high95Very high36 Ų3686.3 Ų86.319%0.18843%0.434CS..  trans-97.233180-60174000112.2L62 L68 F134 L137 R138L62-L64 HydrophobicContact CB-CD1 4.19Å; L62-L64 HydrophobicContact CB-CD2 4.35Å; L62-L64 HydrophobicContact CB-CG 3.89Å; L62-L64 PolarHBondContact O-N 3.36Å; L64-L68 WeakPolarHBondContact O-CB 3.44Å; L64-L68 PolarHBondContact O-N 3.43Å; L64-F134 HydrophobicContact CB-CD1 4.09Å; L64-F134 HydrophobicContact CB-CE1 4.23Å; L64-F134 HydrophobicContact CD1-CD1 4.07Å; L64-F134 HydrophobicContact CD1-CE1 4.42Å; L64-L137 HydrophobicContact CD1-CB 3.61Å; L64-L137 HydrophobicContact CD1-CD1 3.74Å; L64-L137 HydrophobicContact CD1-CG 4.34Å; L64-R138 HydrophobicContact CB-CG 4.4Å; L64-R138 HydrophobicContact CD1-CG 4.49Å
65R92.3Very high95.1Very high127 Ų12780.8 Ų80.848%0.47941%0.408SS..Hα-helixtrans-61.7-54.2-173-174.1176.5176.4-174-9.6112.4N63 L68 V69 A190 A191N63-R65 VanDerWaalsContact C-N 3.32Å; N63-R65 PolarHBondContact O-N 3.4Å; N63-R65 WeakPolarHBondContact OD1-CB 3.29Å; N63-R65 PolarHBondContact OD1-N 3.2Å; R65-L68 PolarHBondContact O-N 3.02Å; R65-V69 WeakPolarHBondContact O-CG2 3.35Å; R65-V69 PolarHBondContact O-N 3.42Å; R65-A190 WeakPolarHBondContact CG-O 3.27Å; R65-A190 PolarHBondContact NE-O 2.8Å; R65-A191 VanDerWaalsContact NH2-C 3.31Å; R65-A191 PolarHBondContact NH2-O 3.03Å
66L94.3Very high95.2Very high119 Ų11975.5 Ų75.562%0.62339%0.386SS*.Hα-helixtrans-62.3-48.6-179.617666.4000112L68 V69 L70L66-L68 VanDerWaalsContact C-N 3.3Å; L66-L68 PolarHBondContact O-N 3.5Å; L66-V69 PolarHBondContact O-N 3.3Å; L66-V69 VanDerWaalsContact O-N 3.15Å; L66-L70 HydrophobicContact CD1-CD1 4.29Å; L66-L70 HydrophobicContact CD1-CG 4.23Å; L66-L70 HydrophobicContact CG-CD1 4.28Å; L66-L70 WeakPolarHBondContact O-CG 3.31Å; L66-L70 PolarHBondContact O-N 2.84Å
67P96.5Very high95.4Very high61 Ų6178.5 Ų78.540%0.39640%0.404SS..Hα-helixtrans-55.3-42.3173-28.935.8000113.5V69 L70 W71 F134P67-V69 PolarHBondContact O-N 3.46Å; P67-L70 PolarHBondContact O-N 3.35Å; P67-W71 WeakPolarHBondContact O-CB 3.23Å; P67-W71 PolarHBondContact O-N 2.95Å; P67-F134 HydrophobicContact CB-CE1 3.97Å; P67-F134 HydrophobicContact CB-CZ 4.34Å
68L95.7Very high95.6Very high24 Ų2473.9 Ų73.913%0.12638%0.384CS..Hα-helixtrans-65.2-38.3178.1179.163.3000112.3L64 R65 L66 S72 F134 A190L64-L68 WeakPolarHBondContact O-CB 3.44Å; L64-L68 PolarHBondContact O-N 3.43Å; R65-L68 PolarHBondContact O-N 3.02Å; L66-L68 VanDerWaalsContact C-N 3.3Å; L66-L68 PolarHBondContact O-N 3.5Å; L68-S72 VanDerWaalsContact O-CB 3.32Å; L68-S72 WeakPolarHBondContact O-CB 3.4Å; L68-S72 PolarHBondContact O-N 3.48Å; L68-S72 PolarHBondContact O-OG 2.57Å; L68-S72 VanDerWaalsContact O-OG 3.08Å; L68-F134 HydrophobicContact CB-CD1 4.15Å; L68-F134 HydrophobicContact CB-CE1 4.26Å; L68-F134 HydrophobicContact CD1-CB 4.04Å; L68-F134 HydrophobicContact CD1-CD1 4.18Å; L68-F134 HydrophobicContact CD1-CD2 4.08Å; L68-F134 HydrophobicContact CD1-CG 3.84Å; L68-A190 HydrophobicContact CD2-CB 4.02Å; L68-A190 HydrophobicContact CG-CB 3.95Å
69V96.6Very high95.7Very high26 Ų2668.8 Ų68.816%0.15835%0.351CS..Hα-helixtrans-62-52.7174.8171.80000110.3R65 L66 P67 W71 S72 L73 A190 A191R65-V69 WeakPolarHBondContact O-CG2 3.35Å; R65-V69 PolarHBondContact O-N 3.42Å; L66-V69 PolarHBondContact O-N 3.3Å; L66-V69 VanDerWaalsContact O-N 3.15Å; P67-V69 PolarHBondContact O-N 3.46Å; V69-W71 VanDerWaalsContact C-N 3.29Å; V69-W71 PolarHBondContact O-N 3.11Å; V69-S72 PolarHBondContact O-N 3.43Å; V69-L73 WeakPolarHBondContact O-CB 3.44Å; V69-L73 PolarHBondContact O-N 3.49Å; V69-A190 HydrophobicContact CB-CB 4.44Å; V69-A190 HydrophobicContact CG2-CB 3.48Å; V69-A190 VanDerWaalsContact CG2-CB 3.48Å; V69-A190 WeakPolarHBondContact CG2-O 3.17Å; V69-A191 HydrophobicContact CG1-CB 4.4Å; V69-A191 HydrophobicContact CG2-CB 4.15Å; V69-A191 VanDerWaalsContact CG2-N 3.3Å
70L97.1Very high95.9Very high104 Ų10467.2 Ų67.255%0.54535%0.349SS..Hα-helixtrans-61.3-40.9-178.7-65.7176.5000111.4L66 P67 L73 S74L66-L70 HydrophobicContact CD1-CD1 4.29Å; L66-L70 HydrophobicContact CD1-CG 4.23Å; L66-L70 HydrophobicContact CG-CD1 4.28Å; L66-L70 WeakPolarHBondContact O-CG 3.31Å; L66-L70 PolarHBondContact O-N 2.84Å; P67-L70 PolarHBondContact O-N 3.35Å; L70-L73 PolarHBondContact O-N 3.34Å; L70-S74 WeakPolarHBondContact O-CB 3.36Å; L70-S74 PolarHBondContact O-N 3.16Å; L70-S74 PolarHBondContact O-OG 3.33Å
71W97.6Very high96.1Very high68 Ų6865.5 Ų65.526%0.25833%0.334SS..Hα-helixtrans-64.3-50.9176.4178.7-94.2000113P67 V69 L73 S74 L75 P127 D131 F134P67-W71 WeakPolarHBondContact O-CB 3.23Å; P67-W71 PolarHBondContact O-N 2.95Å; V69-W71 VanDerWaalsContact C-N 3.29Å; V69-W71 PolarHBondContact O-N 3.11Å; W71-L73 VanDerWaalsContact C-N 3.27Å; W71-L73 PolarHBondContact O-N 2.95Å; W71-S74 PolarHBondContact O-N 2.93Å; W71-S74 PolarHBondContact O-OG 2.91Å; W71-L75 HydrophobicContact CZ2-CD1 4.05Å; W71-L75 PolarHBondContact O-N 3.37Å; W71-L75 VanDerWaalsContact O-N 3.13Å; W71-P127 HydrophobicContact CH2-CB 4.14Å; W71-P127 VanDerWaalsContact CH2-O 3.25Å; W71-P127 WeakPolarHBondContact CH2-O 2.95Å; W71-P127 WeakPolarHBondContact CZ2-O 3.26Å; W71-D131 PolarHBondContact NE1-OD1 3.27Å; W71-F134 HydrophobicContact CB-CE2 3.89Å; W71-F134 HydrophobicContact CB-CZ 4.01Å; W71-F134 AromaticContact CD1-CE2 3.65Å; W71-F134 AromaticContact CD2-CE2 3.83Å; W71-F134 HydrophobicContact CD2-CE2 3.83Å; W71-F134 HydrophobicContact CG-CD2 4.36Å; W71-F134 AromaticContact CG-CE2 3.5Å; W71-F134 HydrophobicContact CG-CE2 3.5Å; W71-F134 VanDerWaalsContact CG-CE2 3.5Å; W71-F134 HydrophobicContact CG-CZ 4.11Å
72S97.1Very high96.2Very high3 Ų357.9 Ų57.92%0.02130%0.301CS..Hα-helixtrans-65-35.2177.8-65.90000111.5L68 V69 A76L68-S72 VanDerWaalsContact O-CB 3.32Å; L68-S72 WeakPolarHBondContact O-CB 3.4Å; L68-S72 PolarHBondContact O-N 3.48Å; L68-S72 PolarHBondContact O-OG 2.57Å; L68-S72 VanDerWaalsContact O-OG 3.08Å; V69-S72 PolarHBondContact O-N 3.43Å; S72-A76 VanDerWaalsContact O-CB 3.27Å; S72-A76 WeakPolarHBondContact O-CB 3.19Å; S72-A76 PolarHBondContact O-N 3.41Å
73L97.3Very high96.3Very high87 Ų8755 Ų5546%0.45529%0.288SS..Hα-helixtrans-68.7-41.7177.3-177.363.1000111.7V69 L70 W71 A76 V77 A187V69-L73 WeakPolarHBondContact O-CB 3.44Å; V69-L73 PolarHBondContact O-N 3.49Å; L70-L73 PolarHBondContact O-N 3.34Å; W71-L73 VanDerWaalsContact C-N 3.27Å; W71-L73 PolarHBondContact O-N 2.95Å; L73-A76 WeakPolarHBondContact O-CB 3.35Å; L73-A76 PolarHBondContact O-N 3.07Å; L73-V77 HydrophobicContact CD1-CG2 4.35Å; L73-V77 WeakPolarHBondContact O-CG2 3.16Å; L73-V77 PolarHBondContact O-N 3.48Å; L73-A187 HydrophobicContact CB-CB 4.29Å
74S97.8Very high96.4Very high63 Ų6353.1 Ų53.144%0.44128%0.277SS..Hα-helixtrans-63.4-43.6177.466.50000111.4L70 W71 A76 V77 F78L70-S74 WeakPolarHBondContact O-CB 3.36Å; L70-S74 PolarHBondContact O-N 3.16Å; L70-S74 PolarHBondContact O-OG 3.33Å; W71-S74 PolarHBondContact O-N 2.93Å; W71-S74 PolarHBondContact O-OG 2.91Å; S74-A76 VanDerWaalsContact C-N 3.34Å; S74-A76 PolarHBondContact O-N 3.5Å; S74-V77 PolarHBondContact O-N 3.48Å; S74-F78 VanDerWaalsContact O-CB 3.29Å; S74-F78 WeakPolarHBondContact O-CB 3.42Å; S74-F78 PolarHBondContact O-N 2.8Å
75L97.6Very high96.4Very high13 Ų1352.5 Ų52.57%0.06827%0.272CS..Hα-helixtrans-66.4-34.4174.5-67.9177.9000112.5W71 S79 E128 Y183W71-L75 HydrophobicContact CZ2-CD1 4.05Å; W71-L75 PolarHBondContact O-N 3.37Å; W71-L75 VanDerWaalsContact O-N 3.13Å; L75-S79 VanDerWaalsContact O-CB 3.26Å; L75-S79 WeakPolarHBondContact O-CB 3.35Å; L75-S79 PolarHBondContact O-N 2.63Å; L75-S79 PolarHBondContact O-OG 3.13Å; L75-E128 HydrophobicContact CD2-CG 4.46Å; L75-Y183 HydrophobicContact CB-CD1 3.86Å; L75-Y183 HydrophobicContact CB-CD2 3.77Å; L75-Y183 HydrophobicContact CB-CE1 4.06Å; L75-Y183 HydrophobicContact CB-CE2 3.95Å; L75-Y183 HydrophobicContact CB-CG 3.73Å; L75-Y183 HydrophobicContact CD1-CD1 4.06Å; L75-Y183 HydrophobicContact CD1-CE1 3.46Å; L75-Y183 VanDerWaalsContact CD1-CE1 3.46Å; L75-Y183 HydrophobicContact CD1-CE2 4.12Å; L75-Y183 HydrophobicContact CG-CE1 4.41Å
76A97.8Very high96.4Very high2 Ų246.4 Ų46.42%0.01725%0.249CC..Hα-helixtrans-63.8-51.4173.600000111.3S72 L73 S74 F78 S79 I80S72-A76 VanDerWaalsContact O-CB 3.27Å; S72-A76 WeakPolarHBondContact O-CB 3.19Å; S72-A76 PolarHBondContact O-N 3.41Å; L73-A76 WeakPolarHBondContact O-CB 3.35Å; L73-A76 PolarHBondContact O-N 3.07Å; S74-A76 VanDerWaalsContact C-N 3.34Å; S74-A76 PolarHBondContact O-N 3.5Å; A76-F78 PolarHBondContact O-N 2.96Å; A76-S79 PolarHBondContact O-N 3.15Å; A76-I80 WeakPolarHBondContact O-CB 3.46Å; A76-I80 WeakPolarHBondContact O-CD1 3.46Å; A76-I80 WeakPolarHBondContact O-CG1 3.46Å; A76-I80 PolarHBondContact O-N 3.06Å
77V98Very high96.4Very high71 Ų7141.4 Ų41.443%0.4323%0.226SC..Hα-helixtrans-60.4-47.3178.8171.40000110.7L73 S74 S79 I80 I81L73-V77 HydrophobicContact CD1-CG2 4.35Å; L73-V77 WeakPolarHBondContact O-CG2 3.16Å; L73-V77 PolarHBondContact O-N 3.48Å; S74-V77 PolarHBondContact O-N 3.48Å; V77-S79 VanDerWaalsContact C-N 3.3Å; V77-S79 PolarHBondContact O-N 3.07Å; V77-I80 PolarHBondContact O-N 3.15Å; V77-I81 HydrophobicContact CG1-CD1 3.75Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 VanDerWaalsContact O-CG1 3.3Å; V77-I81 WeakPolarHBondContact O-CG1 3.48Å; V77-I81 PolarHBondContact O-N 3.24Å
78F97.9Very high96.1Very high50 Ų5041 Ų4122%0.21923%0.225CC..Hα-helixtrans-54.8-47.6175.1172.6-106.4000111.6S74 A76 G82 W117 A120 S124 Y176S74-F78 VanDerWaalsContact O-CB 3.29Å; S74-F78 WeakPolarHBondContact O-CB 3.42Å; S74-F78 PolarHBondContact O-N 2.8Å; A76-F78 PolarHBondContact O-N 2.96Å; F78-G82 PolarHBondContact O-N 3.1Å; F78-W117 HydrophobicContact CD2-CZ3 4.12Å; F78-W117 HydrophobicContact CE2-CE3 4.42Å; F78-W117 AromaticContact CE2-CZ3 3.97Å; F78-W117 HydrophobicContact CE2-CZ3 3.97Å; F78-A120 HydrophobicContact CE2-CB 3.96Å; F78-A120 HydrophobicContact CZ-CB 4.02Å; F78-S124 VanDerWaalsContact CE1-CB 3.44Å; F78-Y176 HydrophobicContact CD1-CE1 4.21Å; F78-Y176 AromaticContact CE1-CE1 3.57Å; F78-Y176 HydrophobicContact CE1-CE1 3.57Å; F78-Y176 AromaticContact CZ-CE1 3.82Å; F78-Y176 HydrophobicContact CZ-CE1 3.82Å; F78-Y176 WeakPolarHBondContact CZ-OH 3.3Å
79S97.8Very high95.8Very high1 Ų140.5 Ų40.51%0.00722%0.221CC..Hα-helixtrans-70.6-35.9-178.1-550000113.1L75 A76 V77 A83L75-S79 VanDerWaalsContact O-CB 3.26Å; L75-S79 WeakPolarHBondContact O-CB 3.35Å; L75-S79 PolarHBondContact O-N 2.63Å; L75-S79 PolarHBondContact O-OG 3.13Å; A76-S79 PolarHBondContact O-N 3.15Å; V77-S79 VanDerWaalsContact C-N 3.3Å; V77-S79 PolarHBondContact O-N 3.07Å; S79-A83 WeakPolarHBondContact O-CB 3.16Å; S79-A83 PolarHBondContact O-N 3.45Å
80I97.9Very high95.5Very high69 Ų6939.7 Ų39.735%0.35422%0.216SC..Hα-helixtrans-64.2-49.5176.6-71.6163.2000110A76 V77 A83 I84 A180A76-I80 WeakPolarHBondContact O-CB 3.46Å; A76-I80 WeakPolarHBondContact O-CD1 3.46Å; A76-I80 WeakPolarHBondContact O-CG1 3.46Å; A76-I80 PolarHBondContact O-N 3.06Å; V77-I80 PolarHBondContact O-N 3.15Å; I80-A83 PolarHBondContact O-N 3.1Å; I80-I84 HydrophobicContact CG2-CD1 3.85Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.28Å; I80-I84 PolarHBondContact O-N 3.06Å; I80-A180 HydrophobicContact CB-CB 4.46Å; I80-A180 HydrophobicContact CG1-CB 3.68Å
81I96.3Very high95.2Very high70 Ų7040.3 Ų40.336%0.35922%0.219SC..Hα-helixtrans-63.6-47.3179.2-57.5168000108.9V77 A83 I84 R85 W117V77-I81 HydrophobicContact CG1-CD1 3.75Å; V77-I81 HydrophobicContact CG1-CG1 4.42Å; V77-I81 VanDerWaalsContact O-CG1 3.3Å; V77-I81 WeakPolarHBondContact O-CG1 3.48Å; V77-I81 PolarHBondContact O-N 3.24Å; I81-A83 VanDerWaalsContact C-N 3.34Å; I81-A83 PolarHBondContact O-N 3.49Å; I81-I84 PolarHBondContact O-N 3.19Å; I81-R85 HydrophobicContact CG2-CG 3.99Å; I81-R85 WeakPolarHBondContact O-CG 3.33Å; I81-R85 PolarHBondContact O-N 3.03Å; I81-W117 HydrophobicContact CB-CH2 3.7Å; I81-W117 HydrophobicContact CB-CZ2 4.27Å; I81-W117 HydrophobicContact CB-CZ3 4.37Å; I81-W117 HydrophobicContact CG2-CH2 3.26Å; I81-W117 HydrophobicContact CG2-CZ2 3.34Å; I81-W117 HydrophobicContact CG2-CZ3 4.29Å
82G95.7Very high94.7Very high0 Ų039.7 Ų39.70%022%0.219CC..Hα-helixtrans-53.3-48.3175.200000112.8F78 I84 R85 T86 W117F78-G82 PolarHBondContact O-N 3.1Å; G82-I84 PolarHBondContact O-N 3.24Å; G82-R85 PolarHBondContact O-N 2.87Å; G82-T86 WeakPolarHBondContact O-CB 3.4Å; G82-T86 WeakPolarHBondContact O-CG2 3.44Å; G82-T86 PolarHBondContact O-N 3.18Å; G82-T86 PolarHBondContact O-OG1 3.02Å; G82-T86 VanDerWaalsContact O-OG1 3.04Å; G82-W117 VanDerWaalsContact CA-CE3 3.44Å
83A96.4Very high94.3Very high15 Ų1539.9 Ų39.912%0.12422%0.22CC..Hα-helixtrans-61.6-42.5179.100000112.6S79 I80 I81 G87S79-A83 WeakPolarHBondContact O-CB 3.16Å; S79-A83 PolarHBondContact O-N 3.45Å; I80-A83 PolarHBondContact O-N 3.1Å; I81-A83 VanDerWaalsContact C-N 3.34Å; I81-A83 PolarHBondContact O-N 3.49Å; A83-G87 VanDerWaalsContact O-CA 3.22Å; A83-G87 WeakPolarHBondContact O-CA 3.44Å; A83-G87 PolarHBondContact O-N 3.38Å
84I94.3Very high93.9Very high107 Ų10738.4 Ų38.455%0.54921%0.212SC..Hα-helixtrans-64.7-48.4178-68.4166.8000110I80 I81 G82 S88I80-I84 HydrophobicContact CG2-CD1 3.85Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.28Å; I80-I84 PolarHBondContact O-N 3.06Å; I81-I84 PolarHBondContact O-N 3.19Å; G82-I84 PolarHBondContact O-N 3.24Å; I84-S88 WeakPolarHBondContact O-CB 3.26Å; I84-S88 PolarHBondContact O-N 3.36Å; I84-S88 PolarHBondContact O-OG 3.41Å; I84-S88 VanDerWaalsContact O-OG 3.09Å
85R92.2Very high93.5Very high22 Ų2240.2 Ų40.28%0.08323%0.225CC..Hα-helixtrans-69.9-46.5-174.6-60.3-59.2-69.8169.80.6112.3V14 E19 I81 G82 S88 Y89 V113 W117V14-R85 PolarHBondContact O-NH1 3.2Å; V14-R85 VanDerWaalsContact O-NH1 3.11Å; V14-R85 PolarHBondContact O-NH2 3.04Å; E19-R85 IonicContact OE1-CZ 3.6Å; E19-R85 IonicContact OE1-NE 3.45Å; E19-R85 PolarHBondContact OE1-NE 3.49Å; E19-R85 IonicContact OE1-NH2 2.64Å; E19-R85 PolarHBondContact OE1-NH2 3.16Å; E19-R85 IonicContact OE2-CZ 2.9Å; E19-R85 IonicContact OE2-NE 2.75Å; E19-R85 IonicContact OE2-NH2 3.29Å; E19-R85 PolarHBondContact OE2-NH2 3.37Å; I81-R85 HydrophobicContact CG2-CG 3.99Å; I81-R85 WeakPolarHBondContact O-CG 3.33Å; I81-R85 PolarHBondContact O-N 3.03Å; G82-R85 PolarHBondContact O-N 2.87Å; R85-S88 PolarHBondContact O-OG 3.2Å; R85-Y89 PolarHBondContact O-N 3.07Å; R85-V113 HydrophobicContact CB-CG1 4.04Å; R85-W117 HydrophobicContact CB-CD2 4.36Å; R85-W117 HydrophobicContact CB-CG 4.22Å; R85-W117 HydrophobicContact CG-CZ2 3.97Å
86T93.6Very high93Very high0 Ų042.7 Ų42.70%025%0.247CC..Hα-helixtrans-74.7-34.2177.7710000111.3G82 Y89 M90 F108 W117 T173 Y176G82-T86 WeakPolarHBondContact O-CB 3.4Å; G82-T86 WeakPolarHBondContact O-CG2 3.44Å; G82-T86 PolarHBondContact O-N 3.18Å; G82-T86 PolarHBondContact O-OG1 3.02Å; G82-T86 VanDerWaalsContact O-OG1 3.04Å; T86-Y89 PolarHBondContact O-N 3.23Å; T86-M90 WeakPolarHBondContact O-CB 3.48Å; T86-M90 VanDerWaalsContact O-CG 3.27Å; T86-M90 WeakPolarHBondContact O-CG 3.49Å; T86-M90 PolarHBondContact O-N 3Å; T86-F108 HydrophobicContact CG2-CE2 4.24Å; T86-F108 HydrophobicContact CG2-CZ 3.68Å; T86-W117 HydrophobicContact CG2-CB 3.61Å; T86-W117 HydrophobicContact CG2-CG 4.29Å; T86-T173 VanDerWaalsContact CB-OG1 3.3Å; T86-T173 WeakPolarHBondContact CB-OG1 3.3Å; T86-T173 PolarHBondContact OG1-OG1 3.42Å; T86-Y176 HydrophobicContact CG2-CD2 4.15Å; T86-Y176 HydrophobicContact CG2-CE2 4.08Å
87G92.6Very high92.4Very high14 Ų1445.6 Ų45.614%0.14427%0.267CS..Hα-helixtrans-62.3-47.6175.300000112.9A83 Y89 M90 L91A83-G87 VanDerWaalsContact O-CA 3.22Å; A83-G87 WeakPolarHBondContact O-CA 3.44Å; A83-G87 PolarHBondContact O-N 3.38Å; G87-Y89 VanDerWaalsContact C-N 3.27Å; G87-Y89 PolarHBondContact O-N 3.43Å; G87-M90 PolarHBondContact O-N 2.92Å; G87-L91 WeakPolarHBondContact O-CB 3.26Å; G87-L91 WeakPolarHBondContact O-CG 3.45Å; G87-L91 PolarHBondContact O-N 2.83Å
88S90.5Very high92Very high52 Ų5243.7 Ų43.736%0.36426%0.262SS..Hα-helixtrans-60.6-39.5175.959.20000112I84 R85 H92I84-S88 WeakPolarHBondContact O-CB 3.26Å; I84-S88 PolarHBondContact O-N 3.36Å; I84-S88 PolarHBondContact O-OG 3.41Å; I84-S88 VanDerWaalsContact O-OG 3.09Å; R85-S88 PolarHBondContact O-OG 3.2Å; S88-H92 WeakPolarHBondContact O-CB 3.19Å; S88-H92 PolarHBondContact O-N 3.31Å
89Y89.8Confident91.7Very high13 Ų1346.2 Ų46.25%0.05127%0.273CS..Hα-helixtrans-67-44.1177.2-176.6-98000112.3L11 R85 T86 G87 H92 I93 S107 F108 S114L11-Y89 HydrophobicContact CD1-CD2 4.02Å; L11-Y89 HydrophobicContact CD2-CD2 3.56Å; L11-Y89 HydrophobicContact CD2-CE2 3.65Å; L11-Y89 HydrophobicContact CG-CD2 4.37Å; R85-Y89 PolarHBondContact O-N 3.07Å; T86-Y89 PolarHBondContact O-N 3.23Å; G87-Y89 VanDerWaalsContact C-N 3.27Å; G87-Y89 PolarHBondContact O-N 3.43Å; Y89-H92 WeakPolarHBondContact O-CB 3.39Å; Y89-H92 PolarHBondContact O-N 3.2Å; Y89-I93 HydrophobicContact CD1-CD1 3.77Å; Y89-I93 HydrophobicContact CE1-CD1 3.15Å; Y89-I93 HydrophobicContact CE1-CG1 4.16Å; Y89-I93 HydrophobicContact CE2-CD1 4.46Å; Y89-I93 PolarHBondContact O-N 2.93Å; Y89-S107 PolarHBondContact OH-O 3.45Å; Y89-S107 PolarHBondContact OH-OG 3.07Å; Y89-F108 AromaticContact CD1-CD2 3.62Å; Y89-F108 HydrophobicContact CD1-CD2 3.62Å; Y89-F108 HydrophobicContact CD1-CE2 4.08Å; Y89-F108 HydrophobicContact CE1-CB 4.19Å; Y89-F108 AromaticContact CE1-CD2 3.77Å; Y89-F108 HydrophobicContact CE1-CD2 3.77Å; Y89-F108 HydrophobicContact CE1-CG 4.35Å; Y89-S114 WeakPolarHBondContact CE1-OG 3.36Å
90M91.3Very high91.3Very high10 Ų1050.6 Ų50.65%0.04929%0.289CS..Hα-helixtrans-65.5-40.4177.3-73.6-57-60.200112.3T86 G87 H92 I93 L94 F108 W170 T173T86-M90 WeakPolarHBondContact O-CB 3.48Å; T86-M90 VanDerWaalsContact O-CG 3.27Å; T86-M90 WeakPolarHBondContact O-CG 3.49Å; T86-M90 PolarHBondContact O-N 3Å; G87-M90 PolarHBondContact O-N 2.92Å; M90-H92 VanDerWaalsContact C-N 3.31Å; M90-H92 PolarHBondContact O-N 2.65Å; M90-I93 PolarHBondContact O-N 2.94Å; M90-L94 VanDerWaalsContact O-CB 3.25Å; M90-L94 WeakPolarHBondContact O-CB 3.45Å; M90-L94 PolarHBondContact O-N 3.48Å; M90-F108 HydrophobicContact CG-CD2 4.34Å; M90-F108 HydrophobicContact CG-CE2 4.03Å; M90-F108 HydrophobicContact SD-CD2 3.62Å; M90-F108 HydrophobicContact SD-CE2 3.9Å; M90-W170 HydrophobicContact CE-CD2 3.91Å; M90-W170 HydrophobicContact CE-CG 3.76Å; M90-W170 HydrophobicContact CE-CZ2 4.38Å; M90-W170 VanDerWaalsContact CE-NE1 3.32Å; M90-T173 HydrophobicContact CG-CG2 4.37Å; M90-T173 WeakPolarHBondContact CG-OG1 3.46Å
91L90.4Very high90.9Very high116 Ų11655.2 Ų55.261%0.60730%0.302SS*.Hα-helixtrans-61.6-41.2174.2-74.7172.2000111.3G87 L94 S95G87-L91 WeakPolarHBondContact O-CB 3.26Å; G87-L91 WeakPolarHBondContact O-CG 3.45Å; G87-L91 PolarHBondContact O-N 2.83Å; L91-L94 PolarHBondContact O-N 2.7Å; L91-S95 WeakPolarHBondContact O-CB 3.39Å; L91-S95 PolarHBondContact O-N 3.21Å; L91-S95 PolarHBondContact O-OG 3.44Å
92H86.8Confident90.6Very high55 Ų5552.1 Ų52.126%0.25529%0.287SS..Hα-helixtrans-59.4-53174.9175.5-90.3000111.6L11 S88 Y89 M90 L94 S95 A96L11-H92 HydrophobicContact CD1-CB 4.01Å; S88-H92 WeakPolarHBondContact O-CB 3.19Å; S88-H92 PolarHBondContact O-N 3.31Å; Y89-H92 WeakPolarHBondContact O-CB 3.39Å; Y89-H92 PolarHBondContact O-N 3.2Å; M90-H92 VanDerWaalsContact C-N 3.31Å; M90-H92 PolarHBondContact O-N 2.65Å; H92-L94 VanDerWaalsContact C-N 3.29Å; H92-L94 PolarHBondContact O-N 3.15Å; H92-S95 PolarHBondContact O-N 2.98Å; H92-S95 PolarHBondContact O-OG 3.24Å; H92-A96 VanDerWaalsContact O-CB 3.32Å; H92-A96 WeakPolarHBondContact O-CB 3.46Å; H92-A96 PolarHBondContact O-N 3.09Å
93I88.1Confident90.5Very high8 Ų852.1 Ų52.14%0.04129%0.287CS..Hα-helixtrans-60.3-41.2178.1-64.1173.4000111.3Y89 M90 S95 A96 S97 G98Y89-I93 HydrophobicContact CD1-CD1 3.77Å; Y89-I93 HydrophobicContact CE1-CD1 3.15Å; Y89-I93 HydrophobicContact CE1-CG1 4.16Å; Y89-I93 HydrophobicContact CE2-CD1 4.46Å; Y89-I93 PolarHBondContact O-N 2.93Å; M90-I93 PolarHBondContact O-N 2.94Å; I93-S95 VanDerWaalsContact C-N 3.33Å; I93-S95 PolarHBondContact O-N 3.15Å; I93-A96 PolarHBondContact O-N 3.42Å; I93-S97 WeakPolarHBondContact O-CA 3.35Å; I93-S97 WeakPolarHBondContact O-CB 3.28Å; I93-S97 PolarHBondContact O-N 3.26Å; I93-G98 PolarHBondContact O-N 3.42Å
94L89.4Confident90.2Very high56 Ų5652.1 Ų52.129%0.29329%0.286SS..Hα-helixtrans-60.5-43.3178.3-178.762.3000111.7M90 L91 H92 G98 F99 W170M90-L94 VanDerWaalsContact O-CB 3.25Å; M90-L94 WeakPolarHBondContact O-CB 3.45Å; M90-L94 PolarHBondContact O-N 3.48Å; L91-L94 PolarHBondContact O-N 2.7Å; H92-L94 VanDerWaalsContact C-N 3.29Å; H92-L94 PolarHBondContact O-N 3.15Å; L94-G98 WeakPolarHBondContact O-CA 3.43Å; L94-G98 PolarHBondContact O-N 2.86Å; L94-G98 VanDerWaalsContact O-N 3.1Å; L94-F99 VanDerWaalsContact CD1-CA 3.49Å; L94-F99 HydrophobicContact CD1-CB 3.82Å; L94-F99 HydrophobicContact CD1-CD2 3.92Å; L94-F99 HydrophobicContact CD1-CG 4.39Å; L94-W170 HydrophobicContact CD2-CH2 4.44Å
95S88.6Confident89.7Confident101 Ų10149.1 Ų49.171%0.70627%0.271SS*.Hα-helixtrans-73.2-37.8179.167.70000113.4L91 H92 I93L91-S95 WeakPolarHBondContact O-CB 3.39Å; L91-S95 PolarHBondContact O-N 3.21Å; L91-S95 PolarHBondContact O-OG 3.44Å; H92-S95 PolarHBondContact O-N 2.98Å; H92-S95 PolarHBondContact O-OG 3.24Å; I93-S95 VanDerWaalsContact C-N 3.33Å; I93-S95 PolarHBondContact O-N 3.15Å
96A87.3Confident89.6Confident65 Ų6550.8 Ų50.854%0.53728%0.279SS..Hα-helixtrans-86-34.9-173.800000113.2H92 I93H92-A96 VanDerWaalsContact O-CB 3.32Å; H92-A96 WeakPolarHBondContact O-CB 3.46Å; H92-A96 PolarHBondContact O-N 3.09Å; I93-A96 PolarHBondContact O-N 3.42Å
97S85.9Confident89.2Confident63 Ų6352.6 Ų52.644%0.44129%0.292SS..Hα-helixtrans-122.9-4-171.5-540000113.8I93 R101I93-S97 WeakPolarHBondContact O-CA 3.35Å; I93-S97 WeakPolarHBondContact O-CB 3.28Å; I93-S97 PolarHBondContact O-N 3.26Å; S97-R101 WeakPolarHBondContact O-CB 3.35Å
98G90.1Very high89.1Confident31 Ų3152 Ų5232%0.3229%0.286SS..Hα-helixtrans80.9170.9178.900000114.3I93 L94 R100 R101 S102I93-G98 PolarHBondContact O-N 3.42Å; L94-G98 WeakPolarHBondContact O-CA 3.43Å; L94-G98 PolarHBondContact O-N 2.86Å; L94-G98 VanDerWaalsContact O-N 3.1Å; G98-R100 PolarHBondContact O-N 3.15Å; G98-R101 PolarHBondContact O-N 2.81Å; G98-S102 PolarHBondContact O-N 2.98Å
99F91.1Very high89Confident102 Ų10249.8 Ų49.845%0.44727%0.269SS..Hα-helixtrans-65-41.6-172.7-178.7-107.4000114.2L94 R101 S102 I103 W170 L220 W224L94-F99 VanDerWaalsContact CD1-CA 3.49Å; L94-F99 HydrophobicContact CD1-CB 3.82Å; L94-F99 HydrophobicContact CD1-CD2 3.92Å; L94-F99 HydrophobicContact CD1-CG 4.39Å; F99-R101 PolarHBondContact O-N 3.49Å; F99-S102 PolarHBondContact O-N 2.86Å; F99-S102 PolarHBondContact O-OG 2.74Å; F99-I103 HydrophobicContact CD1-CD1 4.17Å; F99-I103 HydrophobicContact CE1-CD1 3.56Å; F99-I103 HydrophobicContact CE2-CD1 3.93Å; F99-I103 HydrophobicContact CZ-CD1 3.42Å; F99-I103 VanDerWaalsContact CZ-CD1 3.42Å; F99-I103 HydrophobicContact CZ-CG1 4.49Å; F99-I103 PolarHBondContact O-N 2.84Å; F99-W170 HydrophobicContact CD2-CZ2 4.13Å; F99-W170 HydrophobicContact CE2-CH2 4.43Å; F99-W170 AromaticContact CE2-CZ2 3.98Å; F99-W170 HydrophobicContact CE2-CZ2 3.98Å; F99-L220 HydrophobicContact CE1-CD1 3.71Å; F99-L220 HydrophobicContact CZ-CD1 4.02Å; F99-W224 HydrophobicContact CD1-CH2 4.19Å; F99-W224 HydrophobicContact CE1-CH2 4.22Å
100R89.8Confident88.9Confident93 Ų9352.5 Ų52.535%0.35129%0.285SS..Hα-helixtrans-63.3-44.4179.4-178.2169.8-174-150-8.1111.4G98 I103 C104 W224 D229G98-R100 PolarHBondContact O-N 3.15Å; R100-I103 PolarHBondContact O-N 3.33Å; R100-C104 PolarHBondContact O-N 2.91Å; R100-W224 HydrophobicContact CB-CH2 3.91Å; R100-W224 HydrophobicContact CB-CZ2 4.01Å; R100-W224 HydrophobicContact CB-CZ3 4.27Å; R100-W224 HydrophobicContact CG-CD2 3.78Å; R100-W224 HydrophobicContact CG-CE3 3.91Å; R100-W224 HydrophobicContact CG-CG 4.42Å; R100-W224 HydrophobicContact CG-CH2 3.9Å; R100-W224 HydrophobicContact CG-CZ2 3.76Å; R100-W224 HydrophobicContact CG-CZ3 3.97Å; R100-W224 VanDerWaalsContact NE-CD1 3.3Å; R100-D229 IonicContact CZ-OD2 3.4Å; R100-D229 IonicContact NH1-OD2 3.53Å; R100-D229 IonicContact NH2-OD2 2.67Å; R100-D229 PolarHBondContact NH2-OD2 3.37Å
101R88.3Confident88.6Confident167 Ų16752.2 Ų52.263%0.6328%0.284SS*.Hα-helixtrans-67.3-41.7178.1-160.3115.7-176.81601.6110.8S97 G98 F99 I103 C104 D105S97-R101 WeakPolarHBondContact O-CB 3.35Å; G98-R101 PolarHBondContact O-N 2.81Å; F99-R101 PolarHBondContact O-N 3.49Å; R101-I103 PolarHBondContact O-N 3.25Å; R101-I103 VanDerWaalsContact O-N 3.13Å; R101-C104 PolarHBondContact O-N 3.48Å; R101-C104 VanDerWaalsContact O-N 3.09Å; R101-D105 WeakPolarHBondContact O-CB 3.34Å; R101-D105 PolarHBondContact O-N 3.33Å
102S91.1Very high88.1Confident5 Ų548.3 Ų48.34%0.03527%0.266CS..Hα-helixtrans-61.3-25179.877.90000114.6G98 F99 W170G98-S102 PolarHBondContact O-N 2.98Å; F99-S102 PolarHBondContact O-N 2.86Å; F99-S102 PolarHBondContact O-OG 2.74Å; S102-W170 PolarHBondContact OG-NE1 2.95Å
103I92.3Very high88.1Confident0 Ų045.8 Ų45.80%026%0.255CS..Hα-helixtrans-80.7-46172.2-71.1172.3000111.2F99 R100 R101 D105 A166 G167 V217 L220 V221 W224F99-I103 HydrophobicContact CD1-CD1 4.17Å; F99-I103 HydrophobicContact CE1-CD1 3.56Å; F99-I103 HydrophobicContact CE2-CD1 3.93Å; F99-I103 HydrophobicContact CZ-CD1 3.42Å; F99-I103 VanDerWaalsContact CZ-CD1 3.42Å; F99-I103 HydrophobicContact CZ-CG1 4.49Å; F99-I103 PolarHBondContact O-N 2.84Å; R100-I103 PolarHBondContact O-N 3.33Å; R101-I103 PolarHBondContact O-N 3.25Å; R101-I103 VanDerWaalsContact O-N 3.13Å; I103-D105 VanDerWaalsContact C-N 3.32Å; I103-D105 PolarHBondContact O-N 2.88Å; I103-A166 CarbonylContact O-C 3.54Å; I103-G167 WeakPolarHBondContact O-CA 3.38Å; I103-G167 PolarHBondContact O-N 3.47Å; I103-V217 HydrophobicContact CG2-CG1 4.28Å; I103-L220 HydrophobicContact CD1-CB 4.37Å; I103-L220 HydrophobicContact CD1-CD1 3.59Å; I103-V221 HydrophobicContact CG2-CG2 3.48Å; I103-V221 VanDerWaalsContact CG2-CG2 3.48Å; I103-W224 HydrophobicContact CB-CE3 4.44Å; I103-W224 HydrophobicContact CB-CZ3 3.79Å; I103-W224 HydrophobicContact CD1-CH2 4.04Å; I103-W224 HydrophobicContact CD1-CZ3 3.66Å; I103-W224 HydrophobicContact CG1-CZ3 4.27Å; I103-W224 HydrophobicContact CG2-CE3 4.15Å; I103-W224 HydrophobicContact CG2-CZ3 3.85Å
104C90.4Very high88.2Confident14 Ų1445.4 Ų45.410%0.09525%0.253CS..Hα-helixtrans-81.8-9.7-174.8-69.60000114.7R100 R101 Q106 C230R100-C104 PolarHBondContact O-N 2.91Å; R101-C104 PolarHBondContact O-N 3.48Å; R101-C104 VanDerWaalsContact O-N 3.09Å; C104-Q106 PolarHBondContact O-N 3.43Å; C104-C230 WeakPolarHBondContact CA-SG 3.34Å; C104-C230 HydrophobicContact CB-CB 3.86Å; C104-C230 WeakPolarHBondContact CB-SG 3.41Å; C104-C230 WeakPolarHBondContact SG-CB 3.48Å; C104-C230 CovalentContact SG-SG 2.05Å; C104-C230 PolarHBondContact SG-SG 3.05Å
105D84.6Confident88.3Confident45 Ų4543.7 Ų43.724%0.24124%0.243CC..  trans-76.9119.8-175.2-170.515000112.5R101 I103 S107R101-D105 WeakPolarHBondContact O-CB 3.34Å; R101-D105 PolarHBondContact O-N 3.33Å; I103-D105 VanDerWaalsContact C-N 3.32Å; I103-D105 PolarHBondContact O-N 2.88Å; D105-S107 VanDerWaalsContact C-N 3.31Å; D105-S107 WeakPolarHBondContact OD1-CB 3.34Å; D105-S107 PolarHBondContact OD1-N 2.99Å; D105-S107 PolarHBondContact OD1-OG 2.91Å; D105-S107 WeakPolarHBondContact OD2-CB 3.42Å; D105-S107 PolarHBondContact OD2-OG 3.15Å
106Q89Confident88.6Confident56 Ų5641.6 Ų41.626%0.26222%0.221SC..G310 helixtrans-85.7-4.1173.5-61.9-177.6-55.500112.3C104 F108 Y109 M164C104-Q106 PolarHBondContact O-N 3.43Å; Q106-F108 PolarHBondContact O-N 3.44Å; Q106-Y109 WeakPolarHBondContact O-CD2 3.22Å; Q106-Y109 PolarHBondContact O-N 2.89Å; Q106-Y109 VanDerWaalsContact O-N 3.09Å; Q106-M164 WeakPolarHBondContact CG-O 3.29Å; Q106-M164 PolarHBondContact NE2-O 3.31Å
107S86.6Confident89Confident38 Ų3839.1 Ų39.127%0.26620%0.198SC..G310 helixtrans-58.2-22.1178.280.90000112.6Y89 D105 Y109 N110 G111Y89-S107 PolarHBondContact OH-O 3.45Å; Y89-S107 PolarHBondContact OH-OG 3.07Å; D105-S107 VanDerWaalsContact C-N 3.31Å; D105-S107 WeakPolarHBondContact OD1-CB 3.34Å; D105-S107 PolarHBondContact OD1-N 2.99Å; D105-S107 PolarHBondContact OD1-OG 2.91Å; D105-S107 WeakPolarHBondContact OD2-CB 3.42Å; D105-S107 PolarHBondContact OD2-OG 3.15Å; S107-Y109 PolarHBondContact O-N 3.37Å; S107-Y109 VanDerWaalsContact O-N 3.11Å; S107-N110 CarbonylContact O-C 3.57Å; S107-N110 PolarHBondContact O-N 2.91Å; S107-G111 WeakPolarHBondContact O-CA 3.27Å; S107-G111 PolarHBondContact O-N 2.93Å
108F88.9Confident89.4Confident3 Ų336.1 Ų36.11%0.01318%0.177CC..G310 helixtrans-52.3-34.1173.4-170.6-88000113.7T86 Y89 M90 Q106 N110 S114 A118 G169 M172T86-F108 HydrophobicContact CG2-CE2 4.24Å; T86-F108 HydrophobicContact CG2-CZ 3.68Å; Y89-F108 AromaticContact CD1-CD2 3.62Å; Y89-F108 HydrophobicContact CD1-CD2 3.62Å; Y89-F108 HydrophobicContact CD1-CE2 4.08Å; Y89-F108 HydrophobicContact CE1-CB 4.19Å; Y89-F108 AromaticContact CE1-CD2 3.77Å; Y89-F108 HydrophobicContact CE1-CD2 3.77Å; Y89-F108 HydrophobicContact CE1-CG 4.35Å; M90-F108 HydrophobicContact CG-CD2 4.34Å; M90-F108 HydrophobicContact CG-CE2 4.03Å; M90-F108 HydrophobicContact SD-CD2 3.62Å; M90-F108 HydrophobicContact SD-CE2 3.9Å; Q106-F108 PolarHBondContact O-N 3.44Å; F108-N110 VanDerWaalsContact C-N 3.35Å; F108-S114 CarbonylContact O-C 3.45Å; F108-S114 WeakPolarHBondContact O-CB 3.26Å; F108-S114 PolarHBondContact O-OG 2.89Å; F108-A118 HydrophobicContact CD1-CB 4.08Å; F108-A118 HydrophobicContact CE1-CB 3.79Å; F108-G169 VanDerWaalsContact CD2-CA 3.47Å; F108-G169 VanDerWaalsContact CG-CA 3.5Å; F108-M172 HydrophobicContact CD1-CE 3.5Å; F108-M172 VanDerWaalsContact CD1-CE 3.5Å; F108-M172 HydrophobicContact CE1-CB 4.3Å; F108-M172 HydrophobicContact CE1-CE 3.34Å; F108-M172 HydrophobicContact CE1-SD 3.81Å; F108-M172 HydrophobicContact CZ-CB 4.36Å; F108-M172 HydrophobicContact CZ-CE 4.45Å
109Y88.8Confident89.7Confident5 Ų536.5 Ų36.52%0.0217%0.169CC..G310 helixtrans-78.5-19.4179.3-63.2-85.2000113.4Q106 S107 K115 A118 Y161 M164 V165 G168 M172Q106-Y109 WeakPolarHBondContact O-CD2 3.22Å; Q106-Y109 PolarHBondContact O-N 2.89Å; Q106-Y109 VanDerWaalsContact O-N 3.09Å; S107-Y109 PolarHBondContact O-N 3.37Å; S107-Y109 VanDerWaalsContact O-N 3.11Å; Y109-K115 WeakPolarHBondContact O-CA 3.34Å; Y109-K115 WeakPolarHBondContact O-CB 3.23Å; Y109-A118 HydrophobicContact CD1-CB 4.22Å; Y109-Y161 AromaticContact CD1-CD2 3.82Å; Y109-Y161 HydrophobicContact CD1-CD2 3.82Å; Y109-Y161 AromaticContact CD1-CE2 3.65Å; Y109-Y161 HydrophobicContact CD1-CE2 3.65Å; Y109-Y161 AromaticContact CE1-CD2 3.61Å; Y109-Y161 HydrophobicContact CE1-CD2 3.61Å; Y109-Y161 AromaticContact CE1-CE2 3.94Å; Y109-Y161 HydrophobicContact CE1-CE2 3.94Å; Y109-Y161 HydrophobicContact CE1-CG 4.34Å; Y109-M164 HydrophobicContact CD1-CG 4.3Å; Y109-M164 HydrophobicContact CD2-CB 3.7Å; Y109-M164 HydrophobicContact CD2-CG 4.07Å; Y109-M164 VanDerWaalsContact CE2-C 3.41Å; Y109-M164 HydrophobicContact CE2-CB 3.91Å; Y109-M164 HydrophobicContact CG-CB 4.06Å; Y109-M164 HydrophobicContact CG-CG 3.9Å; Y109-V165 PolarHBondContact OH-N 2.96Å; Y109-V165 PolarHBondContact OH-O 3.28Å; Y109-G168 WeakPolarHBondContact OH-CA 3.37Å; Y109-M172 HydrophobicContact CD1-CE 4.38Å; Y109-M172 HydrophobicContact CE1-CE 3.58Å
110N88.3Confident89.9Confident70 Ų7032.4 Ų32.437%0.37415%0.153SC..THydrogen-bonded Turntrans-119.8-2-175-56.7-56.4000113.3E24 S107 F108E24-N110 HydrophobicContact CG-CB 4.44Å; E24-N110 WeakPolarHBondContact CG-OD1 3.16Å; S107-N110 CarbonylContact O-C 3.57Å; S107-N110 PolarHBondContact O-N 2.91Å; F108-N110 VanDerWaalsContact C-N 3.35Å
111G84.6Confident90.3Very high4 Ų428.7 Ų28.74%0.04114%0.14CC..SBendtrans-66.2147.6-176.900000111.7S107 V113 S114 K115S107-G111 WeakPolarHBondContact O-CA 3.27Å; S107-G111 PolarHBondContact O-N 2.93Å; G111-V113 PolarHBondContact O-N 2.96Å; G111-V113 VanDerWaalsContact O-N 3.08Å; G111-S114 PolarHBondContact O-N 3.22Å; G111-K115 VanDerWaalsContact O-CB 3.27Å; G111-K115 WeakPolarHBondContact O-CB 3.43Å; G111-K115 WeakPolarHBondContact O-CD 3.48Å; G111-K115 WeakPolarHBondContact O-CG 3.49Å; G111-K115 PolarHBondContact O-N 3.29Å
112P81.1Confident90.6Very high33 Ų3320.9 Ų20.921%0.21411%0.111CC..THydrogen-bonded Turntrans-63.8-23.3-169.528-37.6000113.7L11 R12 E19 T20L11-P112 HydrophobicContact CD2-CG 3.56Å; R12-P112 HydrophobicContact CG-CB 4.3Å; R12-P112 HydrophobicContact CG-CG 4.36Å; E19-P112 CarbonylContact C-O 3.43Å; T20-P112 HydrophobicContact CG2-CB 4.48Å
113V85.7Confident90.8Very high3 Ų323.4 Ų23.42%0.01812%0.124CC..THydrogen-bonded Turntrans-100.7-50.4173.6178.60000110.6L11 A15 R85 G111 K115 W117L11-V113 HydrophobicContact CD2-CG2 4.26Å; L11-V113 HydrophobicContact CG-CG2 4.4Å; A15-V113 HydrophobicContact CB-CG2 3.63Å; R85-V113 HydrophobicContact CB-CG1 4.04Å; G111-V113 PolarHBondContact O-N 2.96Å; G111-V113 VanDerWaalsContact O-N 3.08Å; V113-K115 PolarHBondContact O-N 3.34Å; V113-W117 VanDerWaalsContact O-CD1 3.3Å
114S90.2Very high91Very high0 Ų023.9 Ų23.90%013%0.127CC..Hα-helixtrans-72-26.1-166.9560000114.6Y89 F108 G111 F116 W117 A118Y89-S114 WeakPolarHBondContact CE1-OG 3.36Å; F108-S114 CarbonylContact O-C 3.45Å; F108-S114 WeakPolarHBondContact O-CB 3.26Å; F108-S114 PolarHBondContact O-OG 2.89Å; G111-S114 PolarHBondContact O-N 3.22Å; S114-F116 PolarHBondContact O-N 2.87Å; S114-W117 PolarHBondContact O-N 2.99Å; S114-W117 VanDerWaalsContact O-N 3.14Å; S114-A118 WeakPolarHBondContact O-CB 3.34Å; S114-A118 PolarHBondContact O-N 3.11Å
115K92Very high91.3Very high19 Ų1923.3 Ų23.38%0.08312%0.123CC..Hα-helixtrans-57.7-45.7-174.465.5-172.2-172.5160.10114.2E19 T20 F22 E24 Y109 G111 V113 Y119E19-K115 WeakPolarHBondContact O-CE 3.35Å; T20-K115 WeakPolarHBondContact O-CE 3.27Å; T20-K115 PolarHBondContact O-NZ 2.94Å; F22-K115 HydrophobicContact CB-CG 4.49Å; F22-K115 HydrophobicContact CD1-CB 4.45Å; F22-K115 HydrophobicContact CD1-CG 4.06Å; F22-K115 VanDerWaalsContact O-CE 3.28Å; F22-K115 WeakPolarHBondContact O-CE 3.21Å; F22-K115 PolarHBondContact O-NZ 3.43Å; E24-K115 HydrophobicContact CB-CB 4.07Å; E24-K115 HydrophobicContact CB-CD 4.13Å; E24-K115 HydrophobicContact CG-CD 4.35Å; E24-K115 WeakPolarHBondContact OE2-CD 3.47Å; E24-K115 IonicContact OE2-NZ 3.42Å; E24-K115 PolarHBondContact OE2-NZ 3.36Å; Y109-K115 WeakPolarHBondContact O-CA 3.34Å; Y109-K115 WeakPolarHBondContact O-CB 3.23Å; G111-K115 VanDerWaalsContact O-CB 3.27Å; G111-K115 WeakPolarHBondContact O-CB 3.43Å; G111-K115 WeakPolarHBondContact O-CD 3.48Å; G111-K115 WeakPolarHBondContact O-CG 3.49Å; G111-K115 PolarHBondContact O-N 3.29Å; V113-K115 PolarHBondContact O-N 3.34Å; K115-Y119 PolarHBondContact O-N 3.22Å
116F94.4Very high91.8Very high57 Ų5722.5 Ų22.525%0.2512%0.123CC..Hα-helixtrans-63.8-46.3176.5171.4-94.7000110.9F18 E19 F22 S114 A118 Y119 A120F18-F116 HydrophobicContact CD2-CD1 4.34Å; F18-F116 HydrophobicContact CD2-CD2 4.31Å; F18-F116 HydrophobicContact CD2-CE1 4.36Å; F18-F116 HydrophobicContact CD2-CE2 4.32Å; F18-F116 HydrophobicContact CD2-CG 4.31Å; F18-F116 HydrophobicContact CD2-CZ 4.34Å; F18-F116 AromaticContact CE2-CD1 3.7Å; F18-F116 HydrophobicContact CE2-CD1 3.7Å; F18-F116 HydrophobicContact CE2-CD2 4.45Å; F18-F116 AromaticContact CE2-CE1 3.66Å; F18-F116 HydrophobicContact CE2-CE1 3.66Å; F18-F116 HydrophobicContact CE2-CE2 4.41Å; F18-F116 HydrophobicContact CE2-CG 4.11Å; F18-F116 HydrophobicContact CE2-CZ 4.03Å; E19-F116 HydrophobicContact CG-CB 4.48Å; F22-F116 HydrophobicContact CB-CB 4.19Å; F22-F116 HydrophobicContact CB-CD2 4.49Å; F22-F116 HydrophobicContact CD1-CB 4.31Å; F22-F116 AromaticContact CD2-CD2 3.71Å; F22-F116 HydrophobicContact CD2-CD2 3.71Å; F22-F116 HydrophobicContact CE2-CD2 4.14Å; F22-F116 HydrophobicContact CG-CB 4.08Å; F22-F116 HydrophobicContact CG-CD2 4.1Å; S114-F116 PolarHBondContact O-N 2.87Å; F116-A118 VanDerWaalsContact C-N 3.32Å; F116-A118 PolarHBondContact O-N 3.33Å; F116-Y119 PolarHBondContact O-N 3.18Å; F116-A120 HydrophobicContact CE1-CB 4.27Å; F116-A120 HydrophobicContact CZ-CB 4.47Å; F116-A120 WeakPolarHBondContact O-CB 3.23Å; F116-A120 PolarHBondContact O-N 3.47Å
117W95.5Very high92Very high14 Ų1423 Ų235%0.05313%0.131CC..Hα-helixtrans-68.7-30.5-177.3-68.9103.6000113.3E19 F78 I81 G82 R85 T86 V113 S114 F121 Y176E19-W117 PolarHBondContact OE1-NE1 2.9Å; F78-W117 HydrophobicContact CD2-CZ3 4.12Å; F78-W117 HydrophobicContact CE2-CE3 4.42Å; F78-W117 AromaticContact CE2-CZ3 3.97Å; F78-W117 HydrophobicContact CE2-CZ3 3.97Å; I81-W117 HydrophobicContact CB-CH2 3.7Å; I81-W117 HydrophobicContact CB-CZ2 4.27Å; I81-W117 HydrophobicContact CB-CZ3 4.37Å; I81-W117 HydrophobicContact CG2-CH2 3.26Å; I81-W117 HydrophobicContact CG2-CZ2 3.34Å; I81-W117 HydrophobicContact CG2-CZ3 4.29Å; G82-W117 VanDerWaalsContact CA-CE3 3.44Å; R85-W117 HydrophobicContact CB-CD2 4.36Å; R85-W117 HydrophobicContact CB-CG 4.22Å; R85-W117 HydrophobicContact CG-CZ2 3.97Å; T86-W117 HydrophobicContact CG2-CB 3.61Å; T86-W117 HydrophobicContact CG2-CG 4.29Å; V113-W117 VanDerWaalsContact O-CD1 3.3Å; S114-W117 PolarHBondContact O-N 2.99Å; S114-W117 VanDerWaalsContact O-N 3.14Å; W117-F121 VanDerWaalsContact O-CB 3.27Å; W117-F121 WeakPolarHBondContact O-CB 3.44Å; W117-F121 PolarHBondContact O-N 2.7Å; W117-Y176 PolarHBondContact O-OH 2.94Å
118A95.5Very high92.5Very high0 Ų021.3 Ų21.30%012%0.119CC..Hα-helixtrans-65.5-45172.600000110.9F108 Y109 S114 F116 F121 V122 Y161 M172F108-A118 HydrophobicContact CD1-CB 4.08Å; F108-A118 HydrophobicContact CE1-CB 3.79Å; Y109-A118 HydrophobicContact CD1-CB 4.22Å; S114-A118 WeakPolarHBondContact O-CB 3.34Å; S114-A118 PolarHBondContact O-N 3.11Å; F116-A118 VanDerWaalsContact C-N 3.32Å; F116-A118 PolarHBondContact O-N 3.33Å; A118-F121 WeakPolarHBondContact O-CB 3.26Å; A118-F121 PolarHBondContact O-N 2.94Å; A118-V122 PolarHBondContact O-N 3.29Å; A118-Y161 HydrophobicContact CB-CE2 3.88Å; A118-M172 HydrophobicContact CB-CE 4.18Å; A118-M172 HydrophobicContact CB-SD 3.91Å
119Y95.6Very high92.8Very high39 Ų3922.3 Ų22.315%0.15312%0.124CC..Hα-helixtrans-67.6-46.3176.6-175-117.4000112F22 A27 W30 M31 K115 F116 F121 V122 L123 Y161F22-Y119 HydrophobicContact CE1-CD1 4.42Å; F22-Y119 HydrophobicContact CE1-CG 4.32Å; F22-Y119 AromaticContact CE2-CD1 3.86Å; F22-Y119 HydrophobicContact CE2-CD1 3.86Å; F22-Y119 HydrophobicContact CE2-CE1 4.43Å; F22-Y119 AromaticContact CZ-CD1 3.36Å; F22-Y119 HydrophobicContact CZ-CD1 3.36Å; F22-Y119 HydrophobicContact CZ-CE1 4.11Å; F22-Y119 AromaticContact CZ-CG 3.63Å; F22-Y119 HydrophobicContact CZ-CG 3.63Å; A27-Y119 HydrophobicContact CB-CD1 4.38Å; A27-Y119 HydrophobicContact CB-CD2 3.71Å; A27-Y119 HydrophobicContact CB-CE1 4.49Å; A27-Y119 HydrophobicContact CB-CE2 3.88Å; A27-Y119 HydrophobicContact CB-CG 3.96Å; W30-Y119 HydrophobicContact CE3-CE2 4.37Å; M31-Y119 HydrophobicContact CG-CD2 4.33Å; M31-Y119 HydrophobicContact CG-CE2 3.93Å; M31-Y119 HydrophobicContact SD-CE2 4.23Å; K115-Y119 PolarHBondContact O-N 3.22Å; F116-Y119 PolarHBondContact O-N 3.18Å; Y119-F121 PolarHBondContact O-N 3.48Å; Y119-V122 PolarHBondContact O-N 3.38Å; Y119-V122 VanDerWaalsContact O-N 3.15Å; Y119-L123 HydrophobicContact CD1-CD1 3.87Å; Y119-L123 HydrophobicContact CD1-CG 4.36Å; Y119-L123 HydrophobicContact CE1-CD1 3.31Å; Y119-L123 HydrophobicContact CE1-CG 4.03Å; Y119-L123 HydrophobicContact CE2-CD1 4.32Å; Y119-L123 HydrophobicContact CE2-CD2 4.34Å; Y119-L123 HydrophobicContact CE2-CG 4.22Å; Y119-L123 PolarHBondContact O-N 2.88Å; Y119-L123 VanDerWaalsContact O-N 3.07Å; Y119-Y161 HydrophobicContact CD2-CE1 4.17Å
120A96.1Very high93Very high15 Ų1523 Ų2312%0.12413%0.133CC..Hα-helixtrans-58.6-35.7177.800000112.1F78 F116 L123 S124F78-A120 HydrophobicContact CE2-CB 3.96Å; F78-A120 HydrophobicContact CZ-CB 4.02Å; F116-A120 HydrophobicContact CE1-CB 4.27Å; F116-A120 HydrophobicContact CZ-CB 4.47Å; F116-A120 WeakPolarHBondContact O-CB 3.23Å; F116-A120 PolarHBondContact O-N 3.47Å; A120-L123 PolarHBondContact O-N 3.44Å; A120-S124 WeakPolarHBondContact O-CB 3.02Å; A120-S124 PolarHBondContact O-N 3.11Å
121F96.9Very high93.4Very high16 Ų1620.5 Ų20.57%0.0712%0.119CC..Hα-helixtrans-60-46.6176178.1-93.8000112.5W117 A118 Y119 S124 K125 M172 N175 Y176W117-F121 VanDerWaalsContact O-CB 3.27Å; W117-F121 WeakPolarHBondContact O-CB 3.44Å; W117-F121 PolarHBondContact O-N 2.7Å; A118-F121 WeakPolarHBondContact O-CB 3.26Å; A118-F121 PolarHBondContact O-N 2.94Å; Y119-F121 PolarHBondContact O-N 3.48Å; F121-S124 PolarHBondContact O-N 3.4Å; F121-S124 PolarHBondContact O-OG 3.02Å; F121-K125 VanDerWaalsContact CZ-CE 3.49Å; F121-M172 HydrophobicContact CB-CG 4.47Å; F121-M172 HydrophobicContact CB-SD 4.23Å; F121-M172 HydrophobicContact CD1-CB 4.42Å; F121-M172 HydrophobicContact CD1-CG 3.58Å; F121-M172 HydrophobicContact CD1-SD 3.99Å; F121-M172 HydrophobicContact CD2-CB 4.25Å; F121-M172 HydrophobicContact CD2-CG 4.27Å; F121-M172 HydrophobicContact CE1-CG 3.77Å; F121-M172 HydrophobicContact CE2-CB 4.39Å; F121-M172 HydrophobicContact CE2-CG 4.42Å; F121-M172 HydrophobicContact CG-CB 4.25Å; F121-M172 HydrophobicContact CG-CG 3.84Å; F121-M172 HydrophobicContact CG-SD 4.19Å; F121-M172 HydrophobicContact CZ-CG 4.19Å; F121-N175 HydrophobicContact CE2-CB 3.66Å; F121-N175 WeakPolarHBondContact CE2-OD1 3.26Å; F121-N175 HydrophobicContact CZ-CB 3.83Å; F121-Y176 VanDerWaalsContact CA-OH 3.28Å; F121-Y176 WeakPolarHBondContact CA-OH 3.47Å; F121-Y176 HydrophobicContact CB-CE2 3.86Å; F121-Y176 WeakPolarHBondContact CB-OH 3.48Å; F121-Y176 HydrophobicContact CD2-CD1 4.41Å; F121-Y176 AromaticContact CD2-CD2 3.99Å; F121-Y176 HydrophobicContact CD2-CD2 3.99Å; F121-Y176 HydrophobicContact CD2-CE1 4.13Å; F121-Y176 AromaticContact CD2-CE2 3.65Å; F121-Y176 HydrophobicContact CD2-CE2 3.65Å; F121-Y176 HydrophobicContact CD2-CG 4.36Å; F121-Y176 AromaticContact CD2-CZ 3.74Å; F121-Y176 HydrophobicContact CG-CE2 4.19Å; F121-Y176 PolarHBondContact N-OH 3.34Å; F121-Y176 VanDerWaalsContact N-OH 3.15Å
122V95.6Very high93.9Very high3 Ų320.3 Ų20.32%0.01812%0.118CC..Hα-helixtrans-69.7-40.8-177.2176.40000110.2M31 A118 Y119 S124 K125 W158 Y161M31-V122 HydrophobicContact CE-CG1 3.67Å; M31-V122 HydrophobicContact SD-CG1 4.13Å; A118-V122 PolarHBondContact O-N 3.29Å; Y119-V122 PolarHBondContact O-N 3.38Å; Y119-V122 VanDerWaalsContact O-N 3.15Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.83Å; V122-K125 PolarHBondContact O-N 2.95Å; V122-W158 HydrophobicContact CG1-CB 4.45Å; V122-W158 HydrophobicContact CG1-CD2 4.49Å; V122-W158 HydrophobicContact CG1-CG 3.9Å; V122-W158 PolarHBondContact O-NE1 3.22Å; V122-Y161 HydrophobicContact CB-CD2 4.46Å; V122-Y161 HydrophobicContact CG2-CD2 3.45Å; V122-Y161 VanDerWaalsContact CG2-CD2 3.45Å; V122-Y161 HydrophobicContact CG2-CE2 4.3Å; V122-Y161 HydrophobicContact CG2-CG 3.75Å
123L95.3Very high94.5Very high58 Ų5821.1 Ų21.130%0.30413%0.127SC..Hα-helixtrans-65.4-36.2174.7-67.8-169.8000112.2W30 Y119 A120 K125 A126 P127 W158W30-L123 HydrophobicContact CH2-CD2 4.48Å; W30-L123 HydrophobicContact CZ3-CD2 4.14Å; Y119-L123 HydrophobicContact CD1-CD1 3.87Å; Y119-L123 HydrophobicContact CD1-CG 4.36Å; Y119-L123 HydrophobicContact CE1-CD1 3.31Å; Y119-L123 HydrophobicContact CE1-CG 4.03Å; Y119-L123 HydrophobicContact CE2-CD1 4.32Å; Y119-L123 HydrophobicContact CE2-CD2 4.34Å; Y119-L123 HydrophobicContact CE2-CG 4.22Å; Y119-L123 PolarHBondContact O-N 2.88Å; Y119-L123 VanDerWaalsContact O-N 3.07Å; A120-L123 PolarHBondContact O-N 3.44Å; L123-K125 PolarHBondContact O-N 3.39Å; L123-K125 VanDerWaalsContact O-N 3.11Å; L123-A126 PolarHBondContact O-N 3.34Å; L123-A126 VanDerWaalsContact O-N 3.16Å; L123-P127 WeakPolarHBondContact O-CD 3.41Å; L123-W158 HydrophobicContact CD2-CZ2 4.09Å
124S96.4Very high94.9Very high10 Ų1022.5 Ų22.57%0.0713%0.132CC..Hα-helixtrans-60.7-24-177.584.70000113.3F78 A120 F121 V122 A126 P127 E128F78-S124 VanDerWaalsContact CE1-CB 3.44Å; A120-S124 WeakPolarHBondContact O-CB 3.02Å; A120-S124 PolarHBondContact O-N 3.11Å; F121-S124 PolarHBondContact O-N 3.4Å; F121-S124 PolarHBondContact O-OG 3.02Å; V122-S124 VanDerWaalsContact C-N 3.33Å; V122-S124 PolarHBondContact O-N 2.83Å; S124-A126 PolarHBondContact O-N 3.18Å; S124-P127 VanDerWaalsContact O-CD 3.26Å; S124-P127 WeakPolarHBondContact O-CD 3.44Å; S124-E128 WeakPolarHBondContact O-CB 3.49Å; S124-E128 WeakPolarHBondContact O-CG 3.4Å; S124-E128 PolarHBondContact O-N 3.04Å; S124-E128 PolarHBondContact OG-OE1 3.4Å
125K96.3Very high95.1Very high1 Ų124 Ų240%0.00414%0.142CC..Hα-helixtrans-63.8-28.1179.1-57.9-42.9176.9-165.50113.3F121 V122 L123 E128 V153 L154 S157 N175F121-K125 VanDerWaalsContact CZ-CE 3.49Å; V122-K125 PolarHBondContact O-N 2.95Å; L123-K125 PolarHBondContact O-N 3.39Å; L123-K125 VanDerWaalsContact O-N 3.11Å; K125-E128 VanDerWaalsContact CD-OE2 3.27Å; K125-E128 WeakPolarHBondContact CD-OE2 3.21Å; K125-E128 IonicContact NZ-OE1 3.55Å; K125-E128 PolarHBondContact NZ-OE1 3.36Å; K125-E128 IonicContact NZ-OE2 2.91Å; K125-E128 PolarHBondContact NZ-OE2 3.11Å; K125-V153 HydrophobicContact CD-CG1 4.3Å; K125-V153 HydrophobicContact CD-CG2 4.46Å; K125-L154 HydrophobicContact CB-CB 4.37Å; K125-L154 HydrophobicContact CB-CD1 3.78Å; K125-S157 WeakPolarHBondContact CG-OG 3.48Å; K125-N175 PolarHBondContact NZ-OD1 3.45Å
126A94.6Very high95.3Very high29 Ų2923.7 Ų23.724%0.2414%0.141CC..Hα-helixtrans-74.2-49.9175.700000112.3L123 S124 E128 L129 L154L123-A126 PolarHBondContact O-N 3.34Å; L123-A126 VanDerWaalsContact O-N 3.16Å; S124-A126 PolarHBondContact O-N 3.18Å; A126-E128 VanDerWaalsContact C-N 3.31Å; A126-E128 PolarHBondContact O-N 2.6Å; A126-L129 VanDerWaalsContact O-CB 3.24Å; A126-L129 WeakPolarHBondContact O-CB 3.31Å; A126-L129 VanDerWaalsContact O-CG 3.22Å; A126-L129 WeakPolarHBondContact O-CG 3.2Å; A126-L129 PolarHBondContact O-N 2.87Å; A126-L154 HydrophobicContact CB-CD1 4.18Å
127P94.8Very high95.3Very high67 Ų6723.7 Ų23.744%0.43514%0.144SC..Hα-helixtrans-55-42.1169-29.636000113.5W71 L123 S124 L129 G130W71-P127 HydrophobicContact CH2-CB 4.14Å; W71-P127 VanDerWaalsContact CH2-O 3.25Å; W71-P127 WeakPolarHBondContact CH2-O 2.95Å; W71-P127 WeakPolarHBondContact CZ2-O 3.26Å; L123-P127 WeakPolarHBondContact O-CD 3.41Å; S124-P127 VanDerWaalsContact O-CD 3.26Å; S124-P127 WeakPolarHBondContact O-CD 3.44Å; P127-L129 PolarHBondContact O-N 2.99Å; P127-G130 PolarHBondContact O-N 2.64Å
128E96.3Very high95.3Very high2 Ų227 Ų271%0.00916%0.156CC..Hα-helixtrans-55.5-22.8179.9-75.8170.4-145.800113.4L75 S124 K125 A126 G130 D131 H150 H179L75-E128 HydrophobicContact CD2-CG 4.46Å; S124-E128 WeakPolarHBondContact O-CB 3.49Å; S124-E128 WeakPolarHBondContact O-CG 3.4Å; S124-E128 PolarHBondContact O-N 3.04Å; S124-E128 PolarHBondContact OG-OE1 3.4Å; K125-E128 VanDerWaalsContact CD-OE2 3.27Å; K125-E128 WeakPolarHBondContact CD-OE2 3.21Å; K125-E128 IonicContact NZ-OE1 3.55Å; K125-E128 PolarHBondContact NZ-OE1 3.36Å; K125-E128 IonicContact NZ-OE2 2.91Å; K125-E128 PolarHBondContact NZ-OE2 3.11Å; A126-E128 VanDerWaalsContact C-N 3.31Å; A126-E128 PolarHBondContact O-N 2.6Å; E128-G130 PolarHBondContact O-N 3.42Å; E128-G130 VanDerWaalsContact O-N 3.14Å; E128-D131 WeakPolarHBondContact O-CB 3.39Å; E128-D131 PolarHBondContact O-N 2.84Å; E128-D131 VanDerWaalsContact O-N 3.07Å; E128-H150 PolarHBondContact O-CE1 3.21Å; E128-H179 IonicContact OE1-ND1 3.89Å; E128-H179 IonicContact OE2-CE1 2.96Å; E128-H179 PolarHBondContact OE2-CE1 2.77Å; E128-H179 VanDerWaalsContact OE2-CE1 3.29Å; E128-H179 IonicContact OE2-ND1 3.78Å
129L94.4Very high95.1Very high24 Ų2431.5 Ų31.513%0.12618%0.176CC..THydrogen-bonded Turntrans-57.9-24.5170.9-58.9179.7000113.3Y45 A126 P127 D131 T132 H150 L154Y45-L129 HydrophobicContact CD1-CD2 4.48Å; Y45-L129 HydrophobicContact CD2-CB 3.75Å; Y45-L129 HydrophobicContact CD2-CD1 4.15Å; Y45-L129 HydrophobicContact CD2-CD2 3.81Å; Y45-L129 HydrophobicContact CD2-CG 4.11Å; Y45-L129 HydrophobicContact CE2-CB 4.02Å; Y45-L129 HydrophobicContact CE2-CD2 3.94Å; Y45-L129 HydrophobicContact CG-CD1 4.28Å; Y45-L129 HydrophobicContact CG-CD2 4.06Å; A126-L129 VanDerWaalsContact O-CB 3.24Å; A126-L129 WeakPolarHBondContact O-CB 3.31Å; A126-L129 VanDerWaalsContact O-CG 3.22Å; A126-L129 WeakPolarHBondContact O-CG 3.2Å; A126-L129 PolarHBondContact O-N 2.87Å; P127-L129 PolarHBondContact O-N 2.99Å; L129-D131 PolarHBondContact O-N 2.76Å; L129-T132 PolarHBondContact O-N 3.15Å; L129-H150 HydrophobicContact CD2-CB 3.87Å; L129-L154 HydrophobicContact CD1-CD2 4.01Å
130G94.2Very high95Very high20 Ų2034.3 Ų34.321%0.20619%0.19CC..Hα-helixtrans-59.6-24.8174.700000113.6P127 E128 T132 A133 F134P127-G130 PolarHBondContact O-N 2.64Å; E128-G130 PolarHBondContact O-N 3.42Å; E128-G130 VanDerWaalsContact O-N 3.14Å; G130-T132 PolarHBondContact O-N 2.99Å; G130-A133 WeakPolarHBondContact O-CB 3.4Å; G130-A133 PolarHBondContact O-N 2.75Å; G130-F134 VanDerWaalsContact O-CD2 3.26Å; G130-F134 WeakPolarHBondContact O-CD2 3.12Å; G130-F134 PolarHBondContact O-N 3.44Å
131D95Very high94.8Very high17 Ų1742.2 Ų42.29%0.09122%0.222CC..Hα-helixtrans-55.9-41.3175.4-72.5-14.8000111.3W71 E128 L129 A133 F134 V135 H150 Y183W71-D131 PolarHBondContact NE1-OD1 3.27Å; E128-D131 WeakPolarHBondContact O-CB 3.39Å; E128-D131 PolarHBondContact O-N 2.84Å; E128-D131 VanDerWaalsContact O-N 3.07Å; L129-D131 PolarHBondContact O-N 2.76Å; D131-A133 VanDerWaalsContact C-N 3.33Å; D131-A133 PolarHBondContact O-N 3.19Å; D131-F134 PolarHBondContact O-N 3.04Å; D131-V135 PolarHBondContact O-N 2.9Å; D131-H150 IonicContact OD2-CE1 3.88Å; D131-Y183 WeakPolarHBondContact OD2-CE1 3.27Å; D131-Y183 PolarHBondContact OD2-OH 2.93Å
132T95.2Very high94.6Very high0 Ų042.7 Ų42.70%023%0.225CC..Hα-helixtrans-70.9-31.7-179.6-45.90000112Y45 V49 L129 G130 F134 V135 V136 L142 H146Y45-T132 HydrophobicContact CE2-CG2 4.16Å; Y45-T132 WeakPolarHBondContact OH-CB 3.28Å; Y45-T132 WeakPolarHBondContact OH-CG2 2.89Å; Y45-T132 PolarHBondContact OH-OG1 3.33Å; V49-T132 HydrophobicContact CG1-CG2 4.16Å; V49-T132 HydrophobicContact CG2-CG2 3.55Å; L129-T132 PolarHBondContact O-N 3.15Å; G130-T132 PolarHBondContact O-N 2.99Å; T132-F134 VanDerWaalsContact C-N 3.32Å; T132-F134 PolarHBondContact O-N 2.87Å; T132-V135 WeakPolarHBondContact O-CB 3.22Å; T132-V135 PolarHBondContact O-N 3.2Å; T132-V136 HydrophobicContact CG2-CG2 4.45Å; T132-V136 WeakPolarHBondContact O-CG2 3.49Å; T132-V136 PolarHBondContact O-N 3.29Å; T132-L142 HydrophobicContact CG2-CD1 3.6Å; T132-L142 HydrophobicContact CG2-CD2 4.25Å; T132-H146 PolarHBondContact OG1-CD2 2.92Å; T132-H146 VanDerWaalsContact OG1-CD2 3.29Å; T132-H146 PolarHBondContact OG1-NE2 2.81Å
133A94.4Very high94.5Very high49 Ų4945.8 Ų45.841%0.40524%0.241SC..Hα-helixtrans-60.2-44173.200000110.8G130 D131 V135 V136 L137G130-A133 WeakPolarHBondContact O-CB 3.4Å; G130-A133 PolarHBondContact O-N 2.75Å; D131-A133 VanDerWaalsContact C-N 3.33Å; D131-A133 PolarHBondContact O-N 3.19Å; A133-V135 VanDerWaalsContact C-N 3.34Å; A133-V135 PolarHBondContact O-N 3.4Å; A133-V136 PolarHBondContact O-N 3.34Å; A133-L137 VanDerWaalsContact O-CB 3.32Å; A133-L137 WeakPolarHBondContact O-CB 3.38Å; A133-L137 WeakPolarHBondContact O-CG 3.47Å; A133-L137 PolarHBondContact O-N 2.83Å
134F94.8Very high94.4Very high32 Ų3248.3 Ų48.314%0.1425%0.25CC..Hα-helixtrans-62.5-38.7174.6-71.4-72.7000112.8L64 P67 L68 W71 G130 D131 T132 R138L64-F134 HydrophobicContact CB-CD1 4.09Å; L64-F134 HydrophobicContact CB-CE1 4.23Å; L64-F134 HydrophobicContact CD1-CD1 4.07Å; L64-F134 HydrophobicContact CD1-CE1 4.42Å; P67-F134 HydrophobicContact CB-CE1 3.97Å; P67-F134 HydrophobicContact CB-CZ 4.34Å; L68-F134 HydrophobicContact CB-CD1 4.15Å; L68-F134 HydrophobicContact CB-CE1 4.26Å; L68-F134 HydrophobicContact CD1-CB 4.04Å; L68-F134 HydrophobicContact CD1-CD1 4.18Å; L68-F134 HydrophobicContact CD1-CD2 4.08Å; L68-F134 HydrophobicContact CD1-CG 3.84Å; W71-F134 HydrophobicContact CB-CE2 3.89Å; W71-F134 HydrophobicContact CB-CZ 4.01Å; W71-F134 AromaticContact CD1-CE2 3.65Å; W71-F134 AromaticContact CD2-CE2 3.83Å; W71-F134 HydrophobicContact CD2-CE2 3.83Å; W71-F134 HydrophobicContact CG-CD2 4.36Å; W71-F134 AromaticContact CG-CE2 3.5Å; W71-F134 HydrophobicContact CG-CE2 3.5Å; W71-F134 VanDerWaalsContact CG-CE2 3.5Å; W71-F134 HydrophobicContact CG-CZ 4.11Å; G130-F134 VanDerWaalsContact O-CD2 3.26Å; G130-F134 WeakPolarHBondContact O-CD2 3.12Å; G130-F134 PolarHBondContact O-N 3.44Å; D131-F134 PolarHBondContact O-N 3.04Å; T132-F134 VanDerWaalsContact C-N 3.32Å; T132-F134 PolarHBondContact O-N 2.87Å; F134-R138 WeakPolarHBondContact O-CB 3.27Å; F134-R138 WeakPolarHBondContact O-CG 3.18Å; F134-R138 PolarHBondContact O-N 3.42Å
135V94.8Very high94.3Very high32 Ų3248.9 Ų48.919%0.19425%0.252CS..Hα-helixtrans-61.2-48.8175.9171.30000110.6D131 T132 A133 K139 Q140 L142D131-V135 PolarHBondContact O-N 2.9Å; T132-V135 WeakPolarHBondContact O-CB 3.22Å; T132-V135 PolarHBondContact O-N 3.2Å; A133-V135 VanDerWaalsContact C-N 3.34Å; A133-V135 PolarHBondContact O-N 3.4Å; V135-K139 PolarHBondContact O-N 3.43Å; V135-Q140 HydrophobicContact CG1-CB 3.97Å; V135-Q140 PolarHBondContact O-N 2.83Å; V135-L142 HydrophobicContact CG1-CB 4.1Å; V135-L142 HydrophobicContact CG1-CD1 4.01Å
136V95.6Very high94.2Very high12 Ų1251.1 Ų51.17%0.07326%0.262CS..Hα-helixtrans-65.8-50.1-178.9172.90000111.5V49 G52 Q53 M56 T132 A133 R138 K139V49-V136 HydrophobicContact CG1-CG2 4.39Å; G52-V136 VanDerWaalsContact C-CG1 3.4Å; Q53-V136 HydrophobicContact CG-CG1 4.13Å; Q53-V136 HydrophobicContact CG-CG2 4Å; M56-V136 HydrophobicContact CG-CG1 4.41Å; T132-V136 HydrophobicContact CG2-CG2 4.45Å; T132-V136 WeakPolarHBondContact O-CG2 3.49Å; T132-V136 PolarHBondContact O-N 3.29Å; A133-V136 PolarHBondContact O-N 3.34Å; V136-R138 VanDerWaalsContact C-N 3.28Å; V136-R138 PolarHBondContact O-N 3.22Å; V136-K139 PolarHBondContact O-N 3.27Å
137L94.6Very high94.2Very high58 Ų5852.8 Ų52.830%0.30426%0.263SS..Hα-helixtrans-66.3-28.4-177.8-67.5175.5000113.1M56 L62 L64 A133 K139M56-L137 WeakPolarHBondContact CE-O 3.38Å; M56-L137 HydrophobicContact CG-CD2 4.33Å; M56-L137 HydrophobicContact SD-CD2 4.13Å; L62-L137 HydrophobicContact CD1-CB 4.29Å; L62-L137 HydrophobicContact CD1-CD2 4.15Å; L62-L137 PolarHBondContact N-O 3.31Å; L62-L137 VanDerWaalsContact N-O 3.13Å; L64-L137 HydrophobicContact CD1-CB 3.61Å; L64-L137 HydrophobicContact CD1-CD1 3.74Å; L64-L137 HydrophobicContact CD1-CG 4.34Å; A133-L137 VanDerWaalsContact O-CB 3.32Å; A133-L137 WeakPolarHBondContact O-CB 3.38Å; A133-L137 WeakPolarHBondContact O-CG 3.47Å; A133-L137 PolarHBondContact O-N 2.83Å; L137-K139 VanDerWaalsContact C-N 3.31Å
138R94.5Very high94.3Very high83 Ų8352.4 Ų52.431%0.31325%0.253SS..THydrogen-bonded Turntrans-89.66.3174.8-63.8178.764.8-137.9-2.4113.4L64 F134 V136 Q140L64-R138 HydrophobicContact CB-CG 4.4Å; L64-R138 HydrophobicContact CD1-CG 4.49Å; F134-R138 WeakPolarHBondContact O-CB 3.27Å; F134-R138 WeakPolarHBondContact O-CG 3.18Å; F134-R138 PolarHBondContact O-N 3.42Å; V136-R138 VanDerWaalsContact C-N 3.28Å; V136-R138 PolarHBondContact O-N 3.22Å; R138-Q140 HydrophobicContact CB-CG 3.98Å; R138-Q140 PolarHBondContact O-N 3.37Å; R138-Q140 PolarHBondContact O-NE2 2.84Å; R138-Q140 VanDerWaalsContact O-NE2 3.09Å
139K92.7Very high94.3Very high94 Ų9453.3 Ų53.341%0.40926%0.257SS..THydrogen-bonded Turntrans51.737.2-176.6-65.2-170.6153.4-168.50113.3M56 K57 R59 K61 V135 V136 L137M56-K139 WeakPolarHBondContact O-CE 3.47Å; M56-K139 PolarHBondContact O-NZ 3.24Å; K57-K139 PolarHBondContact O-NZ 3.14Å; R59-K139 WeakPolarHBondContact O-CE 3.48Å; R59-K139 PolarHBondContact O-NZ 3.42Å; K61-K139 HydrophobicContact CB-CB 4.28Å; K61-K139 HydrophobicContact CB-CD 4.31Å; K61-K139 HydrophobicContact CB-CG 4.28Å; V135-K139 PolarHBondContact O-N 3.43Å; V136-K139 PolarHBondContact O-N 3.27Å; L137-K139 VanDerWaalsContact C-N 3.31Å
140Q92.5Very high94.4Very high99 Ų9952.5 Ų52.546%0.46325%0.253SS..  trans-81.7155.1174.4-61.9-56.6-65.700110V135 R138 L142V135-Q140 HydrophobicContact CG1-CB 3.97Å; V135-Q140 PolarHBondContact O-N 2.83Å; R138-Q140 HydrophobicContact CB-CG 3.98Å; R138-Q140 PolarHBondContact O-N 3.37Å; R138-Q140 PolarHBondContact O-NE2 2.84Å; R138-Q140 VanDerWaalsContact O-NE2 3.09Å; Q140-L142 PolarHBondContact O-N 2.88Å
141K91.4Very high94.5Very high181 Ų18152.9 Ų52.979%0.78725%0.25SC*.  trans-65.9110.9177.6-177.5178179.4178.90109.4L143K141-L143 HydrophobicContact CD-CD2 4.23Å; K141-L143 HydrophobicContact CG-CD2 4.3Å; K141-L143 PolarHBondContact O-N 3.25Å
142L92.6Very high94.6Very high26 Ų2653.6 Ų53.614%0.13625%0.254CS..  trans-74.7116.2172.5-17862.1000109.7V49 T132 V135 Q140 H146 W147V49-L142 HydrophobicContact CG1-CD2 3.32Å; T132-L142 HydrophobicContact CG2-CD1 3.6Å; T132-L142 HydrophobicContact CG2-CD2 4.25Å; V135-L142 HydrophobicContact CG1-CB 4.1Å; V135-L142 HydrophobicContact CG1-CD1 4.01Å; Q140-L142 PolarHBondContact O-N 2.88Å; L142-H146 HydrophobicContact CD1-CB 4.43Å; L142-W147 HydrophobicContact CD1-CB 4.44Å; L142-W147 HydrophobicContact CD2-CB 4.48Å
143L93.6Very high94.7Very high67 Ų6754.2 Ų54.235%0.35126%0.258SS..  trans-83.2143.7178.3-60.1176.8000110.5K141 L145 H146 W147 F254K141-L143 HydrophobicContact CD-CD2 4.23Å; K141-L143 HydrophobicContact CG-CD2 4.3Å; K141-L143 PolarHBondContact O-N 3.25Å; L143-L145 VanDerWaalsContact C-N 3.27Å; L143-L145 PolarHBondContact O-N 3.46Å; L143-H146 HydrophobicContact CB-CB 4.38Å; L143-H146 WeakPolarHBondContact O-CB 3.43Å; L143-H146 PolarHBondContact O-N 2.8Å; L143-H146 VanDerWaalsContact O-N 3.07Å; L143-W147 VanDerWaalsContact O-CD1 3.29Å; L143-W147 PolarHBondContact O-N 3.41Å; L143-F254 HydrophobicContact CD1-CD2 4.28Å; L143-F254 HydrophobicContact CD1-CE2 3.91Å
144F93.7Very high94.8Very high111 Ų11151.9 Ų51.949%0.48724%0.239SC..Hα-helixtrans-52.1-48.5172.3173.7-104.1000111.7H146 W147 Y148 L250F144-H146 PolarHBondContact O-N 3.3Å; F144-H146 VanDerWaalsContact O-N 3.15Å; F144-W147 AromaticContact CD2-CE2 3.74Å; F144-W147 HydrophobicContact CD2-CH2 4.13Å; F144-W147 AromaticContact CD2-CZ2 3.36Å; F144-W147 HydrophobicContact CD2-CZ2 3.36Å; F144-W147 AromaticContact CD2-NE1 3.96Å; F144-W147 AromaticContact CE2-CH2 3.79Å; F144-W147 HydrophobicContact CE2-CH2 3.79Å; F144-W147 AromaticContact CE2-CZ2 3.5Å; F144-W147 HydrophobicContact CE2-CZ2 3.5Å; F144-W147 PolarHBondContact O-N 2.89Å; F144-Y148 HydrophobicContact CE1-CG 4.21Å; F144-Y148 HydrophobicContact CZ-CD2 4.01Å; F144-Y148 HydrophobicContact CZ-CG 4Å; F144-Y148 WeakPolarHBondContact O-CB 3.36Å; F144-Y148 PolarHBondContact O-N 3.23Å; F144-L250 HydrophobicContact CD1-CD2 4.11Å; F144-L250 HydrophobicContact CE1-CD1 4.19Å; F144-L250 HydrophobicContact CE1-CD2 4.12Å
145L94.1Very high94.9Very high22 Ų2252.2 Ų52.212%0.11524%0.242CC..Hα-helixtrans-51.4-39.8177.8172.264.5000112.5L143 H149 L250 F251 F254L143-L145 VanDerWaalsContact C-N 3.27Å; L143-L145 PolarHBondContact O-N 3.46Å; L145-H149 WeakPolarHBondContact O-CB 3.32Å; L145-H149 PolarHBondContact O-N 3.03Å; L145-L250 HydrophobicContact CD1-CB 3.45Å; L145-L250 VanDerWaalsContact CD1-CB 3.45Å; L145-L250 HydrophobicContact CD1-CD1 3.99Å; L145-L250 HydrophobicContact CD1-CG 4.34Å; L145-L250 HydrophobicContact CG-CB 4.44Å; L145-F251 HydrophobicContact CD1-CD2 3.78Å; L145-F251 HydrophobicContact CD1-CE2 3.66Å; L145-F251 HydrophobicContact CD1-CG 4.47Å; L145-F251 HydrophobicContact CD1-CZ 4.26Å; L145-F251 HydrophobicContact CD2-CD1 4.04Å; L145-F251 HydrophobicContact CD2-CD2 4.23Å; L145-F251 HydrophobicContact CD2-CE1 4Å; L145-F251 HydrophobicContact CD2-CE2 4.2Å; L145-F251 HydrophobicContact CD2-CG 4.16Å; L145-F251 HydrophobicContact CD2-CZ 4.08Å; L145-F251 HydrophobicContact CG-CE2 4.3Å; L145-F251 HydrophobicContact CG-CZ 4.41Å; L145-F254 HydrophobicContact CD2-CB 4.18Å; L145-F254 HydrophobicContact CD2-CG 4.42Å
146H94.8Very high94.9Very high49 Ų4951.8 Ų51.823%0.22724%0.237CC..Hα-helixtrans-68.8-57.6-174.7-17882.6000111.5T132 L142 L143 F144 Y148 H149 H150T132-H146 PolarHBondContact OG1-CD2 2.92Å; T132-H146 VanDerWaalsContact OG1-CD2 3.29Å; T132-H146 PolarHBondContact OG1-NE2 2.81Å; L142-H146 HydrophobicContact CD1-CB 4.43Å; L143-H146 HydrophobicContact CB-CB 4.38Å; L143-H146 WeakPolarHBondContact O-CB 3.43Å; L143-H146 PolarHBondContact O-N 2.8Å; L143-H146 VanDerWaalsContact O-N 3.07Å; F144-H146 PolarHBondContact O-N 3.3Å; F144-H146 VanDerWaalsContact O-N 3.15Å; H146-Y148 PolarHBondContact O-N 2.98Å; H146-H149 PolarHBondContact O-N 3.32Å; H146-H150 AromaticContact CD2-CD2 3.74Å; H146-H150 AromaticContact CE1-CD2 3.48Å; H146-H150 PolarHBondContact CE1-CD2 3.05Å; H146-H150 VanDerWaalsContact CE1-CD2 3.48Å; H146-H150 AromaticContact CE1-NE2 3.07Å; H146-H150 PolarHBondContact CE1-NE2 3.18Å; H146-H150 AromaticContact CG-CD2 3.93Å; H146-H150 AromaticContact ND1-CD2 3.77Å; H146-H150 AromaticContact ND1-NE2 3.56Å; H146-H150 AromaticContact NE2-CD2 3.5Å; H146-H150 AromaticContact NE2-NE2 3.51Å; H146-H150 PolarHBondContact O-CD2 3.19Å; H146-H150 PolarHBondContact O-N 3.29Å
147W95.1Very high94.9Very high64 Ų6451.4 Ų51.424%0.24224%0.235CC..Hα-helixtrans-72.6-32.6-175.869.3-99.6000112.7Y45 F50 L142 L143 F144 I151Y45-W147 HydrophobicContact CE1-CB 4.19Å; Y45-W147 VanDerWaalsContact OH-CA 3.3Å; Y45-W147 WeakPolarHBondContact OH-CA 3.44Å; Y45-W147 WeakPolarHBondContact OH-CB 3.47Å; F50-W147 HydrophobicContact CZ-CZ2 4.49Å; L142-W147 HydrophobicContact CD1-CB 4.44Å; L142-W147 HydrophobicContact CD2-CB 4.48Å; L143-W147 VanDerWaalsContact O-CD1 3.29Å; L143-W147 PolarHBondContact O-N 3.41Å; F144-W147 AromaticContact CD2-CE2 3.74Å; F144-W147 HydrophobicContact CD2-CH2 4.13Å; F144-W147 AromaticContact CD2-CZ2 3.36Å; F144-W147 HydrophobicContact CD2-CZ2 3.36Å; F144-W147 AromaticContact CD2-NE1 3.96Å; F144-W147 AromaticContact CE2-CH2 3.79Å; F144-W147 HydrophobicContact CE2-CH2 3.79Å; F144-W147 AromaticContact CE2-CZ2 3.5Å; F144-W147 HydrophobicContact CE2-CZ2 3.5Å; F144-W147 PolarHBondContact O-N 2.89Å; W147-I151 HydrophobicContact CE3-CD1 3.82Å; W147-I151 HydrophobicContact CZ3-CD1 4.1Å; W147-I151 WeakPolarHBondContact O-CG1 3.43Å; W147-I151 PolarHBondContact O-N 2.99Å
148Y96.3Very high95Very high59 Ų5949 Ų4923%0.23122%0.222CC..Hα-helixtrans-59.2-53.5172.2171-104000110.1F144 H146 H150 I151 T152 S246 Y247 L250F144-Y148 HydrophobicContact CE1-CG 4.21Å; F144-Y148 HydrophobicContact CZ-CD2 4.01Å; F144-Y148 HydrophobicContact CZ-CG 4Å; F144-Y148 WeakPolarHBondContact O-CB 3.36Å; F144-Y148 PolarHBondContact O-N 3.23Å; H146-Y148 PolarHBondContact O-N 2.98Å; Y148-H150 PolarHBondContact O-N 2.98Å; Y148-I151 PolarHBondContact O-N 3.43Å; Y148-T152 HydrophobicContact CD2-CG2 4.17Å; Y148-T152 HydrophobicContact CE2-CG2 3.74Å; Y148-T152 PolarHBondContact O-N 3.34Å; Y148-T152 PolarHBondContact O-OG1 2.91Å; Y148-S246 WeakPolarHBondContact CE1-OG 3.27Å; Y148-S246 WeakPolarHBondContact OH-CB 3.43Å; Y148-S246 PolarHBondContact OH-OG 3Å; Y148-Y247 HydrophobicContact CD1-CD1 4.44Å; Y148-Y247 HydrophobicContact CD1-CE1 4.09Å; Y148-Y247 AromaticContact CE1-CD1 3.97Å; Y148-Y247 HydrophobicContact CE1-CD1 3.97Å; Y148-Y247 AromaticContact CE1-CE1 3.7Å; Y148-Y247 HydrophobicContact CE1-CE1 3.7Å; Y148-L250 HydrophobicContact CD1-CD1 3.62Å; Y148-L250 HydrophobicContact CE1-CD1 3.71Å
149H96.4Very high95Very high20 Ų2046.7 Ų46.79%0.09321%0.213CC..Hα-helixtrans-55.1-48.3178.3170-90.2000112.6L145 H146 I151 T152 V153 Y247L145-H149 WeakPolarHBondContact O-CB 3.32Å; L145-H149 PolarHBondContact O-N 3.03Å; H146-H149 PolarHBondContact O-N 3.32Å; H149-I151 VanDerWaalsContact C-N 3.33Å; H149-I151 PolarHBondContact O-N 3.22Å; H149-T152 PolarHBondContact O-N 3.44Å; H149-T152 PolarHBondContact O-OG1 2.95Å; H149-V153 WeakPolarHBondContact O-CB 3.48Å; H149-V153 VanDerWaalsContact O-CG1 3.23Å; H149-V153 WeakPolarHBondContact O-CG1 3.43Å; H149-V153 PolarHBondContact O-N 3.37Å; H149-Y247 HydrophobicContact CB-CE1 4.24Å; H149-Y247 AromaticContact CD2-CD2 4Å; H149-Y247 AromaticContact CD2-CE2 3.54Å; H149-Y247 AromaticContact CD2-CZ 3.54Å; H149-Y247 PolarHBondContact O-OH 3.48Å
150H96.8Very high95Very high8 Ų842.9 Ų42.94%0.03720%0.198CC..Hα-helixtrans-62.3-38.2-178.7-82.8-65.7000113E128 L129 D131 H146 Y148 L154E128-H150 PolarHBondContact O-CE1 3.21Å; L129-H150 HydrophobicContact CD2-CB 3.87Å; D131-H150 IonicContact OD2-CE1 3.88Å; H146-H150 AromaticContact CD2-CD2 3.74Å; H146-H150 AromaticContact CE1-CD2 3.48Å; H146-H150 PolarHBondContact CE1-CD2 3.05Å; H146-H150 VanDerWaalsContact CE1-CD2 3.48Å; H146-H150 AromaticContact CE1-NE2 3.07Å; H146-H150 PolarHBondContact CE1-NE2 3.18Å; H146-H150 AromaticContact CG-CD2 3.93Å; H146-H150 AromaticContact ND1-CD2 3.77Å; H146-H150 AromaticContact ND1-NE2 3.56Å; H146-H150 AromaticContact NE2-CD2 3.5Å; H146-H150 AromaticContact NE2-NE2 3.51Å; H146-H150 PolarHBondContact O-CD2 3.19Å; H146-H150 PolarHBondContact O-N 3.29Å; Y148-H150 PolarHBondContact O-N 2.98Å; H150-L154 WeakPolarHBondContact O-CB 3.45Å; H150-L154 PolarHBondContact O-N 3.46Å
151I96.6Very high95Very high28 Ų2838.2 Ų38.214%0.14418%0.177CC..Hα-helixtrans-66.5-54174.2-70.8175.9000110.3Y45 A46 W147 Y148 H149 V153 L154 L155Y45-I151 HydrophobicContact CD1-CD1 3.83Å; Y45-I151 HydrophobicContact CD1-CG1 3.5Å; Y45-I151 VanDerWaalsContact CD1-CG1 3.5Å; Y45-I151 HydrophobicContact CE1-CD1 3.9Å; Y45-I151 HydrophobicContact CE1-CG1 3.56Å; A46-I151 HydrophobicContact CB-CD1 4.46Å; W147-I151 HydrophobicContact CE3-CD1 3.82Å; W147-I151 HydrophobicContact CZ3-CD1 4.1Å; W147-I151 WeakPolarHBondContact O-CG1 3.43Å; W147-I151 PolarHBondContact O-N 2.99Å; Y148-I151 PolarHBondContact O-N 3.43Å; H149-I151 VanDerWaalsContact C-N 3.33Å; H149-I151 PolarHBondContact O-N 3.22Å; I151-V153 PolarHBondContact O-N 3.04Å; I151-L154 PolarHBondContact O-N 3.47Å; I151-L155 HydrophobicContact CG2-CD1 3.95Å; I151-L155 WeakPolarHBondContact O-CG 3.38Å; I151-L155 PolarHBondContact O-N 2.92Å; I151-L155 VanDerWaalsContact O-N 3.11Å
152T96.8Very high94.8Very high31 Ų3130.8 Ų30.819%0.1914%0.144CC..Hα-helixtrans-69.5-35.6-170.944.50000112.6Y148 H149 Y156 Y247Y148-T152 HydrophobicContact CD2-CG2 4.17Å; Y148-T152 HydrophobicContact CE2-CG2 3.74Å; Y148-T152 PolarHBondContact O-N 3.34Å; Y148-T152 PolarHBondContact O-OG1 2.91Å; H149-T152 PolarHBondContact O-N 3.44Å; H149-T152 PolarHBondContact O-OG1 2.95Å; T152-Y156 VanDerWaalsContact O-CB 3.26Å; T152-Y156 WeakPolarHBondContact O-CB 3.25Å; T152-Y156 PolarHBondContact O-N 2.76Å; T152-Y247 WeakPolarHBondContact CB-OH 3.38Å; T152-Y247 WeakPolarHBondContact OG1-CE1 3.41Å; T152-Y247 PolarHBondContact OG1-OH 3.39Å
153V96.2Very high94.6Very high13 Ų1331.1 Ų31.18%0.07915%0.146CC..Hα-helixtrans-69.8-33.8176.379.10000112.2K125 H149 I151 S157 Y247K125-V153 HydrophobicContact CD-CG1 4.3Å; K125-V153 HydrophobicContact CD-CG2 4.46Å; H149-V153 WeakPolarHBondContact O-CB 3.48Å; H149-V153 VanDerWaalsContact O-CG1 3.23Å; H149-V153 WeakPolarHBondContact O-CG1 3.43Å; H149-V153 PolarHBondContact O-N 3.37Å; I151-V153 PolarHBondContact O-N 3.04Å; V153-S157 WeakPolarHBondContact O-CB 3.46Å; V153-S157 PolarHBondContact O-N 3.2Å; V153-S157 PolarHBondContact O-OG 3.26Å; V153-Y247 PolarHBondContact N-OH 2.88Å
154L96.7Very high94.4Very high0 Ų030.1 Ų30.10%014%0.14CC..Hα-helixtrans-64.2-51.9174.417767.2000110.7F41 K125 A126 L129 H150 I151 Y156 S157 W158F41-L154 HydrophobicContact CB-CD2 3.85Å; K125-L154 HydrophobicContact CB-CB 4.37Å; K125-L154 HydrophobicContact CB-CD1 3.78Å; A126-L154 HydrophobicContact CB-CD1 4.18Å; L129-L154 HydrophobicContact CD1-CD2 4.01Å; H150-L154 WeakPolarHBondContact O-CB 3.45Å; H150-L154 PolarHBondContact O-N 3.46Å; I151-L154 PolarHBondContact O-N 3.47Å; L154-Y156 PolarHBondContact O-N 3.2Å; L154-S157 PolarHBondContact O-OG 3.48Å; L154-S157 VanDerWaalsContact O-OG 3.11Å; L154-W158 PolarHBondContact O-N 2.96Å
155L96.6Very high94.3Very high39 Ų3925.2 Ų25.220%0.20412%0.119CC..Hα-helixtrans-58.8-49.5178.7-65.6175.2000111.3S38 F39 I151 Y159S38-L155 WeakPolarHBondContact OG-CD2 3.46Å; F39-L155 HydrophobicContact CB-CD2 4.49Å; F39-L155 HydrophobicContact CD1-CD1 4.43Å; F39-L155 HydrophobicContact CD1-CD2 3.57Å; F39-L155 HydrophobicContact CE1-CD1 4.32Å; F39-L155 HydrophobicContact CE1-CD2 3.86Å; F39-L155 HydrophobicContact CG-CD2 3.98Å; I151-L155 HydrophobicContact CG2-CD1 3.95Å; I151-L155 WeakPolarHBondContact O-CG 3.38Å; I151-L155 PolarHBondContact O-N 2.92Å; I151-L155 VanDerWaalsContact O-N 3.11Å; L155-Y159 VanDerWaalsContact O-CB 3.26Å; L155-Y159 WeakPolarHBondContact O-CB 3.44Å; L155-Y159 PolarHBondContact O-N 3.01Å
156Y96.2Very high94.1Very high23 Ų2324.2 Ų24.29%0.0911%0.114CC..Hα-helixtrans-68.6-42.4-175.7178.9-103.9000112.9T152 L154 W158 Y159 S160 W239 A240 M243T152-Y156 VanDerWaalsContact O-CB 3.26Å; T152-Y156 WeakPolarHBondContact O-CB 3.25Å; T152-Y156 PolarHBondContact O-N 2.76Å; L154-Y156 PolarHBondContact O-N 3.2Å; Y156-W158 VanDerWaalsContact C-N 3.33Å; Y156-W158 PolarHBondContact O-N 3.43Å; Y156-Y159 PolarHBondContact O-N 3.2Å; Y156-S160 VanDerWaalsContact O-CB 3.29Å; Y156-S160 WeakPolarHBondContact O-CB 3.34Å; Y156-S160 PolarHBondContact O-N 3.24Å; Y156-S160 PolarHBondContact O-OG 3.41Å; Y156-W239 HydrophobicContact CD2-CB 4.14Å; Y156-W239 HydrophobicContact CE2-CB 4.21Å; Y156-A240 HydrophobicContact CE2-CB 3.94Å; Y156-A240 WeakPolarHBondContact OH-CB 3.21Å; Y156-M243 HydrophobicContact CD1-CE 3.32Å; Y156-M243 HydrophobicContact CD1-SD 3.69Å; Y156-M243 HydrophobicContact CE1-CE 3.67Å; Y156-M243 HydrophobicContact CG-CE 3.92Å; Y156-M243 HydrophobicContact CG-SD 3.77Å
157S95.6Very high94Very high5 Ų521.9 Ų21.94%0.03510%0.104CC..Hα-helixtrans-63.2-39.9178.756.80000112.1K125 V153 L154 S160 Y161K125-S157 WeakPolarHBondContact CG-OG 3.48Å; V153-S157 WeakPolarHBondContact O-CB 3.46Å; V153-S157 PolarHBondContact O-N 3.2Å; V153-S157 PolarHBondContact O-OG 3.26Å; L154-S157 PolarHBondContact O-OG 3.48Å; L154-S157 VanDerWaalsContact O-OG 3.11Å; S157-S160 PolarHBondContact O-OG 3.04Å; S157-Y161 VanDerWaalsContact O-CB 3.31Å; S157-Y161 WeakPolarHBondContact O-CB 3.24Å; S157-Y161 PolarHBondContact O-N 3.13Å; S157-Y161 VanDerWaalsContact O-N 3.13Å
158W95.1Very high93.8Very high6 Ų619.1 Ų19.12%0.02310%0.095CC..Hα-helixtrans-70-41.5178.3-76.746.7000111.8W30 M31 W35 K37 F41 V122 L123 L154 Y156W30-W158 AromaticContact CH2-CH2 3.73Å; W30-W158 HydrophobicContact CH2-CH2 3.73Å; W30-W158 AromaticContact CH2-CZ3 3.9Å; W30-W158 HydrophobicContact CH2-CZ3 3.9Å; W30-W158 HydrophobicContact CZ3-CH2 4.01Å; W30-W158 HydrophobicContact CZ3-CZ3 4.01Å; M31-W158 HydrophobicContact CE-CB 3.74Å; M31-W158 HydrophobicContact CE-CD2 3.88Å; M31-W158 HydrophobicContact CE-CE3 4.03Å; M31-W158 HydrophobicContact CE-CG 3.81Å; M31-W158 WeakPolarHBondContact CE-O 3.34Å; W35-W158 HydrophobicContact CB-CB 4.49Å; K37-W158 HydrophobicContact CB-CZ3 4.09Å; F41-W158 HydrophobicContact CD2-CH2 4.22Å; F41-W158 AromaticContact CE2-CH2 3.66Å; F41-W158 HydrophobicContact CE2-CH2 3.66Å; F41-W158 HydrophobicContact CE2-CZ2 4.26Å; F41-W158 HydrophobicContact CE2-CZ3 4.17Å; V122-W158 HydrophobicContact CG1-CB 4.45Å; V122-W158 HydrophobicContact CG1-CD2 4.49Å; V122-W158 HydrophobicContact CG1-CG 3.9Å; V122-W158 PolarHBondContact O-NE1 3.22Å; L123-W158 HydrophobicContact CD2-CZ2 4.09Å; L154-W158 PolarHBondContact O-N 2.96Å; Y156-W158 VanDerWaalsContact C-N 3.33Å; Y156-W158 PolarHBondContact O-N 3.43Å
159Y94.4Very high93.7Very high36 Ų3616.5 Ų16.514%0.1419%0.086CC..Hα-helixtrans-67.6-43177.6176.4-104000112.9W35 L155 Y156 K162 D235 N236 W239W35-Y159 HydrophobicContact CD2-CD2 4.43Å; W35-Y159 AromaticContact CE3-CD2 3.87Å; W35-Y159 HydrophobicContact CE3-CD2 3.87Å; W35-Y159 HydrophobicContact CH2-CD2 4.22Å; W35-Y159 AromaticContact CZ3-CD2 3.74Å; W35-Y159 HydrophobicContact CZ3-CD2 3.74Å; W35-Y159 HydrophobicContact CZ3-CE2 4.46Å; L155-Y159 VanDerWaalsContact O-CB 3.26Å; L155-Y159 WeakPolarHBondContact O-CB 3.44Å; L155-Y159 PolarHBondContact O-N 3.01Å; Y156-Y159 PolarHBondContact O-N 3.2Å; Y159-K162 HydrophobicContact CD2-CD 4.33Å; Y159-K162 VanDerWaalsContact CD2-CE 3.45Å; Y159-K162 VanDerWaalsContact CE2-CE 3.47Å; Y159-K162 WeakPolarHBondContact O-CD 3.43Å; Y159-K162 WeakPolarHBondContact O-CE 3.31Å; Y159-K162 VanDerWaalsContact O-CG 3.23Å; Y159-K162 WeakPolarHBondContact O-CG 3.36Å; Y159-D235 WeakPolarHBondContact OH-CB 3.13Å; Y159-D235 PolarHBondContact OH-OD2 3.45Å; Y159-N236 VanDerWaalsContact CD1-OD1 3.27Å; Y159-N236 WeakPolarHBondContact CD1-OD1 3.33Å; Y159-N236 WeakPolarHBondContact CE1-OD1 3.49Å; Y159-W239 AromaticContact CE1-CD1 3.89Å
160S93.2Very high93.7Very high13 Ų1318.7 Ų18.79%0.0919%0.094CC..Hα-helixtrans-74.4-34.4-177.355.90000113.5Y156 S157 K162 D163 M164 V165 N236Y156-S160 VanDerWaalsContact O-CB 3.29Å; Y156-S160 WeakPolarHBondContact O-CB 3.34Å; Y156-S160 PolarHBondContact O-N 3.24Å; Y156-S160 PolarHBondContact O-OG 3.41Å; S157-S160 PolarHBondContact O-OG 3.04Å; S160-K162 VanDerWaalsContact C-N 3.31Å; S160-K162 PolarHBondContact O-N 3.27Å; S160-D163 PolarHBondContact O-N 2.72Å; S160-M164 PolarHBondContact O-N 3.14Å; S160-V165 WeakPolarHBondContact O-CG2 3.49Å; S160-V165 PolarHBondContact O-N 3.24Å; S160-N236 WeakPolarHBondContact CA-OD1 3.34Å
161Y92.1Very high93.6Very high2 Ų219 Ų191%0.00810%0.095CC..Hα-helixtrans-63.9-37.1179.1-174.6-84.3000112.4I28 M31 Y109 A118 Y119 V122 S157 D163 M164I28-Y161 HydrophobicContact CG1-CE1 4.05Å; M31-Y161 HydrophobicContact CB-CD1 3.77Å; M31-Y161 HydrophobicContact CB-CE1 4.19Å; M31-Y161 HydrophobicContact CG-CD1 3.49Å; M31-Y161 VanDerWaalsContact CG-CD1 3.49Å; M31-Y161 HydrophobicContact CG-CE1 3.73Å; M31-Y161 HydrophobicContact CG-CG 4.49Å; Y109-Y161 AromaticContact CD1-CD2 3.82Å; Y109-Y161 HydrophobicContact CD1-CD2 3.82Å; Y109-Y161 AromaticContact CD1-CE2 3.65Å; Y109-Y161 HydrophobicContact CD1-CE2 3.65Å; Y109-Y161 AromaticContact CE1-CD2 3.61Å; Y109-Y161 HydrophobicContact CE1-CD2 3.61Å; Y109-Y161 AromaticContact CE1-CE2 3.94Å; Y109-Y161 HydrophobicContact CE1-CE2 3.94Å; Y109-Y161 HydrophobicContact CE1-CG 4.34Å; A118-Y161 HydrophobicContact CB-CE2 3.88Å; Y119-Y161 HydrophobicContact CD2-CE1 4.17Å; V122-Y161 HydrophobicContact CB-CD2 4.46Å; V122-Y161 HydrophobicContact CG2-CD2 3.45Å; V122-Y161 VanDerWaalsContact CG2-CD2 3.45Å; V122-Y161 HydrophobicContact CG2-CE2 4.3Å; V122-Y161 HydrophobicContact CG2-CG 3.75Å; S157-Y161 VanDerWaalsContact O-CB 3.31Å; S157-Y161 WeakPolarHBondContact O-CB 3.24Å; S157-Y161 PolarHBondContact O-N 3.13Å; S157-Y161 VanDerWaalsContact O-N 3.13Å; Y161-D163 PolarHBondContact O-N 2.92Å; Y161-D163 VanDerWaalsContact O-N 3.14Å; Y161-M164 PolarHBondContact O-N 3.44Å
162K88.6Confident93.6Very high24 Ų2418 Ų1810%0.1049%0.09CC..Hα-helixtrans-57.7-30.6178.696.1-167.8165.759.50112.7Q32 W35 Y159 S160Q32-K162 HydrophobicContact CG-CB 4.01Å; Q32-K162 PolarHBondContact NE2-O 3.33Å; W35-K162 HydrophobicContact CB-CD 4.34Å; W35-K162 HydrophobicContact CD2-CD 4.12Å; W35-K162 HydrophobicContact CG-CD 3.78Å; Y159-K162 HydrophobicContact CD2-CD 4.33Å; Y159-K162 VanDerWaalsContact CD2-CE 3.45Å; Y159-K162 VanDerWaalsContact CE2-CE 3.47Å; Y159-K162 WeakPolarHBondContact O-CD 3.43Å; Y159-K162 WeakPolarHBondContact O-CE 3.31Å; Y159-K162 VanDerWaalsContact O-CG 3.23Å; Y159-K162 WeakPolarHBondContact O-CG 3.36Å; S160-K162 VanDerWaalsContact C-N 3.31Å; S160-K162 PolarHBondContact O-N 3.27Å
163D88.1Confident93.6Very high34 Ų3417.3 Ų17.318%0.1829%0.085CC..THydrogen-bonded Turntrans-99.71.3-176.6-71.4-19000112.1S160 Y161 V165 R233 N236S160-D163 PolarHBondContact O-N 2.72Å; Y161-D163 PolarHBondContact O-N 2.92Å; Y161-D163 VanDerWaalsContact O-N 3.14Å; D163-V165 HydrophobicContact CB-CG2 4.04Å; D163-V165 PolarHBondContact O-N 3.46Å; D163-R233 VanDerWaalsContact CG-CD 3.45Å; D163-R233 IonicContact OD1-NH1 3.16Å; D163-R233 WeakPolarHBondContact OD2-CD 3.44Å; D163-R233 IonicContact OD2-CZ 3.5Å; D163-R233 IonicContact OD2-NH1 4Å; D163-R233 PolarHBondContact OD2-NH1 3.41Å; D163-R233 VanDerWaalsContact OD2-NH1 3.16Å; D163-N236 PolarHBondContact OD2-ND2 2.84Å
164M89.9Confident93.6Very high46 Ų4617.5 Ų17.523%0.2279%0.086CC..THydrogen-bonded Turntrans46.547.8-177.4-64.2-179.2-73.900112.2I28 Q106 Y109 S160 Y161 A166I28-M164 HydrophobicContact CD1-CG 4.41Å; I28-M164 HydrophobicContact CD1-SD 3.61Å; I28-M164 HydrophobicContact CG1-SD 4.39Å; Q106-M164 WeakPolarHBondContact CG-O 3.29Å; Q106-M164 PolarHBondContact NE2-O 3.31Å; Y109-M164 HydrophobicContact CD1-CG 4.3Å; Y109-M164 HydrophobicContact CD2-CB 3.7Å; Y109-M164 HydrophobicContact CD2-CG 4.07Å; Y109-M164 VanDerWaalsContact CE2-C 3.41Å; Y109-M164 HydrophobicContact CE2-CB 3.91Å; Y109-M164 HydrophobicContact CG-CB 4.06Å; Y109-M164 HydrophobicContact CG-CG 3.9Å; S160-M164 PolarHBondContact O-N 3.14Å; Y161-M164 PolarHBondContact O-N 3.44Å; M164-A166 PolarHBondContact O-N 3.46Å
165V90.2Very high93.7Very high7 Ų717.9 Ų17.94%0.0429%0.088CC..  trans-54.6132.4-169.6171.90000112Y109 S160 D163 G168 N236Y109-V165 PolarHBondContact OH-N 2.96Å; Y109-V165 PolarHBondContact OH-O 3.28Å; S160-V165 WeakPolarHBondContact O-CG2 3.49Å; S160-V165 PolarHBondContact O-N 3.24Å; D163-V165 HydrophobicContact CB-CG2 4.04Å; D163-V165 PolarHBondContact O-N 3.46Å; V165-G168 PolarHBondContact O-N 3.5Å; V165-N236 HydrophobicContact CG1-CB 4.39Å; V165-N236 HydrophobicContact CG2-CB 3.61Å; V165-N236 WeakPolarHBondContact CG2-OD1 3.17Å
166A90.7Very high93.8Very high1 Ų116.1 Ų16.11%0.0088%0.078CC..THydrogen-bonded Turntrans-55.4139.3170.700000110.9I103 M164 G168 V221I103-A166 CarbonylContact O-C 3.54Å; M164-A166 PolarHBondContact O-N 3.46Å; A166-G168 VanDerWaalsContact C-N 3.26Å; A166-V221 HydrophobicContact CB-CG1 4.06Å; A166-V221 HydrophobicContact CB-CG2 4.28Å
167G91.6Very high93.8Very high1 Ų118 Ų181%0.019%0.093CC..THydrogen-bonded Turntrans85.8-8.2-172.200000113.8I103 G169 W170 F171I103-G167 WeakPolarHBondContact O-CA 3.38Å; I103-G167 PolarHBondContact O-N 3.47Å; G167-G169 VanDerWaalsContact C-N 3.28Å; G167-G169 PolarHBondContact O-N 3.35Å; G167-W170 WeakPolarHBondContact O-CB 3.34Å; G167-W170 PolarHBondContact O-N 3.19Å; G167-F171 WeakPolarHBondContact O-CD2 3.22Å; G167-F171 WeakPolarHBondContact O-CG 3.39Å; G167-F171 PolarHBondContact O-N 3.45Å
168G92.8Very high93.9Very high5 Ų518.3 Ų18.35%0.0529%0.094CC..Hα-helixtrans-51.6-43.1177.800000113.8Y109 V165 A166 W170 F171 M172Y109-G168 WeakPolarHBondContact OH-CA 3.37Å; V165-G168 PolarHBondContact O-N 3.5Å; A166-G168 VanDerWaalsContact C-N 3.26Å; G168-W170 VanDerWaalsContact C-N 3.32Å; G168-W170 PolarHBondContact O-N 3.37Å; G168-F171 PolarHBondContact O-N 3.45Å; G168-M172 WeakPolarHBondContact O-CB 3.44Å; G168-M172 VanDerWaalsContact O-CE 3.22Å; G168-M172 WeakPolarHBondContact O-CE 3.15Å; G168-M172 WeakPolarHBondContact O-CG 3.27Å; G168-M172 PolarHBondContact O-N 2.98Å
169G93.7Very high94.1Very high5 Ų518.5 Ų18.55%0.05210%0.095CC..Hα-helixtrans-59-40.717800000113.4F108 G167 T173F108-G169 VanDerWaalsContact CD2-CA 3.47Å; F108-G169 VanDerWaalsContact CG-CA 3.5Å; G167-G169 VanDerWaalsContact C-N 3.28Å; G167-G169 PolarHBondContact O-N 3.35Å; G169-T173 WeakPolarHBondContact O-CB 3.38Å; G169-T173 PolarHBondContact O-N 2.86Å; G169-T173 PolarHBondContact O-OG1 3.36Å
170W95.6Very high94.2Very high65 Ų6517.3 Ų17.325%0.2469%0.093CC..Hα-helixtrans-66.5-47.6173.5-79.398.9000111.5M90 L94 F99 S102 G167 G168 M172 T173 M174 V217M90-W170 HydrophobicContact CE-CD2 3.91Å; M90-W170 HydrophobicContact CE-CG 3.76Å; M90-W170 HydrophobicContact CE-CZ2 4.38Å; M90-W170 VanDerWaalsContact CE-NE1 3.32Å; L94-W170 HydrophobicContact CD2-CH2 4.44Å; F99-W170 HydrophobicContact CD2-CZ2 4.13Å; F99-W170 HydrophobicContact CE2-CH2 4.43Å; F99-W170 AromaticContact CE2-CZ2 3.98Å; F99-W170 HydrophobicContact CE2-CZ2 3.98Å; S102-W170 PolarHBondContact OG-NE1 2.95Å; G167-W170 WeakPolarHBondContact O-CB 3.34Å; G167-W170 PolarHBondContact O-N 3.19Å; G168-W170 VanDerWaalsContact C-N 3.32Å; G168-W170 PolarHBondContact O-N 3.37Å; W170-M172 PolarHBondContact O-N 3.49Å; W170-T173 PolarHBondContact O-N 3.16Å; W170-M174 WeakPolarHBondContact O-CB 3.4Å; W170-M174 VanDerWaalsContact O-CG 3.24Å; W170-M174 WeakPolarHBondContact O-CG 3.21Å; W170-M174 PolarHBondContact O-N 3.35Å; W170-V217 HydrophobicContact CB-CG1 4.45Å; W170-V217 HydrophobicContact CB-CG2 4.23Å; W170-V217 HydrophobicContact CG-CG2 4.45Å
171F95.7Very high94.4Very high15 Ų1520.9 Ų20.97%0.06611%0.11CC..Hα-helixtrans-60.1-44.2-179.5-61.9-41.7000112.9G167 G168 M174 N175 G214 V217 S218 Y244G167-F171 WeakPolarHBondContact O-CD2 3.22Å; G167-F171 WeakPolarHBondContact O-CG 3.39Å; G167-F171 PolarHBondContact O-N 3.45Å; G168-F171 PolarHBondContact O-N 3.45Å; F171-M174 HydrophobicContact CB-CE 4.43Å; F171-M174 HydrophobicContact CD1-CE 3.83Å; F171-M174 VanDerWaalsContact O-CG 3.25Å; F171-M174 WeakPolarHBondContact O-CG 3.46Å; F171-N175 WeakPolarHBondContact O-CB 3.44Å; F171-N175 PolarHBondContact O-N 3.08Å; F171-G214 WeakPolarHBondContact CE1-O 3.45Å; F171-V217 HydrophobicContact CD1-CG1 4.44Å; F171-V217 HydrophobicContact CE1-CB 3.78Å; F171-V217 HydrophobicContact CE1-CG1 3.7Å; F171-V217 HydrophobicContact CE2-CG1 4.38Å; F171-V217 HydrophobicContact CZ-CB 4.12Å; F171-V217 HydrophobicContact CZ-CG1 3.66Å; F171-S218 WeakPolarHBondContact CZ-OG 3.23Å; F171-Y244 AromaticContact CD1-CE2 3.77Å; F171-Y244 HydrophobicContact CD1-CE2 3.77Å; F171-Y244 AromaticContact CD1-CZ 3.73Å; F171-Y244 VanDerWaalsContact CD1-OH 3.28Å; F171-Y244 WeakPolarHBondContact CD1-OH 3.48Å; F171-Y244 HydrophobicContact CE1-CD2 4.45Å; F171-Y244 AromaticContact CE1-CE2 3.68Å; F171-Y244 HydrophobicContact CE1-CE2 3.68Å; F171-Y244 HydrophobicContact CG-CE2 4.35Å; F171-Y244 HydrophobicContact CZ-CE2 4.2Å
172M96.3Very high94.7Very high8 Ų821.5 Ų21.54%0.03911%0.114CC..Hα-helixtrans-69.8-46.1179.6-69.1-177.7-93.600111.3F108 Y109 A118 F121 G168 W170 N175 Y176F108-M172 HydrophobicContact CD1-CE 3.5Å; F108-M172 VanDerWaalsContact CD1-CE 3.5Å; F108-M172 HydrophobicContact CE1-CB 4.3Å; F108-M172 HydrophobicContact CE1-CE 3.34Å; F108-M172 HydrophobicContact CE1-SD 3.81Å; F108-M172 HydrophobicContact CZ-CB 4.36Å; F108-M172 HydrophobicContact CZ-CE 4.45Å; Y109-M172 HydrophobicContact CD1-CE 4.38Å; Y109-M172 HydrophobicContact CE1-CE 3.58Å; A118-M172 HydrophobicContact CB-CE 4.18Å; A118-M172 HydrophobicContact CB-SD 3.91Å; F121-M172 HydrophobicContact CB-CG 4.47Å; F121-M172 HydrophobicContact CB-SD 4.23Å; F121-M172 HydrophobicContact CD1-CB 4.42Å; F121-M172 HydrophobicContact CD1-CG 3.58Å; F121-M172 HydrophobicContact CD1-SD 3.99Å; F121-M172 HydrophobicContact CD2-CB 4.25Å; F121-M172 HydrophobicContact CD2-CG 4.27Å; F121-M172 HydrophobicContact CE1-CG 3.77Å; F121-M172 HydrophobicContact CE2-CB 4.39Å; F121-M172 HydrophobicContact CE2-CG 4.42Å; F121-M172 HydrophobicContact CG-CB 4.25Å; F121-M172 HydrophobicContact CG-CG 3.84Å; F121-M172 HydrophobicContact CG-SD 4.19Å; F121-M172 HydrophobicContact CZ-CG 4.19Å; G168-M172 WeakPolarHBondContact O-CB 3.44Å; G168-M172 VanDerWaalsContact O-CE 3.22Å; G168-M172 WeakPolarHBondContact O-CE 3.15Å; G168-M172 WeakPolarHBondContact O-CG 3.27Å; G168-M172 PolarHBondContact O-N 2.98Å; W170-M172 PolarHBondContact O-N 3.49Å; M172-N175 PolarHBondContact O-N 3.42Å; M172-Y176 WeakPolarHBondContact O-CD2 3.31Å; M172-Y176 PolarHBondContact O-N 2.84Å
173T96.4Very high95.1Very high15 Ų1520.4 Ų20.49%0.09211%0.109CC..Hα-helixtrans-64.8-43.2-178.1-59.80000112.2T86 M90 G169 W170 N175 T177T86-T173 VanDerWaalsContact CB-OG1 3.3Å; T86-T173 WeakPolarHBondContact CB-OG1 3.3Å; T86-T173 PolarHBondContact OG1-OG1 3.42Å; M90-T173 HydrophobicContact CG-CG2 4.37Å; M90-T173 WeakPolarHBondContact CG-OG1 3.46Å; G169-T173 WeakPolarHBondContact O-CB 3.38Å; G169-T173 PolarHBondContact O-N 2.86Å; G169-T173 PolarHBondContact O-OG1 3.36Å; W170-T173 PolarHBondContact O-N 3.16Å; T173-N175 VanDerWaalsContact C-N 3.33Å; T173-N175 PolarHBondContact O-N 2.84Å; T173-T177 WeakPolarHBondContact O-CB 3.43Å; T173-T177 PolarHBondContact O-N 2.83Å; T173-T177 PolarHBondContact O-OG1 2.93Å
174M97Very high95.5Very high18 Ų1821 Ų219%0.08912%0.116CC..Hα-helixtrans-64.3-40175.772.4179-167.700111.5W170 F171 T177 V178 Q210 M213 Y244W170-M174 WeakPolarHBondContact O-CB 3.4Å; W170-M174 VanDerWaalsContact O-CG 3.24Å; W170-M174 WeakPolarHBondContact O-CG 3.21Å; W170-M174 PolarHBondContact O-N 3.35Å; F171-M174 HydrophobicContact CB-CE 4.43Å; F171-M174 HydrophobicContact CD1-CE 3.83Å; F171-M174 VanDerWaalsContact O-CG 3.25Å; F171-M174 WeakPolarHBondContact O-CG 3.46Å; M174-T177 PolarHBondContact O-N 3.22Å; M174-V178 WeakPolarHBondContact O-CG2 3.29Å; M174-V178 PolarHBondContact O-N 3.46Å; M174-Q210 HydrophobicContact CB-CG 4.18Å; M174-Q210 HydrophobicContact CE-CG 3.54Å; M174-Q210 HydrophobicContact CG-CG 3.62Å; M174-Q210 HydrophobicContact SD-CB 4.48Å; M174-Q210 HydrophobicContact SD-CG 3.5Å; M174-Q210 VanDerWaalsContact SD-CG 3.5Å; M174-M213 HydrophobicContact SD-CB 4.49Å; M174-Y244 HydrophobicContact CE-CD1 4.49Å; M174-Y244 HydrophobicContact CE-CE1 3.38Å; M174-Y244 VanDerWaalsContact CE-CZ 3.47Å; M174-Y244 WeakPolarHBondContact CE-OH 3.24Å
175N97.7Very high95.8Very high7 Ų721.1 Ų21.14%0.03711%0.114CC..Hα-helixtrans-67-45.6179.8-176.1-96.2000111.2F121 K125 F171 M172 T173 T177 V178 H179F121-N175 HydrophobicContact CE2-CB 3.66Å; F121-N175 WeakPolarHBondContact CE2-OD1 3.26Å; F121-N175 HydrophobicContact CZ-CB 3.83Å; K125-N175 PolarHBondContact NZ-OD1 3.45Å; F171-N175 WeakPolarHBondContact O-CB 3.44Å; F171-N175 PolarHBondContact O-N 3.08Å; M172-N175 PolarHBondContact O-N 3.42Å; T173-N175 VanDerWaalsContact C-N 3.33Å; T173-N175 PolarHBondContact O-N 2.84Å; N175-T177 VanDerWaalsContact C-N 3.25Å; N175-T177 PolarHBondContact O-N 3.42Å; N175-V178 PolarHBondContact O-N 3.01Å; N175-H179 PolarHBondContact ND2-CD2 3.25Å; N175-H179 PolarHBondContact ND2-NE2 2.89Å; N175-H179 VanDerWaalsContact O-CB 3.22Å; N175-H179 WeakPolarHBondContact O-CB 3.46Å; N175-H179 PolarHBondContact O-CD2 3Å; N175-H179 PolarHBondContact O-N 2.9Å
176Y98Very high96Very high2 Ų225.4 Ų25.41%0.00813%0.13CC..Hα-helixtrans-54.7-43.5173-85.9-54.6000111.9F78 T86 W117 F121 M172 H179 A180F78-Y176 HydrophobicContact CD1-CE1 4.21Å; F78-Y176 AromaticContact CE1-CE1 3.57Å; F78-Y176 HydrophobicContact CE1-CE1 3.57Å; F78-Y176 AromaticContact CZ-CE1 3.82Å; F78-Y176 HydrophobicContact CZ-CE1 3.82Å; F78-Y176 WeakPolarHBondContact CZ-OH 3.3Å; T86-Y176 HydrophobicContact CG2-CD2 4.15Å; T86-Y176 HydrophobicContact CG2-CE2 4.08Å; W117-Y176 PolarHBondContact O-OH 2.94Å; F121-Y176 VanDerWaalsContact CA-OH 3.28Å; F121-Y176 WeakPolarHBondContact CA-OH 3.47Å; F121-Y176 HydrophobicContact CB-CE2 3.86Å; F121-Y176 WeakPolarHBondContact CB-OH 3.48Å; F121-Y176 HydrophobicContact CD2-CD1 4.41Å; F121-Y176 AromaticContact CD2-CD2 3.99Å; F121-Y176 HydrophobicContact CD2-CD2 3.99Å; F121-Y176 HydrophobicContact CD2-CE1 4.13Å; F121-Y176 AromaticContact CD2-CE2 3.65Å; F121-Y176 HydrophobicContact CD2-CE2 3.65Å; F121-Y176 HydrophobicContact CD2-CG 4.36Å; F121-Y176 AromaticContact CD2-CZ 3.74Å; F121-Y176 HydrophobicContact CG-CE2 4.19Å; F121-Y176 PolarHBondContact N-OH 3.34Å; F121-Y176 VanDerWaalsContact N-OH 3.15Å; M172-Y176 WeakPolarHBondContact O-CD2 3.31Å; M172-Y176 PolarHBondContact O-N 2.84Å; Y176-H179 PolarHBondContact O-N 2.92Å; Y176-A180 VanDerWaalsContact O-CB 3.27Å; Y176-A180 WeakPolarHBondContact O-CB 3.42Å; Y176-A180 PolarHBondContact O-N 3.2Å
177T97.9Very high96.2Very high64 Ų6425.9 Ų25.939%0.39313%0.134SC..Hα-helixtrans-64.5-47.5-179.4-56.80000111.6T173 M174 N175 A180 L181T173-T177 WeakPolarHBondContact O-CB 3.43Å; T173-T177 PolarHBondContact O-N 2.83Å; T173-T177 PolarHBondContact O-OG1 2.93Å; M174-T177 PolarHBondContact O-N 3.22Å; N175-T177 VanDerWaalsContact C-N 3.25Å; N175-T177 PolarHBondContact O-N 3.42Å; T177-A180 WeakPolarHBondContact O-CB 3.41Å; T177-A180 PolarHBondContact O-N 3.24Å; T177-L181 PolarHBondContact O-N 3.47Å
178V97.8Very high96.4Very high11 Ų1127.2 Ų27.27%0.06715%0.145CC..Hα-helixtrans-69.5-38.3178.7172.90000111.6M174 N175 L181 M182 A206 Q207 Q210M174-V178 WeakPolarHBondContact O-CG2 3.29Å; M174-V178 PolarHBondContact O-N 3.46Å; N175-V178 PolarHBondContact O-N 3.01Å; V178-L181 PolarHBondContact O-N 3.49Å; V178-M182 WeakPolarHBondContact O-CB 3.36Å; V178-M182 PolarHBondContact O-N 3.11Å; V178-A206 HydrophobicContact CG2-CB 4.34Å; V178-Q207 HydrophobicContact CG1-CB 4.4Å; V178-Q207 HydrophobicContact CG1-CG 3.42Å; V178-Q207 VanDerWaalsContact CG1-CG 3.42Å; V178-Q210 HydrophobicContact CG2-CB 4.14Å; V178-Q210 HydrophobicContact CG2-CG 4.44Å
179H97.5Very high96.5Very high9 Ų932.8 Ų32.84%0.04216%0.164CC..Hα-helixtrans-66.1-37.2175.6-83-140.4000111.7E128 N175 Y176 L181 M182 Y183E128-H179 IonicContact OE1-ND1 3.89Å; E128-H179 IonicContact OE2-CE1 2.96Å; E128-H179 PolarHBondContact OE2-CE1 2.77Å; E128-H179 VanDerWaalsContact OE2-CE1 3.29Å; E128-H179 IonicContact OE2-ND1 3.78Å; N175-H179 PolarHBondContact ND2-CD2 3.25Å; N175-H179 PolarHBondContact ND2-NE2 2.89Å; N175-H179 VanDerWaalsContact O-CB 3.22Å; N175-H179 WeakPolarHBondContact O-CB 3.46Å; N175-H179 PolarHBondContact O-CD2 3Å; N175-H179 PolarHBondContact O-N 2.9Å; Y176-H179 PolarHBondContact O-N 2.92Å; H179-L181 VanDerWaalsContact C-N 3.32Å; H179-L181 PolarHBondContact O-N 2.77Å; H179-M182 PolarHBondContact O-N 2.89Å; H179-Y183 HydrophobicContact CB-CD2 4.04Å; H179-Y183 HydrophobicContact CB-CE2 4.19Å; H179-Y183 AromaticContact ND1-CE2 3.55Å; H179-Y183 WeakPolarHBondContact O-CB 3.34Å; H179-Y183 WeakPolarHBondContact O-CD2 3.41Å; H179-Y183 PolarHBondContact O-N 2.99Å
180A97.8Very high96.4Very high11 Ų1133.2 Ų33.29%0.09117%0.167CC..Hα-helixtrans-56.7-46.9172.700000111.3I80 Y176 T177 S184I80-A180 HydrophobicContact CB-CB 4.46Å; I80-A180 HydrophobicContact CG1-CB 3.68Å; Y176-A180 VanDerWaalsContact O-CB 3.27Å; Y176-A180 WeakPolarHBondContact O-CB 3.42Å; Y176-A180 PolarHBondContact O-N 3.2Å; T177-A180 WeakPolarHBondContact O-CB 3.41Å; T177-A180 PolarHBondContact O-N 3.24Å; A180-S184 WeakPolarHBondContact O-CB 3.27Å; A180-S184 PolarHBondContact O-N 3.07Å; A180-S184 VanDerWaalsContact O-N 3.15Å; A180-S184 PolarHBondContact O-OG 3.36Å
181L97.1Very high96.3Very high89 Ų8932 Ų3247%0.46617%0.171SC..Hα-helixtrans-66.5-46.8176.9-63.5175.4000112.2T177 V178 H179 Y185 I203T177-L181 PolarHBondContact O-N 3.47Å; V178-L181 PolarHBondContact O-N 3.49Å; H179-L181 VanDerWaalsContact C-N 3.32Å; H179-L181 PolarHBondContact O-N 2.77Å; L181-Y185 WeakPolarHBondContact O-CB 3.45Å; L181-Y185 PolarHBondContact O-N 3.11Å; L181-Y185 VanDerWaalsContact O-N 3.09Å; L181-I203 HydrophobicContact CB-CG1 4.43Å
182M97.3Very high96.1Very high15 Ų1533.5 Ų33.57%0.07419%0.191CC..Hα-helixtrans-64.4-50.1-177.1-176.3-170.471.900112.2V178 H179 Y185 Y186 I203 Q207V178-M182 WeakPolarHBondContact O-CB 3.36Å; V178-M182 PolarHBondContact O-N 3.11Å; H179-M182 PolarHBondContact O-N 2.89Å; M182-Y185 WeakPolarHBondContact O-CB 3.43Å; M182-Y185 PolarHBondContact O-N 3.08Å; M182-Y186 HydrophobicContact CE-CE2 3.99Å; M182-Y186 HydrophobicContact CG-CD2 4.1Å; M182-Y186 HydrophobicContact CG-CE1 4.31Å; M182-Y186 HydrophobicContact CG-CE2 3.5Å; M182-Y186 PolarHBondContact O-N 2.86Å; M182-Y186 HydrophobicContact SD-CE2 3.75Å; M182-I203 HydrophobicContact CB-CG2 4.11Å; M182-I203 HydrophobicContact CG-CG2 4.37Å; M182-Q207 PolarHBondContact SD-NE2 3.28Å
183Y97.6Very high95.8Very high0 Ų039.8 Ų39.80%022%0.218CC..Hα-helixtrans-71.3-33.5-178.9-77.1-62.7000112.4L75 D131 H179 Y185 Y186 A187L75-Y183 HydrophobicContact CB-CD1 3.86Å; L75-Y183 HydrophobicContact CB-CD2 3.77Å; L75-Y183 HydrophobicContact CB-CE1 4.06Å; L75-Y183 HydrophobicContact CB-CE2 3.95Å; L75-Y183 HydrophobicContact CB-CG 3.73Å; L75-Y183 HydrophobicContact CD1-CD1 4.06Å; L75-Y183 HydrophobicContact CD1-CE1 3.46Å; L75-Y183 VanDerWaalsContact CD1-CE1 3.46Å; L75-Y183 HydrophobicContact CD1-CE2 4.12Å; L75-Y183 HydrophobicContact CG-CE1 4.41Å; D131-Y183 WeakPolarHBondContact OD2-CE1 3.27Å; D131-Y183 PolarHBondContact OD2-OH 2.93Å; H179-Y183 HydrophobicContact CB-CD2 4.04Å; H179-Y183 HydrophobicContact CB-CE2 4.19Å; H179-Y183 AromaticContact ND1-CE2 3.55Å; H179-Y183 WeakPolarHBondContact O-CB 3.34Å; H179-Y183 WeakPolarHBondContact O-CD2 3.41Å; H179-Y183 PolarHBondContact O-N 2.99Å; Y183-Y185 VanDerWaalsContact C-N 3.28Å; Y183-Y185 PolarHBondContact O-N 3.09Å; Y183-Y186 HydrophobicContact CD1-CD2 4.1Å; Y183-Y186 HydrophobicContact CE1-CD2 4.38Å; Y183-Y186 PolarHBondContact O-N 3.33Å; Y183-A187 WeakPolarHBondContact O-CB 3.3Å; Y183-A187 PolarHBondContact O-N 2.95Å
184S96.9Very high95.4Very high48 Ų4850.6 Ų50.634%0.33626%0.257SS..Hα-helixtrans-59.6-42.8171-62.70000111.1A180 A187 A188A180-S184 WeakPolarHBondContact O-CB 3.27Å; A180-S184 PolarHBondContact O-N 3.07Å; A180-S184 VanDerWaalsContact O-N 3.15Å; A180-S184 PolarHBondContact O-OG 3.36Å; S184-A187 PolarHBondContact O-N 3.34Å; S184-A188 WeakPolarHBondContact O-CB 3.22Å; S184-A188 PolarHBondContact O-N 3.34Å
185Y96.1Very high95Very high47 Ų4751.1 Ų51.118%0.18426%0.261CS..Hα-helixtrans-63.3-43.8174172.6-93.7000112.2L181 M182 Y183 A188 R189 V195 F199 A200 I203L181-Y185 WeakPolarHBondContact O-CB 3.45Å; L181-Y185 PolarHBondContact O-N 3.11Å; L181-Y185 VanDerWaalsContact O-N 3.09Å; M182-Y185 WeakPolarHBondContact O-CB 3.43Å; M182-Y185 PolarHBondContact O-N 3.08Å; Y183-Y185 VanDerWaalsContact C-N 3.28Å; Y183-Y185 PolarHBondContact O-N 3.09Å; Y185-A188 PolarHBondContact O-N 2.84Å; Y185-R189 HydrophobicContact CD1-CG 4.26Å; Y185-R189 HydrophobicContact CD2-CG 4.39Å; Y185-R189 HydrophobicContact CE1-CG 3.84Å; Y185-R189 HydrophobicContact CE2-CG 3.99Å; Y185-R189 HydrophobicContact CG-CG 4.49Å; Y185-R189 WeakPolarHBondContact O-CB 3.38Å; Y185-R189 VanDerWaalsContact O-CG 3.23Å; Y185-R189 WeakPolarHBondContact O-CG 3.43Å; Y185-R189 PolarHBondContact O-N 2.78Å; Y185-V195 HydrophobicContact CD2-CB 4.15Å; Y185-V195 HydrophobicContact CD2-CG1 3.68Å; Y185-V195 HydrophobicContact CD2-CG2 4.41Å; Y185-V195 HydrophobicContact CE2-CB 3.75Å; Y185-V195 HydrophobicContact CE2-CG1 3.56Å; Y185-V195 HydrophobicContact CE2-CG2 4.37Å; Y185-F199 HydrophobicContact CD2-CB 4.38Å; Y185-F199 HydrophobicContact CE2-CB 4.46Å; Y185-A200 HydrophobicContact CE2-CB 4.35Å; Y185-I203 HydrophobicContact CD1-CD1 4.08Å; Y185-I203 HydrophobicContact CD2-CD1 3.79Å; Y185-I203 HydrophobicContact CG-CD1 3.47Å; Y185-I203 VanDerWaalsContact CG-CD1 3.47Å
186Y94.4Very high94.6Very high98 Ų9854.1 Ų54.138%0.38428%0.281SS..Hα-helixtrans-65.1-41.5177.2-66.8-18.3000113M182 Y183 R189 A190M182-Y186 HydrophobicContact CE-CE2 3.99Å; M182-Y186 HydrophobicContact CG-CD2 4.1Å; M182-Y186 HydrophobicContact CG-CE1 4.31Å; M182-Y186 HydrophobicContact CG-CE2 3.5Å; M182-Y186 PolarHBondContact O-N 2.86Å; M182-Y186 HydrophobicContact SD-CE2 3.75Å; Y183-Y186 HydrophobicContact CD1-CD2 4.1Å; Y183-Y186 HydrophobicContact CE1-CD2 4.38Å; Y183-Y186 PolarHBondContact O-N 3.33Å; Y186-R189 PolarHBondContact O-N 2.72Å; Y186-A190 VanDerWaalsContact O-CB 3.26Å; Y186-A190 WeakPolarHBondContact O-CB 3.38Å; Y186-A190 PolarHBondContact O-N 3.28Å
187A96Very high94Very high10 Ų1059.6 Ų59.68%0.08330%0.302CS..Hα-helixtrans-60.2-48175.200000111L73 Y183 S184 R189 A190 A191L73-A187 HydrophobicContact CB-CB 4.29Å; Y183-A187 WeakPolarHBondContact O-CB 3.3Å; Y183-A187 PolarHBondContact O-N 2.95Å; S184-A187 PolarHBondContact O-N 3.34Å; A187-R189 PolarHBondContact O-N 2.93Å; A187-A190 PolarHBondContact O-N 3.11Å; A187-A191 WeakPolarHBondContact O-CB 3.17Å; A187-A191 PolarHBondContact O-N 2.63Å
188A95.7Very high93.7Very high29 Ų2960.6 Ų60.624%0.2431%0.31CS..Hα-helixtrans-61-45.2177.300000112.1S184 Y185 A191 G192 F193 V195S184-A188 WeakPolarHBondContact O-CB 3.22Å; S184-A188 PolarHBondContact O-N 3.34Å; Y185-A188 PolarHBondContact O-N 2.84Å; A188-A191 PolarHBondContact O-N 2.72Å; A188-G192 PolarHBondContact O-N 2.97Å; A188-F193 HydrophobicContact CB-CB 4.49Å; A188-F193 HydrophobicContact CB-CD2 4.45Å; A188-F193 WeakPolarHBondContact O-CB 3.39Å; A188-F193 WeakPolarHBondContact O-CD2 3.46Å; A188-F193 PolarHBondContact O-N 3.42Å; A188-V195 HydrophobicContact CB-CG2 3.93Å
189R93.1Very high93.5Very high123 Ų12365.8 Ų65.846%0.46433%0.331SS..Hα-helixtrans-63.8-40.9177.1-72.2-67.8-61-1751.9112.2Y185 Y186 A187 A191 G192 V195Y185-R189 HydrophobicContact CD1-CG 4.26Å; Y185-R189 HydrophobicContact CD2-CG 4.39Å; Y185-R189 HydrophobicContact CE1-CG 3.84Å; Y185-R189 HydrophobicContact CE2-CG 3.99Å; Y185-R189 HydrophobicContact CG-CG 4.49Å; Y185-R189 WeakPolarHBondContact O-CB 3.38Å; Y185-R189 VanDerWaalsContact O-CG 3.23Å; Y185-R189 WeakPolarHBondContact O-CG 3.43Å; Y185-R189 PolarHBondContact O-N 2.78Å; Y186-R189 PolarHBondContact O-N 2.72Å; A187-R189 PolarHBondContact O-N 2.93Å; R189-A191 VanDerWaalsContact C-N 3.34Å; R189-G192 PolarHBondContact O-N 2.94Å; R189-V195 HydrophobicContact CG-CB 4.41Å; R189-V195 HydrophobicContact CG-CG2 4.03Å
190A92.7Very high93.2Very high14 Ų1466 Ų6612%0.11634%0.335CS..Hα-helixtrans-68.4-34.5177.500000111.7R65 L68 V69 Y186 A187 G192R65-A190 WeakPolarHBondContact CG-O 3.27Å; R65-A190 PolarHBondContact NE-O 2.8Å; L68-A190 HydrophobicContact CD2-CB 4.02Å; L68-A190 HydrophobicContact CG-CB 3.95Å; V69-A190 HydrophobicContact CB-CB 4.44Å; V69-A190 HydrophobicContact CG2-CB 3.48Å; V69-A190 VanDerWaalsContact CG2-CB 3.48Å; V69-A190 WeakPolarHBondContact CG2-O 3.17Å; Y186-A190 VanDerWaalsContact O-CB 3.26Å; Y186-A190 WeakPolarHBondContact O-CB 3.38Å; Y186-A190 PolarHBondContact O-N 3.28Å; A187-A190 PolarHBondContact O-N 3.11Å; A190-G192 PolarHBondContact O-N 3.49Å
191A93.4Very high93Very high39 Ų3967.3 Ų67.332%0.32234%0.341SS..Hα-helixtrans-69.2-12.7175.300000112.5R65 V69 A187 A188 R189 F193R65-A191 VanDerWaalsContact NH2-C 3.31Å; R65-A191 PolarHBondContact NH2-O 3.03Å; V69-A191 HydrophobicContact CG1-CB 4.4Å; V69-A191 HydrophobicContact CG2-CB 4.15Å; V69-A191 VanDerWaalsContact CG2-N 3.3Å; A187-A191 WeakPolarHBondContact O-CB 3.17Å; A187-A191 PolarHBondContact O-N 2.63Å; A188-A191 PolarHBondContact O-N 2.72Å; R189-A191 VanDerWaalsContact C-N 3.34Å; A191-F193 HydrophobicContact CB-CD2 3.77Å; A191-F193 HydrophobicContact CB-CE2 3.8Å
192G90.8Very high92.9Very high47 Ų4767.5 Ų67.549%0.48535%0.346SS..THydrogen-bonded Turntrans986.8176.500000114.2A188 R189 A190A188-G192 PolarHBondContact O-N 2.97Å; R189-G192 PolarHBondContact O-N 2.94Å; A190-G192 PolarHBondContact O-N 3.49Å
193F91.4Very high92.8Very high140 Ų14067.7 Ų67.761%0.61435%0.347SS*.  trans-68.2134.8174-64.8-74.2000110.3A188 A191 V195A188-F193 HydrophobicContact CB-CB 4.49Å; A188-F193 HydrophobicContact CB-CD2 4.45Å; A188-F193 WeakPolarHBondContact O-CB 3.39Å; A188-F193 WeakPolarHBondContact O-CD2 3.46Å; A188-F193 PolarHBondContact O-N 3.42Å; A191-F193 HydrophobicContact CB-CD2 3.77Å; A191-F193 HydrophobicContact CB-CE2 3.8Å; F193-V195 VanDerWaalsContact C-N 3.32Å; F193-V195 PolarHBondContact O-N 2.85Å
194R87.5Confident92.7Very high242 Ų24268 Ų6891%0.91335%0.349SS*.  trans-8181.1177-164.4177.5-170.5154.20.8109.5P196R194-P196 WeakPolarHBondContact O-CD 3.46Å
195V88.9Confident92.7Very high28 Ų2868.1 Ų68.117%0.1735%0.35CS..  trans-72.2129.2177.8-168.30000110.6Y185 A188 R189 F193 F199Y185-V195 HydrophobicContact CD2-CB 4.15Å; Y185-V195 HydrophobicContact CD2-CG1 3.68Å; Y185-V195 HydrophobicContact CD2-CG2 4.41Å; Y185-V195 HydrophobicContact CE2-CB 3.75Å; Y185-V195 HydrophobicContact CE2-CG1 3.56Å; Y185-V195 HydrophobicContact CE2-CG2 4.37Å; A188-V195 HydrophobicContact CB-CG2 3.93Å; R189-V195 HydrophobicContact CG-CB 4.41Å; R189-V195 HydrophobicContact CG-CG2 4.03Å; F193-V195 VanDerWaalsContact C-N 3.32Å; F193-V195 PolarHBondContact O-N 2.85Å; V195-F199 HydrophobicContact CG1-CB 3.85Å; V195-F199 HydrophobicContact CG1-CD2 3.86Å; V195-F199 HydrophobicContact CG1-CG 3.97Å
196P88Confident92.7Very high71 Ų7167.2 Ų67.246%0.46135%0.352SS..  trans-61.4150.7178.6-24.633.7000113.9R194 P198 F199R194-P196 WeakPolarHBondContact O-CD 3.46Å; P196-P198 VanDerWaalsContact C-CD 3.43Å; P196-F199 HydrophobicContact CB-CD2 3.93Å; P196-F199 HydrophobicContact CB-CE2 4.22Å; P196-F199 HydrophobicContact CG-CD2 4.02Å; P196-F199 HydrophobicContact CG-CE2 3.92Å; P196-F199 PolarHBondContact O-N 3.03Å
197R86.7Confident92.9Very high116 Ų11663.5 Ų63.544%0.43834%0.338SS..Hα-helixtrans-56.7-37.5178.2-179.2175168.4152.2-5.1114.6F199 A200 V201 Y259 E263R197-F199 PolarHBondContact O-N 2.84Å; R197-A200 WeakPolarHBondContact O-CB 3.43Å; R197-A200 PolarHBondContact O-N 3.24Å; R197-V201 PolarHBondContact O-N 3.06Å; R197-Y259 PolarHBondContact NH2-O 2.84Å; R197-E263 IonicContact CZ-OE1 2.76Å; R197-E263 IonicContact NE-OE1 3.52Å; R197-E263 IonicContact NH2-OE1 3.74Å; R197-E263 PolarHBondContact NH2-OE1 3.44Å
198P91.3Very high92.9Very high85 Ų8564.7 Ų64.755%0.55234%0.343SS*.Hα-helixtrans-55.8-34.9178.1-29.436.7000114.1P196 A200 V201 V202P196-P198 VanDerWaalsContact C-CD 3.43Å; P198-A200 VanDerWaalsContact C-N 3.33Å; P198-A200 PolarHBondContact O-N 3.37Å; P198-V201 WeakPolarHBondContact O-CB 3.4Å; P198-V201 PolarHBondContact O-N 3.43Å; P198-V202 WeakPolarHBondContact O-CG2 3.49Å; P198-V202 PolarHBondContact O-N 3.36Å
199F92.5Very high93Very high120 Ų12065.6 Ų65.653%0.52635%0.35SS..Hα-helixtrans-62.7-40.9176.3-71.2-83.1000112.1Y185 V195 P196 R197 V201 V202 I203Y185-F199 HydrophobicContact CD2-CB 4.38Å; Y185-F199 HydrophobicContact CE2-CB 4.46Å; V195-F199 HydrophobicContact CG1-CB 3.85Å; V195-F199 HydrophobicContact CG1-CD2 3.86Å; V195-F199 HydrophobicContact CG1-CG 3.97Å; P196-F199 HydrophobicContact CB-CD2 3.93Å; P196-F199 HydrophobicContact CB-CE2 4.22Å; P196-F199 HydrophobicContact CG-CD2 4.02Å; P196-F199 HydrophobicContact CG-CE2 3.92Å; P196-F199 PolarHBondContact O-N 3.03Å; R197-F199 PolarHBondContact O-N 2.84Å; F199-V201 VanDerWaalsContact C-N 3.31Å; F199-V201 PolarHBondContact O-N 3.2Å; F199-V202 PolarHBondContact O-N 3.09Å; F199-I203 WeakPolarHBondContact O-CD1 3.46Å; F199-I203 VanDerWaalsContact O-CG1 3.25Å; F199-I203 WeakPolarHBondContact O-CG1 3.24Å; F199-I203 PolarHBondContact O-N 3.37Å
200A91.4Very high93.2Very high13 Ų1360 Ų6011%0.10733%0.33CS..Hα-helixtrans-64.1-38.3176.300000111.6Y185 R197 P198 I203 T204 Y259Y185-A200 HydrophobicContact CE2-CB 4.35Å; R197-A200 WeakPolarHBondContact O-CB 3.43Å; R197-A200 PolarHBondContact O-N 3.24Å; P198-A200 VanDerWaalsContact C-N 3.33Å; P198-A200 PolarHBondContact O-N 3.37Å; A200-I203 PolarHBondContact O-N 3.41Å; A200-T204 PolarHBondContact O-N 3.26Å; A200-T204 PolarHBondContact O-OG1 2.88Å; A200-Y259 WeakPolarHBondContact CB-OH 3.49Å; A200-Y259 PolarHBondContact O-OH 3.19Å
201V93.7Very high93.5Very high39 Ų3959.5 Ų59.524%0.23633%0.325CS..Hα-helixtrans-63-49.3174.6178.60000110.4R197 P198 F199 I203 T204 S205 F255 Y259R197-V201 PolarHBondContact O-N 3.06Å; P198-V201 WeakPolarHBondContact O-CB 3.4Å; P198-V201 PolarHBondContact O-N 3.43Å; F199-V201 VanDerWaalsContact C-N 3.31Å; F199-V201 PolarHBondContact O-N 3.2Å; V201-I203 VanDerWaalsContact C-N 3.32Å; V201-I203 PolarHBondContact O-N 2.9Å; V201-T204 PolarHBondContact O-N 3.02Å; V201-S205 WeakPolarHBondContact O-CB 3.22Å; V201-S205 PolarHBondContact O-N 3.05Å; V201-S205 PolarHBondContact O-OG 3.39Å; V201-F255 HydrophobicContact CG1-CE2 3.85Å; V201-F255 HydrophobicContact CG1-CZ 3.97Å; V201-Y259 HydrophobicContact CG2-CD1 3.59Å; V201-Y259 HydrophobicContact CG2-CE1 3.65Å; V201-Y259 HydrophobicContact CG2-CG 4.05Å
202V95.6Very high93.7Very high94 Ų9459.5 Ų59.557%0.5733%0.325SS*.Hα-helixtrans-57.6-44178.3170.60000111.4P198 F199 S205 A206P198-V202 WeakPolarHBondContact O-CG2 3.49Å; P198-V202 PolarHBondContact O-N 3.36Å; F199-V202 PolarHBondContact O-N 3.09Å; V202-S205 PolarHBondContact O-N 2.89Å; V202-A206 WeakPolarHBondContact O-CB 3.39Å; V202-A206 PolarHBondContact O-N 3.42Å
203I96Very high93.9Very high18 Ų1861.8 Ų61.89%0.09232%0.324CS..Hα-helixtrans-63.5-47.4178.3-67.6162.3000110.9L181 M182 Y185 F199 A200 V201 S205 A206 Q207L181-I203 HydrophobicContact CB-CG1 4.43Å; M182-I203 HydrophobicContact CB-CG2 4.11Å; M182-I203 HydrophobicContact CG-CG2 4.37Å; Y185-I203 HydrophobicContact CD1-CD1 4.08Å; Y185-I203 HydrophobicContact CD2-CD1 3.79Å; Y185-I203 HydrophobicContact CG-CD1 3.47Å; Y185-I203 VanDerWaalsContact CG-CD1 3.47Å; F199-I203 WeakPolarHBondContact O-CD1 3.46Å; F199-I203 VanDerWaalsContact O-CG1 3.25Å; F199-I203 WeakPolarHBondContact O-CG1 3.24Å; F199-I203 PolarHBondContact O-N 3.37Å; A200-I203 PolarHBondContact O-N 3.41Å; V201-I203 VanDerWaalsContact C-N 3.32Å; V201-I203 PolarHBondContact O-N 2.9Å; I203-S205 VanDerWaalsContact C-N 3.31Å; I203-S205 PolarHBondContact O-N 3.19Å; I203-A206 PolarHBondContact O-N 3.49Å; I203-Q207 WeakPolarHBondContact O-CG 3.25Å; I203-Q207 PolarHBondContact O-N 3.32Å
204T94.9Very high94.2Very high7 Ų755.1 Ų55.14%0.04330%0.295CS..Hα-helixtrans-65.5-36.7178.8-48.90000111.5A200 V201 Q207 I208 F254 F255 Y259A200-T204 PolarHBondContact O-N 3.26Å; A200-T204 PolarHBondContact O-OG1 2.88Å; V201-T204 PolarHBondContact O-N 3.02Å; T204-Q207 WeakPolarHBondContact O-CB 3.36Å; T204-Q207 PolarHBondContact O-N 3.19Å; T204-I208 HydrophobicContact CG2-CD1 4.49Å; T204-I208 WeakPolarHBondContact O-CG1 3.07Å; T204-I208 PolarHBondContact O-N 3.36Å; T204-F254 HydrophobicContact CG2-CD1 3.91Å; T204-F254 HydrophobicContact CG2-CE1 4.1Å; T204-F255 HydrophobicContact CG2-CB 4.23Å; T204-F255 HydrophobicContact CG2-CD2 3.78Å; T204-Y259 HydrophobicContact CG2-CE2 4.16Å; T204-Y259 PolarHBondContact OG1-OH 3.44Å
205S96Very high94.6Very high51 Ų5145.5 Ų45.536%0.35726%0.262SS..Hα-helixtrans-63.5-41.4173-63.30000112V201 V202 I203 Q207 I208 A209 F255V201-S205 WeakPolarHBondContact O-CB 3.22Å; V201-S205 PolarHBondContact O-N 3.05Å; V201-S205 PolarHBondContact O-OG 3.39Å; V202-S205 PolarHBondContact O-N 2.89Å; I203-S205 VanDerWaalsContact C-N 3.31Å; I203-S205 PolarHBondContact O-N 3.19Å; S205-Q207 VanDerWaalsContact C-N 3.34Å; S205-Q207 PolarHBondContact O-N 3.22Å; S205-I208 PolarHBondContact O-N 2.78Å; S205-A209 WeakPolarHBondContact O-CB 3.37Å; S205-A209 PolarHBondContact O-N 3.46Å; S205-F255 WeakPolarHBondContact OG-CE2 3.46Å
206A97.4Very high95Very high27 Ų2748.3 Ų48.322%0.22328%0.279CS..Hα-helixtrans-63.4-39.2175.200000111.9V178 V202 I203 A209 Q210V178-A206 HydrophobicContact CG2-CB 4.34Å; V202-A206 WeakPolarHBondContact O-CB 3.39Å; V202-A206 PolarHBondContact O-N 3.42Å; I203-A206 PolarHBondContact O-N 3.49Å; A206-A209 PolarHBondContact O-N 3.08Å; A206-Q210 WeakPolarHBondContact O-CB 3.4Å; A206-Q210 PolarHBondContact O-N 3.47Å
207Q97.3Very high95.4Very high20 Ų2045.4 Ų45.49%0.09326%0.26CS..Hα-helixtrans-62.1-42.7173.1-72.2171.9-38.200112.1V178 M182 I203 T204 S205 Q210 M211 F251V178-Q207 HydrophobicContact CG1-CB 4.4Å; V178-Q207 HydrophobicContact CG1-CG 3.42Å; V178-Q207 VanDerWaalsContact CG1-CG 3.42Å; M182-Q207 PolarHBondContact SD-NE2 3.28Å; I203-Q207 WeakPolarHBondContact O-CG 3.25Å; I203-Q207 PolarHBondContact O-N 3.32Å; T204-Q207 WeakPolarHBondContact O-CB 3.36Å; T204-Q207 PolarHBondContact O-N 3.19Å; S205-Q207 VanDerWaalsContact C-N 3.34Å; S205-Q207 PolarHBondContact O-N 3.22Å; Q207-Q210 WeakPolarHBondContact O-CB 3.49Å; Q207-Q210 PolarHBondContact O-N 2.93Å; Q207-M211 WeakPolarHBondContact O-CG 3.43Å; Q207-M211 PolarHBondContact O-N 3.5Å; Q207-F251 HydrophobicContact CB-CD1 4.04Å; Q207-F251 HydrophobicContact CB-CE1 4.01Å; Q207-F251 HydrophobicContact CG-CE1 4.28Å; Q207-F251 VanDerWaalsContact OE1-CE1 3.29Å
208I97.4Very high95.8Very high35 Ų3540 Ų4018%0.17924%0.24CC..Hα-helixtrans-64.9-46.1176.4-69.7168.1000110.8T204 S205 Q210 M211 A212 L248 F251 F255T204-I208 HydrophobicContact CG2-CD1 4.49Å; T204-I208 WeakPolarHBondContact O-CG1 3.07Å; T204-I208 PolarHBondContact O-N 3.36Å; S205-I208 PolarHBondContact O-N 2.78Å; I208-Q210 VanDerWaalsContact C-N 3.27Å; I208-Q210 PolarHBondContact O-N 3.18Å; I208-M211 PolarHBondContact O-N 3.2Å; I208-M211 VanDerWaalsContact O-N 3.08Å; I208-A212 PolarHBondContact O-N 2.87Å; I208-L248 HydrophobicContact CG2-CD1 3.85Å; I208-F251 HydrophobicContact CG1-CB 3.81Å; I208-F255 HydrophobicContact CD1-CB 3.73Å; I208-F255 HydrophobicContact CD1-CD2 4.04Å; I208-F255 HydrophobicContact CD1-CG 3.99Å
209A97.5Very high96Very high48 Ų4837.9 Ų37.940%0.39723%0.233SC..Hα-helixtrans-59.4-39.917700000111.6S205 A206 M211 A212 M213S205-A209 WeakPolarHBondContact O-CB 3.37Å; S205-A209 PolarHBondContact O-N 3.46Å; A206-A209 PolarHBondContact O-N 3.08Å; A209-M211 VanDerWaalsContact C-N 3.34Å; A209-M211 PolarHBondContact O-N 3.05Å; A209-A212 PolarHBondContact O-N 2.66Å; A209-M213 WeakPolarHBondContact O-CG 3.43Å; A209-M213 PolarHBondContact O-N 2.98Å
210Q97.6Very high96.1Very high7 Ų733.8 Ų33.83%0.03322%0.216CC..Hα-helixtrans-57.1-44.8173.1-176.7-161-58.300111.8M174 V178 A206 Q207 I208 M213 G214M174-Q210 HydrophobicContact CB-CG 4.18Å; M174-Q210 HydrophobicContact CE-CG 3.54Å; M174-Q210 HydrophobicContact CG-CG 3.62Å; M174-Q210 HydrophobicContact SD-CB 4.48Å; M174-Q210 HydrophobicContact SD-CG 3.5Å; M174-Q210 VanDerWaalsContact SD-CG 3.5Å; V178-Q210 HydrophobicContact CG2-CB 4.14Å; V178-Q210 HydrophobicContact CG2-CG 4.44Å; A206-Q210 WeakPolarHBondContact O-CB 3.4Å; A206-Q210 PolarHBondContact O-N 3.47Å; Q207-Q210 WeakPolarHBondContact O-CB 3.49Å; Q207-Q210 PolarHBondContact O-N 2.93Å; I208-Q210 VanDerWaalsContact C-N 3.27Å; I208-Q210 PolarHBondContact O-N 3.18Å; Q210-M213 PolarHBondContact O-N 3.2Å; Q210-G214 PolarHBondContact O-N 3.46Å
211M97.4Very high96.2Very high2 Ų233.2 Ų33.21%0.0121%0.212CC..Hα-helixtrans-67.9-39.4179.9-54.1-46.4157.100112.1Q207 I208 A209 G214 L215 Y244 Y247 L248 F251Q207-M211 WeakPolarHBondContact O-CG 3.43Å; Q207-M211 PolarHBondContact O-N 3.5Å; I208-M211 PolarHBondContact O-N 3.2Å; I208-M211 VanDerWaalsContact O-N 3.08Å; A209-M211 VanDerWaalsContact C-N 3.34Å; A209-M211 PolarHBondContact O-N 3.05Å; M211-G214 PolarHBondContact O-N 2.86Å; M211-L215 PolarHBondContact O-N 3.44Å; M211-Y244 HydrophobicContact CB-CD1 4.47Å; M211-Y244 HydrophobicContact SD-CD1 3.68Å; M211-Y244 HydrophobicContact SD-CE1 3.98Å; M211-Y247 HydrophobicContact CE-CD2 4.11Å; M211-Y247 HydrophobicContact SD-CD2 3.71Å; M211-Y247 HydrophobicContact SD-CG 4.22Å; M211-L248 HydrophobicContact CB-CB 3.87Å; M211-L248 HydrophobicContact CB-CD1 4.18Å; M211-F251 HydrophobicContact CE-CD2 4.37Å; M211-F251 HydrophobicContact CE-CE2 4.11Å
212A97.7Very high96.2Very high40 Ų4036.7 Ų36.733%0.33122%0.222SC..Hα-helixtrans-62.4-47.6174.900000111.6I208 A209 G214 L215 T216I208-A212 PolarHBondContact O-N 2.87Å; A209-A212 PolarHBondContact O-N 2.66Å; A212-G214 VanDerWaalsContact C-N 3.28Å; A212-G214 PolarHBondContact O-N 3.27Å; A212-L215 PolarHBondContact O-N 3.45Å; A212-T216 PolarHBondContact O-N 2.87Å; A212-T216 PolarHBondContact O-OG1 3.49Å; A212-T216 VanDerWaalsContact O-OG1 3.13Å
213M96.8Very high96.1Very high95 Ų9539.8 Ų39.847%0.46822%0.223SC..Hα-helixtrans-60.7-38.2174.2-71.5-167.3-61.300111.8M174 A209 Q210 L215 T216 V217M174-M213 HydrophobicContact SD-CB 4.49Å; A209-M213 WeakPolarHBondContact O-CG 3.43Å; A209-M213 PolarHBondContact O-N 2.98Å; Q210-M213 PolarHBondContact O-N 3.2Å; M213-L215 VanDerWaalsContact C-N 3.34Å; M213-L215 PolarHBondContact O-N 2.99Å; M213-T216 PolarHBondContact O-N 3.49Å; M213-V217 WeakPolarHBondContact O-CG2 3.28Å; M213-V217 PolarHBondContact O-N 3.28Å
214G96.3Very high95.9Very high0 Ų040.2 Ų40.20%022%0.223CC..Hα-helixtrans-59.7-4217600000113.1F171 Q210 M211 A212 S218F171-G214 WeakPolarHBondContact CE1-O 3.45Å; Q210-G214 PolarHBondContact O-N 3.46Å; M211-G214 PolarHBondContact O-N 2.86Å; A212-G214 VanDerWaalsContact C-N 3.28Å; A212-G214 PolarHBondContact O-N 3.27Å; G214-S218 WeakPolarHBondContact O-CB 3.42Å; G214-S218 PolarHBondContact O-N 3.41Å; G214-S218 PolarHBondContact O-OG 2.91Å
215L97.3Very high95.7Very high40 Ų4041.6 Ų41.621%0.20923%0.23CC..Hα-helixtrans-65.5-42.9173.1-70.2173.5000112M211 A212 M213 S218 G219 T241 L245 L248M211-L215 PolarHBondContact O-N 3.44Å; A212-L215 PolarHBondContact O-N 3.45Å; M213-L215 VanDerWaalsContact C-N 3.34Å; M213-L215 PolarHBondContact O-N 2.99Å; L215-S218 PolarHBondContact O-N 3.24Å; L215-G219 PolarHBondContact O-N 2.92Å; L215-T241 HydrophobicContact CD2-CG2 4.06Å; L215-T241 WeakPolarHBondContact CD2-O 3.45Å; L215-L245 HydrophobicContact CD1-CD1 4.31Å; L215-L245 HydrophobicContact CD2-CB 4.1Å; L215-L248 HydrophobicContact CD1-CD2 3.69Å
216T96.9Very high95.2Very high87 Ų8745 Ų4553%0.53424%0.24SC..Hα-helixtrans-60.4-48.6177.1-550000111.4A212 M213 S218 G219 L220A212-T216 PolarHBondContact O-N 2.87Å; A212-T216 PolarHBondContact O-OG1 3.49Å; A212-T216 VanDerWaalsContact O-OG1 3.13Å; M213-T216 PolarHBondContact O-N 3.49Å; T216-S218 VanDerWaalsContact C-N 3.33Å; T216-S218 PolarHBondContact O-N 2.93Å; T216-G219 PolarHBondContact O-N 3.29Å; T216-L220 HydrophobicContact CG2-CD1 4.14Å; T216-L220 HydrophobicContact CG2-CG 4.48Å; T216-L220 VanDerWaalsContact O-CG 3.31Å; T216-L220 WeakPolarHBondContact O-CG 3.45Å; T216-L220 PolarHBondContact O-N 3.47Å
217V95.7Very high94.7Very high10 Ų1048.4 Ų48.46%0.06125%0.251CS..Hα-helixtrans-60.3-44.3177.4172.20000110.6I103 W170 F171 M213 G219 L220 V221I103-V217 HydrophobicContact CG2-CG1 4.28Å; W170-V217 HydrophobicContact CB-CG1 4.45Å; W170-V217 HydrophobicContact CB-CG2 4.23Å; W170-V217 HydrophobicContact CG-CG2 4.45Å; F171-V217 HydrophobicContact CD1-CG1 4.44Å; F171-V217 HydrophobicContact CE1-CB 3.78Å; F171-V217 HydrophobicContact CE1-CG1 3.7Å; F171-V217 HydrophobicContact CE2-CG1 4.38Å; F171-V217 HydrophobicContact CZ-CB 4.12Å; F171-V217 HydrophobicContact CZ-CG1 3.66Å; M213-V217 WeakPolarHBondContact O-CG2 3.28Å; M213-V217 PolarHBondContact O-N 3.28Å; V217-G219 PolarHBondContact O-N 2.89Å; V217-L220 PolarHBondContact O-N 3Å; V217-V221 HydrophobicContact CG1-CG2 4.36Å; V217-V221 VanDerWaalsContact O-CG2 3.32Å; V217-V221 WeakPolarHBondContact O-CG2 3.23Å; V217-V221 PolarHBondContact O-N 3.1Å
218S95.4Very high93.8Very high3 Ų350.6 Ų50.62%0.02128%0.28CS..Hα-helixtrans-60.6-42.7177.8-56.90000112.2F171 G214 L215 T216 V221 Y222F171-S218 WeakPolarHBondContact CZ-OG 3.23Å; G214-S218 WeakPolarHBondContact O-CB 3.42Å; G214-S218 PolarHBondContact O-N 3.41Å; G214-S218 PolarHBondContact O-OG 2.91Å; L215-S218 PolarHBondContact O-N 3.24Å; T216-S218 VanDerWaalsContact C-N 3.33Å; T216-S218 PolarHBondContact O-N 2.93Å; S218-V221 PolarHBondContact O-N 3.31Å; S218-Y222 PolarHBondContact O-N 3.39Å
219G94.9Very high92.8Very high39 Ų3953.7 Ų53.740%0.40230%0.297SS..Hα-helixtrans-67.2-35.8176.200000113.5L215 T216 V217 Y222 R223L215-G219 PolarHBondContact O-N 2.92Å; T216-G219 PolarHBondContact O-N 3.29Å; V217-G219 PolarHBondContact O-N 2.89Å; G219-Y222 PolarHBondContact O-N 2.94Å; G219-R223 WeakPolarHBondContact O-CB 3.45Å; G219-R223 PolarHBondContact O-N 2.97Å
220L94.6Very high92.2Very high34 Ų3451.6 Ų51.618%0.17828%0.279CS..Hα-helixtrans-68.4-43.6174.8-70.9174.5000111.9F99 I103 T216 V217 Y222 R223 W224F99-L220 HydrophobicContact CE1-CD1 3.71Å; F99-L220 HydrophobicContact CZ-CD1 4.02Å; I103-L220 HydrophobicContact CD1-CB 4.37Å; I103-L220 HydrophobicContact CD1-CD1 3.59Å; T216-L220 HydrophobicContact CG2-CD1 4.14Å; T216-L220 HydrophobicContact CG2-CG 4.48Å; T216-L220 VanDerWaalsContact O-CG 3.31Å; T216-L220 WeakPolarHBondContact O-CG 3.45Å; T216-L220 PolarHBondContact O-N 3.47Å; V217-L220 PolarHBondContact O-N 3Å; L220-Y222 VanDerWaalsContact C-N 3.33Å; L220-Y222 PolarHBondContact O-N 2.75Å; L220-R223 PolarHBondContact O-N 3.38Å; L220-W224 HydrophobicContact CB-CE3 4.03Å; L220-W224 HydrophobicContact CB-CH2 4.1Å; L220-W224 HydrophobicContact CB-CZ3 3.78Å; L220-W224 HydrophobicContact CD1-CH2 4.05Å; L220-W224 HydrophobicContact CD1-CZ3 4.34Å; L220-W224 HydrophobicContact CD2-CH2 4.04Å; L220-W224 HydrophobicContact CD2-CZ2 3.98Å; L220-W224 HydrophobicContact CG-CH2 4.3Å; L220-W224 HydrophobicContact CG-CZ3 4.45Å; L220-W224 WeakPolarHBondContact O-CB 3.22Å; L220-W224 PolarHBondContact O-N 3.08Å
221V93.8Very high91.5Very high2 Ų254.8 Ų54.81%0.01230%0.3CS..Hα-helixtrans-58.7-46.7173.71720000110.1I103 A166 V217 S218 R223 W224 M225 I237I103-V221 HydrophobicContact CG2-CG2 3.48Å; I103-V221 VanDerWaalsContact CG2-CG2 3.48Å; A166-V221 HydrophobicContact CB-CG1 4.06Å; A166-V221 HydrophobicContact CB-CG2 4.28Å; V217-V221 HydrophobicContact CG1-CG2 4.36Å; V217-V221 VanDerWaalsContact O-CG2 3.32Å; V217-V221 WeakPolarHBondContact O-CG2 3.23Å; V217-V221 PolarHBondContact O-N 3.1Å; S218-V221 PolarHBondContact O-N 3.31Å; V221-R223 PolarHBondContact O-N 3.32Å; V221-W224 PolarHBondContact O-N 2.92Å; V221-M225 WeakPolarHBondContact O-CB 3.49Å; V221-M225 PolarHBondContact O-N 2.97Å; V221-I237 HydrophobicContact CG1-CD1 3.89Å; V221-I237 HydrophobicContact CG1-CG1 4.11Å
222Y93.6Very high91Very high112 Ų11256 Ų5644%0.43931%0.308SS..Hα-helixtrans-55.5-50.6175177.9-104.1000112.3S218 G219 L220 W224 M225 Q226 M234S218-Y222 PolarHBondContact O-N 3.39Å; G219-Y222 PolarHBondContact O-N 2.94Å; L220-Y222 VanDerWaalsContact C-N 3.33Å; L220-Y222 PolarHBondContact O-N 2.75Å; Y222-W224 PolarHBondContact O-N 3.44Å; Y222-M225 HydrophobicContact CD2-CE 4.48Å; Y222-M225 PolarHBondContact O-N 3.44Å; Y222-Q226 WeakPolarHBondContact O-CG 3.14Å; Y222-Q226 PolarHBondContact O-N 2.9Å; Y222-M234 HydrophobicContact CD2-CE 4.06Å; Y222-M234 HydrophobicContact CD2-SD 3.77Å; Y222-M234 HydrophobicContact CE2-CE 3.58Å; Y222-M234 HydrophobicContact CE2-SD 3.62Å
223R93Very high90.5Very high158 Ų15859.8 Ų59.860%0.59631%0.314SS*.Hα-helixtrans-61.6-44.2-178.4-176.1-178.3177.8-176.30.5112.2G219 L220 V221G219-R223 WeakPolarHBondContact O-CB 3.45Å; G219-R223 PolarHBondContact O-N 2.97Å; L220-R223 PolarHBondContact O-N 3.38Å; V221-R223 PolarHBondContact O-N 3.32Å
224W92.2Very high90.1Very high27 Ų2759.2 Ų59.210%0.10231%0.311CS..Hα-helixtrans-81.2-23.7-177.1-64.6-33.4000113.4F99 R100 I103 L220 V221 Y222 Q226 Q227 G228 D229 C230F99-W224 HydrophobicContact CD1-CH2 4.19Å; F99-W224 HydrophobicContact CE1-CH2 4.22Å; R100-W224 HydrophobicContact CB-CH2 3.91Å; R100-W224 HydrophobicContact CB-CZ2 4.01Å; R100-W224 HydrophobicContact CB-CZ3 4.27Å; R100-W224 HydrophobicContact CG-CD2 3.78Å; R100-W224 HydrophobicContact CG-CE3 3.91Å; R100-W224 HydrophobicContact CG-CG 4.42Å; R100-W224 HydrophobicContact CG-CH2 3.9Å; R100-W224 HydrophobicContact CG-CZ2 3.76Å; R100-W224 HydrophobicContact CG-CZ3 3.97Å; R100-W224 VanDerWaalsContact NE-CD1 3.3Å; I103-W224 HydrophobicContact CB-CE3 4.44Å; I103-W224 HydrophobicContact CB-CZ3 3.79Å; I103-W224 HydrophobicContact CD1-CH2 4.04Å; I103-W224 HydrophobicContact CD1-CZ3 3.66Å; I103-W224 HydrophobicContact CG1-CZ3 4.27Å; I103-W224 HydrophobicContact CG2-CE3 4.15Å; I103-W224 HydrophobicContact CG2-CZ3 3.85Å; L220-W224 HydrophobicContact CB-CE3 4.03Å; L220-W224 HydrophobicContact CB-CH2 4.1Å; L220-W224 HydrophobicContact CB-CZ3 3.78Å; L220-W224 HydrophobicContact CD1-CH2 4.05Å; L220-W224 HydrophobicContact CD1-CZ3 4.34Å; L220-W224 HydrophobicContact CD2-CH2 4.04Å; L220-W224 HydrophobicContact CD2-CZ2 3.98Å; L220-W224 HydrophobicContact CG-CH2 4.3Å; L220-W224 HydrophobicContact CG-CZ3 4.45Å; L220-W224 WeakPolarHBondContact O-CB 3.22Å; L220-W224 PolarHBondContact O-N 3.08Å; V221-W224 PolarHBondContact O-N 2.92Å; Y222-W224 PolarHBondContact O-N 3.44Å; W224-Q226 VanDerWaalsContact C-N 3.33Å; W224-Q227 PolarHBondContact O-N 3.29Å; W224-Q227 VanDerWaalsContact O-N 3.15Å; W224-G228 PolarHBondContact O-N 3.04Å; W224-D229 PolarHBondContact O-N 3.28Å; W224-C230 HydrophobicContact CB-CB 3.91Å
225M90.6Very high89.9Confident36 Ų3661.8 Ų61.818%0.17733%0.325CS..Hα-helixtrans-62.7-41.3170-177.2-176.375.700111V221 Y222 Q227 G228 C230 S232 M234 I237V221-M225 WeakPolarHBondContact O-CB 3.49Å; V221-M225 PolarHBondContact O-N 2.97Å; Y222-M225 HydrophobicContact CD2-CE 4.48Å; Y222-M225 PolarHBondContact O-N 3.44Å; M225-Q227 PolarHBondContact O-N 3.17Å; M225-G228 PolarHBondContact O-N 3.01Å; M225-G228 VanDerWaalsContact O-N 3.09Å; M225-C230 HydrophobicContact CB-CB 4.4Å; M225-C230 WeakPolarHBondContact CG-O 3.14Å; M225-S232 VanDerWaalsContact SD-O 3.39Å; M225-M234 HydrophobicContact CE-CE 3.3Å; M225-M234 HydrophobicContact CE-SD 3.93Å; M225-I237 HydrophobicContact CE-CD1 3.83Å; M225-I237 HydrophobicContact SD-CD1 3.68Å
226Q86.3Confident89.7Confident122 Ų12259.9 Ų59.957%0.5732%0.315SS*.THydrogen-bonded Turntrans-63.9-20.4174.9-65.5-63.2-33.100113.3Y222 W224Y222-Q226 WeakPolarHBondContact O-CG 3.14Å; Y222-Q226 PolarHBondContact O-N 2.9Å; W224-Q226 VanDerWaalsContact C-N 3.33Å
227Q86.4Confident89.5Confident99 Ų9956.2 Ų56.246%0.46329%0.292SS..THydrogen-bonded Turntrans-91-3178.1-64.3177-10.200112.9W224 M225W224-Q227 PolarHBondContact O-N 3.29Å; W224-Q227 VanDerWaalsContact O-N 3.15Å; M225-Q227 PolarHBondContact O-N 3.17Å
228G79.3Confident89.4Confident67 Ų6759 Ų5969%0.69131%0.309SS*.THydrogen-bonded Turntrans87.3-5.8177.600000115.7W224 M225W224-G228 PolarHBondContact O-N 3.04Å; M225-G228 PolarHBondContact O-N 3.01Å; M225-G228 VanDerWaalsContact O-N 3.09Å
229D74.8Confident89.4Confident100 Ų10065.9 Ų65.954%0.53534%0.335SS..SBendtrans-94.90.5-171.4-66.8-40.4000114.2R100 W224R100-D229 IonicContact CZ-OD2 3.4Å; R100-D229 IonicContact NH1-OD2 3.53Å; R100-D229 IonicContact NH2-OD2 2.67Å; R100-D229 PolarHBondContact NH2-OD2 3.37Å; W224-D229 PolarHBondContact O-N 3.28Å
230C84.7Confident89.4Confident3 Ų364.1 Ų64.12%0.0232%0.316CS..SBendtrans-139.390.7-169.5-148.10000111C104 W224 M225 S232C104-C230 WeakPolarHBondContact CA-SG 3.34Å; C104-C230 HydrophobicContact CB-CB 3.86Å; C104-C230 WeakPolarHBondContact CB-SG 3.41Å; C104-C230 WeakPolarHBondContact SG-CB 3.48Å; C104-C230 CovalentContact SG-SG 2.05Å; C104-C230 PolarHBondContact SG-SG 3.05Å; W224-C230 HydrophobicContact CB-CB 3.91Å; M225-C230 HydrophobicContact CB-CB 4.4Å; M225-C230 WeakPolarHBondContact CG-O 3.14Å; C230-S232 PolarHBondContact O-N 3.05Å; C230-S232 VanDerWaalsContact O-N 3.1Å
231P83.2Confident89.5Confident75 Ų7565 Ų6549%0.48732%0.323SS..  trans-68.2112179.727.6-32.7000109.8
232S87Confident89.6Confident26 Ų2669.2 Ų69.218%0.18235%0.345CS..  trans-152.4173.5175.4-165.80000109.3M225 C230M225-S232 VanDerWaalsContact SD-O 3.39Å; C230-S232 PolarHBondContact O-N 3.05Å; C230-S232 VanDerWaalsContact O-N 3.1Å
233R87.7Confident89.8Confident121 Ų12164.5 Ų64.546%0.45733%0.327SS..  trans-115.3138.4-179.4-52.2-179.496.8-150.82.5110.2D163 D235 N236 I237D163-R233 VanDerWaalsContact CG-CD 3.45Å; D163-R233 IonicContact OD1-NH1 3.16Å; D163-R233 WeakPolarHBondContact OD2-CD 3.44Å; D163-R233 IonicContact OD2-CZ 3.5Å; D163-R233 IonicContact OD2-NH1 4Å; D163-R233 PolarHBondContact OD2-NH1 3.41Å; D163-R233 VanDerWaalsContact OD2-NH1 3.16Å; R233-D235 VanDerWaalsContact C-N 3.3Å; R233-D235 WeakPolarHBondContact CB-OD1 3.16Å; R233-D235 IonicContact NH1-OD2 3.66Å; R233-D235 PolarHBondContact O-N 3.19Å; R233-N236 PolarHBondContact O-N 3.06Å; R233-I237 WeakPolarHBondContact O-CG1 3.42Å; R233-I237 PolarHBondContact O-N 3.32Å
234M89.4Confident89.9Confident82 Ų8257.6 Ų57.640%0.40430%0.301SS..Hα-helixtrans-62.1-40.1-175.3-167.863.976.600112.1Y222 M225 N236 I237 T238Y222-M234 HydrophobicContact CD2-CE 4.06Å; Y222-M234 HydrophobicContact CD2-SD 3.77Å; Y222-M234 HydrophobicContact CE2-CE 3.58Å; Y222-M234 HydrophobicContact CE2-SD 3.62Å; M225-M234 HydrophobicContact CE-CE 3.3Å; M225-M234 HydrophobicContact CE-SD 3.93Å; M234-N236 VanDerWaalsContact C-N 3.34Å; M234-N236 PolarHBondContact O-N 2.72Å; M234-I237 PolarHBondContact O-N 3.44Å; M234-T238 PolarHBondContact O-N 2.54Å; M234-T238 PolarHBondContact O-OG1 2.93Å; M234-T238 VanDerWaalsContact O-OG1 3.08Å
235D91.5Very high90.2Very high55 Ų5560 Ų6029%0.29432%0.316SS..Hα-helixtrans-53.7-49.1175.353.81.6000111.8Y159 R233 I237 T238 W239Y159-D235 WeakPolarHBondContact OH-CB 3.13Å; Y159-D235 PolarHBondContact OH-OD2 3.45Å; R233-D235 VanDerWaalsContact C-N 3.3Å; R233-D235 WeakPolarHBondContact CB-OD1 3.16Å; R233-D235 IonicContact NH1-OD2 3.66Å; R233-D235 PolarHBondContact O-N 3.19Å; D235-I237 PolarHBondContact O-N 3.44Å; D235-T238 PolarHBondContact O-N 2.88Å; D235-W239 PolarHBondContact O-N 3.42Å
236N92.5Very high90.5Very high0 Ų059.5 Ų59.50%032%0.316CS..Hα-helixtrans-62.4-41.8178.3-82.3-77.4000112.4Y159 S160 D163 V165 R233 M234 W239 A240Y159-N236 VanDerWaalsContact CD1-OD1 3.27Å; Y159-N236 WeakPolarHBondContact CD1-OD1 3.33Å; Y159-N236 WeakPolarHBondContact CE1-OD1 3.49Å; S160-N236 WeakPolarHBondContact CA-OD1 3.34Å; D163-N236 PolarHBondContact OD2-ND2 2.84Å; V165-N236 HydrophobicContact CG1-CB 4.39Å; V165-N236 HydrophobicContact CG2-CB 3.61Å; V165-N236 WeakPolarHBondContact CG2-OD1 3.17Å; R233-N236 PolarHBondContact O-N 3.06Å; M234-N236 VanDerWaalsContact C-N 3.34Å; M234-N236 PolarHBondContact O-N 2.72Å; N236-W239 PolarHBondContact O-N 3.47Å; N236-A240 VanDerWaalsContact O-CB 3.23Å; N236-A240 WeakPolarHBondContact O-CB 2.9Å; N236-A240 PolarHBondContact O-N 2.9Å
237I92.8Very high91Very high10 Ų1053.9 Ų53.95%0.05129%0.29CS..Hα-helixtrans-66.3-42.1178.5-62.1166.1000110.4V221 M225 R233 M234 D235 A240 T241V221-I237 HydrophobicContact CG1-CD1 3.89Å; V221-I237 HydrophobicContact CG1-CG1 4.11Å; M225-I237 HydrophobicContact CE-CD1 3.83Å; M225-I237 HydrophobicContact SD-CD1 3.68Å; R233-I237 WeakPolarHBondContact O-CG1 3.42Å; R233-I237 PolarHBondContact O-N 3.32Å; M234-I237 PolarHBondContact O-N 3.44Å; D235-I237 PolarHBondContact O-N 3.44Å; I237-A240 PolarHBondContact O-N 3.2Å; I237-T241 WeakPolarHBondContact O-CB 3.44Å; I237-T241 PolarHBondContact O-N 3.23Å; I237-T241 PolarHBondContact O-OG1 3.32Å
238T94.6Very high91.5Very high68 Ų6850.9 Ų50.942%0.41728%0.276SS..Hα-helixtrans-61.6-50.3176.1-59.10000110.8M234 D235 A240 T241 L242M234-T238 PolarHBondContact O-N 2.54Å; M234-T238 PolarHBondContact O-OG1 2.93Å; M234-T238 VanDerWaalsContact O-OG1 3.08Å; D235-T238 PolarHBondContact O-N 2.88Å; T238-A240 PolarHBondContact O-N 3.03Å; T238-T241 PolarHBondContact O-N 3.06Å; T238-L242 HydrophobicContact CG2-CD1 4.02Å; T238-L242 HydrophobicContact CG2-CG 4.47Å; T238-L242 WeakPolarHBondContact O-CB 3.47Å; T238-L242 WeakPolarHBondContact O-CG 3.41Å; T238-L242 PolarHBondContact O-N 3.02Å
239W94.8Very high92.4Very high148 Ų14853 Ų5356%0.56127%0.272SS*.Hα-helixtrans-63.3-39.4178.3-68.2125000112.7Y156 Y159 D235 N236 L242 M243Y156-W239 HydrophobicContact CD2-CB 4.14Å; Y156-W239 HydrophobicContact CE2-CB 4.21Å; Y159-W239 AromaticContact CE1-CD1 3.89Å; D235-W239 PolarHBondContact O-N 3.42Å; N236-W239 PolarHBondContact O-N 3.47Å; W239-L242 HydrophobicContact CE3-CD1 3.98Å; W239-L242 HydrophobicContact CZ3-CD1 4.04Å; W239-M243 VanDerWaalsContact O-CB 3.29Å; W239-M243 WeakPolarHBondContact O-CB 3.43Å; W239-M243 PolarHBondContact O-N 2.87Å
240A95.3Very high93.4Very high1 Ų150.2 Ų50.21%0.00826%0.257CS..Hα-helixtrans-58.4-51.4173.600000111Y156 N236 I237 T238 L242 M243 Y244Y156-A240 HydrophobicContact CE2-CB 3.94Å; Y156-A240 WeakPolarHBondContact OH-CB 3.21Å; N236-A240 VanDerWaalsContact O-CB 3.23Å; N236-A240 WeakPolarHBondContact O-CB 2.9Å; N236-A240 PolarHBondContact O-N 2.9Å; I237-A240 PolarHBondContact O-N 3.2Å; T238-A240 PolarHBondContact O-N 3.03Å; A240-L242 PolarHBondContact O-N 3.45Å; A240-M243 PolarHBondContact O-N 2.78Å; A240-Y244 HydrophobicContact CB-CD2 4.47Å; A240-Y244 WeakPolarHBondContact O-CB 3.4Å; A240-Y244 WeakPolarHBondContact O-CD2 3.32Å; A240-Y244 PolarHBondContact O-N 3.47Å
241T95.8Very high93.9Very high52 Ų5250.9 Ų50.932%0.31926%0.259SS..Hα-helixtrans-62.1-46.1-176.8-57.50000110.8L215 I237 T238 M243 L245L215-T241 HydrophobicContact CD2-CG2 4.06Å; L215-T241 WeakPolarHBondContact CD2-O 3.45Å; I237-T241 WeakPolarHBondContact O-CB 3.44Å; I237-T241 PolarHBondContact O-N 3.23Å; I237-T241 PolarHBondContact O-OG1 3.32Å; T238-T241 PolarHBondContact O-N 3.06Å; T241-M243 PolarHBondContact O-N 3.38Å; T241-L245 WeakPolarHBondContact O-CB 3.32Å; T241-L245 PolarHBondContact O-N 2.93Å
242L96.5Very high94.4Very high92 Ų9249.6 Ų49.648%0.48225%0.252SS..Hα-helixtrans-60.8-45177-71.5174.1000112T238 W239 A240 S246T238-L242 HydrophobicContact CG2-CD1 4.02Å; T238-L242 HydrophobicContact CG2-CG 4.47Å; T238-L242 WeakPolarHBondContact O-CB 3.47Å; T238-L242 WeakPolarHBondContact O-CG 3.41Å; T238-L242 PolarHBondContact O-N 3.02Å; W239-L242 HydrophobicContact CE3-CD1 3.98Å; W239-L242 HydrophobicContact CZ3-CD1 4.04Å; A240-L242 PolarHBondContact O-N 3.45Å; L242-S246 WeakPolarHBondContact O-CB 3.37Å; L242-S246 PolarHBondContact O-N 2.97Å; L242-S246 PolarHBondContact O-OG 2.83Å
243M96.5Very high94.8Very high12 Ų1252.1 Ų52.16%0.05926%0.263CS..Hα-helixtrans-64.8-50.8178.8-177.5-168.665.100111.8Y156 W239 A240 T241 L245 S246 Y247Y156-M243 HydrophobicContact CD1-CE 3.32Å; Y156-M243 HydrophobicContact CD1-SD 3.69Å; Y156-M243 HydrophobicContact CE1-CE 3.67Å; Y156-M243 HydrophobicContact CG-CE 3.92Å; Y156-M243 HydrophobicContact CG-SD 3.77Å; W239-M243 VanDerWaalsContact O-CB 3.29Å; W239-M243 WeakPolarHBondContact O-CB 3.43Å; W239-M243 PolarHBondContact O-N 2.87Å; A240-M243 PolarHBondContact O-N 2.78Å; T241-M243 PolarHBondContact O-N 3.38Å; M243-L245 VanDerWaalsContact C-N 3.32Å; M243-L245 PolarHBondContact O-N 3.27Å; M243-S246 PolarHBondContact O-N 3.13Å; M243-S246 PolarHBondContact O-OG 3.1Å; M243-Y247 HydrophobicContact CE-CE2 4.29Å; M243-Y247 HydrophobicContact CG-CD2 4.06Å; M243-Y247 HydrophobicContact CG-CE1 4Å; M243-Y247 HydrophobicContact CG-CE2 3.42Å; M243-Y247 VanDerWaalsContact CG-CE2 3.42Å; M243-Y247 WeakPolarHBondContact CG-OH 3.49Å; M243-Y247 WeakPolarHBondContact O-CD1 3.14Å; M243-Y247 PolarHBondContact O-N 2.98Å; M243-Y247 HydrophobicContact SD-CE2 3.74Å
244Y96.8Very high95.1Very high13 Ų1349.1 Ų49.15%0.05125%0.253CS..Hα-helixtrans-66-35.2-179.3-80.3-67000112.3F171 M174 M211 A240 L248F171-Y244 AromaticContact CD1-CE2 3.77Å; F171-Y244 HydrophobicContact CD1-CE2 3.77Å; F171-Y244 AromaticContact CD1-CZ 3.73Å; F171-Y244 VanDerWaalsContact CD1-OH 3.28Å; F171-Y244 WeakPolarHBondContact CD1-OH 3.48Å; F171-Y244 HydrophobicContact CE1-CD2 4.45Å; F171-Y244 AromaticContact CE1-CE2 3.68Å; F171-Y244 HydrophobicContact CE1-CE2 3.68Å; F171-Y244 HydrophobicContact CG-CE2 4.35Å; F171-Y244 HydrophobicContact CZ-CE2 4.2Å; M174-Y244 HydrophobicContact CE-CD1 4.49Å; M174-Y244 HydrophobicContact CE-CE1 3.38Å; M174-Y244 VanDerWaalsContact CE-CZ 3.47Å; M174-Y244 WeakPolarHBondContact CE-OH 3.24Å; M211-Y244 HydrophobicContact CB-CD1 4.47Å; M211-Y244 HydrophobicContact SD-CD1 3.68Å; M211-Y244 HydrophobicContact SD-CE1 3.98Å; A240-Y244 HydrophobicContact CB-CD2 4.47Å; A240-Y244 WeakPolarHBondContact O-CB 3.4Å; A240-Y244 WeakPolarHBondContact O-CD2 3.32Å; A240-Y244 PolarHBondContact O-N 3.47Å; Y244-L248 WeakPolarHBondContact O-CB 3.43Å; Y244-L248 PolarHBondContact O-N 3.34Å
245L97.4Very high95.3Very high79 Ų7947 Ų4741%0.41424%0.242SC..Hα-helixtrans-66.3-46.2175.5-179.261.1000111.1L215 T241 M243 Y247 L248 L249L215-L245 HydrophobicContact CD1-CD1 4.31Å; L215-L245 HydrophobicContact CD2-CB 4.1Å; T241-L245 WeakPolarHBondContact O-CB 3.32Å; T241-L245 PolarHBondContact O-N 2.93Å; M243-L245 VanDerWaalsContact C-N 3.32Å; M243-L245 PolarHBondContact O-N 3.27Å; L245-Y247 VanDerWaalsContact C-N 3.3Å; L245-Y247 PolarHBondContact O-N 3.21Å; L245-L248 PolarHBondContact O-N 3.48Å; L245-L249 WeakPolarHBondContact O-CG 3.46Å; L245-L249 PolarHBondContact O-N 3.43Å; L245-L249 VanDerWaalsContact O-N 3.1Å
246S97.6Very high95.4Very high25 Ų2550.5 Ų50.518%0.17525%0.252CS..Hα-helixtrans-61.6-41.6178.276.70000111.2Y148 L242 M243 L249 L250Y148-S246 WeakPolarHBondContact CE1-OG 3.27Å; Y148-S246 WeakPolarHBondContact OH-CB 3.43Å; Y148-S246 PolarHBondContact OH-OG 3Å; L242-S246 WeakPolarHBondContact O-CB 3.37Å; L242-S246 PolarHBondContact O-N 2.97Å; L242-S246 PolarHBondContact O-OG 2.83Å; M243-S246 PolarHBondContact O-N 3.13Å; M243-S246 PolarHBondContact O-OG 3.1Å; S246-L249 PolarHBondContact O-N 2.98Å; S246-L250 WeakPolarHBondContact O-CB 3.39Å; S246-L250 VanDerWaalsContact O-CG 3.24Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.37Å
247Y97.1Very high95.3Very high3 Ų355.1 Ų55.11%0.01227%0.274CS..Hα-helixtrans-64.9-44.5175.8-65.3-8.8000112.2Y148 H149 T152 V153 M211 M243 L245 L249 L250 F251Y148-Y247 HydrophobicContact CD1-CD1 4.44Å; Y148-Y247 HydrophobicContact CD1-CE1 4.09Å; Y148-Y247 AromaticContact CE1-CD1 3.97Å; Y148-Y247 HydrophobicContact CE1-CD1 3.97Å; Y148-Y247 AromaticContact CE1-CE1 3.7Å; Y148-Y247 HydrophobicContact CE1-CE1 3.7Å; H149-Y247 HydrophobicContact CB-CE1 4.24Å; H149-Y247 AromaticContact CD2-CD2 4Å; H149-Y247 AromaticContact CD2-CE2 3.54Å; H149-Y247 AromaticContact CD2-CZ 3.54Å; H149-Y247 PolarHBondContact O-OH 3.48Å; T152-Y247 WeakPolarHBondContact CB-OH 3.38Å; T152-Y247 WeakPolarHBondContact OG1-CE1 3.41Å; T152-Y247 PolarHBondContact OG1-OH 3.39Å; V153-Y247 PolarHBondContact N-OH 2.88Å; M211-Y247 HydrophobicContact CE-CD2 4.11Å; M211-Y247 HydrophobicContact SD-CD2 3.71Å; M211-Y247 HydrophobicContact SD-CG 4.22Å; M243-Y247 HydrophobicContact CE-CE2 4.29Å; M243-Y247 HydrophobicContact CG-CD2 4.06Å; M243-Y247 HydrophobicContact CG-CE1 4Å; M243-Y247 HydrophobicContact CG-CE2 3.42Å; M243-Y247 VanDerWaalsContact CG-CE2 3.42Å; M243-Y247 WeakPolarHBondContact CG-OH 3.49Å; M243-Y247 WeakPolarHBondContact O-CD1 3.14Å; M243-Y247 PolarHBondContact O-N 2.98Å; M243-Y247 HydrophobicContact SD-CE2 3.74Å; L245-Y247 VanDerWaalsContact C-N 3.3Å; L245-Y247 PolarHBondContact O-N 3.21Å; Y247-L249 VanDerWaalsContact C-N 3.29Å; Y247-L249 PolarHBondContact O-N 3.19Å; Y247-L250 PolarHBondContact O-N 2.92Å; Y247-F251 WeakPolarHBondContact O-CB 3.32Å; Y247-F251 WeakPolarHBondContact O-CD2 3.25Å; Y247-F251 PolarHBondContact O-N 3.44Å
248L97.3Very high95.2Very high36 Ų3656.3 Ų56.319%0.18828%0.281CS..Hα-helixtrans-56.1-46.2178.418060.9000111I208 M211 L215 Y244 L245 S252I208-L248 HydrophobicContact CG2-CD1 3.85Å; M211-L248 HydrophobicContact CB-CB 3.87Å; M211-L248 HydrophobicContact CB-CD1 4.18Å; L215-L248 HydrophobicContact CD1-CD2 3.69Å; Y244-L248 WeakPolarHBondContact O-CB 3.43Å; Y244-L248 PolarHBondContact O-N 3.34Å; L245-L248 PolarHBondContact O-N 3.48Å; L248-S252 WeakPolarHBondContact O-CB 3.48Å; L248-S252 PolarHBondContact O-N 3.17Å; L248-S252 PolarHBondContact O-OG 2.86Å
249L97.2Very high94.9Very high113 Ų11354 Ų5459%0.59227%0.265SS*.Hα-helixtrans-64.7-46.1177.8-65.5176.1000112L245 S246 Y247 S252 N253L245-L249 WeakPolarHBondContact O-CG 3.46Å; L245-L249 PolarHBondContact O-N 3.43Å; L245-L249 VanDerWaalsContact O-N 3.1Å; S246-L249 PolarHBondContact O-N 2.98Å; Y247-L249 VanDerWaalsContact C-N 3.29Å; Y247-L249 PolarHBondContact O-N 3.19Å; L249-S252 PolarHBondContact O-N 3.49Å; L249-N253 VanDerWaalsContact O-CB 3.31Å; L249-N253 WeakPolarHBondContact O-CB 3.47Å; L249-N253 PolarHBondContact O-N 3.36Å
250L95.6Very high94.7Very high41 Ų4151 Ų5122%0.21526%0.26CS..Hα-helixtrans-67.4-43.1-177.6-70.7169.3000112.5F144 L145 Y148 S246 Y247 F254F144-L250 HydrophobicContact CD1-CD2 4.11Å; F144-L250 HydrophobicContact CE1-CD1 4.19Å; F144-L250 HydrophobicContact CE1-CD2 4.12Å; L145-L250 HydrophobicContact CD1-CB 3.45Å; L145-L250 VanDerWaalsContact CD1-CB 3.45Å; L145-L250 HydrophobicContact CD1-CD1 3.99Å; L145-L250 HydrophobicContact CD1-CG 4.34Å; L145-L250 HydrophobicContact CG-CB 4.44Å; Y148-L250 HydrophobicContact CD1-CD1 3.62Å; Y148-L250 HydrophobicContact CE1-CD1 3.71Å; S246-L250 WeakPolarHBondContact O-CB 3.39Å; S246-L250 VanDerWaalsContact O-CG 3.24Å; S246-L250 WeakPolarHBondContact O-CG 3.32Å; S246-L250 PolarHBondContact O-N 3.37Å; Y247-L250 PolarHBondContact O-N 2.92Å; L250-F254 WeakPolarHBondContact O-CB 3.44Å; L250-F254 PolarHBondContact O-N 2.89Å
251F94.6Very high94.3Very high17 Ų1757.2 Ų57.28%0.07528%0.283CS..Hα-helixtrans-68.9-38.9176.4-85.9-84.1000111.8L145 Q207 I208 M211 Y247 F254 F255L145-F251 HydrophobicContact CD1-CD2 3.78Å; L145-F251 HydrophobicContact CD1-CE2 3.66Å; L145-F251 HydrophobicContact CD1-CG 4.47Å; L145-F251 HydrophobicContact CD1-CZ 4.26Å; L145-F251 HydrophobicContact CD2-CD1 4.04Å; L145-F251 HydrophobicContact CD2-CD2 4.23Å; L145-F251 HydrophobicContact CD2-CE1 4Å; L145-F251 HydrophobicContact CD2-CE2 4.2Å; L145-F251 HydrophobicContact CD2-CG 4.16Å; L145-F251 HydrophobicContact CD2-CZ 4.08Å; L145-F251 HydrophobicContact CG-CE2 4.3Å; L145-F251 HydrophobicContact CG-CZ 4.41Å; Q207-F251 HydrophobicContact CB-CD1 4.04Å; Q207-F251 HydrophobicContact CB-CE1 4.01Å; Q207-F251 HydrophobicContact CG-CE1 4.28Å; Q207-F251 VanDerWaalsContact OE1-CE1 3.29Å; I208-F251 HydrophobicContact CG1-CB 3.81Å; M211-F251 HydrophobicContact CE-CD2 4.37Å; M211-F251 HydrophobicContact CE-CE2 4.11Å; Y247-F251 WeakPolarHBondContact O-CB 3.32Å; Y247-F251 WeakPolarHBondContact O-CD2 3.25Å; Y247-F251 PolarHBondContact O-N 3.44Å; F251-F254 PolarHBondContact O-N 2.96Å; F251-F255 WeakPolarHBondContact O-CB 3.43Å; F251-F255 PolarHBondContact O-N 3.44Å
252S95.6Very high93.3Very high48 Ų4862.5 Ų62.534%0.33630%0.297SS..Hα-helixtrans-63.3-44.3175-60.60000111.4L248 L249 F255 Y256L248-S252 WeakPolarHBondContact O-CB 3.48Å; L248-S252 PolarHBondContact O-N 3.17Å; L248-S252 PolarHBondContact O-OG 2.86Å; L249-S252 PolarHBondContact O-N 3.49Å; S252-F255 PolarHBondContact O-N 3.29Å; S252-Y256 WeakPolarHBondContact O-CB 3.5Å; S252-Y256 PolarHBondContact O-N 3.49Å
253N95.2Very high92.2Very high78 Ų7861.9 Ų61.942%0.41729%0.292SS..Hα-helixtrans-62.6-42.9173.917654.4000111.7L249 F255 Y256 Q257L249-N253 VanDerWaalsContact O-CB 3.31Å; L249-N253 WeakPolarHBondContact O-CB 3.47Å; L249-N253 PolarHBondContact O-N 3.36Å; N253-F255 VanDerWaalsContact C-N 3.35Å; N253-F255 PolarHBondContact O-N 3.38Å; N253-Y256 PolarHBondContact O-N 2.05Å; N253-Q257 PolarHBondContact ND2-NE2 2.84Å; N253-Q257 WeakPolarHBondContact O-CB 3.09Å; N253-Q257 VanDerWaalsContact O-CG 3.3Å; N253-Q257 WeakPolarHBondContact O-CG 3.01Å; N253-Q257 PolarHBondContact O-N 2.9Å; N253-Q257 PolarHBondContact OD1-NE2 3.09Å
254F93.7Very high90.9Very high58 Ų5864.2 Ų64.225%0.25431%0.313SS..Hα-helixtrans-59.6-44.4174.9172.7-97.8000112.1L143 L145 T204 L250 F251 Q257 T258L143-F254 HydrophobicContact CD1-CD2 4.28Å; L143-F254 HydrophobicContact CD1-CE2 3.91Å; L145-F254 HydrophobicContact CD2-CB 4.18Å; L145-F254 HydrophobicContact CD2-CG 4.42Å; T204-F254 HydrophobicContact CG2-CD1 3.91Å; T204-F254 HydrophobicContact CG2-CE1 4.1Å; L250-F254 WeakPolarHBondContact O-CB 3.44Å; L250-F254 PolarHBondContact O-N 2.89Å; F251-F254 PolarHBondContact O-N 2.96Å; F254-Q257 PolarHBondContact O-N 3.13Å; F254-T258 WeakPolarHBondContact CE2-OG1 3.31Å; F254-T258 HydrophobicContact CZ-CG2 4.34Å; F254-T258 WeakPolarHBondContact O-CB 2.97Å; F254-T258 PolarHBondContact O-N 3.2Å; F254-T258 PolarHBondContact O-OG1 3.2Å
255F93.3Very high89.5Confident37 Ų3769.5 Ų69.516%0.16234%0.336CS..Hα-helixtrans-62.6-47.7178.2-174.1-82.1000111.6V201 T204 S205 I208 F251 S252 N253 Q257 T258 Y259 L260V201-F255 HydrophobicContact CG1-CE2 3.85Å; V201-F255 HydrophobicContact CG1-CZ 3.97Å; T204-F255 HydrophobicContact CG2-CB 4.23Å; T204-F255 HydrophobicContact CG2-CD2 3.78Å; S205-F255 WeakPolarHBondContact OG-CE2 3.46Å; I208-F255 HydrophobicContact CD1-CB 3.73Å; I208-F255 HydrophobicContact CD1-CD2 4.04Å; I208-F255 HydrophobicContact CD1-CG 3.99Å; F251-F255 WeakPolarHBondContact O-CB 3.43Å; F251-F255 PolarHBondContact O-N 3.44Å; S252-F255 PolarHBondContact O-N 3.29Å; N253-F255 VanDerWaalsContact C-N 3.35Å; N253-F255 PolarHBondContact O-N 3.38Å; F255-Q257 PolarHBondContact O-N 2.94Å; F255-T258 PolarHBondContact O-N 3.27Å; F255-Y259 HydrophobicContact CB-CD2 4.4Å; F255-Y259 HydrophobicContact CD1-CD2 4.4Å; F255-Y259 AromaticContact CD2-CD2 3.5Å; F255-Y259 HydrophobicContact CD2-CD2 3.5Å; F255-Y259 VanDerWaalsContact CD2-CD2 3.5Å; F255-Y259 AromaticContact CD2-CE2 3.86Å; F255-Y259 HydrophobicContact CD2-CE2 3.86Å; F255-Y259 AromaticContact CE2-CD2 3.74Å; F255-Y259 HydrophobicContact CE2-CD2 3.74Å; F255-Y259 HydrophobicContact CE2-CE2 4.2Å; F255-Y259 AromaticContact CG-CD2 3.85Å; F255-Y259 HydrophobicContact CG-CD2 3.85Å; F255-Y259 HydrophobicContact CZ-CD2 4.28Å; F255-Y259 PolarHBondContact O-N 3.44Å; F255-L260 HydrophobicContact CD1-CD1 4.24Å; F255-L260 HydrophobicContact CD1-CG 4.25Å; F255-L260 HydrophobicContact CE1-CD1 4.15Å; F255-L260 HydrophobicContact CE1-CD2 4.25Å; F255-L260 HydrophobicContact CE1-CG 4Å
256Y93.4Very high88.2Confident130 Ų13068.8 Ų68.851%0.5134%0.341SS..Iπ-helixtrans-58-48.4177176.8-97.8000111.8S252 N253 T258 L260 R261S252-Y256 WeakPolarHBondContact O-CB 3.5Å; S252-Y256 PolarHBondContact O-N 3.49Å; N253-Y256 PolarHBondContact O-N 2.05Å; Y256-T258 PolarHBondContact O-N 3.09Å; Y256-L260 HydrophobicContact CD2-CB 4.2Å; Y256-L260 HydrophobicContact CD2-CD1 4.06Å; Y256-L260 PolarHBondContact O-N 3.23Å; Y256-R261 HydrophobicContact CE1-CB 4.36Å; Y256-R261 WeakPolarHBondContact O-CB 3.15Å; Y256-R261 PolarHBondContact O-N 3.42Å
257Q91.2Very high86.5Confident97 Ų9776.1 Ų76.145%0.45337%0.37SS..Iπ-helixtrans-67.8-37-178.7-68.8-174.119.200113N253 F254 F255N253-Q257 PolarHBondContact ND2-NE2 2.84Å; N253-Q257 WeakPolarHBondContact O-CB 3.09Å; N253-Q257 VanDerWaalsContact O-CG 3.3Å; N253-Q257 WeakPolarHBondContact O-CG 3.01Å; N253-Q257 PolarHBondContact O-N 2.9Å; N253-Q257 PolarHBondContact OD1-NE2 3.09Å; F254-Q257 PolarHBondContact O-N 3.13Å; F255-Q257 PolarHBondContact O-N 2.94Å
258T88.9Confident84.9Confident34 Ų3480.6 Ų80.621%0.20940%0.402CS..Iπ-helixtrans-86.4-40.6-171.3-56.60000112.8F254 F255 Y256 R262F254-T258 WeakPolarHBondContact CE2-OG1 3.31Å; F254-T258 HydrophobicContact CZ-CG2 4.34Å; F254-T258 WeakPolarHBondContact O-CB 2.97Å; F254-T258 PolarHBondContact O-N 3.2Å; F254-T258 PolarHBondContact O-OG1 3.2Å; F255-T258 PolarHBondContact O-N 3.27Å; Y256-T258 PolarHBondContact O-N 3.09Å; T258-R262 VanDerWaalsContact O-CD 3.26Å; T258-R262 WeakPolarHBondContact O-CD 3.46Å
259Y89.7Confident82.5Confident20 Ų2089.5 Ų89.58%0.07844%0.442CS..Iπ-helixtrans-104.9-55-172.1-57.2-64.2000111.7R197 A200 V201 T204 F255 E263R197-Y259 PolarHBondContact NH2-O 2.84Å; A200-Y259 WeakPolarHBondContact CB-OH 3.49Å; A200-Y259 PolarHBondContact O-OH 3.19Å; V201-Y259 HydrophobicContact CG2-CD1 3.59Å; V201-Y259 HydrophobicContact CG2-CE1 3.65Å; V201-Y259 HydrophobicContact CG2-CG 4.05Å; T204-Y259 HydrophobicContact CG2-CE2 4.16Å; T204-Y259 PolarHBondContact OG1-OH 3.44Å; F255-Y259 HydrophobicContact CB-CD2 4.4Å; F255-Y259 HydrophobicContact CD1-CD2 4.4Å; F255-Y259 AromaticContact CD2-CD2 3.5Å; F255-Y259 HydrophobicContact CD2-CD2 3.5Å; F255-Y259 VanDerWaalsContact CD2-CD2 3.5Å; F255-Y259 AromaticContact CD2-CE2 3.86Å; F255-Y259 HydrophobicContact CD2-CE2 3.86Å; F255-Y259 AromaticContact CE2-CD2 3.74Å; F255-Y259 HydrophobicContact CE2-CD2 3.74Å; F255-Y259 HydrophobicContact CE2-CE2 4.2Å; F255-Y259 AromaticContact CG-CD2 3.85Å; F255-Y259 HydrophobicContact CG-CD2 3.85Å; F255-Y259 HydrophobicContact CZ-CD2 4.28Å; F255-Y259 PolarHBondContact O-N 3.44Å; Y259-E263 WeakPolarHBondContact O-CB 3.49Å; Y259-E263 VanDerWaalsContact O-CG 3.24Å; Y259-E263 WeakPolarHBondContact O-CG 3.47Å; Y259-E263 PolarHBondContact O-N 3.4Å
260L89.3Confident81.8Confident85 Ų8588.3 Ų88.345%0.44544%0.435SS..Iπ-helixtrans-75.1-51.8-172.6-59.2179.3000112.9F255 Y256 R262 E263 A264F255-L260 HydrophobicContact CD1-CD1 4.24Å; F255-L260 HydrophobicContact CD1-CG 4.25Å; F255-L260 HydrophobicContact CE1-CD1 4.15Å; F255-L260 HydrophobicContact CE1-CD2 4.25Å; F255-L260 HydrophobicContact CE1-CG 4Å; Y256-L260 HydrophobicContact CD2-CB 4.2Å; Y256-L260 HydrophobicContact CD2-CD1 4.06Å; Y256-L260 PolarHBondContact O-N 3.23Å; L260-R262 VanDerWaalsContact C-N 3.31Å; L260-R262 PolarHBondContact O-N 3.48Å; L260-E263 PolarHBondContact O-N 2.92Å; L260-A264 PolarHBondContact O-N 3.26Å
261R86.8Confident81.1Confident132 Ų13290.8 Ų90.850%0.49845%0.446SS..Hα-helixtrans-64.6-36-177.5-171.8177.2-177.1-170.41.8112.4Y256 K265Y256-R261 HydrophobicContact CE1-CB 4.36Å; Y256-R261 WeakPolarHBondContact O-CB 3.15Å; Y256-R261 PolarHBondContact O-N 3.42Å; R261-K265 PolarHBondContact O-N 3Å
262R75.3Confident80.3Confident163 Ų16394.9 Ų94.962%0.61547%0.467SS*.Hα-helixtrans-68.9-40.4176.4-85.4-179.5153.7-175.4-4.7112.1T258 L260 K265 A266T258-R262 VanDerWaalsContact O-CD 3.26Å; T258-R262 WeakPolarHBondContact O-CD 3.46Å; L260-R262 VanDerWaalsContact C-N 3.31Å; L260-R262 PolarHBondContact O-N 3.48Å; R262-K265 PolarHBondContact O-N 3.5Å; R262-A266 WeakPolarHBondContact O-CB 3.2Å; R262-A266 PolarHBondContact O-N 3Å
263E74.3Confident79.4Confident79 Ų7997.6 Ų97.637%0.36948%0.475SS..Hα-helixtrans-68.3-39.1176-77.3169-157.100112R197 Y259 L260 K265 A266 K267R197-E263 IonicContact CZ-OE1 2.76Å; R197-E263 IonicContact NE-OE1 3.52Å; R197-E263 IonicContact NH2-OE1 3.74Å; R197-E263 PolarHBondContact NH2-OE1 3.44Å; Y259-E263 WeakPolarHBondContact O-CB 3.49Å; Y259-E263 VanDerWaalsContact O-CG 3.24Å; Y259-E263 WeakPolarHBondContact O-CG 3.47Å; Y259-E263 PolarHBondContact O-N 3.4Å; L260-E263 PolarHBondContact O-N 2.92Å; E263-K265 VanDerWaalsContact C-N 3.32Å; E263-K265 PolarHBondContact O-N 3.31Å; E263-A266 PolarHBondContact O-N 3.1Å; E263-K267 WeakPolarHBondContact O-CG 3.21Å; E263-K267 PolarHBondContact O-N 2.67Å
264A68.1Low78.4Confident61 Ų6198.9 Ų98.950%0.50448%0.478SS..Hα-helixtrans-58.7-43.5174.100000112L260 K267 S268L260-A264 PolarHBondContact O-N 3.26Å; A264-K267 PolarHBondContact O-N 3.41Å; A264-S268 PolarHBondContact O-N 3.44Å; A264-S268 PolarHBondContact O-OG 3.41Å
265K67.1Low77.4Confident124 Ų124101.6 Ų101.654%0.53949%0.493SS..Hα-helixtrans-67.6-35.9175.1-75.1-171.6175.1-165.80113.6R261 R262 E263 K267 S268 Q269R261-K265 PolarHBondContact O-N 3Å; R262-K265 PolarHBondContact O-N 3.5Å; E263-K265 VanDerWaalsContact C-N 3.32Å; E263-K265 PolarHBondContact O-N 3.31Å; K265-K267 VanDerWaalsContact C-N 3.31Å; K265-S268 PolarHBondContact O-N 3.5Å; K265-S268 PolarHBondContact O-OG 3.15Å; K265-S268 VanDerWaalsContact O-OG 3.08Å; K265-Q269 PolarHBondContact O-N 3.46Å
266A70.1Confident76.3Confident63 Ų63106.2 Ų106.252%0.52152%0.517SS..Hα-helixtrans-73-24.2178.400000112.9R262 E263R262-A266 WeakPolarHBondContact O-CB 3.2Å; R262-A266 PolarHBondContact O-N 3Å; E263-A266 PolarHBondContact O-N 3.1Å
267K63.8Low75Confident180 Ų180104.4 Ų104.478%0.78352%0.518SS*.Hα-helixtrans-85.3-18.7173.3-71.4-178.5-180-176.60113.4E263 A264 K265E263-K267 WeakPolarHBondContact O-CG 3.21Å; E263-K267 PolarHBondContact O-N 2.67Å; A264-K267 PolarHBondContact O-N 3.41Å; K265-K267 VanDerWaalsContact C-N 3.31Å
268S62Low73.6Confident96 Ų96105 Ų10567%0.67152%0.523SS*.  trans-93.30.6177.773.60000113.6A264 K265A264-S268 PolarHBondContact O-N 3.44Å; A264-S268 PolarHBondContact O-OG 3.41Å; K265-S268 PolarHBondContact O-N 3.5Å; K265-S268 PolarHBondContact O-OG 3.15Å; K265-S268 VanDerWaalsContact O-OG 3.08Å
269Q48Very low72.2Confident223 Ų223111.5 Ų111.5100%1.04255%0.551SS**  trans-110.10171.8-76.3-173.7-38.100108.5K265K265-Q269 PolarHBondContact O-N 3.46Å

Retrieved 269 of 269 residues in 617.7 ms (Link to these results)