A0A060WZN0_ONCMY Loading...

Amyloid protein-binding protein 2

Substrate-recognition component of a Cul2-RING (CRL2) E3 ubiquitin-protein ligase complex of the DesCEND (destruction via C-end degrons) pathway, which recognizes a C-degron located at the extreme C terminus of target proteins, leading to their ubiquitination and degradation. The C-degron recognized by the DesCEND pathway is usually a motif of less than ten residues and can be present in full-length proteins, truncated proteins or proteolytically cleaved forms. The CRL2(APPBP2) complex specifically recognizes proteins with a -Arg-Xaa-Xaa-Gly degron at the C-terminus, leading to their ubiquitination and degradation. The CRL2(APPBP2) complex mediates ubiquitination and degradation of truncated SELENOV selenoproteins produced by failed UGA/Sec decoding, which end with a -Arg-Xaa-Xaa-Gly degron. May play a role in intracellular protein transport: may be involved in the translocation of APP along microtubules toward the cell surface.

AlphaFold DB , UniProt , Accession A0A060WZN0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene APPBP2, Length 586 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
1M41.6Very low47.9Very low248 Ų248149.8 Ų149.8100%1.22279%0.789SS**  096.90-75.5-157.5-76.600107.9
2A38.4Very low51.3Low99 Ų99144 Ų14482%0.81876%0.764SS**  trans-100.4110.9165.600000105.7L4A2-L4 PolarHBondContact O-N 3.15Å; A2-L4 VanDerWaalsContact O-N 3.13Å
3A42.9Very low54.3Low100 Ų100144.6 Ų144.683%0.82677%0.766SS**  trans-66.2107.7168.600000106.6E5A3-E5 PolarHBondContact O-N 3.19Å
4L43.8Very low57Low163 Ų163141.2 Ų141.285%0.85374%0.739SS**  trans-59.4119.5162.8-90.5135.7000106.7A2 L6A2-L4 PolarHBondContact O-N 3.15Å; A2-L4 VanDerWaalsContact O-N 3.13Å; L4-L6 PolarHBondContact O-N 3.44Å
5E44Very low59.2Low179 Ų179136.6 Ų136.684%0.83672%0.715SS**  trans-54.1111.6165.6-72.3178.3152.600107.4A3 E7A3-E5 PolarHBondContact O-N 3.19Å; E5-E7 VanDerWaalsContact C-N 3.27Å; E5-E7 PolarHBondContact O-N 3.07Å
6L41.8Very low61.2Low171 Ų171132.2 Ų132.290%0.89570%0.696SS**  trans-67.492.2169.2-81.8158000106.7L4 W8L4-L6 PolarHBondContact O-N 3.44Å; L6-W8 VanDerWaalsContact C-N 3.35Å; L6-W8 PolarHBondContact O-N 2.97Å
7E36.9Very low63.1Low164 Ų164127.4 Ų127.477%0.76668%0.679SS**  trans-61.299.9165.4-80.7-171.8154.900108.2E5 I9E5-E7 VanDerWaalsContact C-N 3.27Å; E5-E7 PolarHBondContact O-N 3.07Å; E7-I9 PolarHBondContact O-N 3.29Å; E7-I9 VanDerWaalsContact O-N 3.08Å
8W45.7Very low64.8Low215 Ų215120.9 Ų120.981%0.81465%0.645SS**  trans-73.197.8168.7179.676.8000108.1L6 P10L6-W8 VanDerWaalsContact C-N 3.35Å; L6-W8 PolarHBondContact O-N 2.97Å; W8-P10 HydrophobicContact CE3-CB 4.45Å; W8-P10 HydrophobicContact CE3-CG 4.36Å; W8-P10 HydrophobicContact CH2-CB 3.64Å; W8-P10 HydrophobicContact CH2-CG 4.18Å; W8-P10 HydrophobicContact CZ2-CB 3.95Å; W8-P10 HydrophobicContact CZ3-CB 3.9Å; W8-P10 HydrophobicContact CZ3-CG 3.92Å; W8-P10 VanDerWaalsContact O-CD 3.3Å; W8-P10 WeakPolarHBondContact O-CD 3.35Å
9I54.9Low66.3Low134 Ų134115.4 Ų115.469%0.68762%0.616SS**  trans-87.8110.1170.1-55.7172.8000106.8E7 E11E7-I9 PolarHBondContact O-N 3.29Å; E7-I9 VanDerWaalsContact O-N 3.08Å; I9-E11 PolarHBondContact O-N 3.5Å
10P62.6Low67.7Low75 Ų75112.1 Ų112.149%0.48761%0.606SS.*PPolyproline II helixtrans-59.8132.517817.3-26.2000110.8W8W8-P10 HydrophobicContact CE3-CB 4.45Å; W8-P10 HydrophobicContact CE3-CG 4.36Å; W8-P10 HydrophobicContact CH2-CB 3.64Å; W8-P10 HydrophobicContact CH2-CG 4.18Å; W8-P10 HydrophobicContact CZ2-CB 3.95Å; W8-P10 HydrophobicContact CZ3-CB 3.9Å; W8-P10 HydrophobicContact CZ3-CG 3.92Å; W8-P10 VanDerWaalsContact O-CD 3.3Å; W8-P10 WeakPolarHBondContact O-CD 3.35Å
11E74.3Confident69Low100 Ų100109 Ų10947%0.46759%0.591SS.*PPolyproline II helixtrans-55.9144.2170.3-78.1-165.9155.400109.8I9 N15 K46I9-E11 PolarHBondContact O-N 3.5Å; E11-N15 HydrophobicContact CB-CB 4.27Å; E11-K46 IonicContact OE1-NZ 2.86Å; E11-K46 PolarHBondContact OE1-NZ 3.29Å
12T88.8Confident71.6Confident80 Ų8097.2 Ų97.249%0.49153%0.533SS..PPolyproline II helixtrans-61.2148.7172.265.60000109.7Y14 N15 T16T12-Y14 PolarHBondContact O-N 3.49Å; T12-N15 PolarHBondContact O-N 3.5Å; T12-N15 WeakPolarHBondContact OG1-CB 3.27Å; T12-N15 VanDerWaalsContact OG1-CG 3.31Å; T12-N15 PolarHBondContact OG1-N 3.37Å; T12-N15 VanDerWaalsContact OG1-N 3.13Å; T12-N15 PolarHBondContact OG1-ND2 3.07Å; T12-T16 PolarHBondContact O-N 3.15Å; T12-T16 PolarHBondContact O-OG1 3.27Å
13L90.6Very high74.2Confident152 Ų15297.2 Ų97.280%0.79652%0.519SS*.Hα-helixtrans-51.4-35.7174.9178.162.9000111.8A17L13-A17 VanDerWaalsContact O-CB 3.29Å; L13-A17 WeakPolarHBondContact O-CB 3.04Å; L13-A17 PolarHBondContact O-N 2.94Å
14Y92.1Very high76.7Confident97 Ų9796.2 Ų96.238%0.3850%0.5SS..Hα-helixtrans-60.5-53.4174.1-177.1-98.2000112.1T12 T16 A17 I18 D42T12-Y14 PolarHBondContact O-N 3.49Å; Y14-T16 VanDerWaalsContact C-N 3.31Å; Y14-T16 PolarHBondContact O-N 3.4Å; Y14-A17 WeakPolarHBondContact O-CB 3.39Å; Y14-A17 PolarHBondContact O-N 3.41Å; Y14-A17 VanDerWaalsContact O-N 3.16Å; Y14-I18 HydrophobicContact CD1-CG1 4.26Å; Y14-I18 HydrophobicContact CE1-CD1 4.39Å; Y14-I18 HydrophobicContact CE1-CG1 3.84Å; Y14-I18 HydrophobicContact CE2-CD1 4.46Å; Y14-I18 HydrophobicContact CE2-CG1 4.43Å; Y14-I18 WeakPolarHBondContact O-CG1 3.43Å; Y14-I18 PolarHBondContact O-N 3.04Å; Y14-D42 PolarHBondContact OH-OD2 3.32Å
15N89.5Confident79.1Confident72 Ų7288.8 Ų88.839%0.38546%0.461SS..Hα-helixtrans-62-40179.1-73.9-13.8000111.7E11 T12 I18 S19E11-N15 HydrophobicContact CB-CB 4.27Å; T12-N15 PolarHBondContact O-N 3.5Å; T12-N15 WeakPolarHBondContact OG1-CB 3.27Å; T12-N15 VanDerWaalsContact OG1-CG 3.31Å; T12-N15 PolarHBondContact OG1-N 3.37Å; T12-N15 VanDerWaalsContact OG1-N 3.13Å; T12-N15 PolarHBondContact OG1-ND2 3.07Å; N15-I18 PolarHBondContact O-N 3.26Å; N15-S19 WeakPolarHBondContact O-CB 3.49Å; N15-S19 PolarHBondContact O-N 3.16Å; N15-S19 PolarHBondContact O-OG 2.91Å
16T91.1Very high81.3Confident66 Ų6684.9 Ų84.941%0.40545%0.453SS..Hα-helixtrans-64.2-39.8175.3-53.30000111.8T12 Y14 S19 A20T12-T16 PolarHBondContact O-N 3.15Å; T12-T16 PolarHBondContact O-OG1 3.27Å; Y14-T16 VanDerWaalsContact C-N 3.31Å; Y14-T16 PolarHBondContact O-N 3.4Å; T16-S19 WeakPolarHBondContact O-CB 3.32Å; T16-S19 PolarHBondContact O-N 2.85Å; T16-A20 WeakPolarHBondContact O-CB 3.41Å; T16-A20 PolarHBondContact O-N 3.23Å
17A93.5Very high83.8Confident50 Ų5087 Ų8741%0.41345%0.449SS..Hα-helixtrans-64.7-43.2175.300000111.8L13 Y14 A20 V21L13-A17 VanDerWaalsContact O-CB 3.29Å; L13-A17 WeakPolarHBondContact O-CB 3.04Å; L13-A17 PolarHBondContact O-N 2.94Å; Y14-A17 WeakPolarHBondContact O-CB 3.39Å; Y14-A17 PolarHBondContact O-N 3.41Å; Y14-A17 VanDerWaalsContact O-N 3.16Å; A17-A20 PolarHBondContact O-N 3.44Å; A17-V21 WeakPolarHBondContact O-CG2 3.46Å; A17-V21 PolarHBondContact O-N 2.97Å
18I94.8Very high86.4Confident12 Ų1280.1 Ų80.16%0.06242%0.419CS..Hα-helixtrans-61.1-45.5174.3-64.3-67.9000110.5Y14 N15 A20 V21 V22 I39 D42 V43 K46Y14-I18 HydrophobicContact CD1-CG1 4.26Å; Y14-I18 HydrophobicContact CE1-CD1 4.39Å; Y14-I18 HydrophobicContact CE1-CG1 3.84Å; Y14-I18 HydrophobicContact CE2-CD1 4.46Å; Y14-I18 HydrophobicContact CE2-CG1 4.43Å; Y14-I18 WeakPolarHBondContact O-CG1 3.43Å; Y14-I18 PolarHBondContact O-N 3.04Å; N15-I18 PolarHBondContact O-N 3.26Å; I18-A20 PolarHBondContact O-N 2.86Å; I18-V21 PolarHBondContact O-N 3.37Å; I18-V22 HydrophobicContact CG2-CG2 4.49Å; I18-V22 WeakPolarHBondContact O-CG2 3.47Å; I18-V22 PolarHBondContact O-N 2.98Å; I18-I39 HydrophobicContact CD1-CG2 4.12Å; I18-D42 HydrophobicContact CD1-CB 4.28Å; I18-V43 HydrophobicContact CD1-CG2 3.7Å; I18-V43 HydrophobicContact CG2-CG2 4.34Å; I18-K46 HydrophobicContact CG2-CB 3.67Å; I18-K46 HydrophobicContact CG2-CG 3.97Å
19S93.2Very high88.6Confident15 Ų1574.5 Ų74.511%0.10540%0.398CS..Hα-helixtrans-54.8-49.5174.1-63.40000111.3N15 T16 V21 V22 D23 K46N15-S19 WeakPolarHBondContact O-CB 3.49Å; N15-S19 PolarHBondContact O-N 3.16Å; N15-S19 PolarHBondContact O-OG 2.91Å; T16-S19 WeakPolarHBondContact O-CB 3.32Å; T16-S19 PolarHBondContact O-N 2.85Å; S19-V21 PolarHBondContact O-N 3.15Å; S19-V22 CarbonylContact O-C 3.51Å; S19-V22 PolarHBondContact O-N 3.27Å; S19-V22 VanDerWaalsContact O-N 3.14Å; S19-D23 PolarHBondContact O-N 3.39Å; S19-K46 WeakPolarHBondContact OG-CE 3.2Å; S19-K46 PolarHBondContact OG-NZ 3.3Å
20A94Very high90.4Very high49 Ų4978.7 Ų78.741%0.40541%0.405SS..Hα-helixtrans-63-38.3179.900000113.2T16 A17 I18 N24T16-A20 WeakPolarHBondContact O-CB 3.41Å; T16-A20 PolarHBondContact O-N 3.23Å; A17-A20 PolarHBondContact O-N 3.44Å; I18-A20 PolarHBondContact O-N 2.86Å; A20-N24 PolarHBondContact O-N 3.03Å; A20-N24 PolarHBondContact O-ND2 3.18Å
21V94.9Very high91.8Very high48 Ų4880.2 Ų80.229%0.29141%0.409SS..Hα-helixtrans-63.1-441741690000110.7A17 I18 S19 N24 Y25 S28 I32 V43A17-V21 WeakPolarHBondContact O-CG2 3.46Å; A17-V21 PolarHBondContact O-N 2.97Å; I18-V21 PolarHBondContact O-N 3.37Å; S19-V21 PolarHBondContact O-N 3.15Å; V21-N24 CarbonylContact O-C 3.37Å; V21-N24 PolarHBondContact O-N 3.49Å; V21-Y25 PolarHBondContact O-N 3.27Å; V21-Y25 VanDerWaalsContact O-N 3.11Å; V21-S28 PolarHBondContact O-OG 3.47Å; V21-S28 VanDerWaalsContact O-OG 3.08Å; V21-I32 HydrophobicContact CG1-CD1 3.87Å; V21-I32 HydrophobicContact CG1-CG1 3.83Å; V21-V43 HydrophobicContact CG1-CG1 4.18Å; V21-V43 HydrophobicContact CG1-CG2 4.13Å
22V95Very high92.8Very high0 Ų075.5 Ų75.50%039%0.387CS..Hα-helixtrans-66.5-44.8177.8169.80000111.1I18 S19 N24 Y25 V43 K46 L47 R52I18-V22 HydrophobicContact CG2-CG2 4.49Å; I18-V22 WeakPolarHBondContact O-CG2 3.47Å; I18-V22 PolarHBondContact O-N 2.98Å; S19-V22 CarbonylContact O-C 3.51Å; S19-V22 PolarHBondContact O-N 3.27Å; S19-V22 VanDerWaalsContact O-N 3.14Å; V22-N24 PolarHBondContact O-N 2.96Å; V22-N24 VanDerWaalsContact O-N 3.13Å; V22-Y25 WeakPolarHBondContact O-CA 3.43Å; V22-Y25 WeakPolarHBondContact O-CB 3.46Å; V22-Y25 PolarHBondContact O-N 3.17Å; V22-V43 HydrophobicContact CG2-CG1 3.81Å; V22-K46 HydrophobicContact CG2-CB 3.98Å; V22-K46 HydrophobicContact CG2-CG 4.05Å; V22-L47 HydrophobicContact CG1-CD2 3.67Å; V22-L47 HydrophobicContact CG1-CG 4.21Å; V22-L47 HydrophobicContact CG2-CG 4.36Å; V22-R52 VanDerWaalsContact CG1-NH1 3.34Å; V22-R52 PolarHBondContact O-NH1 3.46Å
23D93.9Very high93Very high100 Ų10075.6 Ų75.654%0.53538%0.378SS..Hα-helixtrans-58.7-31.5178.5-65.4-18.2000111.4S19 Q50S19-D23 PolarHBondContact O-N 3.39Å; D23-Q50 PolarHBondContact OD1-NE2 3.26Å
24N94.3Very high93.2Very high79 Ų7972.7 Ų72.742%0.42237%0.371SS..THydrogen-bonded Turntrans-9818.4174.9-67.8-83.9000114.2A20 V21 V22 S26 R27 S28A20-N24 PolarHBondContact O-N 3.03Å; A20-N24 PolarHBondContact O-ND2 3.18Å; V21-N24 CarbonylContact O-C 3.37Å; V21-N24 PolarHBondContact O-N 3.49Å; V22-N24 PolarHBondContact O-N 2.96Å; V22-N24 VanDerWaalsContact O-N 3.13Å; N24-S26 VanDerWaalsContact C-N 3.27Å; N24-S26 PolarHBondContact O-N 3.41Å; N24-R27 WeakPolarHBondContact O-CB 3.44Å; N24-R27 PolarHBondContact O-N 3.05Å; N24-S28 PolarHBondContact O-N 2.75Å; N24-S28 VanDerWaalsContact O-N 3.14Å; N24-S28 PolarHBondContact O-OG 3.12Å
25Y94.3Very high93.2Very high7 Ų770.4 Ų70.43%0.02737%0.365CS..Hα-helixtrans-46.1-45-170.6178-97.1000114.2V21 V22 R27 S28 R29 I32 L47 Q55 E59V21-Y25 PolarHBondContact O-N 3.27Å; V21-Y25 VanDerWaalsContact O-N 3.11Å; V22-Y25 WeakPolarHBondContact O-CA 3.43Å; V22-Y25 WeakPolarHBondContact O-CB 3.46Å; V22-Y25 PolarHBondContact O-N 3.17Å; Y25-R27 PolarHBondContact O-N 2.65Å; Y25-S28 WeakPolarHBondContact CA-OG 3.4Å; Y25-S28 CarbonylContact O-C 3.59Å; Y25-S28 PolarHBondContact O-N 3.37Å; Y25-S28 PolarHBondContact O-OG 3.08Å; Y25-R29 HydrophobicContact CE1-CB 4.45Å; Y25-R29 HydrophobicContact CE1-CG 4.23Å; Y25-R29 WeakPolarHBondContact O-CA 3.33Å; Y25-R29 WeakPolarHBondContact O-CB 3.45Å; Y25-R29 PolarHBondContact O-N 3.07Å; Y25-I32 HydrophobicContact CD2-CD1 3.48Å; Y25-I32 VanDerWaalsContact CD2-CD1 3.48Å; Y25-I32 HydrophobicContact CE2-CD1 3.74Å; Y25-L47 HydrophobicContact CD2-CD1 3.9Å; Y25-L47 HydrophobicContact CD2-CD2 4.16Å; Y25-L47 HydrophobicContact CD2-CG 4.47Å; Y25-L47 HydrophobicContact CE2-CD1 3.64Å; Y25-L47 HydrophobicContact CG-CD2 4.29Å; Y25-Q55 HydrophobicContact CD1-CB 4.31Å; Y25-Q55 HydrophobicContact CD1-CG 4.27Å; Y25-Q55 HydrophobicContact CE1-CB 3.92Å; Y25-Q55 HydrophobicContact CE1-CG 4.16Å; Y25-E59 WeakPolarHBondContact OH-CG 3.25Å; Y25-E59 PolarHBondContact OH-OE1 2.89Å
26S91.2Very high93.4Very high97 Ų9770.5 Ų70.568%0.67837%0.37SS*.Hα-helixtrans-60.4-31.2-178.2-56.20000113N24N24-S26 VanDerWaalsContact C-N 3.27Å; N24-S26 PolarHBondContact O-N 3.41Å
27R93.3Very high93.6Very high214 Ų21470.5 Ų70.581%0.80837%0.365SS*.Hα-helixtrans-83.8-38.6176.9-64.2179.7178.1175-0.6111.6N24 Y25N24-R27 WeakPolarHBondContact O-CB 3.44Å; N24-R27 PolarHBondContact O-N 3.05Å; Y25-R27 PolarHBondContact O-N 2.65Å
28S91.5Very high93.5Very high20 Ų2071.3 Ų71.314%0.1436%0.362CS..Hα-helixtrans-89.8-5.4-175.255.70000114.5V21 N24 Y25 R30 D31 I32V21-S28 PolarHBondContact O-OG 3.47Å; V21-S28 VanDerWaalsContact O-OG 3.08Å; N24-S28 PolarHBondContact O-N 2.75Å; N24-S28 VanDerWaalsContact O-N 3.14Å; N24-S28 PolarHBondContact O-OG 3.12Å; Y25-S28 WeakPolarHBondContact CA-OG 3.4Å; Y25-S28 CarbonylContact O-C 3.59Å; Y25-S28 PolarHBondContact O-N 3.37Å; Y25-S28 PolarHBondContact O-OG 3.08Å; S28-R30 VanDerWaalsContact C-N 3.27Å; S28-R30 PolarHBondContact O-N 3.01Å; S28-R30 VanDerWaalsContact O-N 3.09Å; S28-D31 PolarHBondContact O-N 2.94Å; S28-I32 WeakPolarHBondContact O-CG1 3.44Å; S28-I32 PolarHBondContact O-N 3.27Å; S28-I32 WeakPolarHBondContact OG-CD1 3.38Å
29R93.3Very high93.4Very high97 Ų9773.6 Ų73.637%0.36637%0.374SS..Hα-helixtrans-48.4-43.7-173.2-175.6-177.9-177.6-1394.2114.2Y25 E59Y25-R29 HydrophobicContact CE1-CB 4.45Å; Y25-R29 HydrophobicContact CE1-CG 4.23Å; Y25-R29 WeakPolarHBondContact O-CA 3.33Å; Y25-R29 WeakPolarHBondContact O-CB 3.45Å; Y25-R29 PolarHBondContact O-N 3.07Å; R29-E59 IonicContact CZ-OE1 3.84Å; R29-E59 IonicContact NE-OE1 3.83Å; R29-E59 PolarHBondContact NE-OE1 2.94Å; R29-E59 IonicContact NH2-OE1 2.97Å; R29-E59 PolarHBondContact NH2-OE1 2.62Å
30R91.8Very high93.5Very high223 Ų22373 Ų7384%0.84237%0.369SS*.Hα-helixtrans-68.1-42.9-179.6-69.9-176.2-179.2177.80.7111.3S28 I32 R33S28-R30 VanDerWaalsContact C-N 3.27Å; S28-R30 PolarHBondContact O-N 3.01Å; S28-R30 VanDerWaalsContact O-N 3.09Å; R30-I32 VanDerWaalsContact C-N 3.34Å; R30-R33 PolarHBondContact O-N 3.03Å
31D93.4Very high93.6Very high106 Ų10670.7 Ų70.757%0.56735%0.351SS*.Hα-helixtrans-69.9-33.5-180-53.4-42.1000111.4S28 R33 S34 L35S28-D31 PolarHBondContact O-N 2.94Å; D31-R33 PolarHBondContact O-N 3.04Å; D31-S34 PolarHBondContact O-N 3.26Å; D31-S34 PolarHBondContact O-OG 2.87Å; D31-L35 PolarHBondContact O-N 3.47Å
32I94Very high93.6Very high2 Ų270.2 Ų70.21%0.0135%0.346CS..Hα-helixtrans-56.6-36.7174.9-69.4163.3000111.2V21 Y25 S28 R30 S34 L35 Q40 V43 Y44V21-I32 HydrophobicContact CG1-CD1 3.87Å; V21-I32 HydrophobicContact CG1-CG1 3.83Å; Y25-I32 HydrophobicContact CD2-CD1 3.48Å; Y25-I32 VanDerWaalsContact CD2-CD1 3.48Å; Y25-I32 HydrophobicContact CE2-CD1 3.74Å; S28-I32 WeakPolarHBondContact O-CG1 3.44Å; S28-I32 PolarHBondContact O-N 3.27Å; S28-I32 WeakPolarHBondContact OG-CD1 3.38Å; R30-I32 VanDerWaalsContact C-N 3.34Å; I32-S34 VanDerWaalsContact C-N 3.27Å; I32-S34 PolarHBondContact O-N 3Å; I32-L35 HydrophobicContact CB-CD1 4.45Å; I32-L35 HydrophobicContact CG1-CD1 4.42Å; I32-L35 HydrophobicContact CG2-CD1 4.49Å; I32-L35 WeakPolarHBondContact O-CB 3.02Å; I32-L35 PolarHBondContact O-N 2.81Å; I32-Q40 HydrophobicContact CG2-CG 4.23Å; I32-V43 HydrophobicContact CD1-CG1 3.81Å; I32-V43 HydrophobicContact CG1-CG1 4.12Å; I32-V43 HydrophobicContact CG2-CB 4.36Å; I32-V43 HydrophobicContact CG2-CG1 3.96Å; I32-Y44 HydrophobicContact CG2-CD1 4.47Å; I32-Y44 HydrophobicContact CG2-CE1 3.72Å
33R94.1Very high93.7Very high81 Ų8170.2 Ų70.231%0.30635%0.346SS..Hα-helixtrans-69.4-23.3-179.9-66.3179.3176.3-164.9-5.8113.5R30 D31 E59 V65 K68R30-R33 PolarHBondContact O-N 3.03Å; D31-R33 PolarHBondContact O-N 3.04Å; R33-E59 IonicContact CZ-OE1 3.26Å; R33-E59 IonicContact CZ-OE2 3.53Å; R33-E59 IonicContact NE-OE1 2.63Å; R33-E59 IonicContact NE-OE2 2.84Å; R33-E59 PolarHBondContact NE-OE2 3.36Å; R33-E59 IonicContact NH2-OE1 3.24Å; R33-E59 PolarHBondContact NH2-OE1 2.95Å; R33-E59 IonicContact NH2-OE2 3.19Å; R33-E59 PolarHBondContact NH2-OE2 2.91Å; R33-V65 HydrophobicContact CG-CG2 4.31Å; R33-K68 PolarHBondContact O-NZ 2.94Å
34S93.3Very high93.8Very high92 Ų9265.5 Ų65.564%0.64332%0.321SS*.Hα-helixtrans-86.6-16.7177.268.50000113.1D31 I32D31-S34 PolarHBondContact O-N 3.26Å; D31-S34 PolarHBondContact O-OG 2.87Å; I32-S34 VanDerWaalsContact C-N 3.27Å; I32-S34 PolarHBondContact O-N 3Å
35L93.6Very high93.9Very high49 Ų4964 Ų6426%0.25731%0.309SS..SBendtrans-57.8150.5178.3-64.2176.3000112.7D31 I32 I39 Q40 V43 K68D31-L35 PolarHBondContact O-N 3.47Å; I32-L35 HydrophobicContact CB-CD1 4.45Å; I32-L35 HydrophobicContact CG1-CD1 4.42Å; I32-L35 HydrophobicContact CG2-CD1 4.49Å; I32-L35 WeakPolarHBondContact O-CB 3.02Å; I32-L35 PolarHBondContact O-N 2.81Å; L35-I39 HydrophobicContact CD1-CG2 4.07Å; L35-Q40 HydrophobicContact CB-CB 4.23Å; L35-V43 HydrophobicContact CD1-CG2 4.2Å; L35-K68 WeakPolarHBondContact O-CE 3.39Å; L35-K68 PolarHBondContact O-NZ 3.47Å
36P93.9Very high94Very high74 Ų7465 Ų6548%0.48131%0.314SS..  trans-52.1148.4171.9-26.334.9000112.8N38 I39 Q40P36-N38 VanDerWaalsContact C-N 3.29Å; P36-N38 PolarHBondContact O-N 3.3Å; P36-N38 VanDerWaalsContact O-N 3.14Å; P36-I39 HydrophobicContact CB-CD1 4.45Å; P36-I39 HydrophobicContact CB-CG1 4.47Å; P36-I39 HydrophobicContact CG-CD1 4.14Å; P36-I39 PolarHBondContact O-N 3.49Å; P36-Q40 WeakPolarHBondContact O-CB 3.34Å; P36-Q40 PolarHBondContact O-N 2.99Å
37E93.4Very high94.2Very high65 Ų6560.4 Ų60.430%0.30428%0.282SS..Hα-helixtrans-44.1-50.8-175-7569.3-162.900113F41 K68 R71E37-F41 WeakPolarHBondContact O-CB 3.47Å; E37-F41 PolarHBondContact O-N 3.34Å; E37-K68 HydrophobicContact CG-CG 3.85Å; E37-R71 HydrophobicContact CG-CB 3.77Å; E37-R71 IonicContact OE1-CZ 2.81Å; E37-R71 IonicContact OE1-NE 3.47Å; E37-R71 PolarHBondContact OE1-NE 2.93Å; E37-R71 IonicContact OE1-NH2 2.72Å; E37-R71 PolarHBondContact OE1-NH2 3.01Å
38N91.8Very high94.3Very high68 Ų6852.8 Ų52.836%0.36425%0.253SS..Hα-helixtrans-68.4-39.5-175.7-75.3-18.9000112.7P36 F41 D42 A72 K75P36-N38 VanDerWaalsContact C-N 3.29Å; P36-N38 PolarHBondContact O-N 3.3Å; P36-N38 VanDerWaalsContact O-N 3.14Å; N38-F41 PolarHBondContact O-N 3.27Å; N38-D42 VanDerWaalsContact O-CG 3.26Å; N38-D42 PolarHBondContact O-N 3.42Å; N38-D42 VanDerWaalsContact O-OD2 3.06Å; N38-A72 WeakPolarHBondContact OD1-CB 3.32Å; N38-K75 PolarHBondContact O-NZ 3.45Å
39I93.6Very high94.4Very high60 Ų6057 Ų5731%0.30827%0.271SS..Hα-helixtrans-72.8-41.5179.5-56.5-179.5000109.9I18 L35 P36 F41 D42 V43I18-I39 HydrophobicContact CD1-CG2 4.12Å; L35-I39 HydrophobicContact CD1-CG2 4.07Å; P36-I39 HydrophobicContact CB-CD1 4.45Å; P36-I39 HydrophobicContact CB-CG1 4.47Å; P36-I39 HydrophobicContact CG-CD1 4.14Å; P36-I39 PolarHBondContact O-N 3.49Å; I39-F41 VanDerWaalsContact C-N 3.28Å; I39-F41 PolarHBondContact O-N 3.04Å; I39-D42 PolarHBondContact O-N 3.1Å; I39-D42 VanDerWaalsContact O-N 3.14Å; I39-V43 WeakPolarHBondContact O-CG2 3.45Å; I39-V43 PolarHBondContact O-N 3.25Å
40Q95.1Very high94.5Very high1 Ų155.9 Ų55.91%0.00527%0.27CS..Hα-helixtrans-57.9-44.8174-174.9-173.626.900110.7I32 L35 P36 D42 V43 Y44I32-Q40 HydrophobicContact CG2-CG 4.23Å; L35-Q40 HydrophobicContact CB-CB 4.23Å; P36-Q40 WeakPolarHBondContact O-CB 3.34Å; P36-Q40 PolarHBondContact O-N 2.99Å; Q40-D42 VanDerWaalsContact C-N 3.34Å; Q40-D42 PolarHBondContact O-N 3.3Å; Q40-V43 PolarHBondContact O-N 2.93Å; Q40-Y44 HydrophobicContact CG-CD2 4.04Å; Q40-Y44 HydrophobicContact CG-CE2 3.45Å; Q40-Y44 VanDerWaalsContact CG-CE2 3.45Å; Q40-Y44 PolarHBondContact NE2-OH 3.06Å; Q40-Y44 WeakPolarHBondContact O-CD2 3.46Å; Q40-Y44 PolarHBondContact O-N 3.3Å; Q40-Y44 VanDerWaalsContact O-N 3.1Å
41F95.8Very high94.6Very high2 Ų247.8 Ų47.81%0.00926%0.256CS..Hα-helixtrans-58.8-44.6174.7-173.9-83.5000111.7E37 N38 I39 V43 Y44 Y45 V69 A72 K75 L78 L79E37-F41 WeakPolarHBondContact O-CB 3.47Å; E37-F41 PolarHBondContact O-N 3.34Å; N38-F41 PolarHBondContact O-N 3.27Å; I39-F41 VanDerWaalsContact C-N 3.28Å; I39-F41 PolarHBondContact O-N 3.04Å; F41-V43 VanDerWaalsContact C-N 3.31Å; F41-V43 PolarHBondContact O-N 3.14Å; F41-Y44 CarbonylContact O-C 3.51Å; F41-Y44 PolarHBondContact O-N 3.26Å; F41-Y44 VanDerWaalsContact O-N 3.07Å; F41-Y45 HydrophobicContact CE1-CD2 4.06Å; F41-Y45 HydrophobicContact CE1-CG 4.18Å; F41-Y45 HydrophobicContact CZ-CD2 4.38Å; F41-Y45 WeakPolarHBondContact O-CB 3.46Å; F41-Y45 PolarHBondContact O-N 3.38Å; F41-V69 HydrophobicContact CD2-CG1 3.98Å; F41-V69 HydrophobicContact CE2-CG1 4.2Å; F41-A72 HydrophobicContact CB-CB 4.21Å; F41-A72 HydrophobicContact CD2-CB 4.42Å; F41-A72 HydrophobicContact CG-CB 4.41Å; F41-K75 HydrophobicContact CB-CD 4.12Å; F41-K75 HydrophobicContact CD1-CB 3.91Å; F41-K75 HydrophobicContact CD1-CD 3.28Å; F41-K75 HydrophobicContact CD1-CG 4.2Å; F41-K75 HydrophobicContact CE1-CB 3.76Å; F41-K75 HydrophobicContact CE1-CD 3.88Å; F41-K75 HydrophobicContact CE1-CG 4.41Å; F41-K75 HydrophobicContact CE2-CB 4.4Å; F41-K75 HydrophobicContact CG-CB 4.3Å; F41-K75 HydrophobicContact CG-CD 3.79Å; F41-K75 HydrophobicContact CZ-CB 4.03Å; F41-L78 HydrophobicContact CE1-CB 3.86Å; F41-L78 HydrophobicContact CE1-CD1 4.19Å; F41-L78 HydrophobicContact CZ-CB 3.78Å; F41-L79 HydrophobicContact CE2-CB 3.74Å; F41-L79 HydrophobicContact CE2-CD1 4.01Å; F41-L79 HydrophobicContact CE2-CG 4.33Å; F41-L79 HydrophobicContact CZ-CB 4.09Å
42D95.3Very high94.8Very high37 Ų3745.6 Ų45.620%0.19824%0.24CC..Hα-helixtrans-63-36.9-179.2-68.8-28.9000112.5Y14 I18 N38 I39 Q40 Y45 K46 K75Y14-D42 PolarHBondContact OH-OD2 3.32Å; I18-D42 HydrophobicContact CD1-CB 4.28Å; N38-D42 VanDerWaalsContact O-CG 3.26Å; N38-D42 PolarHBondContact O-N 3.42Å; N38-D42 VanDerWaalsContact O-OD2 3.06Å; I39-D42 PolarHBondContact O-N 3.1Å; I39-D42 VanDerWaalsContact O-N 3.14Å; Q40-D42 VanDerWaalsContact C-N 3.34Å; Q40-D42 PolarHBondContact O-N 3.3Å; D42-Y45 PolarHBondContact O-N 2.72Å; D42-K46 WeakPolarHBondContact O-CB 3.2Å; D42-K46 PolarHBondContact O-N 3.49Å; D42-K75 IonicContact OD1-NZ 3.9Å; D42-K75 PolarHBondContact OD1-NZ 3.26Å; D42-K75 IonicContact OD2-NZ 3.56Å; D42-K75 PolarHBondContact OD2-NZ 3.48Å
43V96.3Very high94.9Very high0 Ų047 Ų470%025%0.247CC..Hα-helixtrans-61.9-45.1171.6175.70000111I18 V21 V22 I32 L35 I39 Q40 F41 K46 L47I18-V43 HydrophobicContact CD1-CG2 3.7Å; I18-V43 HydrophobicContact CG2-CG2 4.34Å; V21-V43 HydrophobicContact CG1-CG1 4.18Å; V21-V43 HydrophobicContact CG1-CG2 4.13Å; V22-V43 HydrophobicContact CG2-CG1 3.81Å; I32-V43 HydrophobicContact CD1-CG1 3.81Å; I32-V43 HydrophobicContact CG1-CG1 4.12Å; I32-V43 HydrophobicContact CG2-CB 4.36Å; I32-V43 HydrophobicContact CG2-CG1 3.96Å; L35-V43 HydrophobicContact CD1-CG2 4.2Å; I39-V43 WeakPolarHBondContact O-CG2 3.45Å; I39-V43 PolarHBondContact O-N 3.25Å; Q40-V43 PolarHBondContact O-N 2.93Å; F41-V43 VanDerWaalsContact C-N 3.31Å; F41-V43 PolarHBondContact O-N 3.14Å; V43-K46 PolarHBondContact O-N 2.49Å; V43-L47 PolarHBondContact O-N 3.36Å
44Y96.9Very high94.9Very high1 Ų147.7 Ų47.70%0.00426%0.263CS..Hα-helixtrans-68.2-38178.1-65.7-22.7000113I32 Q40 F41 K46 L47 Y48 L56 E59 F60 V65 V69I32-Y44 HydrophobicContact CG2-CD1 4.47Å; I32-Y44 HydrophobicContact CG2-CE1 3.72Å; Q40-Y44 HydrophobicContact CG-CD2 4.04Å; Q40-Y44 HydrophobicContact CG-CE2 3.45Å; Q40-Y44 VanDerWaalsContact CG-CE2 3.45Å; Q40-Y44 PolarHBondContact NE2-OH 3.06Å; Q40-Y44 WeakPolarHBondContact O-CD2 3.46Å; Q40-Y44 PolarHBondContact O-N 3.3Å; Q40-Y44 VanDerWaalsContact O-N 3.1Å; F41-Y44 CarbonylContact O-C 3.51Å; F41-Y44 PolarHBondContact O-N 3.26Å; F41-Y44 VanDerWaalsContact O-N 3.07Å; Y44-K46 VanDerWaalsContact C-N 3.33Å; Y44-L47 HydrophobicContact CD1-CD1 4.04Å; Y44-L47 WeakPolarHBondContact O-CB 3.15Å; Y44-L47 PolarHBondContact O-N 3.15Å; Y44-Y48 PolarHBondContact O-N 3.34Å; Y44-Y48 VanDerWaalsContact O-N 3.08Å; Y44-L56 HydrophobicContact CG-CD1 4.19Å; Y44-E59 HydrophobicContact CD1-CG 4.44Å; Y44-E59 HydrophobicContact CE1-CB 4.02Å; Y44-E59 HydrophobicContact CE1-CG 3.67Å; Y44-E59 PolarHBondContact OH-OE2 2.82Å; Y44-F60 AromaticContact CD2-CE1 3.84Å; Y44-F60 HydrophobicContact CD2-CE1 3.84Å; Y44-F60 HydrophobicContact CG-CE1 4.15Å; Y44-V65 HydrophobicContact CE2-CG1 3.66Å; Y44-V65 VanDerWaalsContact OH-CG1 3.23Å; Y44-V65 WeakPolarHBondContact OH-CG1 3.42Å; Y44-V69 HydrophobicContact CD2-CG2 3.67Å; Y44-V69 HydrophobicContact CE2-CG2 3.72Å
45Y95.8Very high95Very high47 Ų4745.8 Ų45.818%0.18424%0.244CC..Hα-helixtrans-64.9-40174-169.5-104.6000110.9F41 D42 Y48 Q49 L78 C82F41-Y45 HydrophobicContact CE1-CD2 4.06Å; F41-Y45 HydrophobicContact CE1-CG 4.18Å; F41-Y45 HydrophobicContact CZ-CD2 4.38Å; F41-Y45 WeakPolarHBondContact O-CB 3.46Å; F41-Y45 PolarHBondContact O-N 3.38Å; D42-Y45 PolarHBondContact O-N 2.72Å; Y45-Y48 HydrophobicContact CD2-CD1 4.27Å; Y45-Y48 AromaticContact CE2-CD1 3.95Å; Y45-Y48 HydrophobicContact CE2-CD1 3.95Å; Y45-Y48 HydrophobicContact CE2-CE1 4.27Å; Y45-Y48 WeakPolarHBondContact O-CA 3.29Å; Y45-Y48 VanDerWaalsContact O-CB 3.3Å; Y45-Y48 WeakPolarHBondContact O-CB 3.46Å; Y45-Y48 PolarHBondContact O-N 3.49Å; Y45-Y48 VanDerWaalsContact O-N 3.16Å; Y45-Q49 HydrophobicContact CD1-CG 4.07Å; Y45-Q49 HydrophobicContact CE1-CG 3.82Å; Y45-Q49 VanDerWaalsContact CE1-NE2 3.34Å; Y45-Q49 WeakPolarHBondContact O-CG 3.43Å; Y45-Q49 PolarHBondContact O-N 2.6Å; Y45-L78 HydrophobicContact CD2-CB 3.99Å; Y45-L78 HydrophobicContact CD2-CD1 4.45Å; Y45-L78 HydrophobicContact CE2-CB 3.79Å; Y45-L78 HydrophobicContact CE2-CD1 4.32Å; Y45-L78 HydrophobicContact CE2-CD2 3.95Å; Y45-L78 HydrophobicContact CE2-CG 4.23Å; Y45-C82 WeakPolarHBondContact CD2-SG 3.42Å; Y45-C82 WeakPolarHBondContact CE2-SG 3.3Å
46K95.8Very high95.2Very high30 Ų3043.4 Ų43.413%0.1323%0.232CC..Hα-helixtrans-66.6-35.6174.3-169.776.5174.6-162.60112.3E11 I18 S19 V22 D42 V43 Y44 Y48 Q49 Q50E11-K46 IonicContact OE1-NZ 2.86Å; E11-K46 PolarHBondContact OE1-NZ 3.29Å; I18-K46 HydrophobicContact CG2-CB 3.67Å; I18-K46 HydrophobicContact CG2-CG 3.97Å; S19-K46 WeakPolarHBondContact OG-CE 3.2Å; S19-K46 PolarHBondContact OG-NZ 3.3Å; V22-K46 HydrophobicContact CG2-CB 3.98Å; V22-K46 HydrophobicContact CG2-CG 4.05Å; D42-K46 WeakPolarHBondContact O-CB 3.2Å; D42-K46 PolarHBondContact O-N 3.49Å; V43-K46 PolarHBondContact O-N 2.49Å; Y44-K46 VanDerWaalsContact C-N 3.33Å; K46-Y48 VanDerWaalsContact C-N 3.3Å; K46-Y48 PolarHBondContact O-N 3.34Å; K46-Q49 PolarHBondContact O-N 3.49Å; K46-Q50 WeakPolarHBondContact O-CG 3.32Å; K46-Q50 PolarHBondContact O-N 2.82Å
47L96.3Very high95.4Very high0 Ų040 Ų400%021%0.211CC..Hα-helixtrans-57.6-44.5169.3-75.7169.8000111.4V22 Y25 V43 Y44 Q50 G51 R52 L56V22-L47 HydrophobicContact CG1-CD2 3.67Å; V22-L47 HydrophobicContact CG1-CG 4.21Å; V22-L47 HydrophobicContact CG2-CG 4.36Å; Y25-L47 HydrophobicContact CD2-CD1 3.9Å; Y25-L47 HydrophobicContact CD2-CD2 4.16Å; Y25-L47 HydrophobicContact CD2-CG 4.47Å; Y25-L47 HydrophobicContact CE2-CD1 3.64Å; Y25-L47 HydrophobicContact CG-CD2 4.29Å; V43-L47 PolarHBondContact O-N 3.36Å; Y44-L47 HydrophobicContact CD1-CD1 4.04Å; Y44-L47 WeakPolarHBondContact O-CB 3.15Å; Y44-L47 PolarHBondContact O-N 3.15Å; L47-Q50 PolarHBondContact O-N 2.7Å; L47-G51 PolarHBondContact O-N 2.6Å; L47-R52 HydrophobicContact CB-CB 4.38Å; L47-R52 HydrophobicContact CD2-CB 3.89Å; L47-R52 WeakPolarHBondContact O-CB 3.36Å; L47-R52 PolarHBondContact O-N 3.09Å; L47-L56 HydrophobicContact CB-CB 4.36Å
48Y95.5Very high95.5Very high53 Ų5338.5 Ų38.521%0.20821%0.212CC..Hα-helixtrans-60-50.3174.2159.8-101.3000111.7Y44 Y45 K46 Q50 G51 L53 H81 C82 A85Y44-Y48 PolarHBondContact O-N 3.34Å; Y44-Y48 VanDerWaalsContact O-N 3.08Å; Y45-Y48 HydrophobicContact CD2-CD1 4.27Å; Y45-Y48 AromaticContact CE2-CD1 3.95Å; Y45-Y48 HydrophobicContact CE2-CD1 3.95Å; Y45-Y48 HydrophobicContact CE2-CE1 4.27Å; Y45-Y48 WeakPolarHBondContact O-CA 3.29Å; Y45-Y48 VanDerWaalsContact O-CB 3.3Å; Y45-Y48 WeakPolarHBondContact O-CB 3.46Å; Y45-Y48 PolarHBondContact O-N 3.49Å; Y45-Y48 VanDerWaalsContact O-N 3.16Å; K46-Y48 VanDerWaalsContact C-N 3.3Å; K46-Y48 PolarHBondContact O-N 3.34Å; Y48-Q50 PolarHBondContact O-N 3.22Å; Y48-G51 WeakPolarHBondContact O-CA 3.03Å; Y48-G51 PolarHBondContact O-N 3.2Å; Y48-L53 HydrophobicContact CD2-CD2 3.96Å; Y48-H81 AromaticContact CE1-CD2 3.92Å; Y48-H81 AromaticContact CZ-CD2 3.58Å; Y48-H81 AromaticContact CZ-NE2 3.9Å; Y48-H81 PolarHBondContact OH-CD2 2.76Å; Y48-H81 PolarHBondContact OH-NE2 2.63Å; Y48-C82 WeakPolarHBondContact CD1-SG 3.45Å; Y48-C82 HydrophobicContact CD2-CB 4.4Å; Y48-C82 HydrophobicContact CG-CB 4.18Å; Y48-A85 HydrophobicContact CD2-CB 3.85Å; Y48-A85 HydrophobicContact CE2-CB 3.43Å; Y48-A85 VanDerWaalsContact CE2-CB 3.43Å
49Q94.4Very high95.7Very high109 Ų10935.3 Ų35.351%0.50920%0.195SC..Hα-helixtrans-59.3-32.3-180-71.2-177.3-45.400112.9Y45 K46 G51Y45-Q49 HydrophobicContact CD1-CG 4.07Å; Y45-Q49 HydrophobicContact CE1-CG 3.82Å; Y45-Q49 VanDerWaalsContact CE1-NE2 3.34Å; Y45-Q49 WeakPolarHBondContact O-CG 3.43Å; Y45-Q49 PolarHBondContact O-N 2.6Å; K46-Q49 PolarHBondContact O-N 3.49Å; Q49-G51 VanDerWaalsContact C-N 3.27Å; Q49-G51 PolarHBondContact O-N 2.75Å
50Q94.8Very high95.9Very high73 Ų7332.5 Ų32.534%0.34118%0.18SC..THydrogen-bonded Turntrans-83.55.7174.6-68.3-174.2-8.500113.7D23 K46 L47 Y48 R52D23-Q50 PolarHBondContact OD1-NE2 3.26Å; K46-Q50 WeakPolarHBondContact O-CG 3.32Å; K46-Q50 PolarHBondContact O-N 2.82Å; L47-Q50 PolarHBondContact O-N 2.7Å; Y48-Q50 PolarHBondContact O-N 3.22Å; Q50-R52 VanDerWaalsContact C-N 3.28Å; Q50-R52 HydrophobicContact CB-CG 3.99Å; Q50-R52 PolarHBondContact O-N 3.27Å; Q50-R52 VanDerWaalsContact OE1-CD 3.26Å
51G94.7Very high96.1Very high53 Ų5333.8 Ų33.855%0.54619%0.189SC..THydrogen-bonded Turntrans71.216.3-179.700000114.7L47 Y48 Q49 L53L47-G51 PolarHBondContact O-N 2.6Å; Y48-G51 WeakPolarHBondContact O-CA 3.03Å; Y48-G51 PolarHBondContact O-N 3.2Å; Q49-G51 VanDerWaalsContact C-N 3.27Å; Q49-G51 PolarHBondContact O-N 2.75Å; G51-L53 PolarHBondContact O-N 3.41Å
52R96.3Very high96.1Very high60 Ų6038.2 Ų38.223%0.22621%0.21CC..  trans-84.951.1-174.1-59.5178.565.7175.12.8112.2V22 L47 Q50 C54 Q55 L56V22-R52 VanDerWaalsContact CG1-NH1 3.34Å; V22-R52 PolarHBondContact O-NH1 3.46Å; L47-R52 HydrophobicContact CB-CB 4.38Å; L47-R52 HydrophobicContact CD2-CB 3.89Å; L47-R52 WeakPolarHBondContact O-CB 3.36Å; L47-R52 PolarHBondContact O-N 3.09Å; Q50-R52 VanDerWaalsContact C-N 3.28Å; Q50-R52 HydrophobicContact CB-CG 3.99Å; Q50-R52 PolarHBondContact O-N 3.27Å; Q50-R52 VanDerWaalsContact OE1-CD 3.26Å; R52-C54 PolarHBondContact O-N 3.26Å; R52-Q55 PolarHBondContact O-N 3.39Å; R52-L56 PolarHBondContact O-N 2.69Å
53L95.8Very high96.2Very high31 Ų3137.2 Ų37.216%0.16221%0.205CC..Hα-helixtrans-63.2-33.5-169.2-60.9-177.1000113.9Y48 G51 Q55 L56 G57 A85 L86 H89Y48-L53 HydrophobicContact CD2-CD2 3.96Å; G51-L53 PolarHBondContact O-N 3.41Å; L53-Q55 PolarHBondContact O-N 3.33Å; L53-L56 PolarHBondContact O-N 3.31Å; L53-G57 PolarHBondContact O-N 2.96Å; L53-A85 HydrophobicContact CD2-CB 4.42Å; L53-L86 HydrophobicContact CB-CD2 4.09Å; L53-L86 HydrophobicContact CD2-CD2 4.22Å; L53-L86 VanDerWaalsContact O-CD2 3.24Å; L53-L86 WeakPolarHBondContact O-CD2 3.45Å; L53-H89 HydrophobicContact CD1-CB 3.89Å
54C95.1Very high96.2Very high96 Ų9642.7 Ų42.765%0.64923%0.23SC*.Hα-helixtrans-63-40.8176.9-63.80000112.6R52 G58R52-C54 PolarHBondContact O-N 3.26Å; C54-G58 PolarHBondContact O-N 2.98Å
55Q95.8Very high96.1Very high52 Ų5243.1 Ų43.124%0.24323%0.233CC..Hα-helixtrans-73.3-42.4179.9-69.6174.5-46.900111.2Y25 R52 L53 G58 E59Y25-Q55 HydrophobicContact CD1-CB 4.31Å; Y25-Q55 HydrophobicContact CD1-CG 4.27Å; Y25-Q55 HydrophobicContact CE1-CB 3.92Å; Y25-Q55 HydrophobicContact CE1-CG 4.16Å; R52-Q55 PolarHBondContact O-N 3.39Å; L53-Q55 PolarHBondContact O-N 3.33Å; Q55-G58 PolarHBondContact O-N 3.12Å; Q55-E59 PolarHBondContact O-N 3.45Å
56L97.3Very high96.2Very high0 Ų040.9 Ų40.90%022%0.224CC..Hα-helixtrans-61.1-45.6174.4-178.964.1000111.6Y44 L47 R52 L53 G58 E59 F60 C82 L86Y44-L56 HydrophobicContact CG-CD1 4.19Å; L47-L56 HydrophobicContact CB-CB 4.36Å; R52-L56 PolarHBondContact O-N 2.69Å; L53-L56 PolarHBondContact O-N 3.31Å; L56-G58 VanDerWaalsContact C-N 3.29Å; L56-G58 PolarHBondContact O-N 3.12Å; L56-E59 PolarHBondContact O-N 3.49Å; L56-F60 HydrophobicContact CD1-CD1 3.82Å; L56-F60 HydrophobicContact CD1-CE1 3.48Å; L56-F60 VanDerWaalsContact CD1-CE1 3.48Å; L56-F60 HydrophobicContact CD1-CE2 4.35Å; L56-F60 HydrophobicContact CD1-CG 4.4Å; L56-F60 HydrophobicContact CD1-CZ 3.78Å; L56-F60 HydrophobicContact CG-CD1 4.43Å; L56-F60 HydrophobicContact CG-CE1 4.4Å; L56-F60 HydrophobicContact CG-CZ 4.47Å; L56-F60 PolarHBondContact O-N 3.47Å; L56-C82 HydrophobicContact CD2-CB 4.41Å; L56-L86 HydrophobicContact CB-CD2 4.2Å; L56-L86 HydrophobicContact CD2-CD1 4.24Å; L56-L86 HydrophobicContact CD2-CD2 4.13Å; L56-L86 HydrophobicContact CD2-CG 4.27Å; L56-L86 HydrophobicContact CG-CD1 4.06Å; L56-L86 HydrophobicContact CG-CD2 4.16Å; L56-L86 HydrophobicContact CG-CG 4.46Å
57G97.1Very high96.2Very high3 Ų339.8 Ų39.83%0.03122%0.221CC..Hα-helixtrans-59.5-38.8175.600000112.5L53 E59 F60 C61L53-G57 PolarHBondContact O-N 2.96Å; G57-E59 VanDerWaalsContact C-N 3.27Å; G57-E59 PolarHBondContact O-N 3.22Å; G57-F60 PolarHBondContact O-N 2.93Å; G57-C61 WeakPolarHBondContact O-CB 3.34Å; G57-C61 PolarHBondContact O-N 2.83Å; G57-C61 PolarHBondContact O-SG 3.34Å
58G96.2Very high96.1Very high32 Ų3241.3 Ų41.333%0.3323%0.227SC..Hα-helixtrans-62.3-29.6172.900000114.2C54 Q55 L56C54-G58 PolarHBondContact O-N 2.98Å; Q55-G58 PolarHBondContact O-N 3.12Å; L56-G58 VanDerWaalsContact C-N 3.29Å; L56-G58 PolarHBondContact O-N 3.12Å
59E96.9Very high96.1Very high1 Ų138.8 Ų38.81%0.00522%0.218CC..Hα-helixtrans-82-43.6173.2-65.8-58117.600112.2Y25 R29 R33 Y44 Q55 L56 G57 C61 E62 V65Y25-E59 WeakPolarHBondContact OH-CG 3.25Å; Y25-E59 PolarHBondContact OH-OE1 2.89Å; R29-E59 IonicContact CZ-OE1 3.84Å; R29-E59 IonicContact NE-OE1 3.83Å; R29-E59 PolarHBondContact NE-OE1 2.94Å; R29-E59 IonicContact NH2-OE1 2.97Å; R29-E59 PolarHBondContact NH2-OE1 2.62Å; R33-E59 IonicContact CZ-OE1 3.26Å; R33-E59 IonicContact CZ-OE2 3.53Å; R33-E59 IonicContact NE-OE1 2.63Å; R33-E59 IonicContact NE-OE2 2.84Å; R33-E59 PolarHBondContact NE-OE2 3.36Å; R33-E59 IonicContact NH2-OE1 3.24Å; R33-E59 PolarHBondContact NH2-OE1 2.95Å; R33-E59 IonicContact NH2-OE2 3.19Å; R33-E59 PolarHBondContact NH2-OE2 2.91Å; Y44-E59 HydrophobicContact CD1-CG 4.44Å; Y44-E59 HydrophobicContact CE1-CB 4.02Å; Y44-E59 HydrophobicContact CE1-CG 3.67Å; Y44-E59 PolarHBondContact OH-OE2 2.82Å; Q55-E59 PolarHBondContact O-N 3.45Å; L56-E59 PolarHBondContact O-N 3.49Å; G57-E59 VanDerWaalsContact C-N 3.27Å; G57-E59 PolarHBondContact O-N 3.22Å; E59-C61 VanDerWaalsContact C-N 3.25Å; E59-C61 PolarHBondContact O-N 2.92Å; E59-E62 WeakPolarHBondContact O-CB 3.32Å; E59-E62 PolarHBondContact O-N 3.4Å; E59-V65 HydrophobicContact CB-CG1 4.15Å
60F97.5Very high96.1Very high1 Ų134.5 Ų34.50%0.00420%0.198CC..Hα-helixtrans-71.1-21.6-175.8-82.123.5000112.9Y44 L56 G57 E62 F66 V69 L79 C82 L86 V93 L97Y44-F60 AromaticContact CD2-CE1 3.84Å; Y44-F60 HydrophobicContact CD2-CE1 3.84Å; Y44-F60 HydrophobicContact CG-CE1 4.15Å; L56-F60 HydrophobicContact CD1-CD1 3.82Å; L56-F60 HydrophobicContact CD1-CE1 3.48Å; L56-F60 VanDerWaalsContact CD1-CE1 3.48Å; L56-F60 HydrophobicContact CD1-CE2 4.35Å; L56-F60 HydrophobicContact CD1-CG 4.4Å; L56-F60 HydrophobicContact CD1-CZ 3.78Å; L56-F60 HydrophobicContact CG-CD1 4.43Å; L56-F60 HydrophobicContact CG-CE1 4.4Å; L56-F60 HydrophobicContact CG-CZ 4.47Å; L56-F60 PolarHBondContact O-N 3.47Å; G57-F60 PolarHBondContact O-N 2.93Å; F60-E62 VanDerWaalsContact C-N 3.27Å; F60-E62 PolarHBondContact O-N 3.04Å; F60-F66 HydrophobicContact CB-CD2 3.97Å; F60-F66 HydrophobicContact CB-CE2 4.24Å; F60-F66 HydrophobicContact CD1-CD2 4.31Å; F60-F66 HydrophobicContact CD2-CD2 4.15Å; F60-F66 AromaticContact CD2-CE2 3.71Å; F60-F66 HydrophobicContact CD2-CE2 3.71Å; F60-F66 HydrophobicContact CE2-CE2 4.17Å; F60-F66 AromaticContact CG-CD2 3.9Å; F60-F66 HydrophobicContact CG-CD2 3.9Å; F60-F66 AromaticContact CG-CE2 3.95Å; F60-F66 HydrophobicContact CG-CE2 3.95Å; F60-V69 HydrophobicContact CE1-CG1 4.32Å; F60-V69 HydrophobicContact CE1-CG2 4.16Å; F60-V69 HydrophobicContact CZ-CG1 4.21Å; F60-L79 HydrophobicContact CE2-CD1 3.62Å; F60-L79 HydrophobicContact CZ-CD1 3.79Å; F60-C82 HydrophobicContact CE2-CB 4.43Å; F60-L86 HydrophobicContact CB-CD1 3.91Å; F60-L86 HydrophobicContact CD2-CD1 3.41Å; F60-L86 VanDerWaalsContact CD2-CD1 3.41Å; F60-L86 HydrophobicContact CE2-CD1 4.18Å; F60-L86 HydrophobicContact CG-CD1 3.89Å; F60-V93 HydrophobicContact CB-CG1 3.95Å; F60-L97 WeakPolarHBondContact O-CD2 3.48Å
61C97.9Very high96.1Very high28 Ų2837.6 Ų37.619%0.18921%0.206CC..THydrogen-bonded Turntrans-73.6-15171.1-77.30000113.8G57 E59 V96G57-C61 WeakPolarHBondContact O-CB 3.34Å; G57-C61 PolarHBondContact O-N 2.83Å; G57-C61 PolarHBondContact O-SG 3.34Å; E59-C61 VanDerWaalsContact C-N 3.25Å; E59-C61 PolarHBondContact O-N 2.92Å; C61-V96 HydrophobicContact CB-CG1 3.88Å
62E97.3Very high95.9Very high95 Ų9535.2 Ų35.244%0.44418%0.182SC..SBendtrans-85.6115.2178.6-66.8-69.1163.600110.3E59 F60 E64 V65 F66E59-E62 WeakPolarHBondContact O-CB 3.32Å; E59-E62 PolarHBondContact O-N 3.4Å; F60-E62 VanDerWaalsContact C-N 3.27Å; F60-E62 PolarHBondContact O-N 3.04Å; E62-E64 VanDerWaalsContact C-N 3.32Å; E62-E64 PolarHBondContact O-N 3.44Å; E62-V65 HydrophobicContact CB-CB 3.94Å; E62-V65 HydrophobicContact CB-CG2 3.76Å; E62-V65 PolarHBondContact O-N 3.22Å; E62-V65 VanDerWaalsContact O-N 3.08Å; E62-F66 PolarHBondContact O-N 2.88Å
63L96.9Very high95.1Very high17 Ų1736.9 Ų36.99%0.08920%0.202CC..Hα-helixtrans-55.9-42.5-171.4-172.765.5000113.4A67 L97 F101 F122 L126L63-A67 VanDerWaalsContact O-CB 3.3Å; L63-A67 WeakPolarHBondContact O-CB 3.34Å; L63-A67 PolarHBondContact O-N 3.35Å; L63-L97 HydrophobicContact CB-CD2 4.48Å; L63-L97 HydrophobicContact CD1-CD2 4Å; L63-F101 HydrophobicContact CD1-CB 4.21Å; L63-F101 HydrophobicContact CD2-CB 4.27Å; L63-F122 HydrophobicContact CD1-CE1 3.74Å; L63-F122 HydrophobicContact CD1-CZ 3.73Å; L63-F122 HydrophobicContact CD2-CE1 4.12Å; L63-F122 HydrophobicContact CG-CE1 3.84Å; L63-F122 HydrophobicContact CG-CZ 4.06Å; L63-L126 HydrophobicContact CD1-CD2 3.82Å
64E95.2Very high94.5Very high114 Ų11440.1 Ų40.153%0.53322%0.22SC..Hα-helixtrans-70.9-35.7-179.9-63.2-60.5160.600112.7E62 K68 R104E62-E64 VanDerWaalsContact C-N 3.32Å; E62-E64 PolarHBondContact O-N 3.44Å; E64-K68 PolarHBondContact O-N 2.87Å; E64-R104 IonicContact OE1-CZ 3.87Å; E64-R104 VanDerWaalsContact OE1-CZ 3.24Å; E64-R104 IonicContact OE1-NH1 2.76Å; E64-R104 PolarHBondContact OE1-NH1 3.44Å; E64-R104 IonicContact OE1-NH2 2.8Å; E64-R104 PolarHBondContact OE1-NH2 3.33Å
65V96.1Very high94.1Very high10 Ų1036.6 Ų36.66%0.06119%0.194CC..Hα-helixtrans-67.2-47.3175.8176.10000109.1R33 Y44 E59 E62 A67 K68 V69R33-V65 HydrophobicContact CG-CG2 4.31Å; Y44-V65 HydrophobicContact CE2-CG1 3.66Å; Y44-V65 VanDerWaalsContact OH-CG1 3.23Å; Y44-V65 WeakPolarHBondContact OH-CG1 3.42Å; E59-V65 HydrophobicContact CB-CG1 4.15Å; E62-V65 HydrophobicContact CB-CB 3.94Å; E62-V65 HydrophobicContact CB-CG2 3.76Å; E62-V65 PolarHBondContact O-N 3.22Å; E62-V65 VanDerWaalsContact O-N 3.08Å; V65-A67 VanDerWaalsContact C-N 3.33Å; V65-A67 PolarHBondContact O-N 3.13Å; V65-K68 WeakPolarHBondContact O-CB 2.93Å; V65-K68 PolarHBondContact O-N 3.43Å; V65-K68 VanDerWaalsContact O-N 3.1Å; V65-V69 WeakPolarHBondContact O-CG2 3.18Å; V65-V69 PolarHBondContact O-N 3.34Å
66F97.1Very high93.7Very high0 Ų037.9 Ų37.90%020%0.196CC..Hα-helixtrans-64.9-37.4178.8-157.8-97.7000112.2F60 E62 K68 V69 L70 L79 F83 L97 L126 F129F60-F66 HydrophobicContact CB-CD2 3.97Å; F60-F66 HydrophobicContact CB-CE2 4.24Å; F60-F66 HydrophobicContact CD1-CD2 4.31Å; F60-F66 HydrophobicContact CD2-CD2 4.15Å; F60-F66 AromaticContact CD2-CE2 3.71Å; F60-F66 HydrophobicContact CD2-CE2 3.71Å; F60-F66 HydrophobicContact CE2-CE2 4.17Å; F60-F66 AromaticContact CG-CD2 3.9Å; F60-F66 HydrophobicContact CG-CD2 3.9Å; F60-F66 AromaticContact CG-CE2 3.95Å; F60-F66 HydrophobicContact CG-CE2 3.95Å; E62-F66 PolarHBondContact O-N 2.88Å; F66-K68 PolarHBondContact O-N 3.48Å; F66-V69 WeakPolarHBondContact O-CB 3.28Å; F66-V69 PolarHBondContact O-N 3.5Å; F66-L70 HydrophobicContact CD1-CD1 3.71Å; F66-L70 HydrophobicContact CD1-CD2 4.43Å; F66-L70 HydrophobicContact CD1-CG 3.89Å; F66-L70 HydrophobicContact CE1-CD1 3.84Å; F66-L70 HydrophobicContact CE1-CD2 3.84Å; F66-L70 HydrophobicContact CE1-CG 3.81Å; F66-L70 HydrophobicContact CZ-CD2 4.48Å; F66-L70 WeakPolarHBondContact O-CG 2.88Å; F66-L70 PolarHBondContact O-N 2.91Å; F66-L79 HydrophobicContact CE2-CD1 4.2Å; F66-L79 HydrophobicContact CZ-CD1 4.38Å; F66-F83 HydrophobicContact CE2-CD2 4.12Å; F66-F83 AromaticContact CZ-CD2 3.95Å; F66-F83 HydrophobicContact CZ-CD2 3.95Å; F66-F83 HydrophobicContact CZ-CE2 4.21Å; F66-L97 HydrophobicContact CB-CD1 4.18Å; F66-L97 HydrophobicContact CB-CD2 3.86Å; F66-L97 HydrophobicContact CD1-CD1 3.42Å; F66-L97 VanDerWaalsContact CD1-CD1 3.42Å; F66-L97 HydrophobicContact CD1-CD2 4.47Å; F66-L97 HydrophobicContact CD2-CD1 3.95Å; F66-L97 HydrophobicContact CE1-CD1 3.68Å; F66-L97 HydrophobicContact CE2-CD1 4.19Å; F66-L97 HydrophobicContact CG-CD1 3.56Å; F66-L97 HydrophobicContact CG-CD2 4.19Å; F66-L97 HydrophobicContact CZ-CD1 4.06Å; F66-L126 HydrophobicContact CD1-CD1 4.01Å; F66-L126 HydrophobicContact CE1-CD1 4.13Å; F66-F129 AromaticContact CE1-CD1 3.85Å; F66-F129 HydrophobicContact CE1-CD1 3.85Å; F66-F129 AromaticContact CE1-CE1 3.97Å; F66-F129 HydrophobicContact CE1-CE1 3.97Å; F66-F129 AromaticContact CZ-CD1 3.91Å; F66-F129 HydrophobicContact CZ-CD1 3.91Å; F66-F129 AromaticContact CZ-CE1 3.53Å; F66-F129 HydrophobicContact CZ-CE1 3.53Å; F66-F129 HydrophobicContact CZ-CZ 4.08Å
67A95.7Very high93.1Very high8 Ų842.4 Ų42.47%0.06622%0.217CC..Hα-helixtrans-57.8-34.2173.200000112.9L63 V65 R71 F122L63-A67 VanDerWaalsContact O-CB 3.3Å; L63-A67 WeakPolarHBondContact O-CB 3.34Å; L63-A67 PolarHBondContact O-N 3.35Å; V65-A67 VanDerWaalsContact C-N 3.33Å; V65-A67 PolarHBondContact O-N 3.13Å; A67-R71 PolarHBondContact O-NH1 3.48Å; A67-F122 HydrophobicContact CB-CD2 4.11Å; A67-F122 HydrophobicContact CB-CE2 3.33Å; A67-F122 HydrophobicContact CB-CZ 3.58Å
68K95.2Very high92.8Very high31 Ų3144.3 Ų44.314%0.13523%0.226CC..Hα-helixtrans-75.9-42175.8-174165.5171.3179.80112.1R33 L35 E37 E64 V65 F66 L70 R71R33-K68 PolarHBondContact O-NZ 2.94Å; L35-K68 WeakPolarHBondContact O-CE 3.39Å; L35-K68 PolarHBondContact O-NZ 3.47Å; E37-K68 HydrophobicContact CG-CG 3.85Å; E64-K68 PolarHBondContact O-N 2.87Å; V65-K68 WeakPolarHBondContact O-CB 2.93Å; V65-K68 PolarHBondContact O-N 3.43Å; V65-K68 VanDerWaalsContact O-N 3.1Å; F66-K68 PolarHBondContact O-N 3.48Å; K68-L70 VanDerWaalsContact C-N 3.26Å; K68-L70 PolarHBondContact O-N 3.44Å; K68-R71 WeakPolarHBondContact O-CB 3.25Å; K68-R71 PolarHBondContact O-N 3.19Å
69V94.8Very high92.7Very high1 Ų143 Ų431%0.00621%0.212CC..Hα-helixtrans-56.6-40.3173.4165.40000111.7F41 Y44 F60 V65 F66 R71 A72 L79F41-V69 HydrophobicContact CD2-CG1 3.98Å; F41-V69 HydrophobicContact CE2-CG1 4.2Å; Y44-V69 HydrophobicContact CD2-CG2 3.67Å; Y44-V69 HydrophobicContact CE2-CG2 3.72Å; F60-V69 HydrophobicContact CE1-CG1 4.32Å; F60-V69 HydrophobicContact CE1-CG2 4.16Å; F60-V69 HydrophobicContact CZ-CG1 4.21Å; V65-V69 WeakPolarHBondContact O-CG2 3.18Å; V65-V69 PolarHBondContact O-N 3.34Å; F66-V69 WeakPolarHBondContact O-CB 3.28Å; F66-V69 PolarHBondContact O-N 3.5Å; V69-R71 PolarHBondContact O-N 2.89Å; V69-R71 VanDerWaalsContact O-N 3.17Å; V69-A72 PolarHBondContact O-N 3.33Å; V69-L79 HydrophobicContact CG1-CD1 3.45Å; V69-L79 VanDerWaalsContact CG1-CD1 3.45Å; V69-L79 HydrophobicContact CG1-CD2 3.79Å; V69-L79 HydrophobicContact CG1-CG 4.23Å
70L95.1Very high92.6Very high18 Ų1843.3 Ų43.39%0.09421%0.213CC..THydrogen-bonded Turntrans-64.2-17.3177.8-72.8170.7000114.5F66 K68 L79 F122 V125 L126 F129F66-L70 HydrophobicContact CD1-CD1 3.71Å; F66-L70 HydrophobicContact CD1-CD2 4.43Å; F66-L70 HydrophobicContact CD1-CG 3.89Å; F66-L70 HydrophobicContact CE1-CD1 3.84Å; F66-L70 HydrophobicContact CE1-CD2 3.84Å; F66-L70 HydrophobicContact CE1-CG 3.81Å; F66-L70 HydrophobicContact CZ-CD2 4.48Å; F66-L70 WeakPolarHBondContact O-CG 2.88Å; F66-L70 PolarHBondContact O-N 2.91Å; K68-L70 VanDerWaalsContact C-N 3.26Å; K68-L70 PolarHBondContact O-N 3.44Å; L70-L79 HydrophobicContact CD2-CD2 3.87Å; L70-F122 HydrophobicContact CD1-CE2 4.4Å; L70-V125 HydrophobicContact CB-CG1 4.11Å; L70-V125 HydrophobicContact CD1-CG1 4.22Å; L70-L126 HydrophobicContact CD1-CB 4.41Å; L70-L126 HydrophobicContact CD1-CD1 4.16Å; L70-F129 HydrophobicContact CD2-CB 3.6Å; L70-F129 HydrophobicContact CD2-CD1 4.13Å; L70-F129 HydrophobicContact CD2-CD2 3.7Å; L70-F129 HydrophobicContact CD2-CE2 4.46Å; L70-F129 HydrophobicContact CD2-CG 3.5Å
71R93.7Very high92.3Very high138 Ų13845.9 Ų45.952%0.52123%0.225SC..THydrogen-bonded Turntrans-82.9-12.5177.6-66.5-168-63.6-92.812.3113.6E37 A67 K68 V69 S73E37-R71 HydrophobicContact CG-CB 3.77Å; E37-R71 IonicContact OE1-CZ 2.81Å; E37-R71 IonicContact OE1-NE 3.47Å; E37-R71 PolarHBondContact OE1-NE 2.93Å; E37-R71 IonicContact OE1-NH2 2.72Å; E37-R71 PolarHBondContact OE1-NH2 3.01Å; A67-R71 PolarHBondContact O-NH1 3.48Å; K68-R71 WeakPolarHBondContact O-CB 3.25Å; K68-R71 PolarHBondContact O-N 3.19Å; V69-R71 PolarHBondContact O-N 2.89Å; V69-R71 VanDerWaalsContact O-N 3.17Å; R71-S73 PolarHBondContact O-N 2.96Å
72A90Very high92.1Very high3 Ų344.6 Ų44.63%0.02522%0.216CC..  trans-77.868.4171.200000110.4N38 F41 V69 D74 K75N38-A72 WeakPolarHBondContact OD1-CB 3.32Å; F41-A72 HydrophobicContact CB-CB 4.21Å; F41-A72 HydrophobicContact CD2-CB 4.42Å; F41-A72 HydrophobicContact CG-CB 4.41Å; V69-A72 PolarHBondContact O-N 3.33Å; A72-D74 VanDerWaalsContact C-N 3.34Å; A72-D74 PolarHBondContact O-N 3.35Å; A72-K75 HydrophobicContact CB-CB 4.36Å; A72-K75 HydrophobicContact CB-CD 4.42Å; A72-K75 HydrophobicContact CB-CG 4.46Å; A72-K75 PolarHBondContact O-N 3.4Å
73S80.8Confident92.1Very high95 Ų9540.1 Ų40.166%0.66420%0.196SC*.G310 helixtrans-64.3-32.3-166.553.70000114.4R71 K75 R76R71-S73 PolarHBondContact O-N 2.96Å; S73-K75 PolarHBondContact O-N 2.87Å; S73-R76 WeakPolarHBondContact O-CB 3.32Å; S73-R76 PolarHBondContact O-N 3.37Å
74D83.1Confident92Very high100 Ų10039.5 Ų39.554%0.53519%0.192SC..G310 helixtrans-67.3-19.1175.160.7-43000112.9A72A72-D74 VanDerWaalsContact C-N 3.34Å; A72-D74 PolarHBondContact O-N 3.35Å
75K86.4Confident92Very high21 Ų2135 Ų359%0.09117%0.174CC..G310 helixtrans-102.811.2-178-51.8-171.2-174.6-173.10113.5N38 F41 D42 A72 S73 H77 L78 L79N38-K75 PolarHBondContact O-NZ 3.45Å; F41-K75 HydrophobicContact CB-CD 4.12Å; F41-K75 HydrophobicContact CD1-CB 3.91Å; F41-K75 HydrophobicContact CD1-CD 3.28Å; F41-K75 HydrophobicContact CD1-CG 4.2Å; F41-K75 HydrophobicContact CE1-CB 3.76Å; F41-K75 HydrophobicContact CE1-CD 3.88Å; F41-K75 HydrophobicContact CE1-CG 4.41Å; F41-K75 HydrophobicContact CE2-CB 4.4Å; F41-K75 HydrophobicContact CG-CB 4.3Å; F41-K75 HydrophobicContact CG-CD 3.79Å; F41-K75 HydrophobicContact CZ-CB 4.03Å; D42-K75 IonicContact OD1-NZ 3.9Å; D42-K75 PolarHBondContact OD1-NZ 3.26Å; D42-K75 IonicContact OD2-NZ 3.56Å; D42-K75 PolarHBondContact OD2-NZ 3.48Å; A72-K75 HydrophobicContact CB-CB 4.36Å; A72-K75 HydrophobicContact CB-CD 4.42Å; A72-K75 HydrophobicContact CB-CG 4.46Å; A72-K75 PolarHBondContact O-N 3.4Å; S73-K75 PolarHBondContact O-N 2.87Å; K75-H77 VanDerWaalsContact C-N 3.29Å; K75-H77 PolarHBondContact O-N 3.4Å; K75-L78 WeakPolarHBondContact O-CB 3.16Å; K75-L78 PolarHBondContact O-N 3.45Å; K75-L79 PolarHBondContact O-N 2.9Å
76R87.8Confident92Very high79 Ų7934.5 Ų34.530%0.29817%0.171SC..Hα-helixtrans-57.2-38.1-174.3-169.3174-173.6129.6-3.7113.8S73 L79 H80 D132S73-R76 WeakPolarHBondContact O-CB 3.32Å; S73-R76 PolarHBondContact O-N 3.37Å; R76-L79 WeakPolarHBondContact O-CB 3.35Å; R76-L79 PolarHBondContact O-N 3.05Å; R76-H80 PolarHBondContact O-CD2 3.3Å; R76-H80 PolarHBondContact O-N 3.22Å; R76-D132 IonicContact CZ-OD2 3.05Å; R76-D132 IonicContact NE-OD2 2.7Å; R76-D132 IonicContact NH2-OD2 2.88Å; R76-D132 PolarHBondContact NH2-OD2 3.41Å
77H84.5Confident91.9Very high96 Ų9635.6 Ų35.644%0.44418%0.177SC..Hα-helixtrans-64.8-40.6176.766.1-78.9000112.2K75 L79 H80 H81K75-H77 VanDerWaalsContact C-N 3.29Å; K75-H77 PolarHBondContact O-N 3.4Å; H77-L79 VanDerWaalsContact C-N 3.33Å; H77-H80 PolarHBondContact O-N 3.07Å; H77-H81 PolarHBondContact O-N 3.13Å
78L90.5Very high91.7Very high42 Ų4238.3 Ų38.322%0.2219%0.19CC..Hα-helixtrans-65.9-37.6173.3-57.8-179.5000111.3F41 Y45 K75 H81 C82F41-L78 HydrophobicContact CE1-CB 3.86Å; F41-L78 HydrophobicContact CE1-CD1 4.19Å; F41-L78 HydrophobicContact CZ-CB 3.78Å; Y45-L78 HydrophobicContact CD2-CB 3.99Å; Y45-L78 HydrophobicContact CD2-CD1 4.45Å; Y45-L78 HydrophobicContact CE2-CB 3.79Å; Y45-L78 HydrophobicContact CE2-CD1 4.32Å; Y45-L78 HydrophobicContact CE2-CD2 3.95Å; Y45-L78 HydrophobicContact CE2-CG 4.23Å; K75-L78 WeakPolarHBondContact O-CB 3.16Å; K75-L78 PolarHBondContact O-N 3.45Å; L78-H81 PolarHBondContact O-N 2.85Å; L78-C82 PolarHBondContact O-N 3.06Å; L78-C82 PolarHBondContact O-SG 3.31Å; L78-C82 VanDerWaalsContact O-SG 3.38Å
79L94.3Very high91.7Very high4 Ų441.7 Ų41.72%0.02121%0.206CC..Hα-helixtrans-62.5-45.7177.1179.754.1000111.4F41 F60 F66 V69 L70 K75 R76 H77 H81 C82 F83 F129F41-L79 HydrophobicContact CE2-CB 3.74Å; F41-L79 HydrophobicContact CE2-CD1 4.01Å; F41-L79 HydrophobicContact CE2-CG 4.33Å; F41-L79 HydrophobicContact CZ-CB 4.09Å; F60-L79 HydrophobicContact CE2-CD1 3.62Å; F60-L79 HydrophobicContact CZ-CD1 3.79Å; F66-L79 HydrophobicContact CE2-CD1 4.2Å; F66-L79 HydrophobicContact CZ-CD1 4.38Å; V69-L79 HydrophobicContact CG1-CD1 3.45Å; V69-L79 VanDerWaalsContact CG1-CD1 3.45Å; V69-L79 HydrophobicContact CG1-CD2 3.79Å; V69-L79 HydrophobicContact CG1-CG 4.23Å; L70-L79 HydrophobicContact CD2-CD2 3.87Å; K75-L79 PolarHBondContact O-N 2.9Å; R76-L79 WeakPolarHBondContact O-CB 3.35Å; R76-L79 PolarHBondContact O-N 3.05Å; H77-L79 VanDerWaalsContact C-N 3.33Å; L79-H81 VanDerWaalsContact C-N 3.25Å; L79-H81 PolarHBondContact O-N 3.28Å; L79-C82 PolarHBondContact O-N 3.43Å; L79-F83 WeakPolarHBondContact O-CB 3.42Å; L79-F83 PolarHBondContact O-N 3.33Å; L79-F129 HydrophobicContact CB-CE2 4.33Å; L79-F129 HydrophobicContact CD1-CZ 4.47Å; L79-F129 HydrophobicContact CD2-CD2 4.07Å; L79-F129 HydrophobicContact CD2-CE2 3.57Å; L79-F129 HydrophobicContact CD2-CZ 4.04Å; L79-F129 HydrophobicContact CG-CE2 3.58Å; L79-F129 HydrophobicContact CG-CZ 3.75Å
80H94.3Very high91.6Very high8 Ų844.1 Ų44.14%0.03723%0.232CC..Hα-helixtrans-56.8-42.3174.8-77.8-62.5000111.5R76 H77 F83 Q84 F129 V321 F322R76-H80 PolarHBondContact O-CD2 3.3Å; R76-H80 PolarHBondContact O-N 3.22Å; H77-H80 PolarHBondContact O-N 3.07Å; H80-F83 PolarHBondContact O-N 3.25Å; H80-Q84 PolarHBondContact O-N 3.48Å; H80-F129 AromaticContact CE1-CD2 3.68Å; H80-F129 AromaticContact CE1-CE2 3.44Å; H80-F129 VanDerWaalsContact CE1-CE2 3.44Å; H80-F129 WeakPolarHBondContact CE1-CE2 3.41Å; H80-F129 AromaticContact ND1-CE2 3.53Å; H80-F129 AromaticContact ND1-CZ 3.86Å; H80-F129 AromaticContact NE2-CE2 3.91Å; H80-V321 CarbonylContact C-O 3.59Å; H80-V321 HydrophobicContact CB-CG1 3.76Å; H80-F322 HydrophobicContact CB-CD1 4.16Å; H80-F322 HydrophobicContact CB-CE1 4.2Å; H80-F322 AromaticContact CG-CE1 3.91Å; H80-F322 AromaticContact ND1-CE1 3.83Å
81H91.6Very high91.5Very high55 Ų5544.8 Ų44.826%0.25524%0.236SC..Hα-helixtrans-65.5-49.2-179.3-16282.8000112.5Y48 H77 L78 L79 F83 Q84 A85 S320 V321Y48-H81 AromaticContact CE1-CD2 3.92Å; Y48-H81 AromaticContact CZ-CD2 3.58Å; Y48-H81 AromaticContact CZ-NE2 3.9Å; Y48-H81 PolarHBondContact OH-CD2 2.76Å; Y48-H81 PolarHBondContact OH-NE2 2.63Å; H77-H81 PolarHBondContact O-N 3.13Å; L78-H81 PolarHBondContact O-N 2.85Å; L79-H81 VanDerWaalsContact C-N 3.25Å; L79-H81 PolarHBondContact O-N 3.28Å; H81-F83 VanDerWaalsContact C-N 3.35Å; H81-F83 PolarHBondContact O-N 3.07Å; H81-Q84 PolarHBondContact O-N 3.44Å; H81-A85 PolarHBondContact O-N 3.34Å; H81-S320 PolarHBondContact ND1-O 3.22Å; H81-V321 WeakPolarHBondContact CA-O 3.41Å; H81-V321 PolarHBondContact N-O 2.89Å
82C93.8Very high91.6Very high1 Ų145.4 Ų45.41%0.00724%0.243CC..Hα-helixtrans-66.5-38176.9-620000112.4Y45 Y48 L56 F60 L78 L79 A85 L86Y45-C82 WeakPolarHBondContact CD2-SG 3.42Å; Y45-C82 WeakPolarHBondContact CE2-SG 3.3Å; Y48-C82 WeakPolarHBondContact CD1-SG 3.45Å; Y48-C82 HydrophobicContact CD2-CB 4.4Å; Y48-C82 HydrophobicContact CG-CB 4.18Å; L56-C82 HydrophobicContact CD2-CB 4.41Å; F60-C82 HydrophobicContact CE2-CB 4.43Å; L78-C82 PolarHBondContact O-N 3.06Å; L78-C82 PolarHBondContact O-SG 3.31Å; L78-C82 VanDerWaalsContact O-SG 3.38Å; L79-C82 PolarHBondContact O-N 3.43Å; C82-A85 PolarHBondContact O-N 3.36Å; C82-L86 WeakPolarHBondContact O-CG 3.29Å; C82-L86 PolarHBondContact O-N 3.06Å
83F96.3Very high91.9Very high1 Ų145.2 Ų45.20%0.00424%0.242CC..Hα-helixtrans-60.7-48.1175.8179.6-90.7000110.4F66 L79 H80 H81 A85 L86 M87 V93 A94 F129 L130 A133 W135F66-F83 HydrophobicContact CE2-CD2 4.12Å; F66-F83 AromaticContact CZ-CD2 3.95Å; F66-F83 HydrophobicContact CZ-CD2 3.95Å; F66-F83 HydrophobicContact CZ-CE2 4.21Å; L79-F83 WeakPolarHBondContact O-CB 3.42Å; L79-F83 PolarHBondContact O-N 3.33Å; H80-F83 PolarHBondContact O-N 3.25Å; H81-F83 VanDerWaalsContact C-N 3.35Å; H81-F83 PolarHBondContact O-N 3.07Å; F83-A85 VanDerWaalsContact C-N 3.33Å; F83-A85 PolarHBondContact O-N 3.49Å; F83-L86 WeakPolarHBondContact O-CB 3.49Å; F83-L86 PolarHBondContact O-N 3.21Å; F83-M87 HydrophobicContact CD1-CG 4.06Å; F83-M87 HydrophobicContact CE1-CG 3.76Å; F83-M87 HydrophobicContact CE1-SD 4.09Å; F83-M87 HydrophobicContact CZ-CG 4.26Å; F83-M87 HydrophobicContact CZ-SD 3.98Å; F83-M87 WeakPolarHBondContact O-CG 3.21Å; F83-M87 PolarHBondContact O-N 2.85Å; F83-M87 VanDerWaalsContact O-N 3.16Å; F83-V93 HydrophobicContact CD2-CB 4.45Å; F83-V93 HydrophobicContact CD2-CG1 4.11Å; F83-V93 HydrophobicContact CE2-CB 3.86Å; F83-V93 HydrophobicContact CE2-CG1 3.62Å; F83-V93 HydrophobicContact CZ-CB 4.47Å; F83-A94 HydrophobicContact CZ-CB 3.96Å; F83-F129 HydrophobicContact CB-CE1 4.45Å; F83-F129 HydrophobicContact CB-CZ 3.99Å; F83-F129 HydrophobicContact CD1-CE1 4.23Å; F83-F129 HydrophobicContact CD1-CZ 4.36Å; F83-F129 AromaticContact CD2-CE1 3.74Å; F83-F129 HydrophobicContact CD2-CE1 3.74Å; F83-F129 HydrophobicContact CD2-CZ 4.12Å; F83-F129 HydrophobicContact CE1-CE1 4.4Å; F83-F129 AromaticContact CE2-CE1 3.93Å; F83-F129 HydrophobicContact CE2-CE1 3.93Å; F83-F129 AromaticContact CG-CE1 3.88Å; F83-F129 HydrophobicContact CG-CE1 3.88Å; F83-F129 AromaticContact CG-CZ 3.91Å; F83-F129 HydrophobicContact CG-CZ 3.91Å; F83-F129 HydrophobicContact CZ-CE1 4.26Å; F83-L130 HydrophobicContact CE2-CD2 4.28Å; F83-L130 HydrophobicContact CZ-CD2 3.8Å; F83-A133 HydrophobicContact CD1-CB 4.34Å; F83-A133 HydrophobicContact CE1-CB 4.25Å; F83-W135 AromaticContact CE1-CD1 3.51Å; F83-W135 HydrophobicContact CE1-CG 4.33Å; F83-W135 AromaticContact CE1-NE1 3.47Å
84Q95.6Very high92.7Very high4 Ų440.7 Ų40.72%0.01921%0.21CC..Hα-helixtrans-58.8-45.6175.8-174.474.333.800111.4H80 H81 L86 M87 D88 F322 K325 N326H80-Q84 PolarHBondContact O-N 3.48Å; H81-Q84 PolarHBondContact O-N 3.44Å; Q84-L86 PolarHBondContact O-N 3.4Å; Q84-L86 VanDerWaalsContact O-N 3.15Å; Q84-M87 CarbonylContact O-C 3.55Å; Q84-M87 WeakPolarHBondContact O-CA 3.48Å; Q84-M87 WeakPolarHBondContact O-CB 3.34Å; Q84-M87 PolarHBondContact O-N 3.28Å; Q84-D88 PolarHBondContact NE2-OD1 3.44Å; Q84-D88 PolarHBondContact O-N 3.47Å; Q84-F322 WeakPolarHBondContact CB-O 3.48Å; Q84-F322 WeakPolarHBondContact CG-O 3.47Å; Q84-F322 PolarHBondContact OE1-O 2.77Å; Q84-K325 PolarHBondContact NE2-O 3.45Å; Q84-N326 PolarHBondContact OE1-ND2 3.37Å
85A94.8Very high93.5Very high19 Ų1937.9 Ų37.916%0.15720%0.198CC..Hα-helixtrans-56.8-34.4-17900000112.8Y48 L53 H81 C82 F83 H89Y48-A85 HydrophobicContact CD2-CB 3.85Å; Y48-A85 HydrophobicContact CE2-CB 3.43Å; Y48-A85 VanDerWaalsContact CE2-CB 3.43Å; L53-A85 HydrophobicContact CD2-CB 4.42Å; H81-A85 PolarHBondContact O-N 3.34Å; C82-A85 PolarHBondContact O-N 3.36Å; F83-A85 VanDerWaalsContact C-N 3.33Å; F83-A85 PolarHBondContact O-N 3.49Å; A85-H89 WeakPolarHBondContact O-CB 3.23Å; A85-H89 PolarHBondContact O-N 3.25Å; A85-H89 VanDerWaalsContact O-N 3.09Å
86L96Very high94Very high0 Ų039.3 Ų39.30%021%0.209CC..Hα-helixtrans-68.7-41.8172.7-65.4172.8000112.4L53 L56 F60 C82 F83 Q84 H89 G90 V91 V93L53-L86 HydrophobicContact CB-CD2 4.09Å; L53-L86 HydrophobicContact CD2-CD2 4.22Å; L53-L86 VanDerWaalsContact O-CD2 3.24Å; L53-L86 WeakPolarHBondContact O-CD2 3.45Å; L56-L86 HydrophobicContact CB-CD2 4.2Å; L56-L86 HydrophobicContact CD2-CD1 4.24Å; L56-L86 HydrophobicContact CD2-CD2 4.13Å; L56-L86 HydrophobicContact CD2-CG 4.27Å; L56-L86 HydrophobicContact CG-CD1 4.06Å; L56-L86 HydrophobicContact CG-CD2 4.16Å; L56-L86 HydrophobicContact CG-CG 4.46Å; F60-L86 HydrophobicContact CB-CD1 3.91Å; F60-L86 HydrophobicContact CD2-CD1 3.41Å; F60-L86 VanDerWaalsContact CD2-CD1 3.41Å; F60-L86 HydrophobicContact CE2-CD1 4.18Å; F60-L86 HydrophobicContact CG-CD1 3.89Å; C82-L86 WeakPolarHBondContact O-CG 3.29Å; C82-L86 PolarHBondContact O-N 3.06Å; F83-L86 WeakPolarHBondContact O-CB 3.49Å; F83-L86 PolarHBondContact O-N 3.21Å; Q84-L86 PolarHBondContact O-N 3.4Å; Q84-L86 VanDerWaalsContact O-N 3.15Å; L86-H89 PolarHBondContact O-N 3.03Å; L86-G90 PolarHBondContact O-N 2.89Å; L86-V91 HydrophobicContact CB-CB 4.17Å; L86-V91 HydrophobicContact CB-CG2 4.43Å; L86-V91 HydrophobicContact CD2-CG2 4.36Å; L86-V91 WeakPolarHBondContact O-CB 3.38Å; L86-V91 PolarHBondContact O-N 3.3Å; L86-V93 HydrophobicContact CB-CG2 4Å; L86-V93 HydrophobicContact CD1-CG2 3.95Å
87M95.3Very high94.5Very high23 Ų2335.6 Ų35.611%0.11319%0.194CC..Hα-helixtrans-63.1-43.2176.7-58-55.4-67.700111F83 Q84 H89 G90 V93 A94 W135F83-M87 HydrophobicContact CD1-CG 4.06Å; F83-M87 HydrophobicContact CE1-CG 3.76Å; F83-M87 HydrophobicContact CE1-SD 4.09Å; F83-M87 HydrophobicContact CZ-CG 4.26Å; F83-M87 HydrophobicContact CZ-SD 3.98Å; F83-M87 WeakPolarHBondContact O-CG 3.21Å; F83-M87 PolarHBondContact O-N 2.85Å; F83-M87 VanDerWaalsContact O-N 3.16Å; Q84-M87 CarbonylContact O-C 3.55Å; Q84-M87 WeakPolarHBondContact O-CA 3.48Å; Q84-M87 WeakPolarHBondContact O-CB 3.34Å; Q84-M87 PolarHBondContact O-N 3.28Å; M87-H89 VanDerWaalsContact C-N 3.29Å; M87-H89 PolarHBondContact O-N 3.39Å; M87-G90 WeakPolarHBondContact O-CA 3.37Å; M87-G90 PolarHBondContact O-N 3.27Å; M87-V93 HydrophobicContact SD-CB 3.95Å; M87-V93 HydrophobicContact SD-CG2 4.36Å; M87-A94 HydrophobicContact CE-CB 3.87Å; M87-A94 HydrophobicContact SD-CB 4.39Å; M87-W135 HydrophobicContact CB-CH2 4.02Å; M87-W135 HydrophobicContact CB-CZ2 3.52Å; M87-W135 HydrophobicContact CE-CD2 3.83Å; M87-W135 HydrophobicContact CE-CE3 3.7Å; M87-W135 HydrophobicContact CE-CH2 3.35Å; M87-W135 HydrophobicContact CE-CZ2 3.46Å; M87-W135 VanDerWaalsContact CE-CZ2 3.46Å; M87-W135 HydrophobicContact CE-CZ3 3.48Å; M87-W135 VanDerWaalsContact CE-CZ3 3.48Å; M87-W135 HydrophobicContact CG-CH2 4.25Å; M87-W135 HydrophobicContact CG-CZ2 3.52Å; M87-W135 HydrophobicContact SD-CZ2 4.34Å
88D92.8Very high95.2Very high65 Ų6531 Ų3135%0.34817%0.173SC..Hα-helixtrans-63.6-33.9176.1-71.5-4.7000112Q84 G90 K325Q84-D88 PolarHBondContact NE2-OD1 3.44Å; Q84-D88 PolarHBondContact O-N 3.47Å; D88-G90 PolarHBondContact O-N 3.28Å; D88-K325 WeakPolarHBondContact OD1-CB 3.43Å
89H93.4Very high95.6Very high102 Ų10232.6 Ų32.647%0.47218%0.182SC..THydrogen-bonded Turntrans-74-3.1172.5-172.4-85.7000113.1L53 A85 L86 M87L53-H89 HydrophobicContact CD1-CB 3.89Å; A85-H89 WeakPolarHBondContact O-CB 3.23Å; A85-H89 PolarHBondContact O-N 3.25Å; A85-H89 VanDerWaalsContact O-N 3.09Å; L86-H89 PolarHBondContact O-N 3.03Å; M87-H89 VanDerWaalsContact C-N 3.29Å; M87-H89 PolarHBondContact O-N 3.39Å
90G92.6Very high95.8Very high53 Ų5334.8 Ų34.855%0.54620%0.198SC..THydrogen-bonded Turntrans85.99.1178.500000114.8L86 M87 D88 K92L86-G90 PolarHBondContact O-N 2.89Å; M87-G90 WeakPolarHBondContact O-CA 3.37Å; M87-G90 PolarHBondContact O-N 3.27Å; D88-G90 PolarHBondContact O-N 3.28Å; G90-K92 PolarHBondContact O-N 3.4Å
91V94.1Very high96Very high31 Ų3134.4 Ų34.419%0.18820%0.196CC..  trans-74.4119.9171.8-1700000108.2L86 V93L86-V91 HydrophobicContact CB-CB 4.17Å; L86-V91 HydrophobicContact CB-CG2 4.43Å; L86-V91 HydrophobicContact CD2-CG2 4.36Å; L86-V91 WeakPolarHBondContact O-CB 3.38Å; L86-V91 PolarHBondContact O-N 3.3Å; V91-V93 HydrophobicContact CB-CG2 4.02Å; V91-V93 HydrophobicContact CG1-CG2 3.5Å; V91-V93 VanDerWaalsContact CG1-CG2 3.5Å; V91-V93 PolarHBondContact O-N 2.86Å
92K95.4Very high96.3Very high151 Ų15133.4 Ų33.466%0.65720%0.195SC*.  trans-82.149.6-176.8-59.2-173.4179.2-174.70112.9G90 A94 S95 V96G90-K92 PolarHBondContact O-N 3.4Å; K92-A94 VanDerWaalsContact C-N 3.35Å; K92-A94 PolarHBondContact O-N 2.95Å; K92-S95 PolarHBondContact O-N 3.34Å; K92-V96 VanDerWaalsContact O-CG2 3.32Å; K92-V96 WeakPolarHBondContact O-CG2 3.37Å; K92-V96 PolarHBondContact O-N 2.97Å
93V97.4Very high96.5Very high0 Ų041.6 Ų41.60%023%0.226CC..Hα-helixtrans-55.7-48.2-172.1-175.20000111.3F60 F83 L86 M87 V91 S95 V96 L97F60-V93 HydrophobicContact CB-CG1 3.95Å; F83-V93 HydrophobicContact CD2-CB 4.45Å; F83-V93 HydrophobicContact CD2-CG1 4.11Å; F83-V93 HydrophobicContact CE2-CB 3.86Å; F83-V93 HydrophobicContact CE2-CG1 3.62Å; F83-V93 HydrophobicContact CZ-CB 4.47Å; L86-V93 HydrophobicContact CB-CG2 4Å; L86-V93 HydrophobicContact CD1-CG2 3.95Å; M87-V93 HydrophobicContact SD-CB 3.95Å; M87-V93 HydrophobicContact SD-CG2 4.36Å; V91-V93 HydrophobicContact CB-CG2 4.02Å; V91-V93 HydrophobicContact CG1-CG2 3.5Å; V91-V93 VanDerWaalsContact CG1-CG2 3.5Å; V91-V93 PolarHBondContact O-N 2.86Å; V93-S95 PolarHBondContact O-N 3.33Å; V93-V96 PolarHBondContact O-N 3.31Å; V93-L97 HydrophobicContact CG1-CD1 3.72Å; V93-L97 HydrophobicContact CG1-CG 4.16Å; V93-L97 WeakPolarHBondContact O-CB 3.43Å; V93-L97 WeakPolarHBondContact O-CG 3.31Å; V93-L97 PolarHBondContact O-N 3.44Å
94A97.6Very high96.6Very high0 Ų046 Ų460%024%0.242CC..Hα-helixtrans-52-54.9179.600000112.2F83 M87 K92 L97 A98 L130 W135 D138F83-A94 HydrophobicContact CZ-CB 3.96Å; M87-A94 HydrophobicContact CE-CB 3.87Å; M87-A94 HydrophobicContact SD-CB 4.39Å; K92-A94 VanDerWaalsContact C-N 3.35Å; K92-A94 PolarHBondContact O-N 2.95Å; A94-L97 PolarHBondContact O-N 3.21Å; A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 3.2Å; A94-L130 HydrophobicContact CB-CD2 3.97Å; A94-W135 HydrophobicContact CB-CB 4.06Å; A94-W135 HydrophobicContact CB-CD2 4.18Å; A94-W135 HydrophobicContact CB-CE3 4.37Å; A94-W135 HydrophobicContact CB-CG 4.03Å; A94-D138 HydrophobicContact CB-CB 4.06Å; A94-D138 VanDerWaalsContact CB-OD2 3.3Å; A94-D138 WeakPolarHBondContact CB-OD2 3.3Å
95S98.1Very high96.7Very high40 Ų4045.9 Ų45.928%0.2824%0.242SC..Hα-helixtrans-68.9-36.7-178.3-52.40000113.1K92 V93 N99 D138K92-S95 PolarHBondContact O-N 3.34Å; V93-S95 PolarHBondContact O-N 3.33Å; S95-N99 WeakPolarHBondContact O-CB 3.42Å; S95-N99 PolarHBondContact O-N 3.34Å; S95-N99 PolarHBondContact O-ND2 3.48Å; S95-D138 WeakPolarHBondContact CA-OD1 3.38Å; S95-D138 WeakPolarHBondContact CB-OD1 3.41Å; S95-D138 PolarHBondContact N-OD1 3.38Å; S95-D138 PolarHBondContact OG-OD1 3.17Å; S95-D138 PolarHBondContact OG-OD2 2.96Å
96V98.6Very high96.6Very high52 Ų5248.3 Ų48.332%0.31526%0.258SS..Hα-helixtrans-62.4-45.2175.4172.30000110.9C61 K92 V93 S100C61-V96 HydrophobicContact CB-CG1 3.88Å; K92-V96 VanDerWaalsContact O-CG2 3.32Å; K92-V96 WeakPolarHBondContact O-CG2 3.37Å; K92-V96 PolarHBondContact O-N 2.97Å; V93-V96 PolarHBondContact O-N 3.31Å; V96-S100 VanDerWaalsContact O-CB 3.26Å; V96-S100 WeakPolarHBondContact O-CB 3.3Å; V96-S100 PolarHBondContact O-N 3.17Å; V96-S100 PolarHBondContact O-OG 2.62Å
97L98.7Very high96.5Very high0 Ų056 Ų560%029%0.288CS..Hα-helixtrans-65.7-47.6177.8-70.4175.9000111.9F60 L63 F66 V93 A94 N99 S100 F101 L126F60-L97 WeakPolarHBondContact O-CD2 3.48Å; L63-L97 HydrophobicContact CB-CD2 4.48Å; L63-L97 HydrophobicContact CD1-CD2 4Å; F66-L97 HydrophobicContact CB-CD1 4.18Å; F66-L97 HydrophobicContact CB-CD2 3.86Å; F66-L97 HydrophobicContact CD1-CD1 3.42Å; F66-L97 VanDerWaalsContact CD1-CD1 3.42Å; F66-L97 HydrophobicContact CD1-CD2 4.47Å; F66-L97 HydrophobicContact CD2-CD1 3.95Å; F66-L97 HydrophobicContact CE1-CD1 3.68Å; F66-L97 HydrophobicContact CE2-CD1 4.19Å; F66-L97 HydrophobicContact CG-CD1 3.56Å; F66-L97 HydrophobicContact CG-CD2 4.19Å; F66-L97 HydrophobicContact CZ-CD1 4.06Å; V93-L97 HydrophobicContact CG1-CD1 3.72Å; V93-L97 HydrophobicContact CG1-CG 4.16Å; V93-L97 WeakPolarHBondContact O-CB 3.43Å; V93-L97 WeakPolarHBondContact O-CG 3.31Å; V93-L97 PolarHBondContact O-N 3.44Å; A94-L97 PolarHBondContact O-N 3.21Å; L97-N99 PolarHBondContact O-N 2.9Å; L97-S100 PolarHBondContact O-N 3.41Å; L97-F101 WeakPolarHBondContact O-CB 3.47Å; L97-F101 PolarHBondContact O-N 3.25Å; L97-L126 HydrophobicContact CB-CD1 4.35Å; L97-L126 HydrophobicContact CD1-CD1 4.2Å
98A98.8Very high96.5Very high0 Ų055.8 Ų55.80%029%0.287CS..Hα-helixtrans-62.9-40.9179.400000112.3A94 S102 L130 D138 K141 V142A94-A98 WeakPolarHBondContact O-CB 3.41Å; A94-A98 PolarHBondContact O-N 3.2Å; A98-S102 VanDerWaalsContact O-CB 3.27Å; A98-S102 WeakPolarHBondContact O-CB 3.42Å; A98-S102 PolarHBondContact O-N 3.34Å; A98-L130 HydrophobicContact CB-CD1 4.49Å; A98-D138 HydrophobicContact CB-CB 3.89Å; A98-K141 HydrophobicContact CB-CB 4.46Å; A98-K141 HydrophobicContact CB-CD 4.38Å; A98-V142 HydrophobicContact CB-CG2 3.86Å
99N98.6Very high96.4Very high76 Ų7654 Ų5441%0.40628%0.282SS..Hα-helixtrans-65.1-46.1174.8-72.5-33.9000112.3S95 L97 F101 S102 R103 K141S95-N99 WeakPolarHBondContact O-CB 3.42Å; S95-N99 PolarHBondContact O-N 3.34Å; S95-N99 PolarHBondContact O-ND2 3.48Å; L97-N99 PolarHBondContact O-N 2.9Å; N99-F101 VanDerWaalsContact C-N 3.35Å; N99-S102 PolarHBondContact O-N 3.21Å; N99-R103 WeakPolarHBondContact O-CB 3.39Å; N99-R103 PolarHBondContact O-N 3.13Å; N99-K141 VanDerWaalsContact OD1-CE 3.31Å; N99-K141 WeakPolarHBondContact OD1-CE 2.97Å; N99-K141 PolarHBondContact OD1-NZ 2.97Å
100S98.4Very high96.3Very high50 Ų5058.1 Ų58.135%0.3530%0.301SS..Hα-helixtrans-61.4-43.8177.8-65.30000111.6V96 L97 R104V96-S100 VanDerWaalsContact O-CB 3.26Å; V96-S100 WeakPolarHBondContact O-CB 3.3Å; V96-S100 PolarHBondContact O-N 3.17Å; V96-S100 PolarHBondContact O-OG 2.62Å; L97-S100 PolarHBondContact O-N 3.41Å; S100-R104 WeakPolarHBondContact O-CB 3.46Å; S100-R104 PolarHBondContact O-N 2.95Å
101F98.6Very high96.2Very high0 Ų057.7 Ų57.70%029%0.29CS..Hα-helixtrans-63.6-48.5176.3179.1-98000111.8L63 L97 N99 R103 R104 C105 A119 F122 L126 V142L63-F101 HydrophobicContact CD1-CB 4.21Å; L63-F101 HydrophobicContact CD2-CB 4.27Å; L97-F101 WeakPolarHBondContact O-CB 3.47Å; L97-F101 PolarHBondContact O-N 3.25Å; N99-F101 VanDerWaalsContact C-N 3.35Å; F101-R103 VanDerWaalsContact C-N 3.35Å; F101-R103 PolarHBondContact O-N 3.35Å; F101-R104 WeakPolarHBondContact O-CA 3.39Å; F101-R104 WeakPolarHBondContact O-CB 3.47Å; F101-R104 PolarHBondContact O-N 3.3Å; F101-C105 WeakPolarHBondContact CE1-SG 3.42Å; F101-C105 VanDerWaalsContact CZ-SG 3.52Å; F101-C105 PolarHBondContact O-N 2.86Å; F101-C105 PolarHBondContact O-SG 3.07Å; F101-A119 WeakPolarHBondContact CE2-O 3.27Å; F101-A119 WeakPolarHBondContact CZ-O 3.45Å; F101-F122 AromaticContact CD2-CD1 3.72Å; F101-F122 HydrophobicContact CD2-CD1 3.72Å; F101-F122 AromaticContact CD2-CE1 3.72Å; F101-F122 HydrophobicContact CD2-CE1 3.72Å; F101-F122 AromaticContact CE2-CD1 3.62Å; F101-F122 HydrophobicContact CE2-CD1 3.62Å; F101-F122 HydrophobicContact CE2-CE1 4.12Å; F101-F122 HydrophobicContact CE2-CG 4.47Å; F101-L126 HydrophobicContact CB-CD2 3.87Å; F101-L126 HydrophobicContact CD2-CD2 4.26Å; F101-L126 HydrophobicContact CG-CD2 4.08Å; F101-V142 HydrophobicContact CD1-CB 4.24Å; F101-V142 HydrophobicContact CD1-CG1 3.76Å; F101-V142 HydrophobicContact CD1-CG2 4.15Å; F101-V142 HydrophobicContact CE1-CG1 3.71Å; F101-V142 HydrophobicContact CZ-CG1 4.43Å
102S98.4Very high96Very high34 Ų3460.8 Ų60.824%0.23831%0.305CS..Hα-helixtrans-59.1-44.3179.2-174.90000112.1A98 N99 R104 C105 S106 S145A98-S102 VanDerWaalsContact O-CB 3.27Å; A98-S102 WeakPolarHBondContact O-CB 3.42Å; A98-S102 PolarHBondContact O-N 3.34Å; N99-S102 PolarHBondContact O-N 3.21Å; S102-R104 VanDerWaalsContact C-N 3.33Å; S102-R104 PolarHBondContact O-N 3.43Å; S102-C105 WeakPolarHBondContact O-CB 3.48Å; S102-C105 PolarHBondContact O-N 3.16Å; S102-S106 PolarHBondContact O-N 3.39Å; S102-S145 VanDerWaalsContact CB-OG 3.31Å; S102-S145 WeakPolarHBondContact CB-OG 3.32Å; S102-S145 PolarHBondContact OG-OG 3.39Å
103R97.9Very high95.6Very high173 Ų17355.2 Ų55.265%0.65329%0.288SS*.Hα-helixtrans-62.9-37.7173.4176.9-179.9-84.1176.8-5.6112N99 F101 C105 S106 Y107N99-R103 WeakPolarHBondContact O-CB 3.39Å; N99-R103 PolarHBondContact O-N 3.13Å; F101-R103 VanDerWaalsContact C-N 3.35Å; F101-R103 PolarHBondContact O-N 3.35Å; R103-C105 VanDerWaalsContact C-N 3.33Å; R103-S106 PolarHBondContact O-N 2.89Å; R103-S106 PolarHBondContact O-OG 3.29Å; R103-Y107 HydrophobicContact CG-CD2 4.48Å; R103-Y107 HydrophobicContact CG-CE2 3.63Å; R103-Y107 WeakPolarHBondContact O-CD2 3.34Å; R103-Y107 WeakPolarHBondContact O-CE2 3.26Å
104R97.1Very high95.3Very high92 Ų9260.8 Ų60.835%0.34731%0.313SS..Hα-helixtrans-62.4-42174.1-176.6-176.8-176.6163.49.9111.4E64 S100 F101 S102 S106 Y107 I108E64-R104 IonicContact OE1-CZ 3.87Å; E64-R104 VanDerWaalsContact OE1-CZ 3.24Å; E64-R104 IonicContact OE1-NH1 2.76Å; E64-R104 PolarHBondContact OE1-NH1 3.44Å; E64-R104 IonicContact OE1-NH2 2.8Å; E64-R104 PolarHBondContact OE1-NH2 3.33Å; S100-R104 WeakPolarHBondContact O-CB 3.46Å; S100-R104 PolarHBondContact O-N 2.95Å; F101-R104 WeakPolarHBondContact O-CA 3.39Å; F101-R104 WeakPolarHBondContact O-CB 3.47Å; F101-R104 PolarHBondContact O-N 3.3Å; S102-R104 VanDerWaalsContact C-N 3.33Å; S102-R104 PolarHBondContact O-N 3.43Å; R104-S106 VanDerWaalsContact C-N 3.28Å; R104-S106 PolarHBondContact O-N 2.9Å; R104-Y107 PolarHBondContact O-N 3.36Å; R104-Y107 VanDerWaalsContact O-N 3.16Å; R104-I108 HydrophobicContact CG-CD1 3.74Å; R104-I108 HydrophobicContact CG-CG1 4.37Å; R104-I108 WeakPolarHBondContact O-CG1 3.25Å; R104-I108 PolarHBondContact O-N 3.03Å; R104-I108 VanDerWaalsContact O-N 3.09Å
105C97.1Very high95.1Very high3 Ų363.2 Ų63.22%0.0233%0.328CS..Hα-helixtrans-60.1-35.8177.8-68.60000112.6F101 S102 R103 Y107 I108 A109 L149F101-C105 WeakPolarHBondContact CE1-SG 3.42Å; F101-C105 VanDerWaalsContact CZ-SG 3.52Å; F101-C105 PolarHBondContact O-N 2.86Å; F101-C105 PolarHBondContact O-SG 3.07Å; S102-C105 WeakPolarHBondContact O-CB 3.48Å; S102-C105 PolarHBondContact O-N 3.16Å; R103-C105 VanDerWaalsContact C-N 3.33Å; C105-Y107 VanDerWaalsContact C-N 3.29Å; C105-Y107 PolarHBondContact O-N 3.22Å; C105-I108 PolarHBondContact O-N 3.37Å; C105-A109 PolarHBondContact O-N 2.87Å; C105-L149 HydrophobicContact CB-CD1 4.07Å; C105-L149 HydrophobicContact CB-CD2 4.47Å; C105-L149 HydrophobicContact CB-CG 4.29Å
106S94.5Very high94.9Very high70 Ų7061.9 Ų61.949%0.4932%0.317SS..Hα-helixtrans-63.4-33.4176.857.10000113.3S102 R103 R104S102-S106 PolarHBondContact O-N 3.39Å; R103-S106 PolarHBondContact O-N 2.89Å; R103-S106 PolarHBondContact O-OG 3.29Å; R104-S106 VanDerWaalsContact C-N 3.28Å; R104-S106 PolarHBondContact O-N 2.9Å
107Y93.9Very high94.7Very high162 Ų16260.2 Ų60.264%0.63531%0.306SS*.Hα-helixtrans-76.7-33.7174.1-56.5-62.6000112.2R103 R104 C105 A109R103-Y107 HydrophobicContact CG-CD2 4.48Å; R103-Y107 HydrophobicContact CG-CE2 3.63Å; R103-Y107 WeakPolarHBondContact O-CD2 3.34Å; R103-Y107 WeakPolarHBondContact O-CE2 3.26Å; R104-Y107 PolarHBondContact O-N 3.36Å; R104-Y107 VanDerWaalsContact O-N 3.16Å; C105-Y107 VanDerWaalsContact C-N 3.29Å; C105-Y107 PolarHBondContact O-N 3.22Å; Y107-A109 VanDerWaalsContact C-N 3.27Å; Y107-A109 PolarHBondContact O-N 3.49Å
108I94Very high94.5Very high17 Ų1766 Ų669%0.08733%0.331CS..Hα-helixtrans-73.2-19.5178.7-69.5176.8000112.2R104 C105 E110 S111 V115 K116 A119 L149R104-I108 HydrophobicContact CG-CD1 3.74Å; R104-I108 HydrophobicContact CG-CG1 4.37Å; R104-I108 WeakPolarHBondContact O-CG1 3.25Å; R104-I108 PolarHBondContact O-N 3.03Å; R104-I108 VanDerWaalsContact O-N 3.09Å; C105-I108 PolarHBondContact O-N 3.37Å; I108-E110 PolarHBondContact O-N 2.92Å; I108-E110 VanDerWaalsContact O-N 3.09Å; I108-S111 VanDerWaalsContact O-CB 3.26Å; I108-S111 WeakPolarHBondContact O-CB 3.34Å; I108-S111 PolarHBondContact O-N 3.13Å; I108-S111 PolarHBondContact O-OG 3.05Å; I108-V115 HydrophobicContact CD1-CG1 4.39Å; I108-V115 HydrophobicContact CG1-CG1 4.25Å; I108-V115 HydrophobicContact CG2-CG1 3.97Å; I108-K116 HydrophobicContact CG2-CB 4.41Å; I108-K116 HydrophobicContact CG2-CG 3.7Å; I108-K116 VanDerWaalsContact O-CE 3.27Å; I108-K116 WeakPolarHBondContact O-CE 3.42Å; I108-A119 HydrophobicContact CD1-CB 3.77Å; I108-A119 HydrophobicContact CG2-CB 4.17Å; I108-L149 HydrophobicContact CG2-CD1 4.38Å
109A91.4Very high94.4Very high28 Ų2866.4 Ų66.423%0.23133%0.334CS..THydrogen-bonded Turntrans-54.3-31.8-179.800000113.5C105 Y107 K116 L149 L152C105-A109 PolarHBondContact O-N 2.87Å; Y107-A109 VanDerWaalsContact C-N 3.27Å; Y107-A109 PolarHBondContact O-N 3.49Å; A109-K116 WeakPolarHBondContact O-CE 3.28Å; A109-K116 PolarHBondContact O-NZ 3.18Å; A109-L149 HydrophobicContact CB-CD2 4.32Å; A109-L152 HydrophobicContact CB-CD1 3.72Å
110E90.4Very high94.3Very high188 Ų18862.8 Ų62.888%0.87932%0.315SS*.THydrogen-bonded Turntrans-92-4.7178.1-61.9-177.8177.100113.6I108I108-E110 PolarHBondContact O-N 2.92Å; I108-E110 VanDerWaalsContact O-N 3.09Å
111S91.4Very high94.2Very high45 Ų4564.8 Ų64.832%0.31532%0.319SS..SBendtrans-78.4172.3178.8-560000112.5I108 K116I108-S111 VanDerWaalsContact O-CB 3.26Å; I108-S111 WeakPolarHBondContact O-CB 3.34Å; I108-S111 PolarHBondContact O-N 3.13Å; I108-S111 PolarHBondContact O-OG 3.05Å; S111-K116 WeakPolarHBondContact O-CE 3.49Å; S111-K116 PolarHBondContact O-NZ 3.35Å
112D89.6Confident94.2Very high96 Ų9666.5 Ų66.551%0.51333%0.326SS..  trans-67.6165.3175.868.578.8000113.1H114 V115 K116D112-H114 VanDerWaalsContact C-N 3.28Å; D112-H114 PolarHBondContact O-N 3.01Å; D112-H114 WeakPolarHBondContact OD1-CA 3.34Å; D112-H114 VanDerWaalsContact OD1-CB 3.26Å; D112-H114 WeakPolarHBondContact OD1-CB 3.38Å; D112-H114 PolarHBondContact OD1-N 3.42Å; D112-V115 PolarHBondContact O-N 3.45Å; D112-V115 PolarHBondContact OD1-N 3.11Å; D112-V115 VanDerWaalsContact OD1-N 3.12Å; D112-V115 VanDerWaalsContact OD2-CG2 3.28Å; D112-V115 WeakPolarHBondContact OD2-CG2 3.27Å; D112-K116 PolarHBondContact O-N 3.11Å
113A87.4Confident94.2Very high34 Ų3464.9 Ų64.928%0.28132%0.315SS..Hα-helixtrans-60.7-32.6-175.700000113.5K116 E117A113-K116 PolarHBondContact O-N 2.87Å; A113-E117 PolarHBondContact O-N 3.24Å
114H90.6Very high94.2Very high117 Ų11757.5 Ų57.554%0.54229%0.288SS..Hα-helixtrans-70.9-39.4-179.7-178.563.9000111.7D112 K116 E117 K118D112-H114 VanDerWaalsContact C-N 3.28Å; D112-H114 PolarHBondContact O-N 3.01Å; D112-H114 WeakPolarHBondContact OD1-CA 3.34Å; D112-H114 VanDerWaalsContact OD1-CB 3.26Å; D112-H114 WeakPolarHBondContact OD1-CB 3.38Å; D112-H114 PolarHBondContact OD1-N 3.42Å; H114-K116 VanDerWaalsContact C-N 3.32Å; H114-E117 PolarHBondContact O-N 3.34Å; H114-K118 VanDerWaalsContact NE2-CE 3.33Å; H114-K118 WeakPolarHBondContact NE2-CE 3.49Å; H114-K118 PolarHBondContact NE2-NZ 3.42Å; H114-K118 WeakPolarHBondContact O-CG 3.39Å; H114-K118 PolarHBondContact O-N 3.45Å; H114-K118 VanDerWaalsContact O-N 3.09Å
115V93.5Very high94.2Very high50 Ų5056.4 Ų56.430%0.30329%0.291SS..Hα-helixtrans-64-40.7174.5178.90000110.7I108 D112 K118 A119I108-V115 HydrophobicContact CD1-CG1 4.39Å; I108-V115 HydrophobicContact CG1-CG1 4.25Å; I108-V115 HydrophobicContact CG2-CG1 3.97Å; D112-V115 PolarHBondContact O-N 3.45Å; D112-V115 PolarHBondContact OD1-N 3.11Å; D112-V115 VanDerWaalsContact OD1-N 3.12Å; D112-V115 VanDerWaalsContact OD2-CG2 3.28Å; D112-V115 WeakPolarHBondContact OD2-CG2 3.27Å; V115-K118 PolarHBondContact O-N 2.91Å; V115-A119 PolarHBondContact O-N 2.92Å; V115-A119 VanDerWaalsContact O-N 3.07Å
116K93.3Very high94.3Very high13 Ų1356.2 Ų56.26%0.05729%0.29CS..Hα-helixtrans-64.6-45.9176-72.4164.7175.8157.40112.5I108 A109 S111 D112 A113 H114 K118 A119 I120 L149 H153I108-K116 HydrophobicContact CG2-CB 4.41Å; I108-K116 HydrophobicContact CG2-CG 3.7Å; I108-K116 VanDerWaalsContact O-CE 3.27Å; I108-K116 WeakPolarHBondContact O-CE 3.42Å; A109-K116 WeakPolarHBondContact O-CE 3.28Å; A109-K116 PolarHBondContact O-NZ 3.18Å; S111-K116 WeakPolarHBondContact O-CE 3.49Å; S111-K116 PolarHBondContact O-NZ 3.35Å; D112-K116 PolarHBondContact O-N 3.11Å; A113-K116 PolarHBondContact O-N 2.87Å; H114-K116 VanDerWaalsContact C-N 3.32Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 2.99Å; K116-A119 WeakPolarHBondContact O-CA 3.46Å; K116-A119 WeakPolarHBondContact O-CB 3.47Å; K116-A119 PolarHBondContact O-N 3.26Å; K116-A119 VanDerWaalsContact O-N 3.08Å; K116-I120 WeakPolarHBondContact O-CG1 3.36Å; K116-I120 PolarHBondContact O-N 3.3Å; K116-L149 HydrophobicContact CG-CD2 4.42Å; K116-H153 WeakPolarHBondContact CD-NE2 3.46Å; K116-H153 WeakPolarHBondContact CE-NE2 3.37Å; K116-H153 PolarHBondContact NZ-NE2 3.05Å
117E94.3Very high94.4Very high16 Ų1652.9 Ų52.98%0.07527%0.267CS..Hα-helixtrans-59.9-43.2177.4174.459.3-169.700111.4A113 H114 A119 I120 Q121 R161A113-E117 PolarHBondContact O-N 3.24Å; H114-E117 PolarHBondContact O-N 3.34Å; E117-A119 VanDerWaalsContact C-N 3.3Å; E117-A119 PolarHBondContact O-N 2.9Å; E117-I120 PolarHBondContact O-N 3.23Å; E117-Q121 WeakPolarHBondContact O-CG 3.49Å; E117-Q121 PolarHBondContact O-N 2.9Å; E117-Q121 PolarHBondContact OE1-NE2 3.26Å; E117-R161 IonicContact OE1-CZ 2.68Å; E117-R161 VanDerWaalsContact OE1-CZ 3.29Å; E117-R161 IonicContact OE1-NE 2.51Å; E117-R161 PolarHBondContact OE1-NE 3.25Å; E117-R161 IonicContact OE1-NH2 3.97Å; E117-R161 PolarHBondContact OE1-NH2 3.03Å; E117-R161 IonicContact OE2-NE 2.91Å; E117-R161 PolarHBondContact OE2-NE 3.48Å
118K94.9Very high94.6Very high122 Ų12245.9 Ų45.953%0.5324%0.244SC..Hα-helixtrans-60.2-40.3173.8-75.9-179.2175.1178.50112.4H114 V115 K116 F122H114-K118 VanDerWaalsContact NE2-CE 3.33Å; H114-K118 WeakPolarHBondContact NE2-CE 3.49Å; H114-K118 PolarHBondContact NE2-NZ 3.42Å; H114-K118 WeakPolarHBondContact O-CG 3.39Å; H114-K118 PolarHBondContact O-N 3.45Å; H114-K118 VanDerWaalsContact O-N 3.09Å; V115-K118 PolarHBondContact O-N 2.91Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 2.99Å; K118-F122 WeakPolarHBondContact O-CB 3.06Å; K118-F122 PolarHBondContact O-N 3.39Å
119A96.5Very high94.8Very high8 Ų845.1 Ų45.17%0.06624%0.24CC..Hα-helixtrans-66.1-41.4176.500000111.9F101 I108 V115 K116 E117 F122 G123 L149F101-A119 WeakPolarHBondContact CE2-O 3.27Å; F101-A119 WeakPolarHBondContact CZ-O 3.45Å; I108-A119 HydrophobicContact CD1-CB 3.77Å; I108-A119 HydrophobicContact CG2-CB 4.17Å; V115-A119 PolarHBondContact O-N 2.92Å; V115-A119 VanDerWaalsContact O-N 3.07Å; K116-A119 WeakPolarHBondContact O-CA 3.46Å; K116-A119 WeakPolarHBondContact O-CB 3.47Å; K116-A119 PolarHBondContact O-N 3.26Å; K116-A119 VanDerWaalsContact O-N 3.08Å; E117-A119 VanDerWaalsContact C-N 3.3Å; E117-A119 PolarHBondContact O-N 2.9Å; A119-F122 PolarHBondContact O-N 3.42Å; A119-G123 PolarHBondContact O-N 3.21Å; A119-L149 HydrophobicContact CB-CD1 3.99Å
120I97.3Very high95.1Very high0 Ų043.8 Ų43.80%023%0.228CC..Hα-helixtrans-61.7-48.9176-68.4160.9000110.4K116 E117 F122 G123 F124 C146 L149 R161K116-I120 WeakPolarHBondContact O-CG1 3.36Å; K116-I120 PolarHBondContact O-N 3.3Å; E117-I120 PolarHBondContact O-N 3.23Å; I120-F122 VanDerWaalsContact C-N 3.35Å; I120-F122 PolarHBondContact O-N 3.47Å; I120-G123 CarbonylContact O-C 3.59Å; I120-G123 PolarHBondContact O-N 3.48Å; I120-G123 VanDerWaalsContact O-N 3.13Å; I120-F124 HydrophobicContact CG2-CD1 4.46Å; I120-F124 HydrophobicContact CG2-CD2 4.45Å; I120-F124 HydrophobicContact CG2-CE1 3.94Å; I120-F124 HydrophobicContact CG2-CE2 3.92Å; I120-F124 HydrophobicContact CG2-CZ 3.64Å; I120-F124 PolarHBondContact O-N 3.46Å; I120-C146 HydrophobicContact CG2-CB 4.47Å; I120-L149 HydrophobicContact CD1-CB 4.06Å; I120-L149 HydrophobicContact CG1-CB 4.03Å; I120-L149 HydrophobicContact CG1-CD1 4.27Å; I120-R161 HydrophobicContact CG2-CB 4.35Å; I120-R161 HydrophobicContact CG2-CG 4.37Å
121Q96.6Very high95.5Very high93 Ų9335.1 Ų35.144%0.43519%0.189SC..Hα-helixtrans-58.7-45.3177.3-71.6177.25.900112E117 G123 F124 V125E117-Q121 WeakPolarHBondContact O-CG 3.49Å; E117-Q121 PolarHBondContact O-N 2.9Å; E117-Q121 PolarHBondContact OE1-NE2 3.26Å; Q121-G123 VanDerWaalsContact C-N 3.34Å; Q121-G123 PolarHBondContact O-N 3.14Å; Q121-F124 PolarHBondContact O-N 2.66Å; Q121-V125 PolarHBondContact O-N 2.66Å
122F97.4Very high95.7Very high36 Ų3635 Ų3516%0.15819%0.185CC..Hα-helixtrans-62.1-43175.2173.7-127.9000111.8L63 A67 L70 F101 K118 A119 I120 F124 V125 L126L63-F122 HydrophobicContact CD1-CE1 3.74Å; L63-F122 HydrophobicContact CD1-CZ 3.73Å; L63-F122 HydrophobicContact CD2-CE1 4.12Å; L63-F122 HydrophobicContact CG-CE1 3.84Å; L63-F122 HydrophobicContact CG-CZ 4.06Å; A67-F122 HydrophobicContact CB-CD2 4.11Å; A67-F122 HydrophobicContact CB-CE2 3.33Å; A67-F122 HydrophobicContact CB-CZ 3.58Å; L70-F122 HydrophobicContact CD1-CE2 4.4Å; F101-F122 AromaticContact CD2-CD1 3.72Å; F101-F122 HydrophobicContact CD2-CD1 3.72Å; F101-F122 AromaticContact CD2-CE1 3.72Å; F101-F122 HydrophobicContact CD2-CE1 3.72Å; F101-F122 AromaticContact CE2-CD1 3.62Å; F101-F122 HydrophobicContact CE2-CD1 3.62Å; F101-F122 HydrophobicContact CE2-CE1 4.12Å; F101-F122 HydrophobicContact CE2-CG 4.47Å; K118-F122 WeakPolarHBondContact O-CB 3.06Å; K118-F122 PolarHBondContact O-N 3.39Å; A119-F122 PolarHBondContact O-N 3.42Å; I120-F122 VanDerWaalsContact C-N 3.35Å; I120-F122 PolarHBondContact O-N 3.47Å; F122-F124 VanDerWaalsContact C-N 3.28Å; F122-F124 PolarHBondContact O-N 3.21Å; F122-V125 PolarHBondContact O-N 2.76Å; F122-V125 VanDerWaalsContact O-N 3.12Å; F122-L126 HydrophobicContact CE1-CD2 4.39Å; F122-L126 HydrophobicContact CE2-CB 4.21Å; F122-L126 HydrophobicContact CZ-CB 4.3Å; F122-L126 HydrophobicContact CZ-CD2 4.17Å; F122-L126 PolarHBondContact O-N 2.89Å
123G98.3Very high96Very high0 Ų030.5 Ų30.50%016%0.161CC..Hα-helixtrans-61-34175.600000113.3A119 I120 Q121 G127 V142A119-G123 PolarHBondContact O-N 3.21Å; I120-G123 CarbonylContact O-C 3.59Å; I120-G123 PolarHBondContact O-N 3.48Å; I120-G123 VanDerWaalsContact O-N 3.13Å; Q121-G123 VanDerWaalsContact C-N 3.34Å; Q121-G123 PolarHBondContact O-N 3.14Å; G123-G127 WeakPolarHBondContact O-CA 3.33Å; G123-G127 PolarHBondContact O-N 2.6Å; G123-V142 WeakPolarHBondContact O-CG1 3.44Å
124F97.9Very high96.4Very high18 Ų1829.3 Ų29.38%0.07915%0.152CC..Hα-helixtrans-65.3-39172.9-70.9-6.3000112.9I120 Q121 F122 G128 F143 C146 E164 C165I120-F124 HydrophobicContact CG2-CD1 4.46Å; I120-F124 HydrophobicContact CG2-CD2 4.45Å; I120-F124 HydrophobicContact CG2-CE1 3.94Å; I120-F124 HydrophobicContact CG2-CE2 3.92Å; I120-F124 HydrophobicContact CG2-CZ 3.64Å; I120-F124 PolarHBondContact O-N 3.46Å; Q121-F124 PolarHBondContact O-N 2.66Å; F122-F124 VanDerWaalsContact C-N 3.28Å; F122-F124 PolarHBondContact O-N 3.21Å; F124-G128 WeakPolarHBondContact O-CA 3.47Å; F124-G128 PolarHBondContact O-N 3.21Å; F124-F143 HydrophobicContact CD1-CD1 4.38Å; F124-F143 HydrophobicContact CD1-CE1 4.5Å; F124-C146 HydrophobicContact CE1-CB 4.13Å; F124-E164 HydrophobicContact CD2-CG 4.34Å; F124-E164 HydrophobicContact CE2-CB 4.14Å; F124-E164 VanDerWaalsContact CE2-CD 3.4Å; F124-E164 HydrophobicContact CE2-CG 3.69Å; F124-E164 WeakPolarHBondContact CE2-OE2 3.4Å; F124-E164 HydrophobicContact CZ-CB 4.19Å; F124-E164 HydrophobicContact CZ-CG 4.07Å; F124-C165 HydrophobicContact CE1-CB 4.41Å; F124-C165 WeakPolarHBondContact CE1-SG 3.21Å; F124-C165 WeakPolarHBondContact CZ-SG 3.41Å
125V97.5Very high96.7Very high68 Ų6825.8 Ų25.841%0.41213%0.134SC..Hα-helixtrans-70.1-48.1176.4-179.20000110.7L70 Q121 F122 G128 F129L70-V125 HydrophobicContact CB-CG1 4.11Å; L70-V125 HydrophobicContact CD1-CG1 4.22Å; Q121-V125 PolarHBondContact O-N 2.66Å; F122-V125 PolarHBondContact O-N 2.76Å; F122-V125 VanDerWaalsContact O-N 3.12Å; V125-G128 PolarHBondContact O-N 2.73Å; V125-F129 WeakPolarHBondContact O-CB 3.2Å; V125-F129 PolarHBondContact O-N 2.97Å
126L98.5Very high96.9Very high0 Ų024.6 Ų24.60%012%0.124CC..Hα-helixtrans-64.4-53.4-179.9175.961.9000111.8L63 F66 L70 L97 F101 F122 G128 F129 L130 V142L63-L126 HydrophobicContact CD1-CD2 3.82Å; F66-L126 HydrophobicContact CD1-CD1 4.01Å; F66-L126 HydrophobicContact CE1-CD1 4.13Å; L70-L126 HydrophobicContact CD1-CB 4.41Å; L70-L126 HydrophobicContact CD1-CD1 4.16Å; L97-L126 HydrophobicContact CB-CD1 4.35Å; L97-L126 HydrophobicContact CD1-CD1 4.2Å; F101-L126 HydrophobicContact CB-CD2 3.87Å; F101-L126 HydrophobicContact CD2-CD2 4.26Å; F101-L126 HydrophobicContact CG-CD2 4.08Å; F122-L126 HydrophobicContact CE1-CD2 4.39Å; F122-L126 HydrophobicContact CE2-CB 4.21Å; F122-L126 HydrophobicContact CZ-CB 4.3Å; F122-L126 HydrophobicContact CZ-CD2 4.17Å; F122-L126 PolarHBondContact O-N 2.89Å; L126-G128 VanDerWaalsContact C-N 3.29Å; L126-G128 PolarHBondContact O-N 2.68Å; L126-F129 PolarHBondContact O-N 3.26Å; L126-L130 HydrophobicContact CD1-CD1 4.39Å; L126-L130 HydrophobicContact CD1-CG 4.43Å; L126-L130 HydrophobicContact CG-CD1 4.39Å; L126-L130 WeakPolarHBondContact O-CG 3.2Å; L126-L130 PolarHBondContact O-N 2.8Å; L126-V142 HydrophobicContact CD2-CG2 4.14Å; L126-V142 HydrophobicContact CG-CG2 4.35Å
127G98.5Very high97Very high0 Ų025.7 Ų25.70%014%0.139CC..Hα-helixtrans-63.5-37.2178.500000111.6G123 L130 S131 A139 F143G123-G127 WeakPolarHBondContact O-CA 3.33Å; G123-G127 PolarHBondContact O-N 2.6Å; G127-L130 PolarHBondContact O-N 3.45Å; G127-S131 VanDerWaalsContact O-CB 3.27Å; G127-S131 WeakPolarHBondContact O-CB 3.43Å; G127-S131 PolarHBondContact O-N 3.37Å; G127-A139 WeakPolarHBondContact O-CB 3.23Å; G127-F143 WeakPolarHBondContact O-CZ 3.27Å
128G97.6Very high97.2Very high15 Ų1526.1 Ų26.116%0.15514%0.141CC..Hα-helixtrans-62.4-41.917400000112.5F124 V125 L126 S131 D132F124-G128 WeakPolarHBondContact O-CA 3.47Å; F124-G128 PolarHBondContact O-N 3.21Å; V125-G128 PolarHBondContact O-N 2.73Å; L126-G128 VanDerWaalsContact C-N 3.29Å; L126-G128 PolarHBondContact O-N 2.68Å; G128-S131 PolarHBondContact O-N 3.2Å; G128-D132 WeakPolarHBondContact O-CB 3.36Å; G128-D132 PolarHBondContact O-N 3.5Å
129F97.6Very high97.4Very high0 Ų020.3 Ų20.30%012%0.116CC..Hα-helixtrans-63.5-47.2173.4173.4-92.7000112.2F66 L70 L79 H80 F83 V125 L126 S131 D132 A133F66-F129 AromaticContact CE1-CD1 3.85Å; F66-F129 HydrophobicContact CE1-CD1 3.85Å; F66-F129 AromaticContact CE1-CE1 3.97Å; F66-F129 HydrophobicContact CE1-CE1 3.97Å; F66-F129 AromaticContact CZ-CD1 3.91Å; F66-F129 HydrophobicContact CZ-CD1 3.91Å; F66-F129 AromaticContact CZ-CE1 3.53Å; F66-F129 HydrophobicContact CZ-CE1 3.53Å; F66-F129 HydrophobicContact CZ-CZ 4.08Å; L70-F129 HydrophobicContact CD2-CB 3.6Å; L70-F129 HydrophobicContact CD2-CD1 4.13Å; L70-F129 HydrophobicContact CD2-CD2 3.7Å; L70-F129 HydrophobicContact CD2-CE2 4.46Å; L70-F129 HydrophobicContact CD2-CG 3.5Å; L79-F129 HydrophobicContact CB-CE2 4.33Å; L79-F129 HydrophobicContact CD1-CZ 4.47Å; L79-F129 HydrophobicContact CD2-CD2 4.07Å; L79-F129 HydrophobicContact CD2-CE2 3.57Å; L79-F129 HydrophobicContact CD2-CZ 4.04Å; L79-F129 HydrophobicContact CG-CE2 3.58Å; L79-F129 HydrophobicContact CG-CZ 3.75Å; H80-F129 AromaticContact CE1-CD2 3.68Å; H80-F129 AromaticContact CE1-CE2 3.44Å; H80-F129 VanDerWaalsContact CE1-CE2 3.44Å; H80-F129 WeakPolarHBondContact CE1-CE2 3.41Å; H80-F129 AromaticContact ND1-CE2 3.53Å; H80-F129 AromaticContact ND1-CZ 3.86Å; H80-F129 AromaticContact NE2-CE2 3.91Å; F83-F129 HydrophobicContact CB-CE1 4.45Å; F83-F129 HydrophobicContact CB-CZ 3.99Å; F83-F129 HydrophobicContact CD1-CE1 4.23Å; F83-F129 HydrophobicContact CD1-CZ 4.36Å; F83-F129 AromaticContact CD2-CE1 3.74Å; F83-F129 HydrophobicContact CD2-CE1 3.74Å; F83-F129 HydrophobicContact CD2-CZ 4.12Å; F83-F129 HydrophobicContact CE1-CE1 4.4Å; F83-F129 AromaticContact CE2-CE1 3.93Å; F83-F129 HydrophobicContact CE2-CE1 3.93Å; F83-F129 AromaticContact CG-CE1 3.88Å; F83-F129 HydrophobicContact CG-CE1 3.88Å; F83-F129 AromaticContact CG-CZ 3.91Å; F83-F129 HydrophobicContact CG-CZ 3.91Å; F83-F129 HydrophobicContact CZ-CE1 4.26Å; V125-F129 WeakPolarHBondContact O-CB 3.2Å; V125-F129 PolarHBondContact O-N 2.97Å; L126-F129 PolarHBondContact O-N 3.26Å; F129-S131 VanDerWaalsContact C-N 3.28Å; F129-S131 PolarHBondContact O-N 2.94Å; F129-D132 PolarHBondContact O-N 3.25Å; F129-A133 HydrophobicContact CE1-CB 4.41Å; F129-A133 VanDerWaalsContact O-CB 3.26Å; F129-A133 WeakPolarHBondContact O-CB 3.06Å; F129-A133 PolarHBondContact O-N 3.46Å
130L98.3Very high97.5Very high0 Ų020.4 Ų20.40%012%0.115CC..Hα-helixtrans-62.2-38178.5-67177.3000111.8F83 A94 A98 L126 G127 A133 G134 W135 D138 A139 V142F83-L130 HydrophobicContact CE2-CD2 4.28Å; F83-L130 HydrophobicContact CZ-CD2 3.8Å; A94-L130 HydrophobicContact CB-CD2 3.97Å; A98-L130 HydrophobicContact CB-CD1 4.49Å; L126-L130 HydrophobicContact CD1-CD1 4.39Å; L126-L130 HydrophobicContact CD1-CG 4.43Å; L126-L130 HydrophobicContact CG-CD1 4.39Å; L126-L130 WeakPolarHBondContact O-CG 3.2Å; L126-L130 PolarHBondContact O-N 2.8Å; G127-L130 PolarHBondContact O-N 3.45Å; L130-A133 PolarHBondContact O-N 3Å; L130-G134 PolarHBondContact O-N 2.91Å; L130-W135 PolarHBondContact O-N 3.46Å; L130-D138 HydrophobicContact CD1-CB 4.04Å; L130-A139 HydrophobicContact CB-CB 3.87Å; L130-V142 HydrophobicContact CD1-CG2 4.21Å
131S97.8Very high97.6Very high6 Ų624.1 Ų24.14%0.04213%0.131CC..Hα-helixtrans-62.9-52.1173.3-177.50000111.5G127 G128 F129 A133 G134 Y136 H171 V172G127-S131 VanDerWaalsContact O-CB 3.27Å; G127-S131 WeakPolarHBondContact O-CB 3.43Å; G127-S131 PolarHBondContact O-N 3.37Å; G128-S131 PolarHBondContact O-N 3.2Å; F129-S131 VanDerWaalsContact C-N 3.28Å; F129-S131 PolarHBondContact O-N 2.94Å; S131-A133 PolarHBondContact O-N 2.92Å; S131-G134 PolarHBondContact O-N 3.48Å; S131-Y136 WeakPolarHBondContact O-CE1 3.25Å; S131-H171 PolarHBondContact OG-CD2 3.41Å; S131-V172 WeakPolarHBondContact OG-CG1 3.46Å
132D95.8Very high97.7Very high43 Ų4319.7 Ų19.723%0.2311%0.111CC..Hα-helixtrans-63.5-23.4178.3-68.1-24.8000111.7R76 G128 F129 K243 F322 H328R76-D132 IonicContact CZ-OD2 3.05Å; R76-D132 IonicContact NE-OD2 2.7Å; R76-D132 IonicContact NH2-OD2 2.88Å; R76-D132 PolarHBondContact NH2-OD2 3.41Å; G128-D132 WeakPolarHBondContact O-CB 3.36Å; G128-D132 PolarHBondContact O-N 3.5Å; F129-D132 PolarHBondContact O-N 3.25Å; D132-K243 IonicContact OD1-NZ 2.94Å; D132-K243 PolarHBondContact OD1-NZ 3.34Å; D132-K243 IonicContact OD2-NZ 3.33Å; D132-F322 WeakPolarHBondContact O-CE1 3.5Å; D132-F322 WeakPolarHBondContact O-CZ 3.36Å; D132-H328 PolarHBondContact O-NE2 2.91Å
133A95.8Very high97.8Very high2 Ų218 Ų182%0.01710%0.104CC..THydrogen-bonded Turntrans-87.1-1175.500000113.8F83 F129 L130 S131 W135 N326F83-A133 HydrophobicContact CD1-CB 4.34Å; F83-A133 HydrophobicContact CE1-CB 4.25Å; F129-A133 HydrophobicContact CE1-CB 4.41Å; F129-A133 VanDerWaalsContact O-CB 3.26Å; F129-A133 WeakPolarHBondContact O-CB 3.06Å; F129-A133 PolarHBondContact O-N 3.46Å; L130-A133 PolarHBondContact O-N 3Å; S131-A133 PolarHBondContact O-N 2.92Å; A133-W135 PolarHBondContact O-NE1 3.33Å; A133-N326 PolarHBondContact O-ND2 2.89Å
134G95.7Very high97.8Very high8 Ų821.4 Ų21.48%0.08212%0.121CC..THydrogen-bonded Turntrans857.717800000115.9L130 S131 Y136 I327 H328L130-G134 PolarHBondContact O-N 2.91Å; S131-G134 PolarHBondContact O-N 3.48Å; G134-Y136 VanDerWaalsContact C-N 3.34Å; G134-Y136 PolarHBondContact O-N 3.15Å; G134-I327 WeakPolarHBondContact O-CG2 3.47Å; G134-H328 VanDerWaalsContact CA-NE2 3.35Å; G134-H328 WeakPolarHBondContact CA-NE2 3.48Å; G134-H328 PolarHBondContact N-NE2 3.49Å
135W96.8Very high97.8Very high44 Ų4420.8 Ų20.817%0.16712%0.119CC..  trans-95.561.7-179.7-60.786000110.8F83 M87 A94 L130 A133 G137 D138 A139 I367F83-W135 AromaticContact CE1-CD1 3.51Å; F83-W135 HydrophobicContact CE1-CG 4.33Å; F83-W135 AromaticContact CE1-NE1 3.47Å; M87-W135 HydrophobicContact CB-CH2 4.02Å; M87-W135 HydrophobicContact CB-CZ2 3.52Å; M87-W135 HydrophobicContact CE-CD2 3.83Å; M87-W135 HydrophobicContact CE-CE3 3.7Å; M87-W135 HydrophobicContact CE-CH2 3.35Å; M87-W135 HydrophobicContact CE-CZ2 3.46Å; M87-W135 VanDerWaalsContact CE-CZ2 3.46Å; M87-W135 HydrophobicContact CE-CZ3 3.48Å; M87-W135 VanDerWaalsContact CE-CZ3 3.48Å; M87-W135 HydrophobicContact CG-CH2 4.25Å; M87-W135 HydrophobicContact CG-CZ2 3.52Å; M87-W135 HydrophobicContact SD-CZ2 4.34Å; A94-W135 HydrophobicContact CB-CB 4.06Å; A94-W135 HydrophobicContact CB-CD2 4.18Å; A94-W135 HydrophobicContact CB-CE3 4.37Å; A94-W135 HydrophobicContact CB-CG 4.03Å; L130-W135 PolarHBondContact O-N 3.46Å; A133-W135 PolarHBondContact O-NE1 3.33Å; W135-G137 VanDerWaalsContact C-N 3.33Å; W135-G137 PolarHBondContact O-N 3.36Å; W135-D138 PolarHBondContact O-N 2.92Å; W135-A139 PolarHBondContact O-N 3.49Å; W135-I367 HydrophobicContact CH2-CG2 4.41Å
136Y97.6Very high97.8Very high25 Ų2517.6 Ų17.610%0.09810%0.1CC..Hα-helixtrans-60.4-35.9-170.4-61.8-46.7000114.2S131 G134 A139 E140 V172 G175 N176 I327 H328S131-Y136 WeakPolarHBondContact O-CE1 3.25Å; G134-Y136 VanDerWaalsContact C-N 3.34Å; G134-Y136 PolarHBondContact O-N 3.15Å; Y136-A139 PolarHBondContact O-N 3.47Å; Y136-E140 VanDerWaalsContact O-CB 3.29Å; Y136-E140 WeakPolarHBondContact O-CB 3.42Å; Y136-E140 PolarHBondContact O-N 3.31Å; Y136-V172 HydrophobicContact CD1-CB 4.09Å; Y136-V172 HydrophobicContact CD1-CG1 4.02Å; Y136-V172 HydrophobicContact CG-CB 4.49Å; Y136-G175 WeakPolarHBondContact CE2-O 3.21Å; Y136-N176 HydrophobicContact CD2-CB 3.99Å; Y136-N176 HydrophobicContact CG-CB 4.22Å; Y136-I327 HydrophobicContact CD2-CD1 4Å; Y136-I327 HydrophobicContact CE2-CD1 3.92Å; Y136-I327 HydrophobicContact CE2-CG2 4.21Å; Y136-H328 PolarHBondContact OH-CE1 3.49Å
137G97.1Very high97.8Very high36 Ų3618.4 Ų18.437%0.37110%0.104SC..Hα-helixtrans-63.4-42.1178.300000112.9W135 K141W135-G137 VanDerWaalsContact C-N 3.33Å; W135-G137 PolarHBondContact O-N 3.36Å; G137-K141 PolarHBondContact O-N 3.1Å
138D98.5Very high97.7Very high24 Ų2424 Ų2413%0.12813%0.13CC..Hα-helixtrans-73.9-37.9177.5-61.4-66.2000111.4A94 S95 A98 L130 W135 K141 V142A94-D138 HydrophobicContact CB-CB 4.06Å; A94-D138 VanDerWaalsContact CB-OD2 3.3Å; A94-D138 WeakPolarHBondContact CB-OD2 3.3Å; S95-D138 WeakPolarHBondContact CA-OD1 3.38Å; S95-D138 WeakPolarHBondContact CB-OD1 3.41Å; S95-D138 PolarHBondContact N-OD1 3.38Å; S95-D138 PolarHBondContact OG-OD1 3.17Å; S95-D138 PolarHBondContact OG-OD2 2.96Å; A98-D138 HydrophobicContact CB-CB 3.89Å; L130-D138 HydrophobicContact CD1-CB 4.04Å; W135-D138 PolarHBondContact O-N 2.92Å; D138-K141 WeakPolarHBondContact O-CB 3.46Å; D138-K141 PolarHBondContact O-N 3.08Å; D138-V142 WeakPolarHBondContact O-CG2 3.32Å; D138-V142 PolarHBondContact O-N 3.37Å; D138-V142 VanDerWaalsContact O-N 3.14Å
139A98.8Very high97.6Very high0 Ų023.4 Ų23.40%012%0.123CC..Hα-helixtrans-61.1-45.2172.700000112.1G127 L130 W135 Y136 K141 V142 F143 V172G127-A139 WeakPolarHBondContact O-CB 3.23Å; L130-A139 HydrophobicContact CB-CB 3.87Å; W135-A139 PolarHBondContact O-N 3.49Å; Y136-A139 PolarHBondContact O-N 3.47Å; A139-K141 VanDerWaalsContact C-N 3.29Å; A139-K141 PolarHBondContact O-N 3.14Å; A139-V142 WeakPolarHBondContact O-CB 2.93Å; A139-V142 PolarHBondContact O-N 2.77Å; A139-V142 VanDerWaalsContact O-N 3.16Å; A139-F143 HydrophobicContact CB-CE2 4.13Å; A139-F143 WeakPolarHBondContact O-CD2 3.29Å; A139-F143 WeakPolarHBondContact O-CG 3.43Å; A139-F143 PolarHBondContact O-N 3.27Å; A139-V172 HydrophobicContact CB-CG1 4Å
140E98.6Very high97.5Very high11 Ų1123.4 Ų23.45%0.05112%0.124CC..Hα-helixtrans-56.2-44.7175.1-178.4178.6-16600110.9Y136 V142 F143 L144 L169 V172 R173 K178Y136-E140 VanDerWaalsContact O-CB 3.29Å; Y136-E140 WeakPolarHBondContact O-CB 3.42Å; Y136-E140 PolarHBondContact O-N 3.31Å; E140-V142 VanDerWaalsContact C-N 3.33Å; E140-V142 PolarHBondContact O-N 3.37Å; E140-F143 PolarHBondContact O-N 2.97Å; E140-L144 HydrophobicContact CG-CD1 3.99Å; E140-L144 HydrophobicContact CG-CG 4.29Å; E140-L144 WeakPolarHBondContact O-CB 3.21Å; E140-L144 VanDerWaalsContact O-CG 3.32Å; E140-L144 WeakPolarHBondContact O-CG 3.32Å; E140-L144 PolarHBondContact O-N 2.68Å; E140-L169 HydrophobicContact CG-CD2 3.9Å; E140-V172 HydrophobicContact CB-CG2 3.91Å; E140-V172 HydrophobicContact CG-CG2 4.46Å; E140-R173 IonicContact OE1-CZ 3.43Å; E140-R173 IonicContact OE1-NE 2.91Å; E140-R173 PolarHBondContact OE1-NE 3.46Å; E140-R173 IonicContact OE1-NH2 3.06Å; E140-R173 PolarHBondContact OE1-NH2 2.92Å; E140-K178 IonicContact OE2-NZ 2.9Å; E140-K178 PolarHBondContact OE2-NZ 3.38Å
141K98.7Very high97.2Very high77 Ų7727 Ų2734%0.33515%0.145SC..Hα-helixtrans-60.3-41.5177.5-177.8169.2-171.8155.70112.8A98 N99 G137 D138 A139 S145A98-K141 HydrophobicContact CB-CB 4.46Å; A98-K141 HydrophobicContact CB-CD 4.38Å; N99-K141 VanDerWaalsContact OD1-CE 3.31Å; N99-K141 WeakPolarHBondContact OD1-CE 2.97Å; N99-K141 PolarHBondContact OD1-NZ 2.97Å; G137-K141 PolarHBondContact O-N 3.1Å; D138-K141 WeakPolarHBondContact O-CB 3.46Å; D138-K141 PolarHBondContact O-N 3.08Å; A139-K141 VanDerWaalsContact C-N 3.29Å; A139-K141 PolarHBondContact O-N 3.14Å; K141-S145 PolarHBondContact O-N 3.09Å; K141-S145 VanDerWaalsContact O-N 3.14Å; K141-S145 PolarHBondContact O-OG 2.91Å
142V98.8Very high96.8Very high0 Ų030.6 Ų30.60%016%0.164CC..Hα-helixtrans-62.8-49.8175.7171.80000110.2A98 F101 G123 L126 L130 D138 A139 E140 L144 S145 C146A98-V142 HydrophobicContact CB-CG2 3.86Å; F101-V142 HydrophobicContact CD1-CB 4.24Å; F101-V142 HydrophobicContact CD1-CG1 3.76Å; F101-V142 HydrophobicContact CD1-CG2 4.15Å; F101-V142 HydrophobicContact CE1-CG1 3.71Å; F101-V142 HydrophobicContact CZ-CG1 4.43Å; G123-V142 WeakPolarHBondContact O-CG1 3.44Å; L126-V142 HydrophobicContact CD2-CG2 4.14Å; L126-V142 HydrophobicContact CG-CG2 4.35Å; L130-V142 HydrophobicContact CD1-CG2 4.21Å; D138-V142 WeakPolarHBondContact O-CG2 3.32Å; D138-V142 PolarHBondContact O-N 3.37Å; D138-V142 VanDerWaalsContact O-N 3.14Å; A139-V142 WeakPolarHBondContact O-CB 2.93Å; A139-V142 PolarHBondContact O-N 2.77Å; A139-V142 VanDerWaalsContact O-N 3.16Å; E140-V142 VanDerWaalsContact C-N 3.33Å; E140-V142 PolarHBondContact O-N 3.37Å; V142-L144 PolarHBondContact O-N 2.86Å; V142-S145 WeakPolarHBondContact O-CB 3.27Å; V142-S145 PolarHBondContact O-N 3.18Å; V142-S145 VanDerWaalsContact O-N 3.12Å; V142-C146 PolarHBondContact O-N 2.84Å; V142-C146 PolarHBondContact O-SG 3.49Å; V142-C146 VanDerWaalsContact O-SG 3.4Å
143F98.8Very high96.3Very high2 Ų230.4 Ų30.41%0.00916%0.161CC..Hα-helixtrans-66.6-34.9-178.7-61.1-42.4000113.5F124 G127 A139 E140 S145 C146 L147 R168 L169 V172F124-F143 HydrophobicContact CD1-CD1 4.38Å; F124-F143 HydrophobicContact CD1-CE1 4.5Å; G127-F143 WeakPolarHBondContact O-CZ 3.27Å; A139-F143 HydrophobicContact CB-CE2 4.13Å; A139-F143 WeakPolarHBondContact O-CD2 3.29Å; A139-F143 WeakPolarHBondContact O-CG 3.43Å; A139-F143 PolarHBondContact O-N 3.27Å; E140-F143 PolarHBondContact O-N 2.97Å; F143-S145 VanDerWaalsContact C-N 3.31Å; F143-S145 PolarHBondContact O-N 2.94Å; F143-C146 WeakPolarHBondContact O-CB 3.24Å; F143-C146 PolarHBondContact O-N 3.41Å; F143-L147 WeakPolarHBondContact O-CB 3.41Å; F143-L147 PolarHBondContact O-N 3.02Å; F143-R168 HydrophobicContact CD1-CB 4.18Å; F143-R168 HydrophobicContact CD2-CB 3.93Å; F143-R168 HydrophobicContact CE1-CB 4.04Å; F143-R168 HydrophobicContact CE1-CG 4.28Å; F143-R168 HydrophobicContact CE2-CB 3.76Å; F143-R168 HydrophobicContact CG-CB 4.13Å; F143-R168 HydrophobicContact CZ-CB 3.81Å; F143-R168 HydrophobicContact CZ-CG 4.12Å; F143-L169 HydrophobicContact CB-CD2 3.63Å; F143-L169 HydrophobicContact CB-CG 3.73Å; F143-V172 HydrophobicContact CD2-CG1 4.29Å; F143-V172 HydrophobicContact CD2-CG2 4.22Å; F143-V172 HydrophobicContact CE2-CG1 3.8Å
144L98.6Very high95.9Very high70 Ų7035.6 Ų35.637%0.36619%0.189SC..Hα-helixtrans-62.8-39.1171.7-74.2173.5000111.7E140 V142 C146 L147 Q148 L169E140-L144 HydrophobicContact CG-CD1 3.99Å; E140-L144 HydrophobicContact CG-CG 4.29Å; E140-L144 WeakPolarHBondContact O-CB 3.21Å; E140-L144 VanDerWaalsContact O-CG 3.32Å; E140-L144 WeakPolarHBondContact O-CG 3.32Å; E140-L144 PolarHBondContact O-N 2.68Å; V142-L144 PolarHBondContact O-N 2.86Å; L144-C146 VanDerWaalsContact C-N 3.34Å; L144-L147 PolarHBondContact O-N 3.43Å; L144-Q148 PolarHBondContact O-N 2.81Å; L144-L169 HydrophobicContact CD2-CD1 4.08Å; L144-L169 HydrophobicContact CD2-CD2 4.03Å; L144-L169 HydrophobicContact CG-CD2 3.91Å
145S98.4Very high95.7Very high6 Ų639.8 Ų39.84%0.04221%0.206CC..Hα-helixtrans-65.6-38.3175.7-54.10000111.4S102 K141 V142 F143 L149S102-S145 VanDerWaalsContact CB-OG 3.31Å; S102-S145 WeakPolarHBondContact CB-OG 3.32Å; S102-S145 PolarHBondContact OG-OG 3.39Å; K141-S145 PolarHBondContact O-N 3.09Å; K141-S145 VanDerWaalsContact O-N 3.14Å; K141-S145 PolarHBondContact O-OG 2.91Å; V142-S145 WeakPolarHBondContact O-CB 3.27Å; V142-S145 PolarHBondContact O-N 3.18Å; V142-S145 VanDerWaalsContact O-N 3.12Å; F143-S145 VanDerWaalsContact C-N 3.31Å; F143-S145 PolarHBondContact O-N 2.94Å; S145-L149 PolarHBondContact O-N 2.97Å
146C98.3Very high95.5Very high0 Ų039.7 Ų39.70%021%0.211CC..Hα-helixtrans-64.8-45.6172.4-64.20000112.2I120 F124 V142 F143 L144 Q148 L149 C150I120-C146 HydrophobicContact CG2-CB 4.47Å; F124-C146 HydrophobicContact CE1-CB 4.13Å; V142-C146 PolarHBondContact O-N 2.84Å; V142-C146 PolarHBondContact O-SG 3.49Å; V142-C146 VanDerWaalsContact O-SG 3.4Å; F143-C146 WeakPolarHBondContact O-CB 3.24Å; F143-C146 PolarHBondContact O-N 3.41Å; L144-C146 VanDerWaalsContact C-N 3.34Å; C146-Q148 VanDerWaalsContact C-N 3.29Å; C146-Q148 PolarHBondContact O-N 2.97Å; C146-L149 WeakPolarHBondContact O-CB 3.45Å; C146-L149 PolarHBondContact O-N 3.21Å; C146-L149 VanDerWaalsContact O-N 3.15Å; C146-C150 PolarHBondContact O-N 3.18Å; C146-C150 PolarHBondContact O-SG 3.46Å
147L97.6Very high95.2Very high18 Ų1842.2 Ų42.29%0.09423%0.225CC..Hα-helixtrans-60.7-41.3179.2179.463.4000110.9F143 L144 L149 C150 T151 A162 C165 L169 L188F143-L147 WeakPolarHBondContact O-CB 3.41Å; F143-L147 PolarHBondContact O-N 3.02Å; L144-L147 PolarHBondContact O-N 3.43Å; L147-L149 PolarHBondContact O-N 3.45Å; L147-C150 WeakPolarHBondContact O-CB 3.14Å; L147-C150 PolarHBondContact O-N 2.97Å; L147-C150 VanDerWaalsContact O-N 3.15Å; L147-T151 WeakPolarHBondContact O-CG2 3.45Å; L147-T151 PolarHBondContact O-N 2.98Å; L147-A162 HydrophobicContact CD1-CB 4.1Å; L147-C165 HydrophobicContact CB-CB 4.17Å; L147-C165 HydrophobicContact CD1-CB 4.14Å; L147-L169 HydrophobicContact CB-CD1 4.46Å; L147-L169 HydrophobicContact CD2-CD1 3.73Å; L147-L188 HydrophobicContact CD1-CD2 4.31Å; L147-L188 HydrophobicContact CD2-CD2 3.69Å
148Q96.6Very high95Very high116 Ų11640.6 Ų40.654%0.54221%0.208SC..Hα-helixtrans-56.4-49173.7-173.9179.26.100111.1L144 C146 C150 T151 L152L144-Q148 PolarHBondContact O-N 2.81Å; C146-Q148 VanDerWaalsContact C-N 3.29Å; C146-Q148 PolarHBondContact O-N 2.97Å; Q148-C150 VanDerWaalsContact C-N 3.31Å; Q148-C150 PolarHBondContact O-N 3.43Å; Q148-T151 PolarHBondContact O-N 3Å; Q148-T151 VanDerWaalsContact O-N 3.13Å; Q148-T151 PolarHBondContact O-OG1 3.18Å; Q148-L152 PolarHBondContact O-N 3.3Å
149L96.3Very high94.8Very high3 Ų340 Ų402%0.01620%0.204CC..Hα-helixtrans-60-38.6176-66.6-179.7000112.9C105 I108 A109 K116 A119 I120 S145 C146 L147 T151 L152C105-L149 HydrophobicContact CB-CD1 4.07Å; C105-L149 HydrophobicContact CB-CD2 4.47Å; C105-L149 HydrophobicContact CB-CG 4.29Å; I108-L149 HydrophobicContact CG2-CD1 4.38Å; A109-L149 HydrophobicContact CB-CD2 4.32Å; K116-L149 HydrophobicContact CG-CD2 4.42Å; A119-L149 HydrophobicContact CB-CD1 3.99Å; I120-L149 HydrophobicContact CD1-CB 4.06Å; I120-L149 HydrophobicContact CG1-CB 4.03Å; I120-L149 HydrophobicContact CG1-CD1 4.27Å; S145-L149 PolarHBondContact O-N 2.97Å; C146-L149 WeakPolarHBondContact O-CB 3.45Å; C146-L149 PolarHBondContact O-N 3.21Å; C146-L149 VanDerWaalsContact O-N 3.15Å; L147-L149 PolarHBondContact O-N 3.45Å; L149-T151 VanDerWaalsContact C-N 3.28Å; L149-T151 PolarHBondContact O-N 3.01Å; L149-L152 HydrophobicContact CD2-CD1 4.05Å; L149-L152 PolarHBondContact O-N 2.74Å
150C94.6Very high94.6Very high1 Ų143.5 Ų43.51%0.00722%0.218CC..Hα-helixtrans-61-38.2176.2-60.70000111.6C146 L147 Q148 L152 H153 A162C146-C150 PolarHBondContact O-N 3.18Å; C146-C150 PolarHBondContact O-SG 3.46Å; L147-C150 WeakPolarHBondContact O-CB 3.14Å; L147-C150 PolarHBondContact O-N 2.97Å; L147-C150 VanDerWaalsContact O-N 3.15Å; Q148-C150 VanDerWaalsContact C-N 3.31Å; Q148-C150 PolarHBondContact O-N 3.43Å; C150-L152 PolarHBondContact O-N 2.81Å; C150-H153 PolarHBondContact O-N 3.36Å; C150-A162 HydrophobicContact CB-CB 4.06Å
151T91.2Very high94.5Very high74 Ų7445.6 Ų45.645%0.45423%0.225SC..Hα-helixtrans-72.6-13.8-177.567.50000114.4L147 Q148 L149 H153 Y192L147-T151 WeakPolarHBondContact O-CG2 3.45Å; L147-T151 PolarHBondContact O-N 2.98Å; Q148-T151 PolarHBondContact O-N 3Å; Q148-T151 VanDerWaalsContact O-N 3.13Å; Q148-T151 PolarHBondContact O-OG1 3.18Å; L149-T151 VanDerWaalsContact C-N 3.28Å; L149-T151 PolarHBondContact O-N 3.01Å; T151-H153 PolarHBondContact O-N 2.91Å; T151-Y192 VanDerWaalsContact CG2-OH 3.27Å; T151-Y192 WeakPolarHBondContact CG2-OH 3.31Å
152L91.3Very high94.4Very high83 Ų8342 Ų4244%0.43521%0.209SC..THydrogen-bonded Turntrans-76.3-12.1178.6-62.5176.2000113.4A109 Q148 L149 C150A109-L152 HydrophobicContact CB-CD1 3.72Å; Q148-L152 PolarHBondContact O-N 3.3Å; L149-L152 HydrophobicContact CD2-CD1 4.05Å; L149-L152 PolarHBondContact O-N 2.74Å; C150-L152 PolarHBondContact O-N 2.81Å
153H84.5Confident94.3Very high38 Ų3842.6 Ų42.618%0.17621%0.213CC..  trans-126.1139.9-178.2-71-82.4000110.5K116 C150 T151 H158K116-H153 WeakPolarHBondContact CD-NE2 3.46Å; K116-H153 WeakPolarHBondContact CE-NE2 3.37Å; K116-H153 PolarHBondContact NZ-NE2 3.05Å; C150-H153 PolarHBondContact O-N 3.36Å; T151-H153 PolarHBondContact O-N 2.91Å; H153-H158 HydrophobicContact CB-CB 4.16Å; H153-H158 WeakPolarHBondContact CB-ND1 3.28Å; H153-H158 AromaticContact CD2-NE2 3.78Å; H153-H158 AromaticContact CG-CE1 3.75Å; H153-H158 AromaticContact CG-NE2 3.88Å
154D87.3Confident94.2Very high111 Ų11145 Ų4559%0.59423%0.225SC*.  trans-105.957.4176.6-150.332.2000113.2W159 K195D154-W159 WeakPolarHBondContact OD1-CZ2 3.44Å; D154-W159 PolarHBondContact OD1-NE1 3.46Å; D154-K195 WeakPolarHBondContact OD1-CE 3.33Å; D154-K195 IonicContact OD1-NZ 2.58Å; D154-K195 PolarHBondContact OD1-NZ 3.3Å; D154-K195 IonicContact OD2-NZ 3.59Å; D154-K195 PolarHBondContact OD2-NZ 3.5Å
155E90.5Very high94.1Very high96 Ų9641.7 Ų41.745%0.44921%0.207SC..SBendtrans-123.4151.1-178-62.8172.3-173.600111L157 H158 W159E155-L157 VanDerWaalsContact C-N 3.28Å; E155-L157 PolarHBondContact O-N 3.26Å; E155-H158 PolarHBondContact O-N 3.14Å; E155-H158 IonicContact OE2-CE1 2.7Å; E155-H158 IonicContact OE2-ND1 2.71Å; E155-H158 PolarHBondContact OE2-ND1 2.85Å; E155-W159 PolarHBondContact O-N 3.23Å
156V92.6Very high94.1Very high42 Ų4241.4 Ų41.426%0.25521%0.205SC..Hα-helixtrans-52.3-44.3-178.1175.10000112.5H158 W159 Y160 L196 H201V156-H158 VanDerWaalsContact C-N 3.3Å; V156-H158 PolarHBondContact O-N 3.2Å; V156-W159 HydrophobicContact CB-CE3 4.43Å; V156-W159 HydrophobicContact CG2-CE3 4.1Å; V156-W159 HydrophobicContact CG2-CH2 4.42Å; V156-W159 HydrophobicContact CG2-CZ3 3.8Å; V156-W159 PolarHBondContact O-N 3.47Å; V156-Y160 HydrophobicContact CG1-CD2 3.8Å; V156-Y160 HydrophobicContact CG1-CE2 3.58Å; V156-Y160 VanDerWaalsContact O-CD2 3.28Å; V156-Y160 WeakPolarHBondContact O-CD2 3.27Å; V156-Y160 PolarHBondContact O-N 3.14Å; V156-L196 HydrophobicContact CG1-CD2 4.04Å; V156-H201 WeakPolarHBondContact CG2-NE2 3.49Å
157L92.5Very high94.1Very high78 Ų7842.4 Ų42.441%0.40821%0.211SC..Hα-helixtrans-55.8-45.9177.4176.863.3000111.6E155 Y160 R161E155-L157 VanDerWaalsContact C-N 3.28Å; E155-L157 PolarHBondContact O-N 3.26Å; L157-Y160 WeakPolarHBondContact O-CB 3.47Å; L157-Y160 PolarHBondContact O-N 3.47Å; L157-R161 WeakPolarHBondContact O-CG 3.37Å; L157-R161 PolarHBondContact O-N 3.27Å
158H92.3Very high94.1Very high2 Ų245 Ų451%0.00922%0.22CC..Hα-helixtrans-72.1-29.7-178.1-64.894.6000112.2H153 E155 V156 R161 A162H153-H158 HydrophobicContact CB-CB 4.16Å; H153-H158 WeakPolarHBondContact CB-ND1 3.28Å; H153-H158 AromaticContact CD2-NE2 3.78Å; H153-H158 AromaticContact CG-CE1 3.75Å; H153-H158 AromaticContact CG-NE2 3.88Å; E155-H158 PolarHBondContact O-N 3.14Å; E155-H158 IonicContact OE2-CE1 2.7Å; E155-H158 IonicContact OE2-ND1 2.71Å; E155-H158 PolarHBondContact OE2-ND1 2.85Å; V156-H158 VanDerWaalsContact C-N 3.3Å; V156-H158 PolarHBondContact O-N 3.2Å; H158-R161 PolarHBondContact O-N 3.11Å; H158-A162 WeakPolarHBondContact O-CB 3.18Å; H158-A162 PolarHBondContact O-N 3.39Å
159W94.9Very high94.2Very high11 Ų1139.6 Ų39.64%0.04219%0.194CC..Hα-helixtrans-66.5-42.8171-53.8-21000111.6D154 E155 V156 R161 A162 V163 Y192 K195 L196 H199D154-W159 WeakPolarHBondContact OD1-CZ2 3.44Å; D154-W159 PolarHBondContact OD1-NE1 3.46Å; E155-W159 PolarHBondContact O-N 3.23Å; V156-W159 HydrophobicContact CB-CE3 4.43Å; V156-W159 HydrophobicContact CG2-CE3 4.1Å; V156-W159 HydrophobicContact CG2-CH2 4.42Å; V156-W159 HydrophobicContact CG2-CZ3 3.8Å; V156-W159 PolarHBondContact O-N 3.47Å; W159-R161 VanDerWaalsContact C-N 3.34Å; W159-R161 PolarHBondContact O-N 2.91Å; W159-A162 WeakPolarHBondContact O-CB 3.44Å; W159-A162 PolarHBondContact O-N 3.19Å; W159-V163 WeakPolarHBondContact O-CG2 3.4Å; W159-V163 PolarHBondContact O-N 2.85Å; W159-Y192 HydrophobicContact CB-CD1 4.08Å; W159-Y192 AromaticContact CD1-CD1 4Å; W159-Y192 AromaticContact CD1-CE1 4Å; W159-Y192 HydrophobicContact CG-CD1 4.21Å; W159-K195 HydrophobicContact CD2-CD 3.83Å; W159-K195 HydrophobicContact CD2-CG 3.97Å; W159-K195 VanDerWaalsContact CE2-CE 3.42Å; W159-K195 HydrophobicContact CE3-CD 4.3Å; W159-K195 HydrophobicContact CE3-CG 3.94Å; W159-K195 HydrophobicContact CG-CD 4.24Å; W159-K195 HydrophobicContact CH2-CD 4.39Å; W159-K195 HydrophobicContact CH2-CG 4.23Å; W159-K195 HydrophobicContact CZ2-CD 3.92Å; W159-K195 HydrophobicContact CZ2-CG 4.26Å; W159-K195 HydrophobicContact CZ3-CG 4.06Å; W159-L196 HydrophobicContact CB-CD2 3.95Å; W159-L196 HydrophobicContact CB-CG 4.02Å; W159-L196 HydrophobicContact CE3-CD2 4.07Å; W159-L196 HydrophobicContact CE3-CG 4.49Å; W159-H199 AromaticContact CH2-CE1 3.71Å; W159-H199 AromaticContact CH2-ND1 3.84Å; W159-H199 AromaticContact CH2-NE2 3.82Å; W159-H199 HydrophobicContact CZ3-CB 4.13Å; W159-H199 AromaticContact CZ3-CE1 3.93Å; W159-H199 AromaticContact CZ3-CG 3.69Å; W159-H199 AromaticContact CZ3-ND1 3.56Å
160Y95.3Very high94.3Very high75 Ų7539.4 Ų39.429%0.29419%0.194SC..Hα-helixtrans-59.1-45.6172.1-83.4-72.8000111.5V156 L157 A162 V163 E164 L196 H201 Q202 A203V156-Y160 HydrophobicContact CG1-CD2 3.8Å; V156-Y160 HydrophobicContact CG1-CE2 3.58Å; V156-Y160 VanDerWaalsContact O-CD2 3.28Å; V156-Y160 WeakPolarHBondContact O-CD2 3.27Å; V156-Y160 PolarHBondContact O-N 3.14Å; L157-Y160 WeakPolarHBondContact O-CB 3.47Å; L157-Y160 PolarHBondContact O-N 3.47Å; Y160-A162 VanDerWaalsContact C-N 3.3Å; Y160-A162 PolarHBondContact O-N 3.46Å; Y160-V163 PolarHBondContact O-N 2.95Å; Y160-E164 WeakPolarHBondContact O-CB 3.47Å; Y160-E164 PolarHBondContact O-N 3.29Å; Y160-L196 HydrophobicContact CD1-CD1 3.96Å; Y160-L196 HydrophobicContact CD1-CD2 4.43Å; Y160-L196 HydrophobicContact CD2-CD2 3.69Å; Y160-L196 HydrophobicContact CE1-CD1 4.1Å; Y160-L196 HydrophobicContact CE1-CD2 4.35Å; Y160-L196 HydrophobicContact CE2-CD2 3.57Å; Y160-L196 HydrophobicContact CG-CD1 4.23Å; Y160-L196 HydrophobicContact CG-CD2 4.12Å; Y160-H201 HydrophobicContact CE2-CB 4.31Å; Y160-H201 WeakPolarHBondContact OH-CB 3.07Å; Y160-Q202 PolarHBondContact OH-O 3.37Å; Y160-A203 HydrophobicContact CD1-CB 4.06Å; Y160-A203 HydrophobicContact CE1-CB 3.59Å
161R95.7Very high94.4Very high55 Ų5542.4 Ų42.421%0.20821%0.208CC..Hα-helixtrans-63-35.5175.9-67.1-63.5-179.4-125.2-7.7112.7E117 I120 L157 H158 W159 E164 C165E117-R161 IonicContact OE1-CZ 2.68Å; E117-R161 VanDerWaalsContact OE1-CZ 3.29Å; E117-R161 IonicContact OE1-NE 2.51Å; E117-R161 PolarHBondContact OE1-NE 3.25Å; E117-R161 IonicContact OE1-NH2 3.97Å; E117-R161 PolarHBondContact OE1-NH2 3.03Å; E117-R161 IonicContact OE2-NE 2.91Å; E117-R161 PolarHBondContact OE2-NE 3.48Å; I120-R161 HydrophobicContact CG2-CB 4.35Å; I120-R161 HydrophobicContact CG2-CG 4.37Å; L157-R161 WeakPolarHBondContact O-CG 3.37Å; L157-R161 PolarHBondContact O-N 3.27Å; H158-R161 PolarHBondContact O-N 3.11Å; W159-R161 VanDerWaalsContact C-N 3.34Å; W159-R161 PolarHBondContact O-N 2.91Å; R161-E164 IonicContact CZ-OE2 3.43Å; R161-E164 IonicContact NH1-OE2 3.22Å; R161-E164 PolarHBondContact NH1-OE2 3.02Å; R161-E164 PolarHBondContact O-N 3.04Å; R161-C165 WeakPolarHBondContact O-CB 3.46Å; R161-C165 PolarHBondContact O-N 3.48Å; R161-C165 PolarHBondContact O-SG 3.16Å
162A96.3Very high94.8Very high0 Ų039 Ų390%019%0.186CC..Hα-helixtrans-66-42.6175.500000111.8L147 C150 H158 W159 Y160 E164 C165 C166 Y192L147-A162 HydrophobicContact CD1-CB 4.1Å; C150-A162 HydrophobicContact CB-CB 4.06Å; H158-A162 WeakPolarHBondContact O-CB 3.18Å; H158-A162 PolarHBondContact O-N 3.39Å; W159-A162 WeakPolarHBondContact O-CB 3.44Å; W159-A162 PolarHBondContact O-N 3.19Å; Y160-A162 VanDerWaalsContact C-N 3.3Å; Y160-A162 PolarHBondContact O-N 3.46Å; A162-E164 VanDerWaalsContact C-N 3.34Å; A162-C165 WeakPolarHBondContact O-CB 3.39Å; A162-C165 PolarHBondContact O-N 2.82Å; A162-C166 PolarHBondContact O-N 3.03Å; A162-C166 PolarHBondContact O-SG 3.2Å; A162-Y192 HydrophobicContact CB-CD1 3.9Å; A162-Y192 HydrophobicContact CB-CD2 3.65Å; A162-Y192 HydrophobicContact CB-CE1 3.86Å; A162-Y192 HydrophobicContact CB-CE2 3.6Å; A162-Y192 HydrophobicContact CB-CG 3.81Å
163V96.6Very high95.1Very high13 Ų1336 Ų368%0.07917%0.169CC..Hα-helixtrans-60.5-46.1172.4175.40000110.4W159 Y160 C165 C166 V167 M193 L196W159-V163 WeakPolarHBondContact O-CG2 3.4Å; W159-V163 PolarHBondContact O-N 2.85Å; Y160-V163 PolarHBondContact O-N 2.95Å; V163-C165 VanDerWaalsContact C-N 3.33Å; V163-C165 PolarHBondContact O-N 3.31Å; V163-C166 WeakPolarHBondContact O-CB 3.38Å; V163-C166 PolarHBondContact O-N 3.13Å; V163-V167 WeakPolarHBondContact O-CG2 3.49Å; V163-V167 PolarHBondContact O-N 3.11Å; V163-M193 HydrophobicContact CB-SD 4.47Å; V163-M193 HydrophobicContact CG1-CG 4.31Å; V163-M193 HydrophobicContact CG1-SD 3.78Å; V163-M193 HydrophobicContact CG2-CG 4.04Å; V163-M193 HydrophobicContact CG2-SD 3.86Å; V163-L196 HydrophobicContact CG2-CD1 4.05Å
164E96Very high95.7Very high54 Ų5435 Ų3525%0.25217%0.165SC..Hα-helixtrans-62-38.1179.2-172172.8-17100112.8F124 Y160 R161 A162 R168F124-E164 HydrophobicContact CD2-CG 4.34Å; F124-E164 HydrophobicContact CE2-CB 4.14Å; F124-E164 VanDerWaalsContact CE2-CD 3.4Å; F124-E164 HydrophobicContact CE2-CG 3.69Å; F124-E164 WeakPolarHBondContact CE2-OE2 3.4Å; F124-E164 HydrophobicContact CZ-CB 4.19Å; F124-E164 HydrophobicContact CZ-CG 4.07Å; Y160-E164 WeakPolarHBondContact O-CB 3.47Å; Y160-E164 PolarHBondContact O-N 3.29Å; R161-E164 IonicContact CZ-OE2 3.43Å; R161-E164 IonicContact NH1-OE2 3.22Å; R161-E164 PolarHBondContact NH1-OE2 3.02Å; R161-E164 PolarHBondContact O-N 3.04Å; A162-E164 VanDerWaalsContact C-N 3.34Å; E164-R168 PolarHBondContact O-N 3.09Å; E164-R168 PolarHBondContact O-NH1 2.83Å; E164-R168 IonicContact OE1-CZ 2.84Å; E164-R168 VanDerWaalsContact OE1-CZ 3.29Å; E164-R168 IonicContact OE1-NH1 2.71Å; E164-R168 PolarHBondContact OE1-NH1 3.16Å; E164-R168 IonicContact OE1-NH2 3.36Å; E164-R168 PolarHBondContact OE1-NH2 3.08Å
165C97.3Very high96.1Very high0 Ų031 Ų310%015%0.15CC..Hα-helixtrans-61.6-46.9169.5-70.90000111F124 L147 R161 A162 V163 V167 R168 L169F124-C165 HydrophobicContact CE1-CB 4.41Å; F124-C165 WeakPolarHBondContact CE1-SG 3.21Å; F124-C165 WeakPolarHBondContact CZ-SG 3.41Å; L147-C165 HydrophobicContact CB-CB 4.17Å; L147-C165 HydrophobicContact CD1-CB 4.14Å; R161-C165 WeakPolarHBondContact O-CB 3.46Å; R161-C165 PolarHBondContact O-N 3.48Å; R161-C165 PolarHBondContact O-SG 3.16Å; A162-C165 WeakPolarHBondContact O-CB 3.39Å; A162-C165 PolarHBondContact O-N 2.82Å; V163-C165 VanDerWaalsContact C-N 3.33Å; V163-C165 PolarHBondContact O-N 3.31Å; C165-V167 VanDerWaalsContact C-N 3.35Å; C165-V167 PolarHBondContact O-N 3.38Å; C165-R168 PolarHBondContact O-N 2.84Å; C165-L169 WeakPolarHBondContact O-CB 3.29Å; C165-L169 WeakPolarHBondContact O-CG 3.45Å; C165-L169 PolarHBondContact O-N 3.03Å
166C98.1Very high96.3Very high0 Ų027 Ų270%013%0.132CC..Hα-helixtrans-62.8-41.4-177.1-68.50000111.6A162 V163 R168 L169 L170 T185 A189A162-C166 PolarHBondContact O-N 3.03Å; A162-C166 PolarHBondContact O-SG 3.2Å; V163-C166 WeakPolarHBondContact O-CB 3.38Å; V163-C166 PolarHBondContact O-N 3.13Å; C166-R168 VanDerWaalsContact C-N 3.33Å; C166-R168 PolarHBondContact O-N 3.49Å; C166-L169 PolarHBondContact O-N 2.88Å; C166-L170 VanDerWaalsContact O-CB 3.29Å; C166-L170 WeakPolarHBondContact O-CB 3.37Å; C166-L170 PolarHBondContact O-N 3.39Å; C166-T185 HydrophobicContact CB-CG2 3.8Å; C166-T185 WeakPolarHBondContact O-CG2 3.44Å; C166-A189 HydrophobicContact CB-CB 3.68Å
167V98Very high96.5Very high21 Ų2126 Ų2613%0.12713%0.126CC..Hα-helixtrans-58.8-45.1174.9174.50000111.1V163 C165 L170 H171 A207 L208 E211V163-V167 WeakPolarHBondContact O-CG2 3.49Å; V163-V167 PolarHBondContact O-N 3.11Å; C165-V167 VanDerWaalsContact C-N 3.35Å; C165-V167 PolarHBondContact O-N 3.38Å; V167-L170 PolarHBondContact O-N 3.38Å; V167-H171 PolarHBondContact O-N 3.25Å; V167-A207 HydrophobicContact CG1-CB 3.88Å; V167-L208 HydrophobicContact CG2-CB 3.86Å; V167-L208 HydrophobicContact CG2-CD1 4.11Å; V167-E211 HydrophobicContact CG1-CG 4.27Å
168R98.3Very high96.7Very high73 Ų7325.4 Ų25.428%0.27512%0.12SC..Hα-helixtrans-67.3-40177.8-75.1165.6177.867-11.2112.9F143 E164 C165 C166 L170 H171 V172F143-R168 HydrophobicContact CD1-CB 4.18Å; F143-R168 HydrophobicContact CD2-CB 3.93Å; F143-R168 HydrophobicContact CE1-CB 4.04Å; F143-R168 HydrophobicContact CE1-CG 4.28Å; F143-R168 HydrophobicContact CE2-CB 3.76Å; F143-R168 HydrophobicContact CG-CB 4.13Å; F143-R168 HydrophobicContact CZ-CB 3.81Å; F143-R168 HydrophobicContact CZ-CG 4.12Å; E164-R168 PolarHBondContact O-N 3.09Å; E164-R168 PolarHBondContact O-NH1 2.83Å; E164-R168 IonicContact OE1-CZ 2.84Å; E164-R168 VanDerWaalsContact OE1-CZ 3.29Å; E164-R168 IonicContact OE1-NH1 2.71Å; E164-R168 PolarHBondContact OE1-NH1 3.16Å; E164-R168 IonicContact OE1-NH2 3.36Å; E164-R168 PolarHBondContact OE1-NH2 3.08Å; C165-R168 PolarHBondContact O-N 2.84Å; C166-R168 VanDerWaalsContact C-N 3.33Å; C166-R168 PolarHBondContact O-N 3.49Å; R168-L170 VanDerWaalsContact C-N 3.32Å; R168-H171 PolarHBondContact O-N 3.13Å; R168-V172 WeakPolarHBondContact O-CG2 3.32Å; R168-V172 PolarHBondContact O-N 3.48Å; R168-V172 VanDerWaalsContact O-N 3.11Å
169L98.4Very high96.9Very high1 Ų126.7 Ų26.71%0.00513%0.125CC..Hα-helixtrans-62.2-42.8174.3-80.6167.7000111.2E140 F143 L144 L147 C165 C166 V172 R173 T185E140-L169 HydrophobicContact CG-CD2 3.9Å; F143-L169 HydrophobicContact CB-CD2 3.63Å; F143-L169 HydrophobicContact CB-CG 3.73Å; L144-L169 HydrophobicContact CD2-CD1 4.08Å; L144-L169 HydrophobicContact CD2-CD2 4.03Å; L144-L169 HydrophobicContact CG-CD2 3.91Å; L147-L169 HydrophobicContact CB-CD1 4.46Å; L147-L169 HydrophobicContact CD2-CD1 3.73Å; C165-L169 WeakPolarHBondContact O-CB 3.29Å; C165-L169 WeakPolarHBondContact O-CG 3.45Å; C165-L169 PolarHBondContact O-N 3.03Å; C166-L169 PolarHBondContact O-N 2.88Å; L169-V172 VanDerWaalsContact O-CG2 3.32Å; L169-V172 WeakPolarHBondContact O-CG2 3.42Å; L169-V172 PolarHBondContact O-N 3.27Å; L169-R173 WeakPolarHBondContact O-CB 3.36Å; L169-R173 WeakPolarHBondContact O-CD 3.44Å; L169-R173 WeakPolarHBondContact O-CG 3.27Å; L169-R173 PolarHBondContact O-N 2.66Å; L169-T185 HydrophobicContact CB-CG2 3.92Å
170L98Very high96.9Very high0 Ų031.9 Ų31.90%015%0.15CC..Hα-helixtrans-62.5-45.9178.4-172.655.6000110.5C166 V167 R168 V172 R173 N174 G182 T185 V186 L208 E211 L215C166-L170 VanDerWaalsContact O-CB 3.29Å; C166-L170 WeakPolarHBondContact O-CB 3.37Å; C166-L170 PolarHBondContact O-N 3.39Å; V167-L170 PolarHBondContact O-N 3.38Å; R168-L170 VanDerWaalsContact C-N 3.32Å; L170-V172 PolarHBondContact O-N 3.05Å; L170-R173 PolarHBondContact O-N 3.25Å; L170-N174 WeakPolarHBondContact O-CB 3.5Å; L170-N174 PolarHBondContact O-N 3.18Å; L170-N174 PolarHBondContact O-ND2 2.58Å; L170-N174 PolarHBondContact O-OD1 2.95Å; L170-G182 WeakPolarHBondContact CD1-O 3.34Å; L170-T185 HydrophobicContact CB-CG2 4.03Å; L170-V186 HydrophobicContact CD1-CG2 3.94Å; L170-V186 HydrophobicContact CD2-CG2 3.62Å; L170-V186 HydrophobicContact CG-CG2 4.46Å; L170-L208 HydrophobicContact CD2-CD1 4.35Å; L170-E211 HydrophobicContact CB-CB 4.3Å; L170-E211 HydrophobicContact CD2-CB 3.52Å; L170-E211 HydrophobicContact CG-CB 3.81Å; L170-L215 HydrophobicContact CD1-CD2 4.08Å
171H98Very high97Very high64 Ų6430 Ų3030%0.29615%0.145SC..Hα-helixtrans-54.4-54174.8-176.278.1000112.9S131 V167 R168 R173 N174 G175 E211S131-H171 PolarHBondContact OG-CD2 3.41Å; V167-H171 PolarHBondContact O-N 3.25Å; R168-H171 PolarHBondContact O-N 3.13Å; H171-R173 VanDerWaalsContact C-N 3.34Å; H171-R173 PolarHBondContact O-N 3.15Å; H171-N174 PolarHBondContact O-N 3.38Å; H171-G175 PolarHBondContact O-N 2.83Å; H171-E211 WeakPolarHBondContact CA-OE2 3.47Å; H171-E211 HydrophobicContact CB-CG 4.45Å; H171-E211 IonicContact CE1-OE1 2.68Å; H171-E211 IonicContact CG-OE1 3.4Å; H171-E211 IonicContact ND1-OE1 3.37Å; H171-E211 PolarHBondContact ND1-OE1 3.46Å; H171-E211 IonicContact ND1-OE2 2.82Å
172V98.3Very high97.1Very high1 Ų127.4 Ų27.41%0.00614%0.135CC..Hα-helixtrans-69.6-30.8-178.5-59.90000112.7S131 Y136 A139 E140 F143 R168 L169 L170 N176S131-V172 WeakPolarHBondContact OG-CG1 3.46Å; Y136-V172 HydrophobicContact CD1-CB 4.09Å; Y136-V172 HydrophobicContact CD1-CG1 4.02Å; Y136-V172 HydrophobicContact CG-CB 4.49Å; A139-V172 HydrophobicContact CB-CG1 4Å; E140-V172 HydrophobicContact CB-CG2 3.91Å; E140-V172 HydrophobicContact CG-CG2 4.46Å; F143-V172 HydrophobicContact CD2-CG1 4.29Å; F143-V172 HydrophobicContact CD2-CG2 4.22Å; F143-V172 HydrophobicContact CE2-CG1 3.8Å; R168-V172 WeakPolarHBondContact O-CG2 3.32Å; R168-V172 PolarHBondContact O-N 3.48Å; R168-V172 VanDerWaalsContact O-N 3.11Å; L169-V172 VanDerWaalsContact O-CG2 3.32Å; L169-V172 WeakPolarHBondContact O-CG2 3.42Å; L169-V172 PolarHBondContact O-N 3.27Å; L170-V172 PolarHBondContact O-N 3.05Å; V172-N176 WeakPolarHBondContact O-CB 3.37Å; V172-N176 PolarHBondContact O-N 3.08Å
173R98.1Very high97.1Very high22 Ų2230.8 Ų30.88%0.08315%0.151CC..Hα-helixtrans-70.7-41175.7-75.8170.1172.2-166.2-5.8111.4E140 L169 L170 H171 N176 C177 K178 L181 T185E140-R173 IonicContact OE1-CZ 3.43Å; E140-R173 IonicContact OE1-NE 2.91Å; E140-R173 PolarHBondContact OE1-NE 3.46Å; E140-R173 IonicContact OE1-NH2 3.06Å; E140-R173 PolarHBondContact OE1-NH2 2.92Å; L169-R173 WeakPolarHBondContact O-CB 3.36Å; L169-R173 WeakPolarHBondContact O-CD 3.44Å; L169-R173 WeakPolarHBondContact O-CG 3.27Å; L169-R173 PolarHBondContact O-N 2.66Å; L170-R173 PolarHBondContact O-N 3.25Å; H171-R173 VanDerWaalsContact C-N 3.34Å; H171-R173 PolarHBondContact O-N 3.15Å; R173-N176 CarbonylContact O-C 3.57Å; R173-N176 PolarHBondContact O-N 3.16Å; R173-C177 PolarHBondContact O-N 2.85Å; R173-C177 VanDerWaalsContact O-N 3.13Å; R173-K178 HydrophobicContact CB-CB 4.25Å; R173-K178 HydrophobicContact CG-CB 4.35Å; R173-K178 PolarHBondContact O-N 2.91Å; R173-L181 HydrophobicContact CG-CB 4.38Å; R173-L181 PolarHBondContact NH1-O 2.85Å; R173-T185 PolarHBondContact NH1-OG1 3.43Å
174N96.9Very high97.1Very high17 Ų1735.5 Ų35.59%0.09117%0.172CC..Hα-helixtrans-61-52.4173.1-71.2-13.7000110.5L170 H171 N176 C177 E211 L215L170-N174 WeakPolarHBondContact O-CB 3.5Å; L170-N174 PolarHBondContact O-N 3.18Å; L170-N174 PolarHBondContact O-ND2 2.58Å; L170-N174 PolarHBondContact O-OD1 2.95Å; H171-N174 PolarHBondContact O-N 3.38Å; N174-N176 PolarHBondContact O-N 3.1Å; N174-C177 PolarHBondContact O-N 3.03Å; N174-E211 PolarHBondContact ND2-O 2.85Å; N174-E211 PolarHBondContact ND2-OE2 3.42Å; N174-L215 WeakPolarHBondContact OD1-CB 3.41Å; N174-L215 WeakPolarHBondContact OD1-CD1 3.26Å
175G95.2Very high97.2Very high26 Ų2633.1 Ų33.127%0.26816%0.161SC..Hα-helixtrans-61.4-28.6179.100000114.1Y136 H171Y136-G175 WeakPolarHBondContact CE2-O 3.21Å; H171-G175 PolarHBondContact O-N 2.83Å
176N96.1Very high97.2Very high13 Ų1334.4 Ų34.47%0.0717%0.169CC..THydrogen-bonded Turntrans-98.515.7177.4-153.828.8000113.6Y136 V172 R173 N174 K178 H372Y136-N176 HydrophobicContact CD2-CB 3.99Å; Y136-N176 HydrophobicContact CG-CB 4.22Å; V172-N176 WeakPolarHBondContact O-CB 3.37Å; V172-N176 PolarHBondContact O-N 3.08Å; R173-N176 CarbonylContact O-C 3.57Å; R173-N176 PolarHBondContact O-N 3.16Å; N174-N176 PolarHBondContact O-N 3.1Å; N176-K178 WeakPolarHBondContact ND2-CE 3.35Å; N176-K178 PolarHBondContact O-N 3.48Å; N176-K178 VanDerWaalsContact O-N 3.09Å; N176-H372 PolarHBondContact O-NE2 3.48Å; N176-H372 PolarHBondContact OD1-NE2 3.2Å
177C96.6Very high97.2Very high21 Ų2141.7 Ų41.714%0.14220%0.201CC..THydrogen-bonded Turntrans56.924.2178.2-57.60000116R173 N174 Y179 L373R173-C177 PolarHBondContact O-N 2.85Å; R173-C177 VanDerWaalsContact O-N 3.13Å; N174-C177 PolarHBondContact O-N 3.03Å; C177-Y179 VanDerWaalsContact C-N 3.29Å; C177-Y179 HydrophobicContact CB-CE2 4.21Å; C177-Y179 PolarHBondContact O-N 3.27Å; C177-Y179 PolarHBondContact SG-OH 3.48Å; C177-L373 HydrophobicContact CB-CB 3.82Å; C177-L373 HydrophobicContact CB-CD2 3.79Å; C177-L373 HydrophobicContact CB-CG 4.29Å
178K96.4Very high97.2Very high65 Ų6543.2 Ų43.228%0.28321%0.208SC..  trans-90.555.5177-62.2-171.8-176.2174.70111.4E140 R173 N176 H180 L181 G182E140-K178 IonicContact OE2-NZ 2.9Å; E140-K178 PolarHBondContact OE2-NZ 3.38Å; R173-K178 HydrophobicContact CB-CB 4.25Å; R173-K178 HydrophobicContact CG-CB 4.35Å; R173-K178 PolarHBondContact O-N 2.91Å; N176-K178 WeakPolarHBondContact ND2-CE 3.35Å; N176-K178 PolarHBondContact O-N 3.48Å; N176-K178 VanDerWaalsContact O-N 3.09Å; K178-H180 VanDerWaalsContact C-N 3.34Å; K178-H180 PolarHBondContact O-N 2.93Å; K178-L181 HydrophobicContact CB-CB 4.4Å; K178-L181 HydrophobicContact CB-CD1 4.25Å; K178-L181 HydrophobicContact CB-CG 4.48Å; K178-L181 HydrophobicContact CD-CD1 3.91Å; K178-L181 PolarHBondContact O-N 2.73Å; K178-L181 VanDerWaalsContact O-N 3.14Å; K178-G182 PolarHBondContact O-N 3.5Å
179Y96.1Very high97.1Very high29 Ų2939.8 Ų39.811%0.11420%0.195CC..Hα-helixtrans-61.2-36.6-169.4-52.3-51.1000114.3C177 L181 G182 E183 L215 A218 K219 L373 F421C177-Y179 VanDerWaalsContact C-N 3.29Å; C177-Y179 HydrophobicContact CB-CE2 4.21Å; C177-Y179 PolarHBondContact O-N 3.27Å; C177-Y179 PolarHBondContact SG-OH 3.48Å; Y179-L181 VanDerWaalsContact C-N 3.34Å; Y179-L181 PolarHBondContact O-N 2.87Å; Y179-G182 WeakPolarHBondContact O-CA 3.48Å; Y179-G182 PolarHBondContact O-N 2.94Å; Y179-E183 PolarHBondContact O-N 3.31Å; Y179-L215 HydrophobicContact CD1-CD1 3.86Å; Y179-L215 HydrophobicContact CG-CD1 4.23Å; Y179-A218 HydrophobicContact CD1-CB 4.26Å; Y179-A218 HydrophobicContact CE1-CB 3.58Å; Y179-K219 HydrophobicContact CG-CG 4.32Å; Y179-L373 HydrophobicContact CD2-CD2 4.38Å; Y179-L373 HydrophobicContact CE2-CD2 3.55Å; Y179-F421 HydrophobicContact CD2-CD1 4.44Å; Y179-F421 AromaticContact CD2-CE1 3.7Å; Y179-F421 HydrophobicContact CD2-CE1 3.7Å; Y179-F421 HydrophobicContact CD2-CZ 4.39Å; Y179-F421 HydrophobicContact CE2-CD1 4.49Å; Y179-F421 AromaticContact CE2-CE1 3.41Å; Y179-F421 HydrophobicContact CE2-CE1 3.41Å; Y179-F421 VanDerWaalsContact CE2-CE1 3.41Å; Y179-F421 AromaticContact CE2-CZ 3.69Å; Y179-F421 HydrophobicContact CE2-CZ 3.69Å
180H95.3Very high97Very high120 Ų12043.1 Ų43.156%0.55621%0.21SC*.Hα-helixtrans-59.8-43.7176.267.3-82.3000112K178 G182 E183 E184K178-H180 VanDerWaalsContact C-N 3.34Å; K178-H180 PolarHBondContact O-N 2.93Å; H180-G182 VanDerWaalsContact C-N 3.28Å; H180-G182 PolarHBondContact O-N 3.46Å; H180-E183 PolarHBondContact O-N 3.26Å; H180-E184 PolarHBondContact O-N 3.49Å
181L97.4Very high96.9Very high36 Ų3648.2 Ų48.219%0.18824%0.237CC..Hα-helixtrans-68.7-30.2174-59.4-175.8000111.7R173 K178 Y179 E184 T185R173-L181 HydrophobicContact CG-CB 4.38Å; R173-L181 PolarHBondContact NH1-O 2.85Å; K178-L181 HydrophobicContact CB-CB 4.4Å; K178-L181 HydrophobicContact CB-CD1 4.25Å; K178-L181 HydrophobicContact CB-CG 4.48Å; K178-L181 HydrophobicContact CD-CD1 3.91Å; K178-L181 PolarHBondContact O-N 2.73Å; K178-L181 VanDerWaalsContact O-N 3.14Å; Y179-L181 VanDerWaalsContact C-N 3.34Å; Y179-L181 PolarHBondContact O-N 2.87Å; L181-E184 PolarHBondContact O-N 3.44Å; L181-T185 PolarHBondContact O-N 3.48Å; L181-T185 PolarHBondContact O-OG1 3.32Å
182G97Very high96.8Very high0 Ų046.5 Ų46.50%023%0.228CC..Hα-helixtrans-59.9-44.5172.500000112L170 K178 Y179 H180 E184 T185 V186L170-G182 WeakPolarHBondContact CD1-O 3.34Å; K178-G182 PolarHBondContact O-N 3.5Å; Y179-G182 WeakPolarHBondContact O-CA 3.48Å; Y179-G182 PolarHBondContact O-N 2.94Å; H180-G182 VanDerWaalsContact C-N 3.28Å; H180-G182 PolarHBondContact O-N 3.46Å; G182-E184 VanDerWaalsContact C-N 3.34Å; G182-E184 PolarHBondContact O-N 3.05Å; G182-T185 WeakPolarHBondContact O-CA 3.45Å; G182-T185 WeakPolarHBondContact O-CB 3.5Å; G182-T185 PolarHBondContact O-N 2.87Å; G182-T185 VanDerWaalsContact O-N 3.11Å; G182-V186 WeakPolarHBondContact O-CG2 3.48Å; G182-V186 PolarHBondContact O-N 3.05Å
183E96.8Very high96.7Very high71 Ų7147 Ų4733%0.33223%0.231SC..Hα-helixtrans-62.9-39.1176.5-67.6179.4126.500112.5Y179 H180 T185 V186 K187 L215 K219Y179-E183 PolarHBondContact O-N 3.31Å; H180-E183 PolarHBondContact O-N 3.26Å; E183-T185 VanDerWaalsContact C-N 3.34Å; E183-V186 PolarHBondContact O-N 3.2Å; E183-K187 WeakPolarHBondContact O-CG 3.5Å; E183-K187 PolarHBondContact O-N 3.04Å; E183-K187 VanDerWaalsContact O-N 3.14Å; E183-L215 HydrophobicContact CG-CD2 3.96Å; E183-K219 IonicContact OE1-NZ 3.47Å; E183-K219 PolarHBondContact OE1-NZ 2.98Å; E183-K219 IonicContact OE2-NZ 3.07Å; E183-K219 PolarHBondContact OE2-NZ 3.07Å
184E97.4Very high96.5Very high112 Ų11249.3 Ų49.352%0.52324%0.244SC..Hα-helixtrans-62.7-41.4172.2-66176.4179.400111.6H180 L181 G182 V186 K187 L188H180-E184 PolarHBondContact O-N 3.49Å; L181-E184 PolarHBondContact O-N 3.44Å; G182-E184 VanDerWaalsContact C-N 3.34Å; G182-E184 PolarHBondContact O-N 3.05Å; E184-V186 VanDerWaalsContact C-N 3.35Å; E184-V186 PolarHBondContact O-N 2.92Å; E184-K187 PolarHBondContact O-N 3.49Å; E184-L188 PolarHBondContact O-N 3.21Å
185T98.1Very high96.4Very high3 Ų351.3 Ų51.32%0.01825%0.252CS..Hα-helixtrans-61.8-41175.1-60.40000112.2C166 L169 L170 R173 L181 G182 E183 L188 A189C166-T185 HydrophobicContact CB-CG2 3.8Å; C166-T185 WeakPolarHBondContact O-CG2 3.44Å; L169-T185 HydrophobicContact CB-CG2 3.92Å; L170-T185 HydrophobicContact CB-CG2 4.03Å; R173-T185 PolarHBondContact NH1-OG1 3.43Å; L181-T185 PolarHBondContact O-N 3.48Å; L181-T185 PolarHBondContact O-OG1 3.32Å; G182-T185 WeakPolarHBondContact O-CA 3.45Å; G182-T185 WeakPolarHBondContact O-CB 3.5Å; G182-T185 PolarHBondContact O-N 2.87Å; G182-T185 VanDerWaalsContact O-N 3.11Å; E183-T185 VanDerWaalsContact C-N 3.34Å; T185-L188 PolarHBondContact O-N 3.31Å; T185-A189 WeakPolarHBondContact O-CB 3.32Å; T185-A189 PolarHBondContact O-N 3.04Å
186V97.7Very high96.5Very high28 Ų2850.1 Ų50.117%0.1724%0.24CC..Hα-helixtrans-62-45.4177.3171.40000110.6L170 G182 E183 E184 L188 A189 Q190 L212 L215L170-V186 HydrophobicContact CD1-CG2 3.94Å; L170-V186 HydrophobicContact CD2-CG2 3.62Å; L170-V186 HydrophobicContact CG-CG2 4.46Å; G182-V186 WeakPolarHBondContact O-CG2 3.48Å; G182-V186 PolarHBondContact O-N 3.05Å; E183-V186 PolarHBondContact O-N 3.2Å; E184-V186 VanDerWaalsContact C-N 3.35Å; E184-V186 PolarHBondContact O-N 2.92Å; V186-L188 VanDerWaalsContact C-N 3.3Å; V186-L188 PolarHBondContact O-N 3.32Å; V186-A189 PolarHBondContact O-N 3Å; V186-Q190 PolarHBondContact O-N 3.06Å; V186-L212 HydrophobicContact CG1-CD1 4.03Å; V186-L212 HydrophobicContact CG1-CD2 4.28Å; V186-L212 HydrophobicContact CG2-CD1 3.92Å; V186-L215 HydrophobicContact CG2-CD2 4.02Å
187K97.7Very high96.4Very high153 Ų15352.5 Ų52.567%0.66526%0.262SS*.Hα-helixtrans-59.7-42.4176.4-69.1171.5-175.3173.50111.5E183 E184 Q190 L191E183-K187 WeakPolarHBondContact O-CG 3.5Å; E183-K187 PolarHBondContact O-N 3.04Å; E183-K187 VanDerWaalsContact O-N 3.14Å; E184-K187 PolarHBondContact O-N 3.49Å; K187-Q190 PolarHBondContact O-N 2.65Å; K187-L191 PolarHBondContact O-N 3.45Å
188L97.3Very high96.3Very high53 Ų5359.9 Ų59.928%0.27729%0.291SS..Hα-helixtrans-67.1-41.3177.4-173.761.5000112.3L147 E184 T185 V186 Q190 L191 Y192L147-L188 HydrophobicContact CD1-CD2 4.31Å; L147-L188 HydrophobicContact CD2-CD2 3.69Å; E184-L188 PolarHBondContact O-N 3.21Å; T185-L188 PolarHBondContact O-N 3.31Å; V186-L188 VanDerWaalsContact C-N 3.3Å; V186-L188 PolarHBondContact O-N 3.32Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 2.89Å; L188-L191 HydrophobicContact CD1-CD2 4.17Å; L188-L191 WeakPolarHBondContact O-CB 3.34Å; L188-L191 PolarHBondContact O-N 2.97Å; L188-Y192 HydrophobicContact CD1-CD2 4.14Å; L188-Y192 HydrophobicContact CD1-CE2 3.66Å; L188-Y192 HydrophobicContact CG-CD2 4.18Å; L188-Y192 HydrophobicContact CG-CE2 3.94Å; L188-Y192 WeakPolarHBondContact O-CD2 3.39Å; L188-Y192 PolarHBondContact O-N 3.18Å
189A97.1Very high96.3Very high0 Ų061.8 Ų61.80%030%0.301CS..Hα-helixtrans-59.1-46.6174.800000110.7C166 T185 V186 L191 Y192 M193 L208C166-A189 HydrophobicContact CB-CB 3.68Å; T185-A189 WeakPolarHBondContact O-CB 3.32Å; T185-A189 PolarHBondContact O-N 3.04Å; V186-A189 PolarHBondContact O-N 3Å; A189-L191 VanDerWaalsContact C-N 3.32Å; A189-L191 PolarHBondContact O-N 3.44Å; A189-Y192 PolarHBondContact O-N 2.91Å; A189-M193 WeakPolarHBondContact O-CB 3.5Å; A189-M193 VanDerWaalsContact O-CG 3.25Å; A189-M193 WeakPolarHBondContact O-CG 3.46Å; A189-M193 PolarHBondContact O-N 2.97Å; A189-L208 HydrophobicContact CB-CD1 3.67Å; A189-L208 HydrophobicContact CB-CD2 3.94Å; A189-L208 HydrophobicContact CB-CG 4.49Å
190Q96.2Very high96.2Very high71 Ų7163.7 Ų63.733%0.33233%0.33SS..Hα-helixtrans-61.1-40.5178.1-170.86145.200111.8V186 K187 L188 Y192 M193 D194V186-Q190 PolarHBondContact O-N 3.06Å; K187-Q190 PolarHBondContact O-N 2.65Å; L188-Q190 VanDerWaalsContact C-N 3.33Å; L188-Q190 PolarHBondContact O-N 2.89Å; Q190-Y192 PolarHBondContact O-N 3.44Å; Q190-M193 WeakPolarHBondContact O-CB 3.38Å; Q190-M193 PolarHBondContact O-N 3.05Å; Q190-D194 PolarHBondContact NE2-OD1 3.29Å; Q190-D194 WeakPolarHBondContact O-CB 3.12Å; Q190-D194 VanDerWaalsContact O-CG 3.23Å; Q190-D194 PolarHBondContact O-N 3Å
191L96Very high96.1Very high107 Ų10761.2 Ų61.256%0.5632%0.318SS*.Hα-helixtrans-56.5-47.5175.817868.3000112.2K187 L188 A189 K195K187-L191 PolarHBondContact O-N 3.45Å; L188-L191 HydrophobicContact CD1-CD2 4.17Å; L188-L191 WeakPolarHBondContact O-CB 3.34Å; L188-L191 PolarHBondContact O-N 2.97Å; A189-L191 VanDerWaalsContact C-N 3.32Å; A189-L191 PolarHBondContact O-N 3.44Å; L191-K195 WeakPolarHBondContact O-CB 3.42Å; L191-K195 PolarHBondContact O-N 2.91Å
192Y96Very high95.6Very high29 Ų2968.3 Ų68.311%0.11435%0.35CS..Hα-helixtrans-71.5-34.6178.4-76-71.1000112.6T151 W159 A162 L188 A189 Q190 K195 L196T151-Y192 VanDerWaalsContact CG2-OH 3.27Å; T151-Y192 WeakPolarHBondContact CG2-OH 3.31Å; W159-Y192 HydrophobicContact CB-CD1 4.08Å; W159-Y192 AromaticContact CD1-CD1 4Å; W159-Y192 AromaticContact CD1-CE1 4Å; W159-Y192 HydrophobicContact CG-CD1 4.21Å; A162-Y192 HydrophobicContact CB-CD1 3.9Å; A162-Y192 HydrophobicContact CB-CD2 3.65Å; A162-Y192 HydrophobicContact CB-CE1 3.86Å; A162-Y192 HydrophobicContact CB-CE2 3.6Å; A162-Y192 HydrophobicContact CB-CG 3.81Å; L188-Y192 HydrophobicContact CD1-CD2 4.14Å; L188-Y192 HydrophobicContact CD1-CE2 3.66Å; L188-Y192 HydrophobicContact CG-CD2 4.18Å; L188-Y192 HydrophobicContact CG-CE2 3.94Å; L188-Y192 WeakPolarHBondContact O-CD2 3.39Å; L188-Y192 PolarHBondContact O-N 3.18Å; A189-Y192 PolarHBondContact O-N 2.91Å; Q190-Y192 PolarHBondContact O-N 3.44Å; Y192-K195 WeakPolarHBondContact O-CB 3.18Å; Y192-K195 PolarHBondContact O-N 3.48Å; Y192-L196 WeakPolarHBondContact O-CG 3.32Å; Y192-L196 PolarHBondContact O-N 3.34Å
193M95.3Very high95.2Very high12 Ų1269 Ų696%0.05936%0.356CS..Hα-helixtrans-61.6-45.2172.8-73.5-63-58.500111.8V163 A189 Q190 K195 L196 A197 A203 K205 L208V163-M193 HydrophobicContact CB-SD 4.47Å; V163-M193 HydrophobicContact CG1-CG 4.31Å; V163-M193 HydrophobicContact CG1-SD 3.78Å; V163-M193 HydrophobicContact CG2-CG 4.04Å; V163-M193 HydrophobicContact CG2-SD 3.86Å; A189-M193 WeakPolarHBondContact O-CB 3.5Å; A189-M193 VanDerWaalsContact O-CG 3.25Å; A189-M193 WeakPolarHBondContact O-CG 3.46Å; A189-M193 PolarHBondContact O-N 2.97Å; Q190-M193 WeakPolarHBondContact O-CB 3.38Å; Q190-M193 PolarHBondContact O-N 3.05Å; M193-K195 VanDerWaalsContact C-N 3.27Å; M193-K195 PolarHBondContact O-N 2.98Å; M193-L196 PolarHBondContact O-N 2.99Å; M193-A197 WeakPolarHBondContact O-CB 3.16Å; M193-A197 PolarHBondContact O-N 3.41Å; M193-A203 HydrophobicContact CE-CB 3.91Å; M193-A203 HydrophobicContact SD-CB 3.77Å; M193-K205 HydrophobicContact CE-CD 3.76Å; M193-K205 VanDerWaalsContact CE-CE 3.48Å; M193-K205 HydrophobicContact CE-CG 3.55Å; M193-L208 HydrophobicContact CG-CD2 4.17Å
194D94.8Very high94.9Very high69 Ų6968.9 Ų68.937%0.36936%0.358SS..Hα-helixtrans-63.7-37.2175.5-68.8-16000111Q190 A197 K198Q190-D194 PolarHBondContact NE2-OD1 3.29Å; Q190-D194 WeakPolarHBondContact O-CB 3.12Å; Q190-D194 VanDerWaalsContact O-CG 3.23Å; Q190-D194 PolarHBondContact O-N 3Å; D194-A197 PolarHBondContact O-N 2.84Å; D194-K198 WeakPolarHBondContact O-CB 3.32Å; D194-K198 VanDerWaalsContact O-CG 3.24Å; D194-K198 WeakPolarHBondContact O-CG 3.33Å; D194-K198 PolarHBondContact O-N 3.31Å
195K94.7Very high94.8Very high60 Ų6066.8 Ų66.826%0.26135%0.347SS..Hα-helixtrans-63.7-46.4175.9-165.6169.2-166.4172.70111.8D154 W159 L191 Y192 M193 K198 H199D154-K195 WeakPolarHBondContact OD1-CE 3.33Å; D154-K195 IonicContact OD1-NZ 2.58Å; D154-K195 PolarHBondContact OD1-NZ 3.3Å; D154-K195 IonicContact OD2-NZ 3.59Å; D154-K195 PolarHBondContact OD2-NZ 3.5Å; W159-K195 HydrophobicContact CD2-CD 3.83Å; W159-K195 HydrophobicContact CD2-CG 3.97Å; W159-K195 VanDerWaalsContact CE2-CE 3.42Å; W159-K195 HydrophobicContact CE3-CD 4.3Å; W159-K195 HydrophobicContact CE3-CG 3.94Å; W159-K195 HydrophobicContact CG-CD 4.24Å; W159-K195 HydrophobicContact CH2-CD 4.39Å; W159-K195 HydrophobicContact CH2-CG 4.23Å; W159-K195 HydrophobicContact CZ2-CD 3.92Å; W159-K195 HydrophobicContact CZ2-CG 4.26Å; W159-K195 HydrophobicContact CZ3-CG 4.06Å; L191-K195 WeakPolarHBondContact O-CB 3.42Å; L191-K195 PolarHBondContact O-N 2.91Å; Y192-K195 WeakPolarHBondContact O-CB 3.18Å; Y192-K195 PolarHBondContact O-N 3.48Å; M193-K195 VanDerWaalsContact C-N 3.27Å; M193-K195 PolarHBondContact O-N 2.98Å; K195-K198 PolarHBondContact O-N 3.05Å; K195-H199 PolarHBondContact O-N 3.12Å; K195-H199 PolarHBondContact O-ND1 3.43Å
196L95.9Very high94.7Very high0 Ų066.7 Ų66.70%035%0.346CS..Hα-helixtrans-59.5-49.3174.4-75.3165.8000111.2V156 W159 Y160 V163 Y192 M193 K198 H199 G200 H201 A203V156-L196 HydrophobicContact CG1-CD2 4.04Å; W159-L196 HydrophobicContact CB-CD2 3.95Å; W159-L196 HydrophobicContact CB-CG 4.02Å; W159-L196 HydrophobicContact CE3-CD2 4.07Å; W159-L196 HydrophobicContact CE3-CG 4.49Å; Y160-L196 HydrophobicContact CD1-CD1 3.96Å; Y160-L196 HydrophobicContact CD1-CD2 4.43Å; Y160-L196 HydrophobicContact CD2-CD2 3.69Å; Y160-L196 HydrophobicContact CE1-CD1 4.1Å; Y160-L196 HydrophobicContact CE1-CD2 4.35Å; Y160-L196 HydrophobicContact CE2-CD2 3.57Å; Y160-L196 HydrophobicContact CG-CD1 4.23Å; Y160-L196 HydrophobicContact CG-CD2 4.12Å; V163-L196 HydrophobicContact CG2-CD1 4.05Å; Y192-L196 WeakPolarHBondContact O-CG 3.32Å; Y192-L196 PolarHBondContact O-N 3.34Å; M193-L196 PolarHBondContact O-N 2.99Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.15Å; L196-H199 CarbonylContact O-C 3.6Å; L196-H199 PolarHBondContact O-N 3.48Å; L196-G200 PolarHBondContact O-N 2.99Å; L196-H201 CarbonylContact C-O 3.42Å; L196-H201 VanDerWaalsContact C-O 3.29Å; L196-H201 HydrophobicContact CB-CB 4.16Å; L196-H201 HydrophobicContact CD2-CB 3.94Å; L196-H201 WeakPolarHBondContact O-CB 3.35Å; L196-H201 PolarHBondContact O-N 3.49Å; L196-A203 HydrophobicContact CD1-CB 4.31Å
197A94.8Very high94.6Very high64 Ų6466.9 Ų66.953%0.52935%0.351SS..Hα-helixtrans-60.1-42.5-179.100000112.5M193 D194 H199 G200 H201M193-A197 WeakPolarHBondContact O-CB 3.16Å; M193-A197 PolarHBondContact O-N 3.41Å; D194-A197 PolarHBondContact O-N 2.84Å; A197-H199 PolarHBondContact O-N 3.36Å; A197-G200 PolarHBondContact O-N 3.35Å; A197-H201 WeakPolarHBondContact CA-O 3.44Å; A197-H201 PolarHBondContact N-O 3.37Å
198K95.4Very high94.6Very high175 Ų17560.1 Ų60.176%0.76132%0.322SS*.Hα-helixtrans-59.7-26.6175.5-77.3172.2-176.3175.80113.5D194 K195 L196D194-K198 WeakPolarHBondContact O-CB 3.32Å; D194-K198 VanDerWaalsContact O-CG 3.24Å; D194-K198 WeakPolarHBondContact O-CG 3.33Å; D194-K198 PolarHBondContact O-N 3.31Å; K195-K198 PolarHBondContact O-N 3.05Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.15Å
199H95.3Very high94.7Very high105 Ų10558.6 Ų58.649%0.48631%0.313SS..THydrogen-bonded Turntrans-98.715.7177.9-65.180000112.7W159 K195 L196 A197 H201W159-H199 AromaticContact CH2-CE1 3.71Å; W159-H199 AromaticContact CH2-ND1 3.84Å; W159-H199 AromaticContact CH2-NE2 3.82Å; W159-H199 HydrophobicContact CZ3-CB 4.13Å; W159-H199 AromaticContact CZ3-CE1 3.93Å; W159-H199 AromaticContact CZ3-CG 3.69Å; W159-H199 AromaticContact CZ3-ND1 3.56Å; K195-H199 PolarHBondContact O-N 3.12Å; K195-H199 PolarHBondContact O-ND1 3.43Å; L196-H199 CarbonylContact O-C 3.6Å; L196-H199 PolarHBondContact O-N 3.48Å; A197-H199 PolarHBondContact O-N 3.36Å; H199-H201 VanDerWaalsContact C-N 3.31Å; H199-H201 PolarHBondContact O-CD2 2.8Å; H199-H201 PolarHBondContact O-N 2.94Å
200G94.5Very high94.7Very high70 Ų7058.9 Ų58.972%0.72232%0.315SS*.THydrogen-bonded Turntrans76.214.6176.500000114.5L196 A197L196-G200 PolarHBondContact O-N 2.99Å; A197-G200 PolarHBondContact O-N 3.35Å
201H93.6Very high94.8Very high68 Ų6856.5 Ų56.532%0.31530%0.304SS..  trans-100.6133.9178.7-67.1-66000111.2V156 Y160 L196 A197 H199V156-H201 WeakPolarHBondContact CG2-NE2 3.49Å; Y160-H201 HydrophobicContact CE2-CB 4.31Å; Y160-H201 WeakPolarHBondContact OH-CB 3.07Å; L196-H201 CarbonylContact C-O 3.42Å; L196-H201 VanDerWaalsContact C-O 3.29Å; L196-H201 HydrophobicContact CB-CB 4.16Å; L196-H201 HydrophobicContact CD2-CB 3.94Å; L196-H201 WeakPolarHBondContact O-CB 3.35Å; L196-H201 PolarHBondContact O-N 3.49Å; A197-H201 WeakPolarHBondContact CA-O 3.44Å; A197-H201 PolarHBondContact N-O 3.37Å; H199-H201 VanDerWaalsContact C-N 3.31Å; H199-H201 PolarHBondContact O-CD2 2.8Å; H199-H201 PolarHBondContact O-N 2.94Å
202Q87Confident94.9Very high184 Ų18452.1 Ų52.186%0.8628%0.281SS*.  trans-112.1122.3176.9-66.2-171.8-11.700110.2Y160Y160-Q202 PolarHBondContact OH-O 3.37Å
203A87.6Confident95Very high16 Ų1650.8 Ų50.813%0.13228%0.276CS..  trans-102.2138.4169.500000109.5Y160 M193 L196 K205Y160-A203 HydrophobicContact CD1-CB 4.06Å; Y160-A203 HydrophobicContact CE1-CB 3.59Å; M193-A203 HydrophobicContact CE-CB 3.91Å; M193-A203 HydrophobicContact SD-CB 3.77Å; L196-A203 HydrophobicContact CD1-CB 4.31Å; A203-K205 WeakPolarHBondContact O-CG 3.28Å; A203-K205 PolarHBondContact O-N 3.12Å
204N90.8Very high95.1Very high68 Ų6850.8 Ų50.836%0.36428%0.278SS..  trans-62.7133.7171.2-176.5-73.2000109.8A206 E235N204-A206 WeakPolarHBondContact OD1-CB 3.18Å; N204-A206 PolarHBondContact OD1-N 2.89Å; N204-E235 PolarHBondContact ND2-O 2.81Å
205K95.1Very high95.2Very high68 Ų6847.7 Ų47.730%0.29626%0.262SS..  trans-106.2-0.7-171.3-49.9-178.1-166.4159.80113.8M193 A203 A207 L208 Y209 E235M193-K205 HydrophobicContact CE-CD 3.76Å; M193-K205 VanDerWaalsContact CE-CE 3.48Å; M193-K205 HydrophobicContact CE-CG 3.55Å; A203-K205 WeakPolarHBondContact O-CG 3.28Å; A203-K205 PolarHBondContact O-N 3.12Å; K205-A207 VanDerWaalsContact C-N 3.35Å; K205-A207 PolarHBondContact O-N 2.87Å; K205-L208 PolarHBondContact O-N 3.44Å; K205-L208 VanDerWaalsContact O-N 3.11Å; K205-Y209 HydrophobicContact CB-CD1 4.21Å; K205-Y209 HydrophobicContact CB-CD2 3.78Å; K205-Y209 HydrophobicContact CB-CE1 3.99Å; K205-Y209 HydrophobicContact CB-CE2 3.54Å; K205-Y209 HydrophobicContact CB-CG 4.13Å; K205-Y209 HydrophobicContact CD-CE1 4.09Å; K205-Y209 HydrophobicContact CD-CE2 3.75Å; K205-Y209 WeakPolarHBondContact CD-OH 3.47Å; K205-Y209 HydrophobicContact CG-CE2 4.3Å; K205-Y209 WeakPolarHBondContact O-CB 3.39Å; K205-Y209 PolarHBondContact O-N 2.99Å; K205-E235 HydrophobicContact CB-CG 4.01Å; K205-E235 PolarHBondContact N-OE2 3.16Å
206A96.3Very high95.4Very high0 Ų045.3 Ų45.30%025%0.252CS..Hα-helixtrans-53.3-49.4-173.300000112.3N204 Y209 G210 E235 L240 V244 V248N204-A206 WeakPolarHBondContact OD1-CB 3.18Å; N204-A206 PolarHBondContact OD1-N 2.89Å; A206-Y209 PolarHBondContact O-N 3.33Å; A206-G210 PolarHBondContact O-N 3.32Å; A206-E235 HydrophobicContact CB-CB 3.7Å; A206-L240 HydrophobicContact CB-CD2 3.67Å; A206-V244 HydrophobicContact CB-CG1 4.33Å; A206-V248 HydrophobicContact CB-CG2 4.36Å; A206-V248 WeakPolarHBondContact O-CG2 3.42Å
207A96.3Very high95.5Very high33 Ų3347.1 Ų47.127%0.27326%0.26SS..Hα-helixtrans-65.3-42-179.800000112.5V167 K205 G210 E211 V244V167-A207 HydrophobicContact CG1-CB 3.88Å; K205-A207 VanDerWaalsContact C-N 3.35Å; K205-A207 PolarHBondContact O-N 2.87Å; A207-G210 PolarHBondContact O-N 3.47Å; A207-E211 WeakPolarHBondContact O-CG 3.15Å; A207-E211 PolarHBondContact O-N 3.49Å; A207-V244 HydrophobicContact CB-CG1 3.75Å; A207-V244 HydrophobicContact CB-CG2 4.4Å
208L97.3Very high95.5Very high10 Ų1045.3 Ų45.35%0.05224%0.244CC..Hα-helixtrans-64.8-45.4178.5177.860.7000111.4V167 L170 A189 M193 K205 E211 L212V167-L208 HydrophobicContact CG2-CB 3.86Å; V167-L208 HydrophobicContact CG2-CD1 4.11Å; L170-L208 HydrophobicContact CD2-CD1 4.35Å; A189-L208 HydrophobicContact CB-CD1 3.67Å; A189-L208 HydrophobicContact CB-CD2 3.94Å; A189-L208 HydrophobicContact CB-CG 4.49Å; M193-L208 HydrophobicContact CG-CD2 4.17Å; K205-L208 PolarHBondContact O-N 3.44Å; K205-L208 VanDerWaalsContact O-N 3.11Å; L208-E211 PolarHBondContact O-N 3.36Å; L208-L212 WeakPolarHBondContact O-CB 3.43Å; L208-L212 PolarHBondContact O-N 3.33Å
209Y98.2Very high95.5Very high22 Ų2238.7 Ų38.79%0.08622%0.216CC..Hα-helixtrans-69-35.3179.1-66.2-11.8000111.9K205 A206 L212 C213 W228 E231 E235K205-Y209 HydrophobicContact CB-CD1 4.21Å; K205-Y209 HydrophobicContact CB-CD2 3.78Å; K205-Y209 HydrophobicContact CB-CE1 3.99Å; K205-Y209 HydrophobicContact CB-CE2 3.54Å; K205-Y209 HydrophobicContact CB-CG 4.13Å; K205-Y209 HydrophobicContact CD-CE1 4.09Å; K205-Y209 HydrophobicContact CD-CE2 3.75Å; K205-Y209 WeakPolarHBondContact CD-OH 3.47Å; K205-Y209 HydrophobicContact CG-CE2 4.3Å; K205-Y209 WeakPolarHBondContact O-CB 3.39Å; K205-Y209 PolarHBondContact O-N 2.99Å; A206-Y209 PolarHBondContact O-N 3.33Å; Y209-L212 PolarHBondContact O-N 3.05Å; Y209-C213 WeakPolarHBondContact O-CB 3.5Å; Y209-C213 PolarHBondContact O-N 3.44Å; Y209-W228 AromaticContact CD1-CE3 3.72Å; Y209-W228 HydrophobicContact CD1-CE3 3.72Å; Y209-W228 HydrophobicContact CD1-CH2 4.4Å; Y209-W228 AromaticContact CD1-CZ3 3.44Å; Y209-W228 HydrophobicContact CD1-CZ3 3.44Å; Y209-W228 VanDerWaalsContact CD1-CZ3 3.44Å; Y209-W228 HydrophobicContact CD2-CE3 4.3Å; Y209-W228 HydrophobicContact CD2-CZ3 4.17Å; Y209-W228 HydrophobicContact CE1-CE3 4.03Å; Y209-W228 AromaticContact CE1-CH2 3.96Å; Y209-W228 HydrophobicContact CE1-CH2 3.96Å; Y209-W228 AromaticContact CE1-CZ3 3.25Å; Y209-W228 HydrophobicContact CE1-CZ3 3.25Å; Y209-W228 HydrophobicContact CE2-CZ3 4.01Å; Y209-W228 AromaticContact CG-CE3 3.86Å; Y209-W228 HydrophobicContact CG-CE3 3.86Å; Y209-W228 AromaticContact CG-CZ3 3.9Å; Y209-W228 HydrophobicContact CG-CZ3 3.9Å; Y209-W228 AromaticContact CZ-CZ3 3.53Å; Y209-E231 HydrophobicContact CD2-CB 3.86Å; Y209-E231 HydrophobicContact CE2-CB 4.13Å; Y209-E235 HydrophobicContact CD2-CG 4.08Å; Y209-E235 HydrophobicContact CE2-CG 4.18Å
210G97.6Very high95.5Very high5 Ų534.2 Ų34.25%0.05220%0.196CC..Hα-helixtrans-61.2-45.9171.400000112.6A206 A207 C213 A214A206-G210 PolarHBondContact O-N 3.32Å; A207-G210 PolarHBondContact O-N 3.47Å; G210-C213 WeakPolarHBondContact O-CB 3.16Å; G210-C213 PolarHBondContact O-N 3.03Å; G210-A214 PolarHBondContact O-N 3.27Å
211E97.9Very high95.6Very high21 Ų2134.2 Ų34.210%0.09818%0.177CC..Hα-helixtrans-69.7-32.5177-73.7-60.9158.800113.2V167 L170 H171 N174 A207 L208 A214 L215V167-E211 HydrophobicContact CG1-CG 4.27Å; L170-E211 HydrophobicContact CB-CB 4.3Å; L170-E211 HydrophobicContact CD2-CB 3.52Å; L170-E211 HydrophobicContact CG-CB 3.81Å; H171-E211 WeakPolarHBondContact CA-OE2 3.47Å; H171-E211 HydrophobicContact CB-CG 4.45Å; H171-E211 IonicContact CE1-OE1 2.68Å; H171-E211 IonicContact CG-OE1 3.4Å; H171-E211 IonicContact ND1-OE1 3.37Å; H171-E211 PolarHBondContact ND1-OE1 3.46Å; H171-E211 IonicContact ND1-OE2 2.82Å; N174-E211 PolarHBondContact ND2-O 2.85Å; N174-E211 PolarHBondContact ND2-OE2 3.42Å; A207-E211 WeakPolarHBondContact O-CG 3.15Å; A207-E211 PolarHBondContact O-N 3.49Å; L208-E211 PolarHBondContact O-N 3.36Å; E211-A214 PolarHBondContact O-N 3.28Å; E211-L215 PolarHBondContact O-N 3.34Å
212L98.2Very high95.7Very high16 Ų1632.4 Ų32.48%0.08417%0.168CC..Hα-helixtrans-66.1-42.4170.6177.554.3000111.3V186 L208 Y209 A214 L215 L216 W228V186-L212 HydrophobicContact CG1-CD1 4.03Å; V186-L212 HydrophobicContact CG1-CD2 4.28Å; V186-L212 HydrophobicContact CG2-CD1 3.92Å; L208-L212 WeakPolarHBondContact O-CB 3.43Å; L208-L212 PolarHBondContact O-N 3.33Å; Y209-L212 PolarHBondContact O-N 3.05Å; L212-A214 VanDerWaalsContact C-N 3.32Å; L212-A214 PolarHBondContact O-N 2.71Å; L212-L215 HydrophobicContact CD1-CD2 4.49Å; L212-L215 PolarHBondContact O-N 3.15Å; L212-L216 HydrophobicContact CD1-CD1 3.87Å; L212-L216 HydrophobicContact CD1-CG 4.05Å; L212-L216 HydrophobicContact CG-CD1 3.96Å; L212-L216 WeakPolarHBondContact O-CB 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 3.4Å; L212-W228 HydrophobicContact CD2-CD2 3.46Å; L212-W228 VanDerWaalsContact CD2-CD2 3.46Å; L212-W228 HydrophobicContact CD2-CE3 3.92Å; L212-W228 HydrophobicContact CD2-CG 3.88Å; L212-W228 HydrophobicContact CD2-CH2 4.13Å; L212-W228 HydrophobicContact CD2-CZ2 3.69Å; L212-W228 HydrophobicContact CD2-CZ3 4.25Å; L212-W228 HydrophobicContact CG-CD2 4.15Å; L212-W228 HydrophobicContact CG-CG 4.04Å
213C97.8Very high96Very high0 Ų027.6 Ų27.60%015%0.148CC..Hα-helixtrans-58.6-45172.9-177.10000110.7Y209 G210 L215 L216 F217 A225 W228 C229Y209-C213 WeakPolarHBondContact O-CB 3.5Å; Y209-C213 PolarHBondContact O-N 3.44Å; G210-C213 WeakPolarHBondContact O-CB 3.16Å; G210-C213 PolarHBondContact O-N 3.03Å; C213-L215 PolarHBondContact O-N 3.34Å; C213-L216 PolarHBondContact O-N 3.45Å; C213-F217 VanDerWaalsContact O-CB 3.25Å; C213-F217 WeakPolarHBondContact O-CB 3.28Å; C213-F217 PolarHBondContact O-N 2.88Å; C213-A225 PolarHBondContact SG-O 3.11Å; C213-W228 HydrophobicContact CB-CB 4.35Å; C213-C229 HydrophobicContact CB-CB 4.16Å; C213-C229 WeakPolarHBondContact CB-SG 3.19Å; C213-C229 WeakPolarHBondContact SG-CB 3.26Å; C213-C229 CovalentContact SG-SG 2.05Å; C213-C229 PolarHBondContact SG-SG 3.2Å
214A97.8Very high96.4Very high13 Ų1330.6 Ų30.611%0.10716%0.159CC..Hα-helixtrans-60.8-43.5176.600000112.9G210 E211 L212 F217 A218 Q251G210-A214 PolarHBondContact O-N 3.27Å; E211-A214 PolarHBondContact O-N 3.28Å; L212-A214 VanDerWaalsContact C-N 3.32Å; L212-A214 PolarHBondContact O-N 2.71Å; A214-F217 PolarHBondContact O-N 3.37Å; A214-A218 WeakPolarHBondContact O-CB 3.35Å; A214-A218 PolarHBondContact O-N 3.41Å; A214-Q251 HydrophobicContact CB-CG 4.21Å
215L98.1Very high96.7Very high3 Ų327.3 Ų27.32%0.01614%0.142CC..Hα-helixtrans-60.2-50.9175.717262.1000111.4L170 N174 Y179 E183 V186 E211 L212 C213 F217 A218 K219L170-L215 HydrophobicContact CD1-CD2 4.08Å; N174-L215 WeakPolarHBondContact OD1-CB 3.41Å; N174-L215 WeakPolarHBondContact OD1-CD1 3.26Å; Y179-L215 HydrophobicContact CD1-CD1 3.86Å; Y179-L215 HydrophobicContact CG-CD1 4.23Å; E183-L215 HydrophobicContact CG-CD2 3.96Å; V186-L215 HydrophobicContact CG2-CD2 4.02Å; E211-L215 PolarHBondContact O-N 3.34Å; L212-L215 HydrophobicContact CD1-CD2 4.49Å; L212-L215 PolarHBondContact O-N 3.15Å; C213-L215 PolarHBondContact O-N 3.34Å; L215-F217 VanDerWaalsContact C-N 3.32Å; L215-F217 PolarHBondContact O-N 3.2Å; L215-A218 PolarHBondContact O-N 3.39Å; L215-K219 HydrophobicContact CD1-CD 4.13Å; L215-K219 HydrophobicContact CD1-CG 4.34Å; L215-K219 WeakPolarHBondContact O-CG 3.37Å; L215-K219 PolarHBondContact O-N 2.05Å
216L98Very high96.8Very high11 Ų1125.1 Ų25.16%0.05813%0.132CC..Hα-helixtrans-64.6-39.1-178.7-70.3166.8000111.4L212 C213 K219 S220 H221 E224 A225 W228L212-L216 HydrophobicContact CD1-CD1 3.87Å; L212-L216 HydrophobicContact CD1-CG 4.05Å; L212-L216 HydrophobicContact CG-CD1 3.96Å; L212-L216 WeakPolarHBondContact O-CB 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 3.4Å; C213-L216 PolarHBondContact O-N 3.45Å; L216-K219 CarbonylContact O-C 3.55Å; L216-K219 PolarHBondContact O-N 3.33Å; L216-S220 PolarHBondContact O-N 2.88Å; L216-S220 VanDerWaalsContact O-N 3.15Å; L216-H221 HydrophobicContact CB-CB 4.27Å; L216-H221 HydrophobicContact CD2-CB 4.02Å; L216-H221 PolarHBondContact O-N 2.93Å; L216-E224 HydrophobicContact CD1-CB 3.94Å; L216-E224 HydrophobicContact CD2-CB 4.32Å; L216-A225 HydrophobicContact CB-CB 3.8Å; L216-W228 HydrophobicContact CD1-CG 4.14Å
217F97.3Very high96.8Very high38 Ų3831.9 Ų31.917%0.16716%0.158CC..Hα-helixtrans-60.2-48.9173.4-176-84.4000111.2C213 A214 L215 K219 S220 Y222 A225 K254 V258 F296C213-F217 VanDerWaalsContact O-CB 3.25Å; C213-F217 WeakPolarHBondContact O-CB 3.28Å; C213-F217 PolarHBondContact O-N 2.88Å; A214-F217 PolarHBondContact O-N 3.37Å; L215-F217 VanDerWaalsContact C-N 3.32Å; L215-F217 PolarHBondContact O-N 3.2Å; F217-K219 PolarHBondContact O-N 3.34Å; F217-S220 WeakPolarHBondContact O-CA 3.3Å; F217-S220 PolarHBondContact O-N 3.23Å; F217-Y222 HydrophobicContact CD2-CD1 4.09Å; F217-Y222 HydrophobicContact CD2-CE1 4.24Å; F217-Y222 HydrophobicContact CE2-CD1 4.31Å; F217-Y222 HydrophobicContact CE2-CE1 4.24Å; F217-A225 HydrophobicContact CB-CB 4.17Å; F217-K254 HydrophobicContact CD2-CB 4.4Å; F217-K254 HydrophobicContact CE1-CD 4.49Å; F217-K254 HydrophobicContact CE2-CB 3.91Å; F217-K254 HydrophobicContact CZ-CB 4.1Å; F217-K254 HydrophobicContact CZ-CD 4.48Å; F217-V258 HydrophobicContact CD2-CG2 4.34Å; F217-V258 HydrophobicContact CE2-CB 4.38Å; F217-V258 HydrophobicContact CE2-CG1 3.53Å; F217-V258 HydrophobicContact CE2-CG2 3.89Å; F217-V258 HydrophobicContact CZ-CG1 3.92Å; F217-F296 HydrophobicContact CZ-CZ 4.26Å
218A95.9Very high96.9Very high25 Ų2533.9 Ų33.921%0.20716%0.158CC..Hα-helixtrans-61.4-33178.500000112.5Y179 A214 L215 S220 F421Y179-A218 HydrophobicContact CD1-CB 4.26Å; Y179-A218 HydrophobicContact CE1-CB 3.58Å; A214-A218 WeakPolarHBondContact O-CB 3.35Å; A214-A218 PolarHBondContact O-N 3.41Å; L215-A218 PolarHBondContact O-N 3.39Å; A218-S220 VanDerWaalsContact C-N 3.25Å; A218-S220 PolarHBondContact O-N 3.19Å; A218-F421 VanDerWaalsContact O-CE1 3.31Å; A218-F421 WeakPolarHBondContact O-CE1 3.49Å
219K96Very high96.8Very high36 Ų3633.5 Ų33.516%0.15716%0.156CC..THydrogen-bonded Turntrans-79.5-0.6173.2-67.4-171.367.5169.60114.1Y179 E183 L215 L216 F217 H221 N425Y179-K219 HydrophobicContact CG-CG 4.32Å; E183-K219 IonicContact OE1-NZ 3.47Å; E183-K219 PolarHBondContact OE1-NZ 2.98Å; E183-K219 IonicContact OE2-NZ 3.07Å; E183-K219 PolarHBondContact OE2-NZ 3.07Å; L215-K219 HydrophobicContact CD1-CD 4.13Å; L215-K219 HydrophobicContact CD1-CG 4.34Å; L215-K219 WeakPolarHBondContact O-CG 3.37Å; L215-K219 PolarHBondContact O-N 2.05Å; L216-K219 CarbonylContact O-C 3.55Å; L216-K219 PolarHBondContact O-N 3.33Å; F217-K219 PolarHBondContact O-N 3.34Å; K219-H221 VanDerWaalsContact C-N 3.28Å; K219-H221 PolarHBondContact O-CD2 2.97Å; K219-H221 PolarHBondContact O-N 3.39Å; K219-N425 PolarHBondContact O-ND2 3.01Å
220S95.5Very high96.7Very high11 Ų1133.6 Ų33.68%0.07716%0.158CC..THydrogen-bonded Turntrans6522.9-175.3-49.40000115.3L216 F217 A218 Y222 Q427L216-S220 PolarHBondContact O-N 2.88Å; L216-S220 VanDerWaalsContact O-N 3.15Å; F217-S220 WeakPolarHBondContact O-CA 3.3Å; F217-S220 PolarHBondContact O-N 3.23Å; A218-S220 VanDerWaalsContact C-N 3.25Å; A218-S220 PolarHBondContact O-N 3.19Å; S220-Y222 PolarHBondContact O-N 3.5Å; S220-Y222 VanDerWaalsContact O-N 3.12Å; S220-Y222 PolarHBondContact OG-OH 3.35Å; S220-Q427 PolarHBondContact OG-NE2 2.89Å
221H95.8Very high96.7Very high71 Ų7136.9 Ų36.933%0.32917%0.172SC..  trans-8663.3172.1-65.9-164000109.6L216 K219 D223 E224 A225L216-H221 HydrophobicContact CB-CB 4.27Å; L216-H221 HydrophobicContact CD2-CB 4.02Å; L216-H221 PolarHBondContact O-N 2.93Å; K219-H221 VanDerWaalsContact C-N 3.28Å; K219-H221 PolarHBondContact O-CD2 2.97Å; K219-H221 PolarHBondContact O-N 3.39Å; H221-D223 PolarHBondContact O-N 2.89Å; H221-E224 HydrophobicContact CB-CB 4.41Å; H221-E224 IonicContact ND1-OE1 3.33Å; H221-E224 PolarHBondContact O-N 3.23Å; H221-A225 WeakPolarHBondContact O-CB 3.36Å; H221-A225 PolarHBondContact O-N 3.3Å
222Y94.6Very high96.6Very high30 Ų3035.9 Ų35.912%0.11817%0.167CC..Hα-helixtrans-64.2-35.4-164-57.7-52.3000114.5F217 S220 A225 Y226 V258 V426 Q427 L463F217-Y222 HydrophobicContact CD2-CD1 4.09Å; F217-Y222 HydrophobicContact CD2-CE1 4.24Å; F217-Y222 HydrophobicContact CE2-CD1 4.31Å; F217-Y222 HydrophobicContact CE2-CE1 4.24Å; S220-Y222 PolarHBondContact O-N 3.5Å; S220-Y222 VanDerWaalsContact O-N 3.12Å; S220-Y222 PolarHBondContact OG-OH 3.35Å; Y222-A225 PolarHBondContact O-N 3Å; Y222-Y226 WeakPolarHBondContact O-CB 3.35Å; Y222-Y226 PolarHBondContact O-N 2.99Å; Y222-V258 HydrophobicContact CD1-CB 4.25Å; Y222-V258 HydrophobicContact CD1-CG1 4.3Å; Y222-V258 HydrophobicContact CD1-CG2 3.84Å; Y222-V258 HydrophobicContact CE1-CG1 4.23Å; Y222-V258 HydrophobicContact CG-CB 4.29Å; Y222-V258 HydrophobicContact CG-CG2 3.98Å; Y222-V426 HydrophobicContact CE2-CB 4.47Å; Y222-V426 HydrophobicContact CE2-CG1 4.35Å; Y222-V426 HydrophobicContact CE2-CG2 4.18Å; Y222-Q427 PolarHBondContact OH-NE2 3.45Å; Y222-L463 HydrophobicContact CD2-CD2 3.82Å; Y222-L463 HydrophobicContact CE2-CD2 4.14Å
223D94.2Very high96.5Very high83 Ų8335.1 Ų35.144%0.44416%0.163SC..Hα-helixtrans-67.8-38.8177.7-72.2-22.3000112.6H221 R227 K259H221-D223 PolarHBondContact O-N 2.89Å; D223-R227 WeakPolarHBondContact O-CG 3.29Å; D223-R227 PolarHBondContact O-N 3.45Å; D223-R227 VanDerWaalsContact O-N 3.14Å; D223-R227 PolarHBondContact O-NE 3.28Å; D223-K259 WeakPolarHBondContact OD1-CE 3.12Å; D223-K259 IonicContact OD1-NZ 2.75Å; D223-K259 PolarHBondContact OD1-NZ 2.94Å
224E96.6Very high96.4Very high78 Ų7840.4 Ų40.436%0.36419%0.186SC..Hα-helixtrans-71.4-41.7175.5-66.7178.5-129.700110.7L216 H221 Y226 R227 W228L216-E224 HydrophobicContact CD1-CB 3.94Å; L216-E224 HydrophobicContact CD2-CB 4.32Å; H221-E224 HydrophobicContact CB-CB 4.41Å; H221-E224 IonicContact ND1-OE1 3.33Å; H221-E224 PolarHBondContact O-N 3.23Å; E224-Y226 VanDerWaalsContact C-N 3.34Å; E224-Y226 PolarHBondContact O-N 3.28Å; E224-R227 PolarHBondContact O-N 3.15Å; E224-W228 VanDerWaalsContact O-CD1 3.28Å; E224-W228 PolarHBondContact O-N 3.45Å
225A97.3Very high96.4Very high0 Ų042.2 Ų42.20%019%0.192CC..Hα-helixtrans-56.3-50174.400000110.6C213 L216 F217 H221 Y222 R227 W228 C229C213-A225 PolarHBondContact SG-O 3.11Å; L216-A225 HydrophobicContact CB-CB 3.8Å; F217-A225 HydrophobicContact CB-CB 4.17Å; H221-A225 WeakPolarHBondContact O-CB 3.36Å; H221-A225 PolarHBondContact O-N 3.3Å; Y222-A225 PolarHBondContact O-N 3Å; A225-R227 PolarHBondContact O-N 3.31Å; A225-W228 PolarHBondContact O-N 2.99Å; A225-C229 WeakPolarHBondContact O-CB 3.42Å; A225-C229 PolarHBondContact O-N 3.5Å
226Y96.4Very high96.2Very high22 Ų2243.2 Ų43.29%0.08620%0.198CC..Hα-helixtrans-58-45.2178-174.7-108.9000112.7Y222 E224 W228 C229 I230 A255 K259 E261 Q578Y222-Y226 WeakPolarHBondContact O-CB 3.35Å; Y222-Y226 PolarHBondContact O-N 2.99Å; E224-Y226 VanDerWaalsContact C-N 3.34Å; E224-Y226 PolarHBondContact O-N 3.28Å; Y226-W228 PolarHBondContact O-N 3.31Å; Y226-C229 PolarHBondContact O-N 3.29Å; Y226-I230 HydrophobicContact CD1-CD1 4.05Å; Y226-I230 HydrophobicContact CE1-CD1 3.64Å; Y226-I230 PolarHBondContact O-N 3.33Å; Y226-I230 VanDerWaalsContact O-N 3.08Å; Y226-A255 HydrophobicContact CD2-CB 4.07Å; Y226-K259 HydrophobicContact CD1-CG 4.35Å; Y226-K259 HydrophobicContact CD2-CB 4.46Å; Y226-K259 HydrophobicContact CD2-CG 3.85Å; Y226-K259 HydrophobicContact CE2-CG 4.47Å; Y226-K259 HydrophobicContact CG-CG 3.79Å; Y226-E261 VanDerWaalsContact CZ-OE1 3.27Å; Y226-E261 PolarHBondContact OH-OE1 2.92Å; Y226-E261 PolarHBondContact OH-OE2 3.33Å; Y226-Q578 PolarHBondContact OH-NE2 3.25Å; Y226-Q578 PolarHBondContact OH-OE1 2.89Å
227R97.3Very high95.9Very high142 Ų14246.4 Ų46.454%0.53622%0.218SC..Hα-helixtrans-58.6-47.8175-78.9179.5-98.2136-7.8112.4D223 E224 A225 C229 I230 E231D223-R227 WeakPolarHBondContact O-CG 3.29Å; D223-R227 PolarHBondContact O-N 3.45Å; D223-R227 VanDerWaalsContact O-N 3.14Å; D223-R227 PolarHBondContact O-NE 3.28Å; E224-R227 PolarHBondContact O-N 3.15Å; A225-R227 PolarHBondContact O-N 3.31Å; R227-C229 VanDerWaalsContact C-N 3.32Å; R227-C229 PolarHBondContact O-N 3.15Å; R227-I230 WeakPolarHBondContact O-CB 3.47Å; R227-I230 PolarHBondContact O-N 3.3Å; R227-E231 PolarHBondContact O-N 2.87Å; R227-E231 VanDerWaalsContact O-N 3.15Å
228W97.3Very high95.4Very high74 Ų7450.6 Ų50.628%0.2825%0.246SC..Hα-helixtrans-68.4-31.3179.1-82.2109.6000113.4Y209 L212 C213 L216 E224 A225 Y226 I230 E231 A232Y209-W228 AromaticContact CD1-CE3 3.72Å; Y209-W228 HydrophobicContact CD1-CE3 3.72Å; Y209-W228 HydrophobicContact CD1-CH2 4.4Å; Y209-W228 AromaticContact CD1-CZ3 3.44Å; Y209-W228 HydrophobicContact CD1-CZ3 3.44Å; Y209-W228 VanDerWaalsContact CD1-CZ3 3.44Å; Y209-W228 HydrophobicContact CD2-CE3 4.3Å; Y209-W228 HydrophobicContact CD2-CZ3 4.17Å; Y209-W228 HydrophobicContact CE1-CE3 4.03Å; Y209-W228 AromaticContact CE1-CH2 3.96Å; Y209-W228 HydrophobicContact CE1-CH2 3.96Å; Y209-W228 AromaticContact CE1-CZ3 3.25Å; Y209-W228 HydrophobicContact CE1-CZ3 3.25Å; Y209-W228 HydrophobicContact CE2-CZ3 4.01Å; Y209-W228 AromaticContact CG-CE3 3.86Å; Y209-W228 HydrophobicContact CG-CE3 3.86Å; Y209-W228 AromaticContact CG-CZ3 3.9Å; Y209-W228 HydrophobicContact CG-CZ3 3.9Å; Y209-W228 AromaticContact CZ-CZ3 3.53Å; L212-W228 HydrophobicContact CD2-CD2 3.46Å; L212-W228 VanDerWaalsContact CD2-CD2 3.46Å; L212-W228 HydrophobicContact CD2-CE3 3.92Å; L212-W228 HydrophobicContact CD2-CG 3.88Å; L212-W228 HydrophobicContact CD2-CH2 4.13Å; L212-W228 HydrophobicContact CD2-CZ2 3.69Å; L212-W228 HydrophobicContact CD2-CZ3 4.25Å; L212-W228 HydrophobicContact CG-CD2 4.15Å; L212-W228 HydrophobicContact CG-CG 4.04Å; C213-W228 HydrophobicContact CB-CB 4.35Å; L216-W228 HydrophobicContact CD1-CG 4.14Å; E224-W228 VanDerWaalsContact O-CD1 3.28Å; E224-W228 PolarHBondContact O-N 3.45Å; A225-W228 PolarHBondContact O-N 2.99Å; Y226-W228 PolarHBondContact O-N 3.31Å; W228-I230 VanDerWaalsContact C-N 3.34Å; W228-E231 HydrophobicContact CE3-CB 4.12Å; W228-E231 HydrophobicContact CE3-CG 4.41Å; W228-E231 HydrophobicContact CZ3-CB 4.47Å; W228-E231 PolarHBondContact O-N 3.49Å; W228-A232 WeakPolarHBondContact O-CB 3.43Å; W228-A232 PolarHBondContact O-N 3.39Å
229C95.1Very high95Very high2 Ų253.1 Ų53.11%0.01427%0.274CS..Hα-helixtrans-65-37.6171.9-93.50000111.7C213 A225 Y226 R227 A232 M233 A252 A255C213-C229 HydrophobicContact CB-CB 4.16Å; C213-C229 WeakPolarHBondContact CB-SG 3.19Å; C213-C229 WeakPolarHBondContact SG-CB 3.26Å; C213-C229 CovalentContact SG-SG 2.05Å; C213-C229 PolarHBondContact SG-SG 3.2Å; A225-C229 WeakPolarHBondContact O-CB 3.42Å; A225-C229 PolarHBondContact O-N 3.5Å; Y226-C229 PolarHBondContact O-N 3.29Å; R227-C229 VanDerWaalsContact C-N 3.32Å; R227-C229 PolarHBondContact O-N 3.15Å; C229-A232 PolarHBondContact O-N 3.08Å; C229-M233 WeakPolarHBondContact O-CG 3.48Å; C229-M233 PolarHBondContact O-N 3.46Å; C229-A252 HydrophobicContact CB-CB 4.12Å; C229-A252 WeakPolarHBondContact SG-CA 3.23Å; C229-A252 PolarHBondContact SG-N 3.18Å; C229-A252 VanDerWaalsContact SG-N 3.39Å; C229-A255 HydrophobicContact CB-CB 4.3Å
230I96.2Very high94.9Very high25 Ų2552.7 Ų52.713%0.12827%0.274CS..Hα-helixtrans-61.8-44.3171.3-67.1167.3000111Y226 R227 W228 A232 M233 K234 F574 L575 Q578Y226-I230 HydrophobicContact CD1-CD1 4.05Å; Y226-I230 HydrophobicContact CE1-CD1 3.64Å; Y226-I230 PolarHBondContact O-N 3.33Å; Y226-I230 VanDerWaalsContact O-N 3.08Å; R227-I230 WeakPolarHBondContact O-CB 3.47Å; R227-I230 PolarHBondContact O-N 3.3Å; W228-I230 VanDerWaalsContact C-N 3.34Å; I230-A232 PolarHBondContact O-N 3.46Å; I230-M233 PolarHBondContact O-N 2.89Å; I230-K234 WeakPolarHBondContact O-CG 3.5Å; I230-K234 PolarHBondContact O-N 3.43Å; I230-K234 VanDerWaalsContact O-N 3.15Å; I230-F574 HydrophobicContact CG1-CE1 4.09Å; I230-F574 HydrophobicContact CG1-CZ 4.23Å; I230-L575 HydrophobicContact CG2-CD2 4.03Å; I230-Q578 HydrophobicContact CD1-CG 4.25Å
231E97.3Very high94.9Very high73 Ų7356 Ų5634%0.34130%0.295SS..Hα-helixtrans-64.3-38.7176.3-62.7-51.8129.300112.3Y209 R227 W228 M233 K234 E235Y209-E231 HydrophobicContact CD2-CB 3.86Å; Y209-E231 HydrophobicContact CE2-CB 4.13Å; R227-E231 PolarHBondContact O-N 2.87Å; R227-E231 VanDerWaalsContact O-N 3.15Å; W228-E231 HydrophobicContact CE3-CB 4.12Å; W228-E231 HydrophobicContact CE3-CG 4.41Å; W228-E231 HydrophobicContact CZ3-CB 4.47Å; W228-E231 PolarHBondContact O-N 3.49Å; E231-M233 VanDerWaalsContact C-N 3.32Å; E231-M233 PolarHBondContact O-N 3.33Å; E231-K234 PolarHBondContact O-N 2.8Å; E231-K234 IonicContact OE1-NZ 3.2Å; E231-K234 PolarHBondContact OE1-NZ 3.3Å; E231-K234 IonicContact OE2-NZ 2.66Å; E231-K234 PolarHBondContact OE2-NZ 3.47Å; E231-E235 WeakPolarHBondContact O-CG 3.46Å; E231-E235 PolarHBondContact O-N 3.04Å
232A97Very high94.9Very high0 Ų054.7 Ų54.70%029%0.292CS..Hα-helixtrans-61.7-40.6174.500000112W228 C229 I230 K234 E235 V248W228-A232 WeakPolarHBondContact O-CB 3.43Å; W228-A232 PolarHBondContact O-N 3.39Å; C229-A232 PolarHBondContact O-N 3.08Å; I230-A232 PolarHBondContact O-N 3.46Å; A232-K234 VanDerWaalsContact C-N 3.35Å; A232-K234 PolarHBondContact O-N 3.29Å; A232-E235 PolarHBondContact O-N 3.14Å; A232-V248 HydrophobicContact CB-CG1 3.71Å; A232-V248 HydrophobicContact CB-CG2 4.4Å
233M95.9Very high94.9Very high0 Ų057.5 Ų57.50%031%0.305CS..Hα-helixtrans-64.9-36.3178-70.9-71.6-74.800112.3C229 I230 E231 E235 I236 V248 L249 A252 L268 V571 F574 L575C229-M233 WeakPolarHBondContact O-CG 3.48Å; C229-M233 PolarHBondContact O-N 3.46Å; I230-M233 PolarHBondContact O-N 2.89Å; E231-M233 VanDerWaalsContact C-N 3.32Å; E231-M233 PolarHBondContact O-N 3.33Å; M233-E235 PolarHBondContact O-N 3.45Å; M233-I236 WeakPolarHBondContact O-CB 3.33Å; M233-I236 PolarHBondContact O-N 3.06Å; M233-I236 HydrophobicContact SD-CD1 3.69Å; M233-V248 HydrophobicContact CG-CG1 4.26Å; M233-V248 HydrophobicContact SD-CG1 3.86Å; M233-L249 HydrophobicContact CE-CD2 3.84Å; M233-L249 HydrophobicContact SD-CD2 3.88Å; M233-A252 HydrophobicContact CG-CB 4.21Å; M233-A252 HydrophobicContact SD-CB 4.21Å; M233-L268 HydrophobicContact CE-CD2 3.52Å; M233-V571 HydrophobicContact CE-CB 4.16Å; M233-V571 HydrophobicContact CE-CG1 4.17Å; M233-V571 HydrophobicContact CE-CG2 3.71Å; M233-V571 WeakPolarHBondContact O-CG1 3.45Å; M233-F574 HydrophobicContact CB-CD1 4.37Å; M233-F574 HydrophobicContact CB-CE1 4.38Å; M233-F574 HydrophobicContact CE-CB 4.22Å; M233-F574 HydrophobicContact CE-CD1 3.78Å; M233-F574 HydrophobicContact CE-CE1 4.45Å; M233-F574 HydrophobicContact CE-CG 4.08Å; M233-F574 HydrophobicContact CG-CD1 4.16Å; M233-F574 HydrophobicContact CG-CE1 4.02Å; M233-L575 HydrophobicContact CB-CD2 4.26Å
234K96.2Very high95Very high112 Ų11255 Ų5549%0.48729%0.293SS..Hα-helixtrans-64.7-24.8175.5-69.1171.6-175.8168.60113.4I230 E231 A232 I236 L575I230-K234 WeakPolarHBondContact O-CG 3.5Å; I230-K234 PolarHBondContact O-N 3.43Å; I230-K234 VanDerWaalsContact O-N 3.15Å; E231-K234 PolarHBondContact O-N 2.8Å; E231-K234 IonicContact OE1-NZ 3.2Å; E231-K234 PolarHBondContact OE1-NZ 3.3Å; E231-K234 IonicContact OE2-NZ 2.66Å; E231-K234 PolarHBondContact OE2-NZ 3.47Å; A232-K234 VanDerWaalsContact C-N 3.35Å; A232-K234 PolarHBondContact O-N 3.29Å; K234-I236 VanDerWaalsContact C-N 3.34Å; K234-L575 HydrophobicContact CG-CD1 4.11Å; K234-L575 HydrophobicContact CG-CD2 4.02Å
235E96.3Very high95.1Very high50 Ų5051.9 Ų51.923%0.23428%0.279CS..THydrogen-bonded Turntrans-86.7-4.3-179.6-65.8-82.2158.500112.6N204 K205 A206 Y209 E231 A232 M233 T237N204-E235 PolarHBondContact ND2-O 2.81Å; K205-E235 HydrophobicContact CB-CG 4.01Å; K205-E235 PolarHBondContact N-OE2 3.16Å; A206-E235 HydrophobicContact CB-CB 3.7Å; Y209-E235 HydrophobicContact CD2-CG 4.08Å; Y209-E235 HydrophobicContact CE2-CG 4.18Å; E231-E235 WeakPolarHBondContact O-CG 3.46Å; E231-E235 PolarHBondContact O-N 3.04Å; A232-E235 PolarHBondContact O-N 3.14Å; M233-E235 PolarHBondContact O-N 3.45Å; E235-T237 PolarHBondContact O-N 3.35Å
236I95.2Very high95.1Very high25 Ų2551.9 Ų51.913%0.12828%0.279CS..  trans-70.4121.6174.4-63.5177000109M233 K234 V245 V248 T567 V571M233-I236 WeakPolarHBondContact O-CB 3.33Å; M233-I236 PolarHBondContact O-N 3.06Å; M233-I236 HydrophobicContact SD-CD1 3.69Å; K234-I236 VanDerWaalsContact C-N 3.34Å; I236-V245 HydrophobicContact CG2-CG2 4.31Å; I236-V248 HydrophobicContact CD1-CB 4.31Å; I236-V248 HydrophobicContact CD1-CG1 3.91Å; I236-V248 HydrophobicContact CG1-CG1 4.43Å; I236-T567 HydrophobicContact CG2-CG2 4.34Å; I236-V571 HydrophobicContact CB-CG2 4.41Å; I236-V571 HydrophobicContact CD1-CG2 3.87Å; I236-V571 HydrophobicContact CG2-CG2 4.25Å
237T91.3Very high95.2Very high78 Ų7852.1 Ų52.148%0.47928%0.281SS..  trans-134.6158.7-177.150.50000111E235 G239 L240E235-T237 PolarHBondContact O-N 3.35Å; T237-G239 PolarHBondContact O-N 3.19Å; T237-G239 VanDerWaalsContact O-N 3.16Å; T237-L240 WeakPolarHBondContact O-CB 3.45Å; T237-L240 PolarHBondContact O-N 2.9Å; T237-L240 VanDerWaalsContact O-N 3.13Å
238V86.4Confident95.2Very high125 Ų12545.4 Ų45.476%0.75826%0.256SS*.THydrogen-bonded Turntrans-60.3116.1174.8-174.30000109E568V238-E568 HydrophobicContact CG2-CG 4.34Å; V238-E568 WeakPolarHBondContact CG2-OE1 3.42Å
239G87.6Confident95.2Very high78 Ų7841.9 Ų41.980%0.80424%0.243SC*.THydrogen-bonded Turntrans107.3-4.9-179.200000115.2T237T237-G239 PolarHBondContact O-N 3.19Å; T237-G239 VanDerWaalsContact O-N 3.16Å
240L93.4Very high95.4Very high28 Ų2842.7 Ų42.715%0.14725%0.246CC..SBendtrans-63.2138.7169.6-162.768.9000109.9A206 T237 V242 V244 V245A206-L240 HydrophobicContact CB-CD2 3.67Å; T237-L240 WeakPolarHBondContact O-CB 3.45Å; T237-L240 PolarHBondContact O-N 2.9Å; T237-L240 VanDerWaalsContact O-N 3.13Å; L240-V242 PolarHBondContact O-N 3.27Å; L240-V244 HydrophobicContact CD2-CB 4.25Å; L240-V244 HydrophobicContact CD2-CG1 3.78Å; L240-V244 HydrophobicContact CG-CB 4.23Å; L240-V244 HydrophobicContact CG-CG1 4.17Å; L240-V245 HydrophobicContact CB-CG2 4.17Å; L240-V245 HydrophobicContact CD2-CG2 4.06Å; L240-V245 HydrophobicContact CG-CG2 4.39Å
241P95Very high95.5Very high81 Ų8142.8 Ų42.853%0.52625%0.245SC..  trans-57.5132.5179.3-25.634.3000111.6K243 V244 V245P241-K243 PolarHBondContact O-N 2.68Å; P241-V244 HydrophobicContact CB-CG2 4.27Å; P241-V244 WeakPolarHBondContact O-CA 3.35Å; P241-V244 WeakPolarHBondContact O-CB 3.46Å; P241-V244 PolarHBondContact O-N 3.11Å; P241-V245 PolarHBondContact O-N 3.03Å
242V95.7Very high95.5Very high43 Ų4339.3 Ų39.326%0.26123%0.23SC..Hα-helixtrans-53.8-34.5-178.4177.80000112.2L240 V244 V245 V246 H279 F280L240-V242 PolarHBondContact O-N 3.27Å; V242-V244 VanDerWaalsContact C-N 3.27Å; V242-V244 PolarHBondContact O-N 3.02Å; V242-V245 PolarHBondContact O-N 3.44Å; V242-V246 HydrophobicContact CG1-CG2 4.09Å; V242-V246 WeakPolarHBondContact O-CB 3.16Å; V242-V246 WeakPolarHBondContact O-CG2 3.49Å; V242-V246 PolarHBondContact O-N 3.47Å; V242-H279 HydrophobicContact CG1-CB 4.09Å; V242-F280 HydrophobicContact CG1-CE2 4.34Å; V242-F280 HydrophobicContact CG1-CZ 4.47Å
243K95.6Very high95.5Very high89 Ų8939.3 Ų39.339%0.38723%0.23SC..Hα-helixtrans-54.3-44.2174.6-171.6178.5-178.4173.20111.7D132 P241 D247 F280D132-K243 IonicContact OD1-NZ 2.94Å; D132-K243 PolarHBondContact OD1-NZ 3.34Å; D132-K243 IonicContact OD2-NZ 3.33Å; P241-K243 PolarHBondContact O-N 2.68Å; K243-D247 PolarHBondContact O-N 3.18Å; K243-D247 VanDerWaalsContact O-N 3.14Å; K243-D247 VanDerWaalsContact O-OD2 3.1Å; K243-F280 HydrophobicContact CB-CZ 4.12Å
244V96.9Very high95.6Very high31 Ų3140.8 Ų40.819%0.18824%0.236CC..Hα-helixtrans-71-44-179.5179.10000110.8A206 A207 L240 P241 V242 V246 D247 V248A206-V244 HydrophobicContact CB-CG1 4.33Å; A207-V244 HydrophobicContact CB-CG1 3.75Å; A207-V244 HydrophobicContact CB-CG2 4.4Å; L240-V244 HydrophobicContact CD2-CB 4.25Å; L240-V244 HydrophobicContact CD2-CG1 3.78Å; L240-V244 HydrophobicContact CG-CB 4.23Å; L240-V244 HydrophobicContact CG-CG1 4.17Å; P241-V244 HydrophobicContact CB-CG2 4.27Å; P241-V244 WeakPolarHBondContact O-CA 3.35Å; P241-V244 WeakPolarHBondContact O-CB 3.46Å; P241-V244 PolarHBondContact O-N 3.11Å; V242-V244 VanDerWaalsContact C-N 3.27Å; V242-V244 PolarHBondContact O-N 3.02Å; V244-V246 PolarHBondContact O-N 3.05Å; V244-D247 PolarHBondContact O-N 3.34Å; V244-V248 HydrophobicContact CG1-CG2 4.36Å; V244-V248 WeakPolarHBondContact O-CG2 3.16Å; V244-V248 PolarHBondContact O-N 3.49Å
245V97.6Very high95.6Very high11 Ų1135.4 Ų35.47%0.06721%0.213CC..Hα-helixtrans-56.7-50.9176.5175.10000110.4I236 L240 P241 V242 D247 V248 L249 L275 T567I236-V245 HydrophobicContact CG2-CG2 4.31Å; L240-V245 HydrophobicContact CB-CG2 4.17Å; L240-V245 HydrophobicContact CD2-CG2 4.06Å; L240-V245 HydrophobicContact CG-CG2 4.39Å; P241-V245 PolarHBondContact O-N 3.03Å; V242-V245 PolarHBondContact O-N 3.44Å; V245-D247 VanDerWaalsContact C-N 3.31Å; V245-D247 PolarHBondContact O-N 2.92Å; V245-V248 PolarHBondContact O-N 3.13Å; V245-L249 HydrophobicContact CG1-CD1 3.89Å; V245-L249 HydrophobicContact CG1-CG 4.38Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.49Å; V245-L249 PolarHBondContact O-N 2.97Å; V245-L275 HydrophobicContact CG1-CD1 3.98Å; V245-T567 HydrophobicContact CG1-CG2 3.63Å
246V97.7Very high95.7Very high0 Ų033 Ų330%020%0.202CC..Hα-helixtrans-56.7-44.8177.4168.40000111.1V242 V244 L249 R250 L275 A276 T290V242-V246 HydrophobicContact CG1-CG2 4.09Å; V242-V246 WeakPolarHBondContact O-CB 3.16Å; V242-V246 WeakPolarHBondContact O-CG2 3.49Å; V242-V246 PolarHBondContact O-N 3.47Å; V244-V246 PolarHBondContact O-N 3.05Å; V246-L249 PolarHBondContact O-N 3.27Å; V246-R250 HydrophobicContact CG1-CG 4.39Å; V246-R250 WeakPolarHBondContact O-CD 3.28Å; V246-R250 WeakPolarHBondContact O-CG 3.27Å; V246-R250 PolarHBondContact O-N 3.11Å; V246-L275 HydrophobicContact CG2-CB 3.75Å; V246-L275 HydrophobicContact CG2-CD1 4.32Å; V246-A276 HydrophobicContact CG1-CB 4.3Å; V246-T290 HydrophobicContact CG1-CG2 3.54Å
247D97.6Very high95.7Very high27 Ų2731.9 Ų31.914%0.14420%0.195CC..Hα-helixtrans-64.6-44.1179.1-74.2-31.8000113K243 V244 V245 L249 R250 Q251 K286K243-D247 PolarHBondContact O-N 3.18Å; K243-D247 VanDerWaalsContact O-N 3.14Å; K243-D247 VanDerWaalsContact O-OD2 3.1Å; V244-D247 PolarHBondContact O-N 3.34Å; V245-D247 VanDerWaalsContact C-N 3.31Å; V245-D247 PolarHBondContact O-N 2.92Å; D247-L249 PolarHBondContact O-N 3.33Å; D247-R250 PolarHBondContact O-N 3.42Å; D247-R250 IonicContact OD1-CZ 2.68Å; D247-R250 IonicContact OD1-NH1 3.88Å; D247-R250 PolarHBondContact OD1-NH1 2.9Å; D247-Q251 WeakPolarHBondContact O-CG 3.04Å; D247-Q251 PolarHBondContact O-N 3.43Å; D247-K286 WeakPolarHBondContact OD1-CE 3.33Å; D247-K286 IonicContact OD1-NZ 2.98Å; D247-K286 PolarHBondContact OD1-NZ 2.98Å; D247-K286 IonicContact OD2-NZ 3.73Å; D247-K286 PolarHBondContact OD2-NZ 3.47Å
248V98.3Very high95.8Very high2 Ų229.2 Ų29.21%0.01218%0.179CC..Hα-helixtrans-61.7-44.9177.3173.80000110.9A206 A232 M233 I236 V244 V245 R250 Q251 A252A206-V248 HydrophobicContact CB-CG2 4.36Å; A206-V248 WeakPolarHBondContact O-CG2 3.42Å; A232-V248 HydrophobicContact CB-CG1 3.71Å; A232-V248 HydrophobicContact CB-CG2 4.4Å; M233-V248 HydrophobicContact CG-CG1 4.26Å; M233-V248 HydrophobicContact SD-CG1 3.86Å; I236-V248 HydrophobicContact CD1-CB 4.31Å; I236-V248 HydrophobicContact CD1-CG1 3.91Å; I236-V248 HydrophobicContact CG1-CG1 4.43Å; V244-V248 HydrophobicContact CG1-CG2 4.36Å; V244-V248 WeakPolarHBondContact O-CG2 3.16Å; V244-V248 PolarHBondContact O-N 3.49Å; V245-V248 PolarHBondContact O-N 3.13Å; V248-R250 PolarHBondContact O-N 3.36Å; V248-Q251 PolarHBondContact O-N 3.47Å; V248-A252 VanDerWaalsContact O-CB 3.28Å; V248-A252 WeakPolarHBondContact O-CB 3.29Å; V248-A252 PolarHBondContact O-N 2.83Å
249L98Very high96.1Very high0 Ų027.1 Ų27.10%016%0.16CC..Hα-helixtrans-61-42.4178.1-67.6171.6000112.3M233 V245 V246 D247 A252 S253 L268 A272 L275M233-L249 HydrophobicContact CE-CD2 3.84Å; M233-L249 HydrophobicContact SD-CD2 3.88Å; V245-L249 HydrophobicContact CG1-CD1 3.89Å; V245-L249 HydrophobicContact CG1-CG 4.38Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.49Å; V245-L249 PolarHBondContact O-N 2.97Å; V246-L249 PolarHBondContact O-N 3.27Å; D247-L249 PolarHBondContact O-N 3.33Å; L249-A252 PolarHBondContact O-N 3.14Å; L249-S253 WeakPolarHBondContact O-CB 3.43Å; L249-S253 PolarHBondContact O-N 3.11Å; L249-L268 HydrophobicContact CD2-CD2 3.63Å; L249-A272 HydrophobicContact CB-CB 3.94Å; L249-A272 HydrophobicContact CD1-CB 4.38Å; L249-L275 HydrophobicContact CD1-CD1 3.95Å
250R98.1Very high96.3Very high19 Ų1925.4 Ų25.47%0.07213%0.129CC..Hα-helixtrans-61.6-47.2176.6-71.4164.465-167.88.2112.1V246 D247 V248 S253 K254 I269 A272 D289 T290 D293V246-R250 HydrophobicContact CG1-CG 4.39Å; V246-R250 WeakPolarHBondContact O-CD 3.28Å; V246-R250 WeakPolarHBondContact O-CG 3.27Å; V246-R250 PolarHBondContact O-N 3.11Å; D247-R250 PolarHBondContact O-N 3.42Å; D247-R250 IonicContact OD1-CZ 2.68Å; D247-R250 IonicContact OD1-NH1 3.88Å; D247-R250 PolarHBondContact OD1-NH1 2.9Å; V248-R250 PolarHBondContact O-N 3.36Å; R250-S253 PolarHBondContact O-N 2.93Å; R250-K254 PolarHBondContact O-N 3.3Å; R250-K254 VanDerWaalsContact O-N 3.11Å; R250-I269 HydrophobicContact CG-CD1 4.34Å; R250-A272 HydrophobicContact CG-CB 4.05Å; R250-D289 VanDerWaalsContact CZ-CB 3.47Å; R250-D289 IonicContact CZ-OD2 2.92Å; R250-D289 IonicContact NH1-OD2 3.29Å; R250-D289 PolarHBondContact NH1-OD2 3.19Å; R250-D289 PolarHBondContact NH2-O 2.96Å; R250-D289 IonicContact NH2-OD2 2.61Å; R250-T290 HydrophobicContact CG-CG2 3.95Å; R250-D293 IonicContact CZ-OD2 2.8Å; R250-D293 VanDerWaalsContact CZ-OD2 3.22Å; R250-D293 IonicContact NE-OD2 3.36Å; R250-D293 PolarHBondContact NE-OD2 2.94Å; R250-D293 IonicContact NH2-OD2 2.6Å; R250-D293 PolarHBondContact NH2-OD2 3.2Å
251Q97.9Very high96.3Very high26 Ų2626.5 Ų26.512%0.12113%0.133CC..Hα-helixtrans-66.5-42178.7-59.7-55-22.700111.3A214 D247 V248 S253 K254 A255A214-Q251 HydrophobicContact CB-CG 4.21Å; D247-Q251 WeakPolarHBondContact O-CG 3.04Å; D247-Q251 PolarHBondContact O-N 3.43Å; V248-Q251 PolarHBondContact O-N 3.47Å; Q251-S253 VanDerWaalsContact C-N 3.34Å; Q251-S253 PolarHBondContact O-N 2.88Å; Q251-K254 PolarHBondContact O-N 3.19Å; Q251-A255 PolarHBondContact O-N 3.1Å
252A97.7Very high96.1Very high1 Ų124.2 Ų24.21%0.00812%0.115CC..Hα-helixtrans-62.1-41.3176.500000111.7C229 M233 V248 L249 A255 C256 L268C229-A252 HydrophobicContact CB-CB 4.12Å; C229-A252 WeakPolarHBondContact SG-CA 3.23Å; C229-A252 PolarHBondContact SG-N 3.18Å; C229-A252 VanDerWaalsContact SG-N 3.39Å; M233-A252 HydrophobicContact CG-CB 4.21Å; M233-A252 HydrophobicContact SD-CB 4.21Å; V248-A252 VanDerWaalsContact O-CB 3.28Å; V248-A252 WeakPolarHBondContact O-CB 3.29Å; V248-A252 PolarHBondContact O-N 2.83Å; L249-A252 PolarHBondContact O-N 3.14Å; A252-A255 PolarHBondContact O-N 2.93Å; A252-C256 PolarHBondContact O-N 2.96Å; A252-C256 PolarHBondContact O-SG 3.22Å; A252-L268 HydrophobicContact CB-CD1 3.8Å
253S97.9Very high96Very high0 Ų026.7 Ų26.70%014%0.135CC..Hα-helixtrans-59.2-49.1174179.30000111.9L249 R250 Q251 A255 C256 V257 A265 I269L249-S253 WeakPolarHBondContact O-CB 3.43Å; L249-S253 PolarHBondContact O-N 3.11Å; R250-S253 PolarHBondContact O-N 2.93Å; Q251-S253 VanDerWaalsContact C-N 3.34Å; Q251-S253 PolarHBondContact O-N 2.88Å; S253-A255 VanDerWaalsContact C-N 3.32Å; S253-A255 PolarHBondContact O-N 3.33Å; S253-C256 WeakPolarHBondContact O-CA 3.22Å; S253-C256 WeakPolarHBondContact O-CB 3.46Å; S253-C256 PolarHBondContact O-N 3.05Å; S253-V257 WeakPolarHBondContact O-CG2 3.49Å; S253-V257 PolarHBondContact O-N 3.12Å; S253-A265 PolarHBondContact OG-O 2.97Å; S253-I269 WeakPolarHBondContact OG-CB 3.45Å
254K97.6Very high95.9Very high30 Ų3024.3 Ų24.313%0.1312%0.124CC..Hα-helixtrans-58.7-42.6176.7-77.1-171.8-73.5-1480113F217 R250 Q251 C256 V257 V258 D293 F296F217-K254 HydrophobicContact CD2-CB 4.4Å; F217-K254 HydrophobicContact CE1-CD 4.49Å; F217-K254 HydrophobicContact CE2-CB 3.91Å; F217-K254 HydrophobicContact CZ-CB 4.1Å; F217-K254 HydrophobicContact CZ-CD 4.48Å; R250-K254 PolarHBondContact O-N 3.3Å; R250-K254 VanDerWaalsContact O-N 3.11Å; Q251-K254 PolarHBondContact O-N 3.19Å; K254-C256 VanDerWaalsContact C-N 3.32Å; K254-C256 PolarHBondContact O-N 3.48Å; K254-V257 WeakPolarHBondContact O-CB 3.46Å; K254-V257 PolarHBondContact O-N 2.84Å; K254-V258 PolarHBondContact O-N 2.91Å; K254-D293 VanDerWaalsContact CD-OD1 3.27Å; K254-D293 WeakPolarHBondContact CD-OD1 3.35Å; K254-D293 WeakPolarHBondContact CE-OD1 3.3Å; K254-D293 IonicContact NZ-OD1 2.68Å; K254-D293 PolarHBondContact NZ-OD1 2.87Å; K254-D293 IonicContact NZ-OD2 3.29Å; K254-F296 HydrophobicContact CB-CE1 4.29Å; K254-F296 HydrophobicContact CD-CD1 4.49Å; K254-F296 HydrophobicContact CG-CD1 3.88Å; K254-F296 HydrophobicContact CG-CE1 3.89Å
255A96.8Very high95.9Very high0 Ų022.8 Ų22.80%012%0.115CC..Hα-helixtrans-61.9-40.4174.900000111.6Y226 C229 Q251 A252 S253 V258 K259Y226-A255 HydrophobicContact CD2-CB 4.07Å; C229-A255 HydrophobicContact CB-CB 4.3Å; Q251-A255 PolarHBondContact O-N 3.1Å; A252-A255 PolarHBondContact O-N 2.93Å; S253-A255 VanDerWaalsContact C-N 3.32Å; S253-A255 PolarHBondContact O-N 3.33Å; A255-V258 WeakPolarHBondContact O-CG2 3.47Å; A255-V258 PolarHBondContact O-N 2.81Å; A255-K259 WeakPolarHBondContact O-CG 3.2Å; A255-K259 PolarHBondContact O-N 3.31Å; A255-K259 VanDerWaalsContact O-N 3.16Å
256C96.6Very high95.7Very high0 Ų025.2 Ų25.20%013%0.126CC..Hα-helixtrans-63.2-41.2174.4-65.40000112.2A252 S253 K254 V258 K259 R260 E261 A265 F574A252-C256 PolarHBondContact O-N 2.96Å; A252-C256 PolarHBondContact O-SG 3.22Å; S253-C256 WeakPolarHBondContact O-CA 3.22Å; S253-C256 WeakPolarHBondContact O-CB 3.46Å; S253-C256 PolarHBondContact O-N 3.05Å; K254-C256 VanDerWaalsContact C-N 3.32Å; K254-C256 PolarHBondContact O-N 3.48Å; C256-V258 PolarHBondContact O-N 3.22Å; C256-K259 CarbonylContact O-C 3.5Å; C256-K259 PolarHBondContact O-N 3Å; C256-R260 PolarHBondContact O-N 3.35Å; C256-E261 HydrophobicContact CB-CB 4.14Å; C256-E261 PolarHBondContact O-N 2.95Å; C256-A265 HydrophobicContact CB-CB 3.66Å; C256-F574 VanDerWaalsContact SG-CE2 3.59Å
257V96.1Very high95.5Very high0 Ų027.8 Ų27.80%014%0.138CC..Hα-helixtrans-57.7-48.7177.7170.40000111.4S253 K254 K259 R260 F262 A265 F296 Y297 N300S253-V257 WeakPolarHBondContact O-CG2 3.49Å; S253-V257 PolarHBondContact O-N 3.12Å; K254-V257 WeakPolarHBondContact O-CB 3.46Å; K254-V257 PolarHBondContact O-N 2.84Å; V257-K259 VanDerWaalsContact C-N 3.26Å; V257-K259 PolarHBondContact O-N 3.29Å; V257-R260 PolarHBondContact O-N 2.92Å; V257-R260 PolarHBondContact O-NH1 3.21Å; V257-F262 HydrophobicContact CG1-CE1 4.31Å; V257-A265 HydrophobicContact CG2-CB 3.64Å; V257-F296 HydrophobicContact CB-CE1 3.79Å; V257-F296 HydrophobicContact CB-CZ 4.48Å; V257-F296 HydrophobicContact CG1-CD1 4.4Å; V257-F296 HydrophobicContact CG1-CE1 3.58Å; V257-F296 HydrophobicContact CG1-CZ 3.91Å; V257-F296 HydrophobicContact CG2-CD1 4.46Å; V257-F296 HydrophobicContact CG2-CE1 4.1Å; V257-Y297 HydrophobicContact CG2-CD2 4Å; V257-N300 HydrophobicContact CG1-CB 3.38Å
258V92.6Very high95.5Very high22 Ų2226.5 Ų26.513%0.13313%0.131CC..Hα-helixtrans-68.9-26.6179.9-64.20000112.5F217 Y222 K254 A255 C256 R260F217-V258 HydrophobicContact CD2-CG2 4.34Å; F217-V258 HydrophobicContact CE2-CB 4.38Å; F217-V258 HydrophobicContact CE2-CG1 3.53Å; F217-V258 HydrophobicContact CE2-CG2 3.89Å; F217-V258 HydrophobicContact CZ-CG1 3.92Å; Y222-V258 HydrophobicContact CD1-CB 4.25Å; Y222-V258 HydrophobicContact CD1-CG1 4.3Å; Y222-V258 HydrophobicContact CD1-CG2 3.84Å; Y222-V258 HydrophobicContact CE1-CG1 4.23Å; Y222-V258 HydrophobicContact CG-CB 4.29Å; Y222-V258 HydrophobicContact CG-CG2 3.98Å; K254-V258 PolarHBondContact O-N 2.91Å; A255-V258 WeakPolarHBondContact O-CG2 3.47Å; A255-V258 PolarHBondContact O-N 2.81Å; C256-V258 PolarHBondContact O-N 3.22Å; V258-R260 VanDerWaalsContact C-N 3.26Å
259K92.5Very high95.4Very high81 Ų8126.4 Ų26.435%0.35213%0.13SC..THydrogen-bonded Turntrans-83.12.2171.3-64.3-53.4-56.8175.70113.9D223 Y226 A255 C256 V257 E261D223-K259 WeakPolarHBondContact OD1-CE 3.12Å; D223-K259 IonicContact OD1-NZ 2.75Å; D223-K259 PolarHBondContact OD1-NZ 2.94Å; Y226-K259 HydrophobicContact CD1-CG 4.35Å; Y226-K259 HydrophobicContact CD2-CB 4.46Å; Y226-K259 HydrophobicContact CD2-CG 3.85Å; Y226-K259 HydrophobicContact CE2-CG 4.47Å; Y226-K259 HydrophobicContact CG-CG 3.79Å; A255-K259 WeakPolarHBondContact O-CG 3.2Å; A255-K259 PolarHBondContact O-N 3.31Å; A255-K259 VanDerWaalsContact O-N 3.16Å; C256-K259 CarbonylContact O-C 3.5Å; C256-K259 PolarHBondContact O-N 3Å; V257-K259 VanDerWaalsContact C-N 3.26Å; V257-K259 PolarHBondContact O-N 3.29Å; K259-E261 HydrophobicContact CB-CG 4.28Å; K259-E261 PolarHBondContact O-N 3.38Å
260R91.9Very high95.3Very high42 Ų4227.9 Ų27.916%0.15814%0.137CC..THydrogen-bonded Turntrans6124.2-177.8-47.6-61.9169.3-133.11.1113.9C256 V257 V258 F262 Y468 L505C256-R260 PolarHBondContact O-N 3.35Å; V257-R260 PolarHBondContact O-N 2.92Å; V257-R260 PolarHBondContact O-NH1 3.21Å; V258-R260 VanDerWaalsContact C-N 3.26Å; R260-F262 HydrophobicContact CB-CE2 4.1Å; R260-F262 HydrophobicContact CB-CZ 4.24Å; R260-F262 VanDerWaalsContact CD-CZ 3.46Å; R260-F262 HydrophobicContact CG-CZ 4.46Å; R260-F262 PolarHBondContact O-N 3.22Å; R260-F262 VanDerWaalsContact O-N 3.11Å; R260-Y468 VanDerWaalsContact NH2-CD1 3.31Å; R260-L505 HydrophobicContact CG-CD2 4.32Å
261E93.4Very high95.1Very high52 Ų5227 Ų2724%0.24313%0.133CC..  trans-87.959.9173.1-61.7-165.5-15600110.3Y226 C256 K259 S263 K264 A265Y226-E261 VanDerWaalsContact CZ-OE1 3.27Å; Y226-E261 PolarHBondContact OH-OE1 2.92Å; Y226-E261 PolarHBondContact OH-OE2 3.33Å; C256-E261 HydrophobicContact CB-CB 4.14Å; C256-E261 PolarHBondContact O-N 2.95Å; K259-E261 HydrophobicContact CB-CG 4.28Å; K259-E261 PolarHBondContact O-N 3.38Å; E261-S263 VanDerWaalsContact C-N 3.35Å; E261-S263 PolarHBondContact O-N 3.43Å; E261-K264 HydrophobicContact CB-CB 4.37Å; E261-K264 HydrophobicContact CB-CG 4.48Å; E261-K264 PolarHBondContact O-N 3.36Å; E261-K264 VanDerWaalsContact O-N 3.11Å; E261-K264 WeakPolarHBondContact OE2-CD 3.4Å; E261-K264 WeakPolarHBondContact OE2-CE 3.28Å; E261-K264 IonicContact OE2-NZ 3.84Å; E261-K264 PolarHBondContact OE2-NZ 2.86Å; E261-A265 PolarHBondContact O-N 3.45Å
262F92.4Very high95.1Very high32 Ų3225.8 Ų25.814%0.1413%0.128CC..Hα-helixtrans-60.5-38.2-168-62.9-57000114V257 R260 K264 A265 E266 Y297 N300 V301 F506V257-F262 HydrophobicContact CG1-CE1 4.31Å; R260-F262 HydrophobicContact CB-CE2 4.1Å; R260-F262 HydrophobicContact CB-CZ 4.24Å; R260-F262 VanDerWaalsContact CD-CZ 3.46Å; R260-F262 HydrophobicContact CG-CZ 4.46Å; R260-F262 PolarHBondContact O-N 3.22Å; R260-F262 VanDerWaalsContact O-N 3.11Å; F262-K264 VanDerWaalsContact C-N 3.33Å; F262-K264 PolarHBondContact O-N 2.93Å; F262-A265 WeakPolarHBondContact O-CB 3.24Å; F262-A265 PolarHBondContact O-N 3.03Å; F262-E266 WeakPolarHBondContact O-CB 3.36Å; F262-E266 PolarHBondContact O-N 3.34Å; F262-Y297 WeakPolarHBondContact O-CE2 3.4Å; F262-N300 HydrophobicContact CE1-CB 4.25Å; F262-V301 HydrophobicContact CB-CG1 3.86Å; F262-V301 HydrophobicContact CD1-CG1 3.49Å; F262-V301 VanDerWaalsContact CD1-CG1 3.49Å; F262-V301 HydrophobicContact CE1-CG1 4.14Å; F262-V301 HydrophobicContact CG-CG1 3.72Å; F262-F506 AromaticContact CE2-CD1 3.87Å; F262-F506 HydrophobicContact CE2-CD1 3.87Å; F262-F506 AromaticContact CE2-CE1 3.79Å; F262-F506 HydrophobicContact CE2-CE1 3.79Å; F262-F506 AromaticContact CZ-CD1 4Å; F262-F506 HydrophobicContact CZ-CD1 4Å; F262-F506 AromaticContact CZ-CE1 3.45Å; F262-F506 HydrophobicContact CZ-CE1 3.45Å; F262-F506 VanDerWaalsContact CZ-CE1 3.45Å; F262-F506 HydrophobicContact CZ-CZ 4.21Å
263S92.4Very high95Very high96 Ų9625.7 Ų25.767%0.67113%0.127SC*.Hα-helixtrans-63.4-39177.4175.60000112.1E261 Q267E261-S263 VanDerWaalsContact C-N 3.35Å; E261-S263 PolarHBondContact O-N 3.43Å; S263-Q267 PolarHBondContact O-N 3.44Å
264K94.4Very high94.8Very high38 Ų3827.8 Ų27.817%0.16514%0.136CC..Hα-helixtrans-69.9-43.8175.1-59.2-166.2-156.9167.80110.9E261 F262 E266 Q267 L268 F574 S577E261-K264 HydrophobicContact CB-CB 4.37Å; E261-K264 HydrophobicContact CB-CG 4.48Å; E261-K264 PolarHBondContact O-N 3.36Å; E261-K264 VanDerWaalsContact O-N 3.11Å; E261-K264 WeakPolarHBondContact OE2-CD 3.4Å; E261-K264 WeakPolarHBondContact OE2-CE 3.28Å; E261-K264 IonicContact OE2-NZ 3.84Å; E261-K264 PolarHBondContact OE2-NZ 2.86Å; F262-K264 VanDerWaalsContact C-N 3.33Å; F262-K264 PolarHBondContact O-N 2.93Å; K264-E266 VanDerWaalsContact C-N 3.27Å; K264-E266 PolarHBondContact O-N 3.36Å; K264-Q267 PolarHBondContact O-N 3.33Å; K264-L268 VanDerWaalsContact O-CG 3.27Å; K264-L268 WeakPolarHBondContact O-CG 3.43Å; K264-L268 PolarHBondContact O-N 3.39Å; K264-L268 VanDerWaalsContact O-N 3.13Å; K264-F574 HydrophobicContact CB-CD2 4.04Å; K264-F574 HydrophobicContact CB-CE2 4.09Å; K264-F574 HydrophobicContact CD-CD2 3.87Å; K264-F574 HydrophobicContact CD-CE2 3.82Å; K264-F574 HydrophobicContact CG-CD2 4.37Å; K264-S577 WeakPolarHBondContact CD-OG 3.35Å; K264-S577 WeakPolarHBondContact CE-OG 3.09Å; K264-S577 PolarHBondContact NZ-OG 3.18Å
265A96.4Very high94.7Very high0 Ų027 Ų270%013%0.133CC..Hα-helixtrans-56-44.5177.200000111.9S253 C256 V257 E261 F262 L268 I269 Y297S253-A265 PolarHBondContact OG-O 2.97Å; C256-A265 HydrophobicContact CB-CB 3.66Å; V257-A265 HydrophobicContact CG2-CB 3.64Å; E261-A265 PolarHBondContact O-N 3.45Å; F262-A265 WeakPolarHBondContact O-CB 3.24Å; F262-A265 PolarHBondContact O-N 3.03Å; A265-L268 PolarHBondContact O-N 3.04Å; A265-I269 VanDerWaalsContact O-CG2 3.27Å; A265-I269 WeakPolarHBondContact O-CG2 3.35Å; A265-I269 PolarHBondContact O-N 3.43Å; A265-Y297 HydrophobicContact CB-CD2 3.83Å; A265-Y297 HydrophobicContact CB-CE2 4.09Å
266E94.1Very high94.6Very high62 Ų6227 Ų2729%0.2913%0.133SC..Hα-helixtrans-60.1-52.5178.5-168.5178.5176.900111.9F262 K264 L268 I269 K270 Y297F262-E266 WeakPolarHBondContact O-CB 3.36Å; F262-E266 PolarHBondContact O-N 3.34Å; K264-E266 VanDerWaalsContact C-N 3.27Å; K264-E266 PolarHBondContact O-N 3.36Å; E266-L268 VanDerWaalsContact C-N 3.27Å; E266-L268 PolarHBondContact O-N 2.89Å; E266-I269 WeakPolarHBondContact O-CG2 3.49Å; E266-I269 PolarHBondContact O-N 3.16Å; E266-K270 HydrophobicContact CG-CD 3.95Å; E266-K270 HydrophobicContact CG-CG 4.3Å; E266-K270 WeakPolarHBondContact O-CB 3.34Å; E266-K270 WeakPolarHBondContact O-CG 3.39Å; E266-K270 PolarHBondContact O-N 3.16Å; E266-K270 WeakPolarHBondContact OE1-CE 3.47Å; E266-K270 IonicContact OE1-NZ 2.72Å; E266-K270 PolarHBondContact OE1-NZ 3.37Å; E266-Y297 HydrophobicContact CB-CE1 4.28Å; E266-Y297 HydrophobicContact CB-CE2 3.75Å; E266-Y297 VanDerWaalsContact CB-OH 3.28Å; E266-Y297 WeakPolarHBondContact CB-OH 3.44Å; E266-Y297 VanDerWaalsContact CD-OH 3.24Å; E266-Y297 HydrophobicContact CG-CE1 4.03Å; E266-Y297 HydrophobicContact CG-CE2 4.39Å; E266-Y297 VanDerWaalsContact CG-OH 3.27Å; E266-Y297 WeakPolarHBondContact CG-OH 3.44Å; E266-Y297 PolarHBondContact OE2-OH 3.39Å
267Q93.5Very high94.5Very high53 Ų5328.9 Ų28.925%0.24814%0.14CC..Hα-helixtrans-56.3-45.6-179.7-169.8-176.824.700110.8S263 K264 H271 V570 S573S263-Q267 PolarHBondContact O-N 3.44Å; K264-Q267 PolarHBondContact O-N 3.33Å; Q267-H271 WeakPolarHBondContact O-CB 3.42Å; Q267-H271 PolarHBondContact O-N 2.93Å; Q267-V570 HydrophobicContact CG-CG1 4.07Å; Q267-S573 PolarHBondContact OE1-OG 2.96Å
268L96.3Very high94.4Very high0 Ų034.2 Ų34.20%017%0.165CC..Hα-helixtrans-67.8-45.1-178.2-64.1175.3000112.5M233 L249 A252 K264 A265 E266 H271 A272 V570 F574M233-L268 HydrophobicContact CE-CD2 3.52Å; L249-L268 HydrophobicContact CD2-CD2 3.63Å; A252-L268 HydrophobicContact CB-CD1 3.8Å; K264-L268 VanDerWaalsContact O-CG 3.27Å; K264-L268 WeakPolarHBondContact O-CG 3.43Å; K264-L268 PolarHBondContact O-N 3.39Å; K264-L268 VanDerWaalsContact O-N 3.13Å; A265-L268 PolarHBondContact O-N 3.04Å; E266-L268 VanDerWaalsContact C-N 3.27Å; E266-L268 PolarHBondContact O-N 2.89Å; L268-H271 PolarHBondContact O-N 3.42Å; L268-A272 WeakPolarHBondContact O-CB 3.45Å; L268-A272 PolarHBondContact O-N 3.06Å; L268-V570 HydrophobicContact CD2-CG1 4.18Å; L268-F574 HydrophobicContact CD1-CD2 3.84Å; L268-F574 HydrophobicContact CD1-CE2 3.85Å; L268-F574 HydrophobicContact CD1-CG 4.48Å; L268-F574 HydrophobicContact CD1-CZ 4.49Å; L268-F574 HydrophobicContact CD2-CB 4.38Å; L268-F574 HydrophobicContact CD2-CD2 4.36Å; L268-F574 HydrophobicContact CD2-CG 4.36Å; L268-F574 HydrophobicContact CG-CD2 4.34Å
269I97.1Very high94.4Very high0 Ų038.5 Ų38.50%018%0.184CC..Hα-helixtrans-73.3-39.7-176.1-166.555000112.1R250 S253 A265 E266 H271 A272 V273 D293 Y294 Y297R250-I269 HydrophobicContact CG-CD1 4.34Å; S253-I269 WeakPolarHBondContact OG-CB 3.45Å; A265-I269 VanDerWaalsContact O-CG2 3.27Å; A265-I269 WeakPolarHBondContact O-CG2 3.35Å; A265-I269 PolarHBondContact O-N 3.43Å; E266-I269 WeakPolarHBondContact O-CG2 3.49Å; E266-I269 PolarHBondContact O-N 3.16Å; I269-H271 VanDerWaalsContact C-N 3.3Å; I269-H271 PolarHBondContact O-N 3.01Å; I269-A272 HydrophobicContact CD1-CB 4.46Å; I269-A272 PolarHBondContact O-N 3.26Å; I269-V273 HydrophobicContact CG1-CG2 4.45Å; I269-V273 VanDerWaalsContact O-CG2 3.27Å; I269-V273 WeakPolarHBondContact O-CG2 3.29Å; I269-V273 PolarHBondContact O-N 3.31Å; I269-D293 HydrophobicContact CD1-CB 3.72Å; I269-Y294 HydrophobicContact CG1-CD2 4.08Å; I269-Y294 HydrophobicContact CG1-CG 4.29Å; I269-Y294 HydrophobicContact CG2-CD2 3.72Å; I269-Y294 HydrophobicContact CG2-CE2 4.26Å; I269-Y297 HydrophobicContact CG2-CD1 4.18Å; I269-Y297 HydrophobicContact CG2-CG 4.04Å
270K94.9Very high94.4Very high31 Ų3137.7 Ų37.714%0.13518%0.18CC..Hα-helixtrans-60.8-42.7174.7-70.4-172166.9171.80110.8E266 V273 F274 Y294 D559 V560E266-K270 HydrophobicContact CG-CD 3.95Å; E266-K270 HydrophobicContact CG-CG 4.3Å; E266-K270 WeakPolarHBondContact O-CB 3.34Å; E266-K270 WeakPolarHBondContact O-CG 3.39Å; E266-K270 PolarHBondContact O-N 3.16Å; E266-K270 WeakPolarHBondContact OE1-CE 3.47Å; E266-K270 IonicContact OE1-NZ 2.72Å; E266-K270 PolarHBondContact OE1-NZ 3.37Å; K270-V273 PolarHBondContact O-N 2.91Å; K270-F274 WeakPolarHBondContact O-CB 3.48Å; K270-F274 PolarHBondContact O-N 3.31Å; K270-Y294 HydrophobicContact CG-CE2 4.36Å; K270-D559 WeakPolarHBondContact CE-OD2 3.42Å; K270-D559 VanDerWaalsContact NZ-CG 3.29Å; K270-D559 IonicContact NZ-OD1 2.65Å; K270-D559 PolarHBondContact NZ-OD1 3.43Å; K270-D559 IonicContact NZ-OD2 2.77Å; K270-D559 PolarHBondContact NZ-OD2 3.46Å; K270-V560 HydrophobicContact CB-CG2 4.35Å; K270-V560 HydrophobicContact CD-CG2 4.43Å; K270-V560 HydrophobicContact CG-CG2 3.97Å; K270-V560 WeakPolarHBondContact O-CG1 3.46Å
271H95.3Very high94.4Very high1 Ų136.9 Ų36.91%0.00519%0.186CC..Hα-helixtrans-64.4-40.9175.7-165.362000112.4Q267 L268 I269 F274 L275 Q565 T567 V570Q267-H271 WeakPolarHBondContact O-CB 3.42Å; Q267-H271 PolarHBondContact O-N 2.93Å; L268-H271 PolarHBondContact O-N 3.42Å; I269-H271 VanDerWaalsContact C-N 3.3Å; I269-H271 PolarHBondContact O-N 3.01Å; H271-F274 PolarHBondContact O-N 3.14Å; H271-L275 WeakPolarHBondContact O-CB 3.26Å; H271-L275 WeakPolarHBondContact O-CG 3.41Å; H271-L275 PolarHBondContact O-N 2.58Å; H271-Q565 PolarHBondContact CE1-O 3.18Å; H271-T567 WeakPolarHBondContact NE2-CA 3.36Å; H271-T567 PolarHBondContact NE2-OG1 2.94Å; H271-V570 HydrophobicContact CB-CG1 4.31Å; H271-V570 HydrophobicContact CB-CG2 4.5Å
272A96.6Very high94.4Very high0 Ų040 Ų400%020%0.2CC..Hα-helixtrans-62.8-44175.900000112.4L249 R250 L268 I269 L275 A276 T290L249-A272 HydrophobicContact CB-CB 3.94Å; L249-A272 HydrophobicContact CD1-CB 4.38Å; R250-A272 HydrophobicContact CG-CB 4.05Å; L268-A272 WeakPolarHBondContact O-CB 3.45Å; L268-A272 PolarHBondContact O-N 3.06Å; I269-A272 HydrophobicContact CD1-CB 4.46Å; I269-A272 PolarHBondContact O-N 3.26Å; A272-L275 PolarHBondContact O-N 2.8Å; A272-A276 VanDerWaalsContact O-CB 3.29Å; A272-A276 WeakPolarHBondContact O-CB 3.39Å; A272-A276 PolarHBondContact O-N 2.54Å; A272-T290 HydrophobicContact CB-CG2 4.1Å
273V96.2Very high94.3Very high0 Ų045.3 Ų45.30%022%0.223CC..Hα-helixtrans-61.3-44.8176.2173.10000110.7I269 K270 A276 R277 Y287 L291 Y294 V560I269-V273 HydrophobicContact CG1-CG2 4.45Å; I269-V273 VanDerWaalsContact O-CG2 3.27Å; I269-V273 WeakPolarHBondContact O-CG2 3.29Å; I269-V273 PolarHBondContact O-N 3.31Å; K270-V273 PolarHBondContact O-N 2.91Å; V273-A276 PolarHBondContact O-N 3.4Å; V273-R277 WeakPolarHBondContact O-CB 3.46Å; V273-R277 PolarHBondContact O-N 3.45Å; V273-Y287 HydrophobicContact CG1-CD2 4.45Å; V273-Y287 HydrophobicContact CG1-CE2 3.64Å; V273-L291 HydrophobicContact CG1-CD2 4.1Å; V273-Y294 HydrophobicContact CG2-CD1 4.44Å; V273-Y294 HydrophobicContact CG2-CG 4.32Å; V273-V560 HydrophobicContact CB-CG1 3.85Å; V273-V560 HydrophobicContact CG1-CB 4.44Å; V273-V560 HydrophobicContact CG1-CG1 3.6Å
274F94.5Very high94.3Very high43 Ų4343.9 Ų43.919%0.18921%0.205CC..Hα-helixtrans-58.2-56.5174.9172.1-97.1000111.5K270 H271 A276 R277 E278 V560K270-F274 WeakPolarHBondContact O-CB 3.48Å; K270-F274 PolarHBondContact O-N 3.31Å; H271-F274 PolarHBondContact O-N 3.14Å; F274-A276 VanDerWaalsContact C-N 3.27Å; F274-A276 PolarHBondContact O-N 2.91Å; F274-R277 PolarHBondContact O-N 2.96Å; F274-R277 VanDerWaalsContact O-N 3.14Å; F274-E278 HydrophobicContact CD1-CG 4.43Å; F274-E278 HydrophobicContact CD2-CG 4.05Å; F274-E278 HydrophobicContact CE1-CG 4.05Å; F274-E278 HydrophobicContact CE2-CG 3.63Å; F274-E278 HydrophobicContact CG-CG 4.42Å; F274-E278 HydrophobicContact CZ-CG 3.63Å; F274-E278 WeakPolarHBondContact O-CG 3.45Å; F274-E278 PolarHBondContact O-N 2.71Å; F274-V560 HydrophobicContact CB-CG1 4.38Å
275L94.5Very high94.3Very high14 Ų1442.9 Ų42.97%0.07320%0.203CC..Hα-helixtrans-56.8-42.1179.7-73.7178.3000111.9V245 V246 L249 H271 A272 H279V245-L275 HydrophobicContact CG1-CD1 3.98Å; V246-L275 HydrophobicContact CG2-CB 3.75Å; V246-L275 HydrophobicContact CG2-CD1 4.32Å; L249-L275 HydrophobicContact CD1-CD1 3.95Å; H271-L275 WeakPolarHBondContact O-CB 3.26Å; H271-L275 WeakPolarHBondContact O-CG 3.41Å; H271-L275 PolarHBondContact O-N 2.58Å; A272-L275 PolarHBondContact O-N 2.8Å; L275-H279 WeakPolarHBondContact O-CB 3.42Å; L275-H279 PolarHBondContact O-CD2 3.29Å; L275-H279 VanDerWaalsContact O-CD2 3.32Å; L275-H279 PolarHBondContact O-N 2.85Å
276A95.8Very high94.2Very high0 Ų043.5 Ų43.50%021%0.206CC..Hα-helixtrans-66.4-39.6-179.400000112.1V246 A272 V273 F274 F280 Y287 T290V246-A276 HydrophobicContact CG1-CB 4.3Å; A272-A276 VanDerWaalsContact O-CB 3.29Å; A272-A276 WeakPolarHBondContact O-CB 3.39Å; A272-A276 PolarHBondContact O-N 2.54Å; V273-A276 PolarHBondContact O-N 3.4Å; F274-A276 VanDerWaalsContact C-N 3.27Å; F274-A276 PolarHBondContact O-N 2.91Å; A276-F280 HydrophobicContact CB-CD2 4.28Å; A276-F280 WeakPolarHBondContact O-CB 3.4Å; A276-F280 WeakPolarHBondContact O-CD2 3.47Å; A276-F280 PolarHBondContact O-N 3.13Å; A276-Y287 HydrophobicContact CB-CD2 4.32Å; A276-T290 HydrophobicContact CB-CG2 3.71Å
277R94Very high94.3Very high39 Ų3941.2 Ų41.215%0.14719%0.194CC..Hα-helixtrans-65-50.7175.7-174.4-178.464.8-148.6-1.2111.8V273 F274 G281 Y287 N561V273-R277 WeakPolarHBondContact O-CB 3.46Å; V273-R277 PolarHBondContact O-N 3.45Å; F274-R277 PolarHBondContact O-N 2.96Å; F274-R277 VanDerWaalsContact O-N 3.14Å; R277-G281 WeakPolarHBondContact O-CA 3.35Å; R277-G281 PolarHBondContact O-N 3.34Å; R277-Y287 HydrophobicContact CB-CD2 3.81Å; R277-Y287 HydrophobicContact CB-CE2 3.68Å; R277-Y287 HydrophobicContact CG-CE2 4.26Å; R277-N561 PolarHBondContact NH1-OD1 3.14Å
278E92.8Very high94.5Very high112 Ų11238.7 Ų38.752%0.52318%0.183SC..Hα-helixtrans-66.4-40.2-174.5-65.4-51.6118.500112F274F274-E278 HydrophobicContact CD1-CG 4.43Å; F274-E278 HydrophobicContact CD2-CG 4.05Å; F274-E278 HydrophobicContact CE1-CG 4.05Å; F274-E278 HydrophobicContact CE2-CG 3.63Å; F274-E278 HydrophobicContact CG-CG 4.42Å; F274-E278 HydrophobicContact CZ-CG 3.63Å; F274-E278 WeakPolarHBondContact O-CG 3.45Å; F274-E278 PolarHBondContact O-N 2.71Å
279H93.4Very high94.5Very high113 Ų11340.3 Ų40.352%0.52319%0.191SC..Hα-helixtrans-87.8-31.8-175.4-75.3-83000114.5V242 L275V242-H279 HydrophobicContact CG1-CB 4.09Å; L275-H279 WeakPolarHBondContact O-CB 3.42Å; L275-H279 PolarHBondContact O-CD2 3.29Å; L275-H279 VanDerWaalsContact O-CD2 3.32Å; L275-H279 PolarHBondContact O-N 2.85Å
280F92.9Very high94.6Very high63 Ų6340.3 Ų40.328%0.27619%0.191SC..Hα-helixtrans-112.2-20.9-175.6-52-73.9000113.7V242 K243 A276 H284 K286V242-F280 HydrophobicContact CG1-CE2 4.34Å; V242-F280 HydrophobicContact CG1-CZ 4.47Å; K243-F280 HydrophobicContact CB-CZ 4.12Å; A276-F280 HydrophobicContact CB-CD2 4.28Å; A276-F280 WeakPolarHBondContact O-CB 3.4Å; A276-F280 WeakPolarHBondContact O-CD2 3.47Å; A276-F280 PolarHBondContact O-N 3.13Å; F280-H284 HydrophobicContact CB-CB 3.7Å; F280-H284 AromaticContact CG-ND1 3.99Å; F280-H284 WeakPolarHBondContact O-CB 3.43Å; F280-K286 HydrophobicContact CD2-CB 3.85Å; F280-K286 HydrophobicContact CD2-CG 3.67Å; F280-K286 HydrophobicContact CE2-CB 4.26Å; F280-K286 HydrophobicContact CE2-CG 3.61Å; F280-K286 HydrophobicContact CG-CB 4.12Å; F280-K286 HydrophobicContact CG-CG 4.37Å; F280-K286 HydrophobicContact CZ-CG 4.23Å
281G92.3Very high94.8Very high26 Ų2638.8 Ų38.827%0.26819%0.185SC..  trans92156.7-177.400000114.1R277 K283 H284R277-G281 WeakPolarHBondContact O-CA 3.35Å; R277-G281 PolarHBondContact O-N 3.34Å; G281-K283 PolarHBondContact O-N 3.16Å; G281-K283 VanDerWaalsContact O-N 3.13Å; G281-H284 WeakPolarHBondContact O-CB 3.41Å; G281-H284 PolarHBondContact O-N 3.22Å; G281-H284 VanDerWaalsContact O-N 3.12Å
282H91.8Very high94.9Very high118 Ų11839.2 Ų39.255%0.54619%0.187SC..THydrogen-bonded Turntrans-68.9-9.1-172.863.1-87000115.4Y287 I317H282-Y287 HydrophobicContact CB-CD1 4.4Å; H282-Y287 HydrophobicContact CB-CE1 4.23Å; H282-Y287 VanDerWaalsContact O-CD1 3.32Å; H282-Y287 WeakPolarHBondContact O-CD1 3.43Å; H282-I317 VanDerWaalsContact O-CD1 3.32Å; H282-I317 WeakPolarHBondContact O-CD1 3.33Å
283K90.9Very high95Very high142 Ų14240 Ų4062%0.61719%0.191SC*.THydrogen-bonded Turntrans-106.72.5175.4-60-170.3178.5-178.30113.3G281 I317G281-K283 PolarHBondContact O-N 3.16Å; G281-K283 VanDerWaalsContact O-N 3.13Å; K283-I317 WeakPolarHBondContact O-CG2 3.38Å
284H92.4Very high95.1Very high66 Ų6640.1 Ų40.131%0.30619%0.192SC..SBendtrans-82.4141.4-174.8-168.9-89.7000111.1F280 G281 K286 Y287 S288F280-H284 HydrophobicContact CB-CB 3.7Å; F280-H284 AromaticContact CG-ND1 3.99Å; F280-H284 WeakPolarHBondContact O-CB 3.43Å; G281-H284 WeakPolarHBondContact O-CB 3.41Å; G281-H284 PolarHBondContact O-N 3.22Å; G281-H284 VanDerWaalsContact O-N 3.12Å; H284-K286 WeakPolarHBondContact ND1-CB 3.4Å; H284-K286 PolarHBondContact ND1-N 3.2Å; H284-K286 PolarHBondContact O-N 2.85Å; H284-K286 VanDerWaalsContact O-N 3.1Å; H284-Y287 WeakPolarHBondContact O-CB 3.24Å; H284-Y287 PolarHBondContact O-N 2.94Å; H284-S288 PolarHBondContact O-N 3.23Å
285P93.7Very high95.2Very high18 Ų1838.1 Ų38.112%0.11718%0.183CC..Hα-helixtrans-53.8-34.1177.5-30.637.8000114Y287 S288 D289 V321 F322P285-Y287 VanDerWaalsContact C-N 3.27Å; P285-Y287 PolarHBondContact O-N 2.96Å; P285-S288 WeakPolarHBondContact O-CB 3.5Å; P285-S288 PolarHBondContact O-N 3.49Å; P285-D289 WeakPolarHBondContact O-CB 3.48Å; P285-D289 PolarHBondContact O-N 3.31Å; P285-V321 HydrophobicContact CG-CB 4.1Å; P285-V321 HydrophobicContact CG-CG1 3.62Å; P285-V321 HydrophobicContact CG-CG2 4.05Å; P285-F322 HydrophobicContact CB-CE2 3.83Å; P285-F322 HydrophobicContact CB-CZ 3.7Å; P285-F322 HydrophobicContact CG-CE1 4.43Å; P285-F322 HydrophobicContact CG-CE2 3.91Å; P285-F322 HydrophobicContact CG-CZ 3.62Å
286K95.1Very high95.4Very high13 Ų1339.7 Ų39.76%0.05719%0.189CC..Hα-helixtrans-62.4-31.9176.8-164.655.3157.6-161.40113.8D247 F280 H284 D289 T290D247-K286 WeakPolarHBondContact OD1-CE 3.33Å; D247-K286 IonicContact OD1-NZ 2.98Å; D247-K286 PolarHBondContact OD1-NZ 2.98Å; D247-K286 IonicContact OD2-NZ 3.73Å; D247-K286 PolarHBondContact OD2-NZ 3.47Å; F280-K286 HydrophobicContact CD2-CB 3.85Å; F280-K286 HydrophobicContact CD2-CG 3.67Å; F280-K286 HydrophobicContact CE2-CB 4.26Å; F280-K286 HydrophobicContact CE2-CG 3.61Å; F280-K286 HydrophobicContact CG-CB 4.12Å; F280-K286 HydrophobicContact CG-CG 4.37Å; F280-K286 HydrophobicContact CZ-CG 4.23Å; H284-K286 WeakPolarHBondContact ND1-CB 3.4Å; H284-K286 PolarHBondContact ND1-N 3.2Å; H284-K286 PolarHBondContact O-N 2.85Å; H284-K286 VanDerWaalsContact O-N 3.1Å; K286-D289 HydrophobicContact CD-CB 4.43Å; K286-D289 VanDerWaalsContact O-CB 3.28Å; K286-D289 WeakPolarHBondContact O-CB 3.35Å; K286-T290 PolarHBondContact O-N 2.93Å
287Y96.5Very high95.4Very high13 Ų1340.3 Ų40.35%0.05119%0.192CC..Hα-helixtrans-73-44.9173.4178.4-119.2000110.5V273 A276 R277 H282 H284 P285 D289 T290 L291 I317V273-Y287 HydrophobicContact CG1-CD2 4.45Å; V273-Y287 HydrophobicContact CG1-CE2 3.64Å; A276-Y287 HydrophobicContact CB-CD2 4.32Å; R277-Y287 HydrophobicContact CB-CD2 3.81Å; R277-Y287 HydrophobicContact CB-CE2 3.68Å; R277-Y287 HydrophobicContact CG-CE2 4.26Å; H282-Y287 HydrophobicContact CB-CD1 4.4Å; H282-Y287 HydrophobicContact CB-CE1 4.23Å; H282-Y287 VanDerWaalsContact O-CD1 3.32Å; H282-Y287 WeakPolarHBondContact O-CD1 3.43Å; H284-Y287 WeakPolarHBondContact O-CB 3.24Å; H284-Y287 PolarHBondContact O-N 2.94Å; P285-Y287 VanDerWaalsContact C-N 3.27Å; P285-Y287 PolarHBondContact O-N 2.96Å; Y287-D289 VanDerWaalsContact C-N 3.26Å; Y287-D289 PolarHBondContact O-N 3.38Å; Y287-T290 PolarHBondContact O-N 3.28Å; Y287-T290 PolarHBondContact O-OG1 2.91Å; Y287-L291 HydrophobicContact CD1-CD1 4.04Å; Y287-L291 HydrophobicContact CD1-CG 4.47Å; Y287-L291 HydrophobicContact CE1-CD1 3.68Å; Y287-L291 HydrophobicContact CE1-CD2 4.44Å; Y287-L291 HydrophobicContact CE1-CG 4.2Å; Y287-L291 HydrophobicContact CE2-CD2 4.16Å; Y287-L291 HydrophobicContact CE2-CG 4.33Å; Y287-L291 WeakPolarHBondContact O-CG 3.42Å; Y287-L291 PolarHBondContact O-N 3.43Å; Y287-I317 HydrophobicContact CD1-CD1 3.76Å; Y287-I317 HydrophobicContact CE1-CD1 4.14Å
288S97.1Very high95.5Very high0 Ų038.8 Ų38.80%019%0.186CC..Hα-helixtrans-55.5-41.5172.5171.40000112.4H284 P285 T290 L291 L292 A314 R318H284-S288 PolarHBondContact O-N 3.23Å; P285-S288 WeakPolarHBondContact O-CB 3.5Å; P285-S288 PolarHBondContact O-N 3.49Å; S288-T290 VanDerWaalsContact C-N 3.35Å; S288-T290 PolarHBondContact O-N 3.35Å; S288-L291 WeakPolarHBondContact O-CB 3.26Å; S288-L291 PolarHBondContact O-N 3.46Å; S288-L292 PolarHBondContact O-N 2.8Å; S288-A314 PolarHBondContact OG-O 3.32Å; S288-R318 WeakPolarHBondContact OG-CD 3.42Å; S288-R318 WeakPolarHBondContact OG-CG 3.43Å; S288-R318 PolarHBondContact OG-NE 3.24Å
289D97.7Very high95.5Very high34 Ų3434.7 Ų34.718%0.18217%0.168CC..Hα-helixtrans-52.9-46.3172.6-102.322.1000113.5R250 P285 K286 Y287 D293 R318R250-D289 VanDerWaalsContact CZ-CB 3.47Å; R250-D289 IonicContact CZ-OD2 2.92Å; R250-D289 IonicContact NH1-OD2 3.29Å; R250-D289 PolarHBondContact NH1-OD2 3.19Å; R250-D289 PolarHBondContact NH2-O 2.96Å; R250-D289 IonicContact NH2-OD2 2.61Å; P285-D289 WeakPolarHBondContact O-CB 3.48Å; P285-D289 PolarHBondContact O-N 3.31Å; K286-D289 HydrophobicContact CD-CB 4.43Å; K286-D289 VanDerWaalsContact O-CB 3.28Å; K286-D289 WeakPolarHBondContact O-CB 3.35Å; Y287-D289 VanDerWaalsContact C-N 3.26Å; Y287-D289 PolarHBondContact O-N 3.38Å; D289-D293 PolarHBondContact O-N 3.1Å; D289-R318 IonicContact OD1-CZ 3.85Å; D289-R318 IonicContact OD1-NH2 2.8Å; D289-R318 PolarHBondContact OD1-NH2 2.87Å
290T98.2Very high95.5Very high0 Ų031 Ų310%015%0.152CC..Hα-helixtrans-70-33.5174.853.70000112.6V246 R250 A272 A276 K286 Y287 S288 D293 Y294V246-T290 HydrophobicContact CG1-CG2 3.54Å; R250-T290 HydrophobicContact CG-CG2 3.95Å; A272-T290 HydrophobicContact CB-CG2 4.1Å; A276-T290 HydrophobicContact CB-CG2 3.71Å; K286-T290 PolarHBondContact O-N 2.93Å; Y287-T290 PolarHBondContact O-N 3.28Å; Y287-T290 PolarHBondContact O-OG1 2.91Å; S288-T290 VanDerWaalsContact C-N 3.35Å; S288-T290 PolarHBondContact O-N 3.35Å; T290-D293 PolarHBondContact O-N 3.38Å; T290-Y294 WeakPolarHBondContact O-CB 3.11Å; T290-Y294 PolarHBondContact O-N 3.04Å
291L98.3Very high95.4Very high0 Ų029.7 Ų29.70%015%0.149CC..Hα-helixtrans-66.6-39.4176.6-67.9-179.1000111.7V273 Y287 S288 D293 Y294 G295 I310 T313 A314 I317 L557V273-L291 HydrophobicContact CG1-CD2 4.1Å; Y287-L291 HydrophobicContact CD1-CD1 4.04Å; Y287-L291 HydrophobicContact CD1-CG 4.47Å; Y287-L291 HydrophobicContact CE1-CD1 3.68Å; Y287-L291 HydrophobicContact CE1-CD2 4.44Å; Y287-L291 HydrophobicContact CE1-CG 4.2Å; Y287-L291 HydrophobicContact CE2-CD2 4.16Å; Y287-L291 HydrophobicContact CE2-CG 4.33Å; Y287-L291 WeakPolarHBondContact O-CG 3.42Å; Y287-L291 PolarHBondContact O-N 3.43Å; S288-L291 WeakPolarHBondContact O-CB 3.26Å; S288-L291 PolarHBondContact O-N 3.46Å; L291-D293 PolarHBondContact O-N 3.31Å; L291-Y294 CarbonylContact O-C 3.29Å; L291-Y294 PolarHBondContact O-N 3.32Å; L291-G295 PolarHBondContact O-N 3.4Å; L291-I310 HydrophobicContact CB-CG2 3.97Å; L291-I310 HydrophobicContact CD2-CD1 4.36Å; L291-I310 HydrophobicContact CD2-CG2 4.24Å; L291-I310 WeakPolarHBondContact O-CG2 3.36Å; L291-T313 HydrophobicContact CD1-CG2 3.81Å; L291-A314 HydrophobicContact CB-CB 3.83Å; L291-A314 HydrophobicContact CD1-CB 4.47Å; L291-I317 HydrophobicContact CD1-CD1 3.94Å; L291-L557 HydrophobicContact CD2-CD2 3.78Å
292L98.3Very high95.2Very high10 Ų1029 Ų295%0.05214%0.139CC..Hα-helixtrans-61.2-45.1175.3-67.2-176.6000112.3S288 Y294 G295 F296 Y311 A314 A332S288-L292 PolarHBondContact O-N 2.8Å; L292-Y294 VanDerWaalsContact C-N 3.28Å; L292-Y294 PolarHBondContact O-N 3.49Å; L292-G295 PolarHBondContact O-N 3.46Å; L292-F296 PolarHBondContact O-N 3.22Å; L292-Y311 HydrophobicContact CB-CE1 4.33Å; L292-Y311 HydrophobicContact CD2-CD1 3.58Å; L292-Y311 HydrophobicContact CD2-CE1 3.9Å; L292-Y311 VanDerWaalsContact O-CE1 3.26Å; L292-Y311 WeakPolarHBondContact O-CE1 3.47Å; L292-A314 HydrophobicContact CD2-CB 3.49Å; L292-A314 VanDerWaalsContact CD2-CB 3.49Å; L292-A314 HydrophobicContact CG-CB 3.96Å; L292-A332 HydrophobicContact CD2-CB 4.19Å
293D98.4Very high95.1Very high15 Ų1525.4 Ų25.48%0.0812%0.124CC..Hα-helixtrans-69.8-27.4176.9-66.3-44.4000111.6R250 K254 I269 D289 T290 L291 F296 Y297R250-D293 IonicContact CZ-OD2 2.8Å; R250-D293 VanDerWaalsContact CZ-OD2 3.22Å; R250-D293 IonicContact NE-OD2 3.36Å; R250-D293 PolarHBondContact NE-OD2 2.94Å; R250-D293 IonicContact NH2-OD2 2.6Å; R250-D293 PolarHBondContact NH2-OD2 3.2Å; K254-D293 VanDerWaalsContact CD-OD1 3.27Å; K254-D293 WeakPolarHBondContact CD-OD1 3.35Å; K254-D293 WeakPolarHBondContact CE-OD1 3.3Å; K254-D293 IonicContact NZ-OD1 2.68Å; K254-D293 PolarHBondContact NZ-OD1 2.87Å; K254-D293 IonicContact NZ-OD2 3.29Å; I269-D293 HydrophobicContact CD1-CB 3.72Å; D289-D293 PolarHBondContact O-N 3.1Å; T290-D293 PolarHBondContact O-N 3.38Å; L291-D293 PolarHBondContact O-N 3.31Å; D293-F296 WeakPolarHBondContact O-CB 3.39Å; D293-F296 PolarHBondContact O-N 3.47Å; D293-Y297 PolarHBondContact O-N 3.48Å
294Y97.9Very high95Very high4 Ų419.7 Ų19.72%0.01610%0.1CC..Hα-helixtrans-72-42.3172-172.4-144.2000112.6I269 K270 V273 T290 L291 L292 F296 Y297 L298 I310 A556 V560I269-Y294 HydrophobicContact CG1-CD2 4.08Å; I269-Y294 HydrophobicContact CG1-CG 4.29Å; I269-Y294 HydrophobicContact CG2-CD2 3.72Å; I269-Y294 HydrophobicContact CG2-CE2 4.26Å; K270-Y294 HydrophobicContact CG-CE2 4.36Å; V273-Y294 HydrophobicContact CG2-CD1 4.44Å; V273-Y294 HydrophobicContact CG2-CG 4.32Å; T290-Y294 WeakPolarHBondContact O-CB 3.11Å; T290-Y294 PolarHBondContact O-N 3.04Å; L291-Y294 CarbonylContact O-C 3.29Å; L291-Y294 PolarHBondContact O-N 3.32Å; L292-Y294 VanDerWaalsContact C-N 3.28Å; L292-Y294 PolarHBondContact O-N 3.49Å; Y294-F296 PolarHBondContact O-N 2.95Å; Y294-Y297 AromaticContact CD2-CD1 3.81Å; Y294-Y297 HydrophobicContact CD2-CD1 3.81Å; Y294-Y297 AromaticContact CE2-CD1 3.71Å; Y294-Y297 HydrophobicContact CE2-CD1 3.71Å; Y294-Y297 HydrophobicContact CE2-CE1 4.09Å; Y294-Y297 WeakPolarHBondContact O-CB 3.28Å; Y294-Y297 PolarHBondContact O-N 3.29Å; Y294-L298 HydrophobicContact CD1-CD1 4.15Å; Y294-L298 HydrophobicContact CD2-CD1 4.33Å; Y294-L298 HydrophobicContact CD2-CG 4.14Å; Y294-L298 HydrophobicContact CE1-CD1 3.97Å; Y294-L298 HydrophobicContact CE2-CD1 4.13Å; Y294-L298 HydrophobicContact CE2-CD2 4.04Å; Y294-L298 HydrophobicContact CE2-CG 3.88Å; Y294-L298 HydrophobicContact CG-CD1 4.33Å; Y294-L298 WeakPolarHBondContact O-CG 3.47Å; Y294-L298 PolarHBondContact O-N 3.47Å; Y294-I310 HydrophobicContact CD1-CD1 3.99Å; Y294-I310 HydrophobicContact CD1-CG1 4.18Å; Y294-I310 HydrophobicContact CD1-CG2 4.26Å; Y294-I310 HydrophobicContact CE1-CD1 4.11Å; Y294-I310 HydrophobicContact CE1-CG1 4.38Å; Y294-A556 HydrophobicContact CE1-CB 3.94Å; Y294-A556 PolarHBondContact OH-O 3.4Å; Y294-V560 HydrophobicContact CE1-CG2 3.92Å
295G97.6Very high94.8Very high0 Ų020.1 Ų20.10%011%0.11CC..Hα-helixtrans-58-38.5170.600000111.6L291 L292 L298 L299 S307 Y311L291-G295 PolarHBondContact O-N 3.4Å; L292-G295 PolarHBondContact O-N 3.46Å; G295-L298 PolarHBondContact O-N 3.04Å; G295-L299 WeakPolarHBondContact O-CB 3.41Å; G295-L299 PolarHBondContact O-N 3.37Å; G295-S307 PolarHBondContact O-OG 2.94Å; G295-Y311 VanDerWaalsContact C-CZ 3.43Å
296F97.6Very high94.7Very high48 Ų4820.9 Ų20.921%0.21111%0.111CC..Hα-helixtrans-64.5-46174.7169.9-97.6000111.6F217 K254 V257 L292 D293 Y294 L299 N300 Y311F217-F296 HydrophobicContact CZ-CZ 4.26Å; K254-F296 HydrophobicContact CB-CE1 4.29Å; K254-F296 HydrophobicContact CD-CD1 4.49Å; K254-F296 HydrophobicContact CG-CD1 3.88Å; K254-F296 HydrophobicContact CG-CE1 3.89Å; V257-F296 HydrophobicContact CB-CE1 3.79Å; V257-F296 HydrophobicContact CB-CZ 4.48Å; V257-F296 HydrophobicContact CG1-CD1 4.4Å; V257-F296 HydrophobicContact CG1-CE1 3.58Å; V257-F296 HydrophobicContact CG1-CZ 3.91Å; V257-F296 HydrophobicContact CG2-CD1 4.46Å; V257-F296 HydrophobicContact CG2-CE1 4.1Å; L292-F296 PolarHBondContact O-N 3.22Å; D293-F296 WeakPolarHBondContact O-CB 3.39Å; D293-F296 PolarHBondContact O-N 3.47Å; Y294-F296 PolarHBondContact O-N 2.95Å; F296-L299 PolarHBondContact O-N 3.29Å; F296-N300 WeakPolarHBondContact CE2-ND2 3.39Å; F296-N300 PolarHBondContact O-N 3.46Å; F296-N300 PolarHBondContact O-ND2 3.2Å; F296-Y311 WeakPolarHBondContact CA-OH 3.44Å; F296-Y311 PolarHBondContact N-OH 2.95Å
297Y97.4Very high94.6Very high13 Ų1320.2 Ų20.25%0.05111%0.109CC..Hα-helixtrans-57.6-51.7173.1161.9-93.8000111.1V257 F262 A265 E266 I269 D293 Y294 L299 N300 V301V257-Y297 HydrophobicContact CG2-CD2 4Å; F262-Y297 WeakPolarHBondContact O-CE2 3.4Å; A265-Y297 HydrophobicContact CB-CD2 3.83Å; A265-Y297 HydrophobicContact CB-CE2 4.09Å; E266-Y297 HydrophobicContact CB-CE1 4.28Å; E266-Y297 HydrophobicContact CB-CE2 3.75Å; E266-Y297 VanDerWaalsContact CB-OH 3.28Å; E266-Y297 WeakPolarHBondContact CB-OH 3.44Å; E266-Y297 VanDerWaalsContact CD-OH 3.24Å; E266-Y297 HydrophobicContact CG-CE1 4.03Å; E266-Y297 HydrophobicContact CG-CE2 4.39Å; E266-Y297 VanDerWaalsContact CG-OH 3.27Å; E266-Y297 WeakPolarHBondContact CG-OH 3.44Å; E266-Y297 PolarHBondContact OE2-OH 3.39Å; I269-Y297 HydrophobicContact CG2-CD1 4.18Å; I269-Y297 HydrophobicContact CG2-CG 4.04Å; D293-Y297 PolarHBondContact O-N 3.48Å; Y294-Y297 AromaticContact CD2-CD1 3.81Å; Y294-Y297 HydrophobicContact CD2-CD1 3.81Å; Y294-Y297 AromaticContact CE2-CD1 3.71Å; Y294-Y297 HydrophobicContact CE2-CD1 3.71Å; Y294-Y297 HydrophobicContact CE2-CE1 4.09Å; Y294-Y297 WeakPolarHBondContact O-CB 3.28Å; Y294-Y297 PolarHBondContact O-N 3.29Å; Y297-L299 VanDerWaalsContact C-N 3.28Å; Y297-L299 PolarHBondContact O-N 2.9Å; Y297-N300 PolarHBondContact O-N 3.48Å; Y297-V301 HydrophobicContact CD1-CG2 4.32Å; Y297-V301 HydrophobicContact CD2-CG1 4.12Å; Y297-V301 HydrophobicContact CE1-CG1 4.4Å; Y297-V301 HydrophobicContact CE1-CG2 3.79Å; Y297-V301 HydrophobicContact CE2-CG1 3.49Å; Y297-V301 VanDerWaalsContact CE2-CG1 3.49Å; Y297-V301 HydrophobicContact CE2-CG2 4.39Å; Y297-V301 WeakPolarHBondContact O-CG2 3.35Å; Y297-V301 PolarHBondContact O-N 3.3Å
298L94.9Very high94.5Very high6 Ų621 Ų213%0.03111%0.114CC..Hα-helixtrans-58.2-40-178.5-72.9169.5000112.1Y294 G295 N300 V301 D302 N303 Q306 I310 A556Y294-L298 HydrophobicContact CD1-CD1 4.15Å; Y294-L298 HydrophobicContact CD2-CD1 4.33Å; Y294-L298 HydrophobicContact CD2-CG 4.14Å; Y294-L298 HydrophobicContact CE1-CD1 3.97Å; Y294-L298 HydrophobicContact CE2-CD1 4.13Å; Y294-L298 HydrophobicContact CE2-CD2 4.04Å; Y294-L298 HydrophobicContact CE2-CG 3.88Å; Y294-L298 HydrophobicContact CG-CD1 4.33Å; Y294-L298 WeakPolarHBondContact O-CG 3.47Å; Y294-L298 PolarHBondContact O-N 3.47Å; G295-L298 PolarHBondContact O-N 3.04Å; L298-N300 VanDerWaalsContact C-N 3.33Å; L298-N300 PolarHBondContact O-N 2.86Å; L298-V301 CarbonylContact O-C 3.52Å; L298-V301 PolarHBondContact O-N 3.24Å; L298-D302 PolarHBondContact O-N 2.85Å; L298-N303 HydrophobicContact CB-CB 4.49Å; L298-N303 HydrophobicContact CD2-CB 4.07Å; L298-N303 PolarHBondContact O-N 2.88Å; L298-Q306 HydrophobicContact CD1-CB 3.99Å; L298-Q306 HydrophobicContact CD2-CB 4.45Å; L298-I310 HydrophobicContact CD1-CB 4.39Å; L298-I310 HydrophobicContact CD1-CG1 3.72Å; L298-A556 HydrophobicContact CD1-CB 4.11Å
299L93.3Very high94.4Very high26 Ų2623.2 Ų23.214%0.13613%0.133CC..Hα-helixtrans-62.7-40.7175.6-171.864000111.8G295 F296 Y297 D302 I304 Y338 V342G295-L299 WeakPolarHBondContact O-CB 3.41Å; G295-L299 PolarHBondContact O-N 3.37Å; F296-L299 PolarHBondContact O-N 3.29Å; Y297-L299 VanDerWaalsContact C-N 3.28Å; Y297-L299 PolarHBondContact O-N 2.9Å; L299-D302 PolarHBondContact O-N 3.43Å; L299-I304 HydrophobicContact CD1-CG1 4.28Å; L299-I304 HydrophobicContact CD1-CG2 4.47Å; L299-Y338 HydrophobicContact CD2-CD1 3.71Å; L299-Y338 HydrophobicContact CD2-CE1 3.66Å; L299-V342 HydrophobicContact CD1-CB 4.38Å; L299-V342 HydrophobicContact CD1-CG1 4.28Å
300N93.6Very high94.3Very high35 Ų3521.7 Ų21.719%0.18713%0.125CC..Hα-helixtrans-79.4-21-178.5-78.5-96.9000113.8V257 F262 F296 Y297 L298 D302 F506V257-N300 HydrophobicContact CG1-CB 3.38Å; F262-N300 HydrophobicContact CE1-CB 4.25Å; F296-N300 WeakPolarHBondContact CE2-ND2 3.39Å; F296-N300 PolarHBondContact O-N 3.46Å; F296-N300 PolarHBondContact O-ND2 3.2Å; Y297-N300 PolarHBondContact O-N 3.48Å; L298-N300 VanDerWaalsContact C-N 3.33Å; L298-N300 PolarHBondContact O-N 2.86Å; N300-D302 VanDerWaalsContact C-N 3.25Å; N300-F506 WeakPolarHBondContact O-CE1 3.44Å
301V91Very high94.3Very high36 Ų3621.9 Ų21.922%0.21813%0.126CC..THydrogen-bonded Turntrans-93.214.5167.2-58.90000112.4F262 Y297 L298 N303F262-V301 HydrophobicContact CB-CG1 3.86Å; F262-V301 HydrophobicContact CD1-CG1 3.49Å; F262-V301 VanDerWaalsContact CD1-CG1 3.49Å; F262-V301 HydrophobicContact CE1-CG1 4.14Å; F262-V301 HydrophobicContact CG-CG1 3.72Å; Y297-V301 HydrophobicContact CD1-CG2 4.32Å; Y297-V301 HydrophobicContact CD2-CG1 4.12Å; Y297-V301 HydrophobicContact CE1-CG1 4.4Å; Y297-V301 HydrophobicContact CE1-CG2 3.79Å; Y297-V301 HydrophobicContact CE2-CG1 3.49Å; Y297-V301 VanDerWaalsContact CE2-CG1 3.49Å; Y297-V301 HydrophobicContact CE2-CG2 4.39Å; Y297-V301 WeakPolarHBondContact O-CG2 3.35Å; Y297-V301 PolarHBondContact O-N 3.3Å; L298-V301 CarbonylContact O-C 3.52Å; L298-V301 PolarHBondContact O-N 3.24Å; V301-N303 HydrophobicContact CG2-CB 4.44Å; V301-N303 PolarHBondContact O-N 3.41Å
302D88.3Confident94.3Very high11 Ų1124.9 Ų24.96%0.05914%0.14CC..THydrogen-bonded Turntrans6723.5169.4-162.310.4000114.4L298 L299 N300 I304 Y510 S511 R547 F551L298-D302 PolarHBondContact O-N 2.85Å; L299-D302 PolarHBondContact O-N 3.43Å; N300-D302 VanDerWaalsContact C-N 3.25Å; D302-I304 PolarHBondContact O-N 3.27Å; D302-Y510 HydrophobicContact CB-CD2 4.36Å; D302-Y510 VanDerWaalsContact OD2-CD2 3.32Å; D302-Y510 WeakPolarHBondContact OD2-CD2 3.49Å; D302-S511 WeakPolarHBondContact OD1-CB 3.19Å; D302-S511 PolarHBondContact OD1-OG 3.15Å; D302-S511 WeakPolarHBondContact OD2-CB 3.38Å; D302-S511 PolarHBondContact OD2-N 3.24Å; D302-S511 PolarHBondContact OD2-OG 3.45Å; D302-S511 VanDerWaalsContact OD2-OG 3.09Å; D302-R547 IonicContact OD1-CZ 2.65Å; D302-R547 IonicContact OD1-NH1 3.49Å; D302-R547 PolarHBondContact OD1-NH1 3.41Å; D302-R547 IonicContact OD1-NH2 3.37Å; D302-R547 IonicContact OD2-CZ 2.75Å; D302-R547 IonicContact OD2-NH1 2.6Å; D302-R547 PolarHBondContact OD2-NH1 3.49Å; D302-F551 HydrophobicContact CB-CZ 4.48Å; D302-F551 VanDerWaalsContact O-CE1 3.28Å; D302-F551 WeakPolarHBondContact O-CE1 3.4Å; D302-F551 WeakPolarHBondContact O-CZ 3.19Å
303N89Confident94.2Very high43 Ų4326.6 Ų26.623%0.2315%0.15CC..  trans-96.266.1171.3-166-12000110.8L298 V301 C305 Q306 S307 F551L298-N303 HydrophobicContact CB-CB 4.49Å; L298-N303 HydrophobicContact CD2-CB 4.07Å; L298-N303 PolarHBondContact O-N 2.88Å; V301-N303 HydrophobicContact CG2-CB 4.44Å; V301-N303 PolarHBondContact O-N 3.41Å; N303-C305 PolarHBondContact O-N 2.91Å; N303-Q306 PolarHBondContact O-N 2.98Å; N303-Q306 WeakPolarHBondContact OD1-CB 3.35Å; N303-Q306 VanDerWaalsContact OD1-CG 3.26Å; N303-Q306 WeakPolarHBondContact OD1-CG 3.27Å; N303-S307 PolarHBondContact O-N 2.95Å; N303-F551 HydrophobicContact CB-CD1 4.23Å; N303-F551 HydrophobicContact CB-CE1 3.86Å
304I88.4Confident94.2Very high22 Ų2225.9 Ų25.911%0.11315%0.147CC..Hα-helixtrans-65.2-40.7-168.5-57.2154000112.1L299 D302 Q306 S307 V308 V342 H343L299-I304 HydrophobicContact CD1-CG1 4.28Å; L299-I304 HydrophobicContact CD1-CG2 4.47Å; D302-I304 PolarHBondContact O-N 3.27Å; I304-Q306 VanDerWaalsContact C-N 3.35Å; I304-Q306 PolarHBondContact O-N 2.85Å; I304-S307 WeakPolarHBondContact O-CB 3.4Å; I304-S307 PolarHBondContact O-N 3.44Å; I304-S307 VanDerWaalsContact O-N 3.15Å; I304-V308 PolarHBondContact O-N 3.12Å; I304-V342 HydrophobicContact CD1-CG1 3.69Å; I304-V342 HydrophobicContact CG1-CG1 3.97Å; I304-V342 HydrophobicContact CG2-CB 4.42Å; I304-V342 HydrophobicContact CG2-CG1 4.17Å; I304-H343 HydrophobicContact CG2-CB 3.61Å
305C88.5Confident94.2Very high76 Ų7625.8 Ų25.851%0.51415%0.146SC..Hα-helixtrans-61-44.6-178.4-610000111.7N303 V308 A309 H343N303-C305 PolarHBondContact O-N 2.91Å; C305-V308 PolarHBondContact O-N 2.98Å; C305-A309 PolarHBondContact O-N 3.12Å; C305-H343 PolarHBondContact SG-CE1 2.94Å
306Q90.7Very high94.1Very high33 Ų3329.5 Ų29.515%0.15417%0.166CC..Hα-helixtrans-69.3-37176.3-65.5-61.3-39.300111.3L298 N303 I304 V308 A309 I310 A554 A556L298-Q306 HydrophobicContact CD1-CB 3.99Å; L298-Q306 HydrophobicContact CD2-CB 4.45Å; N303-Q306 PolarHBondContact O-N 2.98Å; N303-Q306 WeakPolarHBondContact OD1-CB 3.35Å; N303-Q306 VanDerWaalsContact OD1-CG 3.26Å; N303-Q306 WeakPolarHBondContact OD1-CG 3.27Å; I304-Q306 VanDerWaalsContact C-N 3.35Å; I304-Q306 PolarHBondContact O-N 2.85Å; Q306-V308 VanDerWaalsContact C-N 3.34Å; Q306-V308 PolarHBondContact O-N 3.23Å; Q306-A309 PolarHBondContact O-N 3.36Å; Q306-I310 WeakPolarHBondContact O-CB 3.49Å; Q306-I310 VanDerWaalsContact O-CG1 3.24Å; Q306-I310 WeakPolarHBondContact O-CG1 3.41Å; Q306-I310 PolarHBondContact O-N 3.41Å; Q306-A554 VanDerWaalsContact CD-O 3.28Å; Q306-A554 PolarHBondContact NE2-O 3.15Å; Q306-A554 VanDerWaalsContact NE2-O 3.15Å; Q306-A556 HydrophobicContact CB-CB 3.94Å; Q306-A556 HydrophobicContact CG-CB 4.11Å
307S94.3Very high94.1Very high0 Ų027.9 Ų27.90%016%0.16CC..Hα-helixtrans-55.2-47.8174.1-179.40000111.9G295 N303 I304 A309 I310 Y311 S339G295-S307 PolarHBondContact O-OG 2.94Å; N303-S307 PolarHBondContact O-N 2.95Å; I304-S307 WeakPolarHBondContact O-CB 3.4Å; I304-S307 PolarHBondContact O-N 3.44Å; I304-S307 VanDerWaalsContact O-N 3.15Å; S307-A309 PolarHBondContact O-N 3.08Å; S307-I310 PolarHBondContact O-N 3.4Å; S307-Y311 WeakPolarHBondContact O-CB 3.43Å; S307-Y311 WeakPolarHBondContact O-CD2 3.29Å; S307-Y311 PolarHBondContact O-N 3.21Å; S307-Y311 WeakPolarHBondContact OG-CD2 3.33Å; S307-Y311 WeakPolarHBondContact OG-CE2 3.46Å; S307-S339 WeakPolarHBondContact CB-OG 2.93Å; S307-S339 PolarHBondContact OG-OG 2.91Å
308V94.1Very high94Very high28 Ų2827.9 Ų27.917%0.1716%0.16CC..Hα-helixtrans-59.6-47177.1174.20000111.5I304 C305 Q306 I310 Y311 Q312 L336 S339 H343I304-V308 PolarHBondContact O-N 3.12Å; C305-V308 PolarHBondContact O-N 2.98Å; Q306-V308 VanDerWaalsContact C-N 3.34Å; Q306-V308 PolarHBondContact O-N 3.23Å; V308-I310 PolarHBondContact O-N 2.72Å; V308-Y311 PolarHBondContact O-N 3.45Å; V308-Q312 WeakPolarHBondContact O-CB 3.46Å; V308-Q312 PolarHBondContact O-N 2.92Å; V308-L336 HydrophobicContact CG1-CD1 3.96Å; V308-S339 WeakPolarHBondContact CG2-OG 3.41Å; V308-S339 PolarHBondContact N-OG 2.86Å; V308-H343 HydrophobicContact CG2-CB 3.95Å
309A94.4Very high94Very high47 Ų4731.2 Ų31.239%0.38818%0.175SC..Hα-helixtrans-62.6-41.4-18000000112.8C305 Q306 S307 Q312 T313C305-A309 PolarHBondContact O-N 3.12Å; Q306-A309 PolarHBondContact O-N 3.36Å; S307-A309 PolarHBondContact O-N 3.08Å; A309-Q312 PolarHBondContact O-N 3.07Å; A309-T313 PolarHBondContact O-N 3.31Å; A309-T313 PolarHBondContact O-OG1 3.09Å
310I96.1Very high94Very high2 Ų233 Ų331%0.0119%0.19CC..Hα-helixtrans-66.1-44.3176.7-68.1-65.6000111.1L291 Y294 L298 Q306 S307 V308 Q312 T313 A314 A556 L557L291-I310 HydrophobicContact CB-CG2 3.97Å; L291-I310 HydrophobicContact CD2-CD1 4.36Å; L291-I310 HydrophobicContact CD2-CG2 4.24Å; L291-I310 WeakPolarHBondContact O-CG2 3.36Å; Y294-I310 HydrophobicContact CD1-CD1 3.99Å; Y294-I310 HydrophobicContact CD1-CG1 4.18Å; Y294-I310 HydrophobicContact CD1-CG2 4.26Å; Y294-I310 HydrophobicContact CE1-CD1 4.11Å; Y294-I310 HydrophobicContact CE1-CG1 4.38Å; L298-I310 HydrophobicContact CD1-CB 4.39Å; L298-I310 HydrophobicContact CD1-CG1 3.72Å; Q306-I310 WeakPolarHBondContact O-CB 3.49Å; Q306-I310 VanDerWaalsContact O-CG1 3.24Å; Q306-I310 WeakPolarHBondContact O-CG1 3.41Å; Q306-I310 PolarHBondContact O-N 3.41Å; S307-I310 PolarHBondContact O-N 3.4Å; V308-I310 PolarHBondContact O-N 2.72Å; I310-Q312 VanDerWaalsContact C-N 3.35Å; I310-Q312 PolarHBondContact O-N 3.2Å; I310-T313 PolarHBondContact O-N 3.46Å; I310-A314 WeakPolarHBondContact O-CB 3.18Å; I310-A314 PolarHBondContact O-N 3.43Å; I310-A556 HydrophobicContact CD1-CB 4.32Å; I310-A556 HydrophobicContact CG1-CB 4.36Å; I310-L557 HydrophobicContact CD1-CD1 4.15Å; I310-L557 HydrophobicContact CD1-CD2 3.32Å; I310-L557 HydrophobicContact CD1-CG 3.46Å; I310-L557 VanDerWaalsContact CD1-CG 3.46Å
311Y98.1Very high93.9Very high5 Ų531.6 Ų31.62%0.0218%0.183CC..Hα-helixtrans-63.4-39.3176.4-78.9-51.1000112.5L292 G295 F296 S307 V308 A314 L315 D335L292-Y311 HydrophobicContact CB-CE1 4.33Å; L292-Y311 HydrophobicContact CD2-CD1 3.58Å; L292-Y311 HydrophobicContact CD2-CE1 3.9Å; L292-Y311 VanDerWaalsContact O-CE1 3.26Å; L292-Y311 WeakPolarHBondContact O-CE1 3.47Å; G295-Y311 VanDerWaalsContact C-CZ 3.43Å; F296-Y311 WeakPolarHBondContact CA-OH 3.44Å; F296-Y311 PolarHBondContact N-OH 2.95Å; S307-Y311 WeakPolarHBondContact O-CB 3.43Å; S307-Y311 WeakPolarHBondContact O-CD2 3.29Å; S307-Y311 PolarHBondContact O-N 3.21Å; S307-Y311 WeakPolarHBondContact OG-CD2 3.33Å; S307-Y311 WeakPolarHBondContact OG-CE2 3.46Å; V308-Y311 PolarHBondContact O-N 3.45Å; Y311-A314 PolarHBondContact O-N 2.95Å; Y311-L315 WeakPolarHBondContact O-CB 3.47Å; Y311-L315 PolarHBondContact O-N 3.45Å; Y311-D335 HydrophobicContact CD1-CB 3.69Å; Y311-D335 HydrophobicContact CE1-CB 3.46Å; Y311-D335 VanDerWaalsContact CE1-CB 3.46Å; Y311-D335 HydrophobicContact CE2-CB 4.42Å; Y311-D335 HydrophobicContact CG-CB 4.31Å
312Q97.7Very high94Very high63 Ų6330.1 Ų30.129%0.29417%0.173SC..Hα-helixtrans-60.1-47.3173.5-175.863.860.800111.2V308 A309 I310 A314 L315 D316V308-Q312 WeakPolarHBondContact O-CB 3.46Å; V308-Q312 PolarHBondContact O-N 2.92Å; A309-Q312 PolarHBondContact O-N 3.07Å; I310-Q312 VanDerWaalsContact C-N 3.35Å; I310-Q312 PolarHBondContact O-N 3.2Å; Q312-A314 VanDerWaalsContact C-N 3.31Å; Q312-A314 PolarHBondContact O-N 2.81Å; Q312-L315 WeakPolarHBondContact O-CB 3.35Å; Q312-L315 PolarHBondContact O-N 3.44Å; Q312-D316 PolarHBondContact NE2-OD1 2.99Å; Q312-D316 PolarHBondContact O-N 3.35Å
313T97.1Very high94Very high45 Ų4530.5 Ų30.528%0.27618%0.18SC..Hα-helixtrans-60.2-42.7177.5-56.10000111.5L291 A309 I310 L315 D316 I317L291-T313 HydrophobicContact CD1-CG2 3.81Å; A309-T313 PolarHBondContact O-N 3.31Å; A309-T313 PolarHBondContact O-OG1 3.09Å; I310-T313 PolarHBondContact O-N 3.46Å; T313-L315 VanDerWaalsContact C-N 3.34Å; T313-L315 PolarHBondContact O-N 2.76Å; T313-D316 PolarHBondContact O-N 3.04Å; T313-I317 HydrophobicContact CG2-CD1 4.27Å; T313-I317 WeakPolarHBondContact O-CG1 3.39Å; T313-I317 PolarHBondContact O-N 3.34Å; T313-I317 VanDerWaalsContact O-N 3.15Å
314A97.9Very high93.5Very high0 Ų030.3 Ų30.30%019%0.188CC..Hα-helixtrans-63.2-40.1177.400000112.3S288 L291 L292 I310 Y311 Q312 R318S288-A314 PolarHBondContact OG-O 3.32Å; L291-A314 HydrophobicContact CB-CB 3.83Å; L291-A314 HydrophobicContact CD1-CB 4.47Å; L292-A314 HydrophobicContact CD2-CB 3.49Å; L292-A314 VanDerWaalsContact CD2-CB 3.49Å; L292-A314 HydrophobicContact CG-CB 3.96Å; I310-A314 WeakPolarHBondContact O-CB 3.18Å; I310-A314 PolarHBondContact O-N 3.43Å; Y311-A314 PolarHBondContact O-N 2.95Å; Q312-A314 VanDerWaalsContact C-N 3.31Å; Q312-A314 PolarHBondContact O-N 2.81Å; A314-R318 PolarHBondContact O-N 3.43Å; A314-R318 VanDerWaalsContact O-N 3.11Å
315L97.9Very high93.8Very high2 Ų232.4 Ų32.41%0.0120%0.196CC..Hα-helixtrans-64.1-47.5175.6174.662.7000111.5Y311 Q312 T313 I317 R318 Q319 V329 A332 H333 L336Y311-L315 WeakPolarHBondContact O-CB 3.47Å; Y311-L315 PolarHBondContact O-N 3.45Å; Q312-L315 WeakPolarHBondContact O-CB 3.35Å; Q312-L315 PolarHBondContact O-N 3.44Å; T313-L315 VanDerWaalsContact C-N 3.34Å; T313-L315 PolarHBondContact O-N 2.76Å; L315-I317 VanDerWaalsContact C-N 3.29Å; L315-I317 PolarHBondContact O-N 2.73Å; L315-R318 PolarHBondContact O-N 3.33Å; L315-Q319 HydrophobicContact CD1-CG 3.94Å; L315-Q319 HydrophobicContact CG-CG 4.35Å; L315-Q319 WeakPolarHBondContact O-CG 3.45Å; L315-Q319 PolarHBondContact O-N 3.07Å; L315-V329 HydrophobicContact CD1-CG1 4.18Å; L315-A332 HydrophobicContact CB-CB 4.1Å; L315-A332 HydrophobicContact CD1-CB 3.84Å; L315-H333 WeakPolarHBondContact CD2-ND1 3.43Å; L315-L336 HydrophobicContact CD2-CD2 3.65Å
316D96.8Very high94.1Very high78 Ų7828.8 Ų28.842%0.41717%0.172SC..Hα-helixtrans-58.2-43.2180-65.8-14.3000111.1Q312 T313 Q319 S320Q312-D316 PolarHBondContact NE2-OD1 2.99Å; Q312-D316 PolarHBondContact O-N 3.35Å; T313-D316 PolarHBondContact O-N 3.04Å; D316-Q319 PolarHBondContact O-N 3.49Å; D316-S320 WeakPolarHBondContact O-CB 3.28Å; D316-S320 PolarHBondContact O-N 3.5Å
317I95.7Very high94.4Very high15 Ų1527.5 Ų27.58%0.07717%0.166CC..Hα-helixtrans-61-48.7174.5-66163000110.3H282 K283 Y287 L291 T313 L315 Q319 S320 V321H282-I317 VanDerWaalsContact O-CD1 3.32Å; H282-I317 WeakPolarHBondContact O-CD1 3.33Å; K283-I317 WeakPolarHBondContact O-CG2 3.38Å; Y287-I317 HydrophobicContact CD1-CD1 3.76Å; Y287-I317 HydrophobicContact CE1-CD1 4.14Å; L291-I317 HydrophobicContact CD1-CD1 3.94Å; T313-I317 HydrophobicContact CG2-CD1 4.27Å; T313-I317 WeakPolarHBondContact O-CG1 3.39Å; T313-I317 PolarHBondContact O-N 3.34Å; T313-I317 VanDerWaalsContact O-N 3.15Å; L315-I317 VanDerWaalsContact C-N 3.29Å; L315-I317 PolarHBondContact O-N 2.73Å; I317-Q319 PolarHBondContact O-N 2.97Å; I317-S320 PolarHBondContact O-N 3.44Å; I317-S320 PolarHBondContact O-OG 3.21Å; I317-V321 WeakPolarHBondContact O-CG2 3.46Å; I317-V321 PolarHBondContact O-N 3.5Å; I317-V321 VanDerWaalsContact O-N 3.07Å
318R96.3Very high94.5Very high12 Ų1228.3 Ų28.35%0.04517%0.17CC..Hα-helixtrans-63.2-40.7-178.6-83.4171.3171-149.10.9112.3S288 D289 A314 L315 S320 V321 F322 H328 V329S288-R318 WeakPolarHBondContact OG-CD 3.42Å; S288-R318 WeakPolarHBondContact OG-CG 3.43Å; S288-R318 PolarHBondContact OG-NE 3.24Å; D289-R318 IonicContact OD1-CZ 3.85Å; D289-R318 IonicContact OD1-NH2 2.8Å; D289-R318 PolarHBondContact OD1-NH2 2.87Å; A314-R318 PolarHBondContact O-N 3.43Å; A314-R318 VanDerWaalsContact O-N 3.11Å; L315-R318 PolarHBondContact O-N 3.33Å; R318-S320 VanDerWaalsContact C-N 3.35Å; R318-V321 PolarHBondContact O-N 3.1Å; R318-F322 HydrophobicContact CB-CD2 4.29Å; R318-F322 HydrophobicContact CG-CD2 4.19Å; R318-F322 HydrophobicContact CG-CE2 4.3Å; R318-F322 WeakPolarHBondContact O-CA 3.4Å; R318-F322 WeakPolarHBondContact O-CB 3.25Å; R318-F322 PolarHBondContact O-N 3.14Å; R318-H328 WeakPolarHBondContact CD-O 3.45Å; R318-H328 HydrophobicContact CG-CB 4.38Å; R318-H328 PolarHBondContact NH1-O 3.44Å; R318-V329 HydrophobicContact CB-CG2 4.13Å
319Q95.4Very high94.6Very high76 Ų7627 Ų2736%0.35516%0.162SC..Hα-helixtrans-64.5-40.4174.9-72.6-179.3-26.300111.6L315 D316 I317 V321 G323 V329 H333L315-Q319 HydrophobicContact CD1-CG 3.94Å; L315-Q319 HydrophobicContact CG-CG 4.35Å; L315-Q319 WeakPolarHBondContact O-CG 3.45Å; L315-Q319 PolarHBondContact O-N 3.07Å; D316-Q319 PolarHBondContact O-N 3.49Å; I317-Q319 PolarHBondContact O-N 2.97Å; Q319-V321 VanDerWaalsContact C-N 3.33Å; Q319-V321 PolarHBondContact O-N 3.03Å; Q319-G323 VanDerWaalsContact O-CA 3.32Å; Q319-G323 WeakPolarHBondContact O-CA 3.46Å; Q319-G323 PolarHBondContact O-N 2.87Å; Q319-V329 HydrophobicContact CG-CG1 3.89Å; Q319-V329 HydrophobicContact CG-CG2 4.5Å; Q319-H333 PolarHBondContact NE2-NE2 2.9Å
320S92.9Very high94.8Very high64 Ų6424.8 Ų24.845%0.44814%0.143SC..Hα-helixtrans-63.6-37.517878.60000112.8H81 D316 I317 R318H81-S320 PolarHBondContact ND1-O 3.22Å; D316-S320 WeakPolarHBondContact O-CB 3.28Å; D316-S320 PolarHBondContact O-N 3.5Å; I317-S320 PolarHBondContact O-N 3.44Å; I317-S320 PolarHBondContact O-OG 3.21Å; R318-S320 VanDerWaalsContact C-N 3.35Å
321V91.8Very high94.8Very high6 Ų626.9 Ų26.94%0.03616%0.156CC..Hα-helixtrans-88.2-44.6-176.9-179.60000112.4H80 H81 P285 I317 R318 Q319H80-V321 CarbonylContact C-O 3.59Å; H80-V321 HydrophobicContact CB-CG1 3.76Å; H81-V321 WeakPolarHBondContact CA-O 3.41Å; H81-V321 PolarHBondContact N-O 2.89Å; P285-V321 HydrophobicContact CG-CB 4.1Å; P285-V321 HydrophobicContact CG-CG1 3.62Å; P285-V321 HydrophobicContact CG-CG2 4.05Å; I317-V321 WeakPolarHBondContact O-CG2 3.46Å; I317-V321 PolarHBondContact O-N 3.5Å; I317-V321 VanDerWaalsContact O-N 3.07Å; R318-V321 PolarHBondContact O-N 3.1Å; Q319-V321 VanDerWaalsContact C-N 3.33Å; Q319-V321 PolarHBondContact O-N 3.03Å
322F93.5Very high94.8Very high4 Ų426.6 Ų26.62%0.01816%0.155CC..Hα-helixtrans-108.75.9-170.3-55.9-62.7000114.1H80 Q84 D132 P285 R318 N326 H328 V329H80-F322 HydrophobicContact CB-CD1 4.16Å; H80-F322 HydrophobicContact CB-CE1 4.2Å; H80-F322 AromaticContact CG-CE1 3.91Å; H80-F322 AromaticContact ND1-CE1 3.83Å; Q84-F322 WeakPolarHBondContact CB-O 3.48Å; Q84-F322 WeakPolarHBondContact CG-O 3.47Å; Q84-F322 PolarHBondContact OE1-O 2.77Å; D132-F322 WeakPolarHBondContact O-CE1 3.5Å; D132-F322 WeakPolarHBondContact O-CZ 3.36Å; P285-F322 HydrophobicContact CB-CE2 3.83Å; P285-F322 HydrophobicContact CB-CZ 3.7Å; P285-F322 HydrophobicContact CG-CE1 4.43Å; P285-F322 HydrophobicContact CG-CE2 3.91Å; P285-F322 HydrophobicContact CG-CZ 3.62Å; R318-F322 HydrophobicContact CB-CD2 4.29Å; R318-F322 HydrophobicContact CG-CD2 4.19Å; R318-F322 HydrophobicContact CG-CE2 4.3Å; R318-F322 WeakPolarHBondContact O-CA 3.4Å; R318-F322 WeakPolarHBondContact O-CB 3.25Å; R318-F322 PolarHBondContact O-N 3.14Å; F322-N326 HydrophobicContact CB-CB 3.84Å; F322-H328 HydrophobicContact CD2-CB 3.94Å; F322-H328 HydrophobicContact CE2-CB 4.02Å; F322-H328 AromaticContact CE2-CD2 3.82Å; F322-H328 AromaticContact CZ-CD2 3.87Å; F322-V329 HydrophobicContact CB-CG2 4.13Å
323G86.9Confident94.9Very high19 Ų1924 Ų2420%0.19614%0.143CC..  trans65.7-143.8177.700000113.7Q319 V329Q319-G323 VanDerWaalsContact O-CA 3.32Å; Q319-G323 WeakPolarHBondContact O-CA 3.46Å; Q319-G323 PolarHBondContact O-N 2.87Å; G323-V329 WeakPolarHBondContact O-CG2 3.21Å
324G79.9Confident94.9Very high39 Ų3922.9 Ų22.940%0.40213%0.134SC..SBendtrans-93.8-58.7-16900000114.9N326 I363G324-N326 PolarHBondContact O-N 3.07Å; G324-I363 VanDerWaalsContact O-CD1 3.26Å; G324-I363 WeakPolarHBondContact O-CD1 3.3Å
325K92.8Very high94.9Very high66 Ų6624.8 Ų24.829%0.28715%0.145SC..SBendtrans-97.368-170.2-60.7171.2167.1-173.30111.9Q84 D88 H366 I367Q84-K325 PolarHBondContact NE2-O 3.45Å; D88-K325 WeakPolarHBondContact OD1-CB 3.43Å; K325-H366 PolarHBondContact NZ-CE1 2.95Å; K325-H366 PolarHBondContact NZ-NE2 2.63Å; K325-I367 HydrophobicContact CB-CG2 4.48Å
326N96.1Very high94.9Very high1 Ų124.8 Ų24.81%0.00515%0.145CC..  trans-127.7144.4-179.4-169.1-79.7000111.6Q84 A133 F322 G324 H328 V329 A330 I363Q84-N326 PolarHBondContact OE1-ND2 3.37Å; A133-N326 PolarHBondContact O-ND2 2.89Å; F322-N326 HydrophobicContact CB-CB 3.84Å; G324-N326 PolarHBondContact O-N 3.07Å; N326-H328 VanDerWaalsContact C-N 3.26Å; N326-H328 PolarHBondContact O-N 3.15Å; N326-H328 WeakPolarHBondContact OD1-CB 3.32Å; N326-H328 PolarHBondContact OD1-CD2 3.4Å; N326-H328 PolarHBondContact OD1-N 3.12Å; N326-V329 HydrophobicContact CB-CB 4.36Å; N326-V329 HydrophobicContact CB-CG2 4.01Å; N326-V329 WeakPolarHBondContact O-CB 3.36Å; N326-V329 PolarHBondContact O-N 3.49Å; N326-V329 VanDerWaalsContact O-N 3.07Å; N326-A330 PolarHBondContact O-N 2.91Å; N326-I363 WeakPolarHBondContact O-CG2 3.47Å
327I95.9Very high94.9Very high6 Ų621 Ų213%0.03113%0.125CC..Hα-helixtrans-58.3-37.4-179.9-156.3170.4000112.4G134 Y136 V329 A330 T331 I367 L368 L374G134-I327 WeakPolarHBondContact O-CG2 3.47Å; Y136-I327 HydrophobicContact CD2-CD1 4Å; Y136-I327 HydrophobicContact CE2-CD1 3.92Å; Y136-I327 HydrophobicContact CE2-CG2 4.21Å; I327-V329 VanDerWaalsContact C-N 3.34Å; I327-V329 PolarHBondContact O-N 3.15Å; I327-A330 PolarHBondContact O-N 3.02Å; I327-T331 PolarHBondContact O-N 2.65Å; I327-T331 PolarHBondContact O-OG1 3.14Å; I327-T331 VanDerWaalsContact O-OG1 3.07Å; I327-I367 HydrophobicContact CB-CD1 3.8Å; I327-I367 HydrophobicContact CG1-CD1 4.32Å; I327-L368 HydrophobicContact CD1-CD1 3.83Å; I327-L368 HydrophobicContact CG1-CD1 4.32Å; I327-L374 HydrophobicContact CD1-CD1 3.47Å; I327-L374 VanDerWaalsContact CD1-CD1 3.47Å; I327-L374 HydrophobicContact CG1-CD1 3.81Å
328H97.1Very high95Very high17 Ų1724.4 Ų24.48%0.07914%0.137CC..Hα-helixtrans-66.4-39.7178-62.1-60.8000111D132 G134 Y136 R318 F322 N326 T331 A332D132-H328 PolarHBondContact O-NE2 2.91Å; G134-H328 VanDerWaalsContact CA-NE2 3.35Å; G134-H328 WeakPolarHBondContact CA-NE2 3.48Å; G134-H328 PolarHBondContact N-NE2 3.49Å; Y136-H328 PolarHBondContact OH-CE1 3.49Å; R318-H328 WeakPolarHBondContact CD-O 3.45Å; R318-H328 HydrophobicContact CG-CB 4.38Å; R318-H328 PolarHBondContact NH1-O 3.44Å; F322-H328 HydrophobicContact CD2-CB 3.94Å; F322-H328 HydrophobicContact CE2-CB 4.02Å; F322-H328 AromaticContact CE2-CD2 3.82Å; F322-H328 AromaticContact CZ-CD2 3.87Å; N326-H328 VanDerWaalsContact C-N 3.26Å; N326-H328 PolarHBondContact O-N 3.15Å; N326-H328 WeakPolarHBondContact OD1-CB 3.32Å; N326-H328 PolarHBondContact OD1-CD2 3.4Å; N326-H328 PolarHBondContact OD1-N 3.12Å; H328-T331 PolarHBondContact O-N 3.44Å; H328-A332 PolarHBondContact O-N 3.42Å; H328-A332 VanDerWaalsContact O-N 3.09Å
329V97.4Very high94.9Very high1 Ų123.8 Ų23.81%0.00614%0.135CC..Hα-helixtrans-66.8-41.3176.8177.70000110.1L315 R318 Q319 F322 G323 N326 I327 A332 H333 I363L315-V329 HydrophobicContact CD1-CG1 4.18Å; R318-V329 HydrophobicContact CB-CG2 4.13Å; Q319-V329 HydrophobicContact CG-CG1 3.89Å; Q319-V329 HydrophobicContact CG-CG2 4.5Å; F322-V329 HydrophobicContact CB-CG2 4.13Å; G323-V329 WeakPolarHBondContact O-CG2 3.21Å; N326-V329 HydrophobicContact CB-CB 4.36Å; N326-V329 HydrophobicContact CB-CG2 4.01Å; N326-V329 WeakPolarHBondContact O-CB 3.36Å; N326-V329 PolarHBondContact O-N 3.49Å; N326-V329 VanDerWaalsContact O-N 3.07Å; I327-V329 VanDerWaalsContact C-N 3.34Å; I327-V329 PolarHBondContact O-N 3.15Å; V329-A332 PolarHBondContact O-N 3.12Å; V329-H333 PolarHBondContact O-CD2 3.49Å; V329-H333 PolarHBondContact O-N 2.68Å; V329-I363 HydrophobicContact CG1-CD1 4.01Å
330A97.6Very high94.9Very high0 Ų020.3 Ų20.30%012%0.119CC..Hα-helixtrans-61.9-46175.600000113N326 I327 A332 H333 E334 A360 I363 I364N326-A330 PolarHBondContact O-N 2.91Å; I327-A330 PolarHBondContact O-N 3.02Å; A330-A332 VanDerWaalsContact C-N 3.32Å; A330-A332 PolarHBondContact O-N 3.12Å; A330-H333 WeakPolarHBondContact O-CB 3.21Å; A330-H333 PolarHBondContact O-N 3.36Å; A330-E334 PolarHBondContact O-N 2.9Å; A330-A360 WeakPolarHBondContact O-CB 3.39Å; A330-I363 HydrophobicContact CB-CB 3.92Å; A330-I363 HydrophobicContact CB-CD1 4.41Å; A330-I363 HydrophobicContact CB-CG2 3.77Å; A330-I364 HydrophobicContact CB-CD1 4.15Å; A330-I364 HydrophobicContact CB-CG1 3.67Å
331T96.7Very high95Very high45 Ų4517.8 Ų17.828%0.27610%0.099SC..Hα-helixtrans-61.3-41.1176.7-55.30000111.7I327 H328 H333 E334 D335I327-T331 PolarHBondContact O-N 2.65Å; I327-T331 PolarHBondContact O-OG1 3.14Å; I327-T331 VanDerWaalsContact O-OG1 3.07Å; H328-T331 PolarHBondContact O-N 3.44Å; T331-H333 VanDerWaalsContact C-N 3.34Å; T331-H333 PolarHBondContact O-N 2.94Å; T331-E334 PolarHBondContact O-N 3.34Å; T331-D335 PolarHBondContact O-N 3.43Å
332A98Very high95Very high0 Ų019.4 Ų19.40%011%0.109CC..Hα-helixtrans-66.4-36.5177.200000112.3L292 L315 H328 V329 A330 L336L292-A332 HydrophobicContact CD2-CB 4.19Å; L315-A332 HydrophobicContact CB-CB 4.1Å; L315-A332 HydrophobicContact CD1-CB 3.84Å; H328-A332 PolarHBondContact O-N 3.42Å; H328-A332 VanDerWaalsContact O-N 3.09Å; V329-A332 PolarHBondContact O-N 3.12Å; A330-A332 VanDerWaalsContact C-N 3.32Å; A330-A332 PolarHBondContact O-N 3.12Å; A332-L336 VanDerWaalsContact O-CB 3.28Å; A332-L336 WeakPolarHBondContact O-CB 3.18Å; A332-L336 PolarHBondContact O-N 3.07Å
333H98.3Very high94.8Very high7 Ų723.2 Ų23.23%0.03213%0.127CC..Hα-helixtrans-62.9-43.4170.5-83.7-51.2000112.2L315 Q319 V329 A330 T331 L336 A337 H356 A360L315-H333 WeakPolarHBondContact CD2-ND1 3.43Å; Q319-H333 PolarHBondContact NE2-NE2 2.9Å; V329-H333 PolarHBondContact O-CD2 3.49Å; V329-H333 PolarHBondContact O-N 2.68Å; A330-H333 WeakPolarHBondContact O-CB 3.21Å; A330-H333 PolarHBondContact O-N 3.36Å; T331-H333 VanDerWaalsContact C-N 3.34Å; T331-H333 PolarHBondContact O-N 2.94Å; H333-L336 PolarHBondContact O-N 3.19Å; H333-A337 VanDerWaalsContact O-CB 3.24Å; H333-A337 WeakPolarHBondContact O-CB 3.48Å; H333-A337 PolarHBondContact O-N 3.46Å; H333-H356 AromaticContact CE1-ND1 3.5Å; H333-H356 AromaticContact ND1-CE1 3.76Å; H333-H356 AromaticContact ND1-CG 3.9Å; H333-H356 AromaticContact ND1-ND1 2.97Å; H333-H356 PolarHBondContact ND1-ND1 3.1Å; H333-A360 HydrophobicContact CB-CB 3.97Å
334E97.8Very high94.7Very high22 Ų2223.9 Ų23.910%0.10313%0.126CC..Hα-helixtrans-60.9-49.1177.2-175.9-173.1132.500111.9A330 T331 L336 A337 Y338 A360 S377 S378A330-E334 PolarHBondContact O-N 2.9Å; T331-E334 PolarHBondContact O-N 3.34Å; E334-L336 VanDerWaalsContact C-N 3.35Å; E334-L336 PolarHBondContact O-N 2.76Å; E334-A337 WeakPolarHBondContact O-CB 3.47Å; E334-A337 PolarHBondContact O-N 3.09Å; E334-Y338 PolarHBondContact O-N 3.37Å; E334-A360 HydrophobicContact CB-CB 4.13Å; E334-S377 WeakPolarHBondContact OE1-CB 3.16Å; E334-S377 PolarHBondContact OE1-OG 2.87Å; E334-S378 PolarHBondContact OE2-N 3.25Å; E334-S378 VanDerWaalsContact OE2-N 3.15Å; E334-S378 PolarHBondContact OE2-OG 3.36Å
335D97.8Very high94.9Very high41 Ų4126.3 Ų26.322%0.21912%0.124CC..Hα-helixtrans-60.9-45.1-179.8-72.9-27.2000111.3Y311 T331 Y338 S339Y311-D335 HydrophobicContact CD1-CB 3.69Å; Y311-D335 HydrophobicContact CE1-CB 3.46Å; Y311-D335 VanDerWaalsContact CE1-CB 3.46Å; Y311-D335 HydrophobicContact CE2-CB 4.42Å; Y311-D335 HydrophobicContact CG-CB 4.31Å; T331-D335 PolarHBondContact O-N 3.43Å; D335-Y338 PolarHBondContact O-N 2.89Å; D335-S339 WeakPolarHBondContact O-CB 3.49Å; D335-S339 PolarHBondContact O-N 3.32Å
336L97.7Very high94.1Very high1 Ų128.3 Ų28.31%0.00515%0.146CC..Hα-helixtrans-65.7-37.7176.2-178.557.8000112.1V308 L315 A332 H333 E334 S340 H356V308-L336 HydrophobicContact CG1-CD1 3.96Å; L315-L336 HydrophobicContact CD2-CD2 3.65Å; A332-L336 VanDerWaalsContact O-CB 3.28Å; A332-L336 WeakPolarHBondContact O-CB 3.18Å; A332-L336 PolarHBondContact O-N 3.07Å; H333-L336 PolarHBondContact O-N 3.19Å; E334-L336 VanDerWaalsContact C-N 3.35Å; E334-L336 PolarHBondContact O-N 2.76Å; L336-S340 WeakPolarHBondContact O-CB 3.37Å; L336-S340 PolarHBondContact O-N 2.95Å; L336-S340 PolarHBondContact O-OG 3.27Å; L336-H356 VanDerWaalsContact CD2-NE2 3.28Å; L336-H356 WeakPolarHBondContact CD2-NE2 3.36Å
337A98Very high93.4Very high0 Ų031.2 Ų31.20%017%0.166CC..Hα-helixtrans-61.3-47.3176.400000111H333 E334 S340 Y341 A353 H356 A357 V381H333-A337 VanDerWaalsContact O-CB 3.24Å; H333-A337 WeakPolarHBondContact O-CB 3.48Å; H333-A337 PolarHBondContact O-N 3.46Å; E334-A337 WeakPolarHBondContact O-CB 3.47Å; E334-A337 PolarHBondContact O-N 3.09Å; A337-S340 PolarHBondContact O-N 3.11Å; A337-Y341 WeakPolarHBondContact O-CB 3.42Å; A337-Y341 PolarHBondContact O-N 2.91Å; A337-A353 WeakPolarHBondContact CB-O 3.21Å; A337-H356 HydrophobicContact CB-CB 3.7Å; A337-A357 HydrophobicContact CB-CB 3.97Å; A337-V381 HydrophobicContact CB-CG1 3.98Å
338Y97.1Very high92.8Very high85 Ų8532.2 Ų32.233%0.33318%0.178SC..Hα-helixtrans-66.6-45.5179.2-176.8-117.2000112L299 E334 D335 S340 Y341 V342 V381L299-Y338 HydrophobicContact CD2-CD1 3.71Å; L299-Y338 HydrophobicContact CD2-CE1 3.66Å; E334-Y338 PolarHBondContact O-N 3.37Å; D335-Y338 PolarHBondContact O-N 2.89Å; Y338-S340 VanDerWaalsContact C-N 3.33Å; Y338-S340 PolarHBondContact O-N 3.03Å; Y338-Y341 HydrophobicContact CD2-CD1 4.28Å; Y338-Y341 HydrophobicContact CE2-CD1 4.28Å; Y338-Y341 WeakPolarHBondContact O-CB 3.36Å; Y338-Y341 PolarHBondContact O-N 3.41Å; Y338-V342 HydrophobicContact CD2-CG2 4.49Å; Y338-V342 HydrophobicContact CE1-CG2 4.31Å; Y338-V342 HydrophobicContact CE2-CG2 4.07Å; Y338-V342 WeakPolarHBondContact O-CG2 3.43Å; Y338-V342 PolarHBondContact O-N 2.97Å; Y338-V381 HydrophobicContact CD2-CG2 4.11Å; Y338-V381 HydrophobicContact CG-CG2 4.37Å
339S95.2Very high92.4Very high0 Ų038.5 Ų38.50%021%0.205CC..Hα-helixtrans-62.5-40.8177.3-169.40000111.9S307 V308 D335 V342 H343S307-S339 WeakPolarHBondContact CB-OG 2.93Å; S307-S339 PolarHBondContact OG-OG 2.91Å; V308-S339 WeakPolarHBondContact CG2-OG 3.41Å; V308-S339 PolarHBondContact N-OG 2.86Å; D335-S339 WeakPolarHBondContact O-CB 3.49Å; D335-S339 PolarHBondContact O-N 3.32Å; S339-V342 PolarHBondContact O-N 3.45Å; S339-H343 WeakPolarHBondContact O-CB 3.44Å; S339-H343 PolarHBondContact O-N 2.98Å
340S94.9Very high92.2Very high2 Ų238.6 Ų38.61%0.01421%0.206CC..Hα-helixtrans-66-39.5175.3-60.10000112.3L336 A337 Y338 H343 L344L336-S340 WeakPolarHBondContact O-CB 3.37Å; L336-S340 PolarHBondContact O-N 2.95Å; L336-S340 PolarHBondContact O-OG 3.27Å; A337-S340 PolarHBondContact O-N 3.11Å; Y338-S340 VanDerWaalsContact C-N 3.33Å; Y338-S340 PolarHBondContact O-N 3.03Å; S340-H343 PolarHBondContact O-N 2.97Å; S340-L344 VanDerWaalsContact O-CB 3.28Å; S340-L344 WeakPolarHBondContact O-CB 3.43Å; S340-L344 WeakPolarHBondContact O-CD1 3.18Å; S340-L344 WeakPolarHBondContact O-CG 3.17Å; S340-L344 PolarHBondContact O-N 3.07Å
341Y95.1Very high92Very high11 Ų1144.8 Ų44.84%0.04324%0.239CC..Hα-helixtrans-58-48.3173.4163.8-100.8000111.1A337 Y338 H343 L344 Y345 F350 L384 I385 E388A337-Y341 WeakPolarHBondContact O-CB 3.42Å; A337-Y341 PolarHBondContact O-N 2.91Å; Y338-Y341 HydrophobicContact CD2-CD1 4.28Å; Y338-Y341 HydrophobicContact CE2-CD1 4.28Å; Y338-Y341 WeakPolarHBondContact O-CB 3.36Å; Y338-Y341 PolarHBondContact O-N 3.41Å; Y341-H343 VanDerWaalsContact C-N 3.35Å; Y341-H343 PolarHBondContact O-N 3.3Å; Y341-L344 PolarHBondContact O-N 3.01Å; Y341-Y345 HydrophobicContact CE2-CD2 4.38Å; Y341-Y345 PolarHBondContact O-N 3.38Å; Y341-Y345 VanDerWaalsContact O-N 3.1Å; Y341-F350 AromaticContact CD2-CD1 3.92Å; Y341-F350 HydrophobicContact CD2-CD1 3.92Å; Y341-F350 AromaticContact CD2-CE1 3.82Å; Y341-F350 HydrophobicContact CD2-CE1 3.82Å; Y341-F350 HydrophobicContact CE2-CE1 4.11Å; Y341-L384 HydrophobicContact CE1-CB 4.4Å; Y341-L384 HydrophobicContact CE1-CD1 4.39Å; Y341-L384 HydrophobicContact CE2-CB 4.28Å; Y341-I385 HydrophobicContact CD2-CG1 3.59Å; Y341-I385 HydrophobicContact CE2-CG1 4.36Å; Y341-I385 HydrophobicContact CG-CG1 4.11Å; Y341-E388 HydrophobicContact CE2-CG 3.61Å; Y341-E388 PolarHBondContact OH-OE1 3.21Å; Y341-E388 VanDerWaalsContact OH-OE1 3.09Å
342V91.4Very high91.8Very high40 Ų4046.3 Ų46.324%0.24225%0.245CC..Hα-helixtrans-63.8-40.9178177.40000111L299 I304 Y338 S339 L344L299-V342 HydrophobicContact CD1-CB 4.38Å; L299-V342 HydrophobicContact CD1-CG1 4.28Å; I304-V342 HydrophobicContact CD1-CG1 3.69Å; I304-V342 HydrophobicContact CG1-CG1 3.97Å; I304-V342 HydrophobicContact CG2-CB 4.42Å; I304-V342 HydrophobicContact CG2-CG1 4.17Å; Y338-V342 HydrophobicContact CD2-CG2 4.49Å; Y338-V342 HydrophobicContact CE1-CG2 4.31Å; Y338-V342 HydrophobicContact CE2-CG2 4.07Å; Y338-V342 WeakPolarHBondContact O-CG2 3.43Å; Y338-V342 PolarHBondContact O-N 2.97Å; S339-V342 PolarHBondContact O-N 3.45Å; V342-L344 PolarHBondContact O-N 3.3Å
343H88.7Confident91.7Very high85 Ų8546.3 Ų46.339%0.39425%0.245SC..Hα-helixtrans-62.5-42.4177.6-177.250.6000112.9I304 C305 V308 S339 S340 Y341 Y345I304-H343 HydrophobicContact CG2-CB 3.61Å; C305-H343 PolarHBondContact SG-CE1 2.94Å; V308-H343 HydrophobicContact CG2-CB 3.95Å; S339-H343 WeakPolarHBondContact O-CB 3.44Å; S339-H343 PolarHBondContact O-N 2.98Å; S340-H343 PolarHBondContact O-N 2.97Å; Y341-H343 VanDerWaalsContact C-N 3.35Å; Y341-H343 PolarHBondContact O-N 3.3Å; H343-Y345 VanDerWaalsContact C-N 3.35Å
344L86.5Confident91.6Very high33 Ų3347.4 Ų47.417%0.17325%0.251CS..Hα-helixtrans-91.5-0.9-170.3-62.9165.1000112.6S340 Y341 V342 S346 S347 G348 K349 F350S340-L344 VanDerWaalsContact O-CB 3.28Å; S340-L344 WeakPolarHBondContact O-CB 3.43Å; S340-L344 WeakPolarHBondContact O-CD1 3.18Å; S340-L344 WeakPolarHBondContact O-CG 3.17Å; S340-L344 PolarHBondContact O-N 3.07Å; Y341-L344 PolarHBondContact O-N 3.01Å; V342-L344 PolarHBondContact O-N 3.3Å; L344-S346 PolarHBondContact O-N 3.26Å; L344-S347 WeakPolarHBondContact O-CA 3.32Å; L344-S347 PolarHBondContact O-N 2.79Å; L344-S347 PolarHBondContact O-OG 2.6Å; L344-G348 PolarHBondContact O-N 3.28Å; L344-G348 VanDerWaalsContact O-N 3.08Å; L344-K349 VanDerWaalsContact CD1-O 3.27Å; L344-K349 WeakPolarHBondContact CD1-O 3.26Å; L344-F350 HydrophobicContact CB-CD1 4.32Å; L344-F350 HydrophobicContact CB-CE1 4.43Å
345Y82.9Confident91.6Very high90 Ų9051 Ų5135%0.35327%0.267SS..G310 helixtrans-48.9-52.5-177.6-166.4-95.7000112.6Y341 H343 S347 E388Y341-Y345 HydrophobicContact CE2-CD2 4.38Å; Y341-Y345 PolarHBondContact O-N 3.38Å; Y341-Y345 VanDerWaalsContact O-N 3.1Å; H343-Y345 VanDerWaalsContact C-N 3.35Å; Y345-S347 PolarHBondContact O-N 3.27Å; Y345-E388 HydrophobicContact CE2-CG 4.24Å; Y345-E388 VanDerWaalsContact CE2-OE1 3.29Å; Y345-E388 WeakPolarHBondContact CE2-OE1 3.48Å
346S75.3Confident91.6Very high108 Ų10849.4 Ų49.476%0.75526%0.258SS*.G310 helixtrans-70.7-16.1-180-47.30000114.1L344L344-S346 PolarHBondContact O-N 3.26Å
347S82.3Confident91.7Very high61 Ų6149.4 Ų49.443%0.42726%0.258SS..G310 helixtrans-96.4-18.6-176.876.90000114.2L344 Y345 K349L344-S347 WeakPolarHBondContact O-CA 3.32Å; L344-S347 PolarHBondContact O-N 2.79Å; L344-S347 PolarHBondContact O-OG 2.6Å; Y345-S347 PolarHBondContact O-N 3.27Å; S347-K349 PolarHBondContact O-N 3.01Å; S347-K349 PolarHBondContact OG-N 3.08Å
348G83.5Confident91.7Very high28 Ų2853.4 Ų53.429%0.28928%0.276SS..THydrogen-bonded Turntrans69.71.5-174.900000115.4L344 F350L344-G348 PolarHBondContact O-N 3.28Å; L344-G348 VanDerWaalsContact O-N 3.08Å; G348-F350 WeakPolarHBondContact O-CD2 3.39Å; G348-F350 PolarHBondContact O-N 3.48Å
349K89.2Confident91.7Very high148 Ų14855 Ų5564%0.64328%0.282SS*.  trans-93.478.5-173-66.3180-176.5177.30112L344 S347L344-K349 VanDerWaalsContact CD1-O 3.27Å; L344-K349 WeakPolarHBondContact CD1-O 3.26Å; S347-K349 PolarHBondContact O-N 3.01Å; S347-K349 PolarHBondContact OG-N 3.08Å
350F92.9Very high91.8Very high4 Ų455 Ų552%0.01828%0.282CS..  trans-89.94.6-171.8-56.2-70.4000116.2Y341 L344 G348 N352 A353 L354 I385 E388 I389Y341-F350 AromaticContact CD2-CD1 3.92Å; Y341-F350 HydrophobicContact CD2-CD1 3.92Å; Y341-F350 AromaticContact CD2-CE1 3.82Å; Y341-F350 HydrophobicContact CD2-CE1 3.82Å; Y341-F350 HydrophobicContact CE2-CE1 4.11Å; L344-F350 HydrophobicContact CB-CD1 4.32Å; L344-F350 HydrophobicContact CB-CE1 4.43Å; G348-F350 WeakPolarHBondContact O-CD2 3.39Å; G348-F350 PolarHBondContact O-N 3.48Å; F350-N352 VanDerWaalsContact C-N 3.3Å; F350-N352 PolarHBondContact O-N 2.86Å; F350-A353 PolarHBondContact O-N 2.68Å; F350-A353 VanDerWaalsContact O-N 3.1Å; F350-L354 WeakPolarHBondContact O-CB 3.32Å; F350-L354 PolarHBondContact O-N 2.87Å; F350-I385 HydrophobicContact CB-CG2 3.66Å; F350-I385 HydrophobicContact CG-CG2 4.33Å; F350-E388 HydrophobicContact CD2-CB 3.98Å; F350-E388 HydrophobicContact CE2-CB 3.35Å; F350-E388 HydrophobicContact CE2-CG 4.07Å; F350-E388 HydrophobicContact CZ-CB 3.73Å; F350-E388 HydrophobicContact CZ-CG 3.9Å; F350-I389 HydrophobicContact CB-CD1 4.22Å; F350-I389 HydrophobicContact CB-CG1 4.21Å; F350-I389 HydrophobicContact CD2-CG1 3.99Å
351D92.4Very high92Very high129 Ų12956.2 Ų56.269%0.6929%0.288SS*.Hα-helixtrans-53.3-44.3-174.6-63.1-46.5000113.3L354 F355D351-L354 PolarHBondContact O-N 3.22Å; D351-F355 WeakPolarHBondContact O-CB 3.45Å; D351-F355 PolarHBondContact O-N 3.22Å
352N92.4Very high92.1Very high77 Ų7759.6 Ų59.641%0.41231%0.307SS..Hα-helixtrans-68.6-43.7179.8-167.46.3000111.9F350 L354 F355 H356F350-N352 VanDerWaalsContact C-N 3.3Å; F350-N352 PolarHBondContact O-N 2.86Å; N352-L354 VanDerWaalsContact C-N 3.32Å; N352-L354 PolarHBondContact O-N 2.92Å; N352-F355 PolarHBondContact O-N 3.13Å; N352-H356 PolarHBondContact O-CD2 2.95Å; N352-H356 VanDerWaalsContact O-CD2 3.27Å; N352-H356 PolarHBondContact O-N 2.71Å; N352-H356 VanDerWaalsContact O-N 3.14Å; N352-H356 PolarHBondContact OD1-CD2 3.39Å; N352-H356 PolarHBondContact OD1-NE2 3.27Å; N352-H356 VanDerWaalsContact OD1-NE2 3.08Å
353A96.3Very high92.3Very high0 Ų058 Ų580%030%0.297CS..Hα-helixtrans-61.3-42.6176.300000111.2A337 F350 H356 A357 I385A337-A353 WeakPolarHBondContact CB-O 3.21Å; F350-A353 PolarHBondContact O-N 2.68Å; F350-A353 VanDerWaalsContact O-N 3.1Å; A353-H356 PolarHBondContact O-N 2.83Å; A353-A357 WeakPolarHBondContact O-CB 3.38Å; A353-A357 PolarHBondContact O-N 3.34Å; A353-I385 HydrophobicContact CB-CD1 3.78Å; A353-I385 HydrophobicContact CB-CG1 4.32Å
354L97.3Very high92.7Very high30 Ų3054.1 Ų54.116%0.15728%0.279CS..Hα-helixtrans-64.1-46.3177.8-175.958.7000111.4F350 D351 N352 H356 A357 E358 K382 I385 L386 I389F350-L354 WeakPolarHBondContact O-CB 3.32Å; F350-L354 PolarHBondContact O-N 2.87Å; D351-L354 PolarHBondContact O-N 3.22Å; N352-L354 VanDerWaalsContact C-N 3.32Å; N352-L354 PolarHBondContact O-N 2.92Å; L354-H356 VanDerWaalsContact C-N 3.29Å; L354-H356 PolarHBondContact O-N 2.65Å; L354-A357 PolarHBondContact O-N 2.93Å; L354-E358 HydrophobicContact CD1-CG 4.11Å; L354-E358 HydrophobicContact CG-CG 4.4Å; L354-E358 WeakPolarHBondContact O-CG 3.36Å; L354-E358 PolarHBondContact O-N 3.05Å; L354-K382 HydrophobicContact CD1-CG 4.12Å; L354-I385 HydrophobicContact CB-CG2 3.94Å; L354-I385 HydrophobicContact CD1-CG2 4.15Å; L354-L386 HydrophobicContact CD1-CD2 4.25Å; L354-I389 HydrophobicContact CD2-CD1 4.04Å
355F97.2Very high93.1Very high98 Ų9855.5 Ų55.543%0.4329%0.289SS..Hα-helixtrans-53.2-48.1176.5169.2-98.1000111.5D351 N352 E358 R359D351-F355 WeakPolarHBondContact O-CB 3.45Å; D351-F355 PolarHBondContact O-N 3.22Å; N352-F355 PolarHBondContact O-N 3.13Å; F355-E358 PolarHBondContact O-N 3.44Å; F355-R359 HydrophobicContact CD1-CG 4.47Å; F355-R359 HydrophobicContact CD2-CG 4.36Å; F355-R359 HydrophobicContact CE1-CG 4.1Å; F355-R359 HydrophobicContact CE2-CG 3.98Å; F355-R359 HydrophobicContact CZ-CG 3.84Å; F355-R359 WeakPolarHBondContact O-CB 3.43Å; F355-R359 WeakPolarHBondContact O-CG 3.48Å; F355-R359 PolarHBondContact O-N 3.04Å
356H98.1Very high93.6Very high8 Ų856.5 Ų56.54%0.03730%0.297CS..Hα-helixtrans-68.3-40.5179.7-72.2-49.7000112.7H333 L336 A337 N352 A353 L354 E358 R359 A360H333-H356 AromaticContact CE1-ND1 3.5Å; H333-H356 AromaticContact ND1-CE1 3.76Å; H333-H356 AromaticContact ND1-CG 3.9Å; H333-H356 AromaticContact ND1-ND1 2.97Å; H333-H356 PolarHBondContact ND1-ND1 3.1Å; L336-H356 VanDerWaalsContact CD2-NE2 3.28Å; L336-H356 WeakPolarHBondContact CD2-NE2 3.36Å; A337-H356 HydrophobicContact CB-CB 3.7Å; N352-H356 PolarHBondContact O-CD2 2.95Å; N352-H356 VanDerWaalsContact O-CD2 3.27Å; N352-H356 PolarHBondContact O-N 2.71Å; N352-H356 VanDerWaalsContact O-N 3.14Å; N352-H356 PolarHBondContact OD1-CD2 3.39Å; N352-H356 PolarHBondContact OD1-NE2 3.27Å; N352-H356 VanDerWaalsContact OD1-NE2 3.08Å; A353-H356 PolarHBondContact O-N 2.83Å; L354-H356 VanDerWaalsContact C-N 3.29Å; L354-H356 PolarHBondContact O-N 2.65Å; H356-E358 VanDerWaalsContact C-N 3.33Å; H356-E358 PolarHBondContact O-N 2.95Å; H356-R359 PolarHBondContact O-N 3.22Å; H356-A360 PolarHBondContact O-N 3.33Å
357A98.2Very high94.5Very high1 Ų153.5 Ų53.51%0.00827%0.271CS..Hα-helixtrans-61.5-42176.100000111.7A337 A353 L354 A360 I361 V381 K382 I385A337-A357 HydrophobicContact CB-CB 3.97Å; A353-A357 WeakPolarHBondContact O-CB 3.38Å; A353-A357 PolarHBondContact O-N 3.34Å; L354-A357 PolarHBondContact O-N 2.93Å; A357-A360 PolarHBondContact O-N 3.45Å; A357-I361 WeakPolarHBondContact O-CG1 3.4Å; A357-I361 PolarHBondContact O-N 2.99Å; A357-I361 VanDerWaalsContact O-N 3.14Å; A357-V381 HydrophobicContact CB-CG1 4.31Å; A357-K382 HydrophobicContact CB-CB 4.08Å; A357-I385 HydrophobicContact CB-CD1 4.12Å
358E98.1Very high95.1Very high83 Ų8352 Ų5239%0.38826%0.259SS..Hα-helixtrans-67.1-40.2177.2-70.6-172.1147.400112.5L354 F355 H356 I361 D362 K382L354-E358 HydrophobicContact CD1-CG 4.11Å; L354-E358 HydrophobicContact CG-CG 4.4Å; L354-E358 WeakPolarHBondContact O-CG 3.36Å; L354-E358 PolarHBondContact O-N 3.05Å; F355-E358 PolarHBondContact O-N 3.44Å; H356-E358 VanDerWaalsContact C-N 3.33Å; H356-E358 PolarHBondContact O-N 2.95Å; E358-I361 PolarHBondContact O-N 3.25Å; E358-D362 WeakPolarHBondContact O-CB 3.44Å; E358-D362 PolarHBondContact O-N 3.42Å; E358-K382 HydrophobicContact CG-CD 4.08Å; E358-K382 IonicContact OE1-NZ 2.75Å; E358-K382 PolarHBondContact OE1-NZ 2.94Å
359R97.8Very high95.5Very high119 Ų11954.4 Ų54.445%0.44927%0.269SS..Hα-helixtrans-62.9-41.5175.3-72.1-73.3158.3175.6-4112.1F355 H356 D362 I363F355-R359 HydrophobicContact CD1-CG 4.47Å; F355-R359 HydrophobicContact CD2-CG 4.36Å; F355-R359 HydrophobicContact CE1-CG 4.1Å; F355-R359 HydrophobicContact CE2-CG 3.98Å; F355-R359 HydrophobicContact CZ-CG 3.84Å; F355-R359 WeakPolarHBondContact O-CB 3.43Å; F355-R359 WeakPolarHBondContact O-CG 3.48Å; F355-R359 PolarHBondContact O-N 3.04Å; H356-R359 PolarHBondContact O-N 3.22Å; R359-D362 PolarHBondContact O-N 3.05Å; R359-I363 WeakPolarHBondContact O-CB 3.31Å; R359-I363 WeakPolarHBondContact O-CD1 3.4Å; R359-I363 VanDerWaalsContact O-CG1 3.24Å; R359-I363 WeakPolarHBondContact O-CG1 3.38Å; R359-I363 PolarHBondContact O-N 3.18Å
360A97.9Very high95.5Very high0 Ų055.1 Ų55.10%028%0.275CS..Hα-helixtrans-59.8-48.4175.200000111.2A330 H333 E334 H356 A357 I363 I364 S378A330-A360 WeakPolarHBondContact O-CB 3.39Å; H333-A360 HydrophobicContact CB-CB 3.97Å; E334-A360 HydrophobicContact CB-CB 4.13Å; H356-A360 PolarHBondContact O-N 3.33Å; A357-A360 PolarHBondContact O-N 3.45Å; A360-I363 PolarHBondContact O-N 3.21Å; A360-I364 WeakPolarHBondContact O-CB 3.49Å; A360-I364 WeakPolarHBondContact O-CD1 3.48Å; A360-I364 WeakPolarHBondContact O-CG1 3.34Å; A360-I364 PolarHBondContact O-N 3.46Å; A360-S378 WeakPolarHBondContact CB-OG 3.22Å
361I97.6Very high95.4Very high27 Ų2759.1 Ų59.114%0.13830%0.296CS..Hα-helixtrans-63.1-46.5178.8-64.8170.2000111.4A357 E358 I363 I364 T365 L375 K379 K382A357-I361 WeakPolarHBondContact O-CG1 3.4Å; A357-I361 PolarHBondContact O-N 2.99Å; A357-I361 VanDerWaalsContact O-N 3.14Å; E358-I361 PolarHBondContact O-N 3.25Å; I361-I363 PolarHBondContact O-N 3.36Å; I361-I364 PolarHBondContact O-N 3.23Å; I361-T365 HydrophobicContact CG2-CG2 4.1Å; I361-T365 WeakPolarHBondContact O-CB 3.44Å; I361-T365 WeakPolarHBondContact O-CG2 3.49Å; I361-T365 PolarHBondContact O-N 2.99Å; I361-T365 PolarHBondContact O-OG1 3.25Å; I361-L375 HydrophobicContact CG2-CD2 4.35Å; I361-K379 HydrophobicContact CD1-CG 4.24Å; I361-K382 HydrophobicContact CD1-CB 3.93Å; I361-K382 HydrophobicContact CD1-CD 3.78Å; I361-K382 HydrophobicContact CD1-CG 4.47Å
362D97.1Very high95.6Very high82 Ų8254.2 Ų54.244%0.43927%0.269SS..Hα-helixtrans-58.3-48178.9177.866.9000111.5E358 R359 T365 H366E358-D362 WeakPolarHBondContact O-CB 3.44Å; E358-D362 PolarHBondContact O-N 3.42Å; R359-D362 PolarHBondContact O-N 3.05Å; D362-T365 PolarHBondContact O-OG1 3.25Å; D362-T365 VanDerWaalsContact O-OG1 3.09Å; D362-H366 WeakPolarHBondContact O-CB 3.35Å; D362-H366 PolarHBondContact O-N 3.22Å; D362-H366 VanDerWaalsContact O-N 3.12Å
363I96.7Very high95.7Very high8 Ų851.7 Ų51.74%0.04126%0.256CS..Hα-helixtrans-62.1-52.4177.5-65.3163.3000110G324 N326 V329 A330 R359 A360 I361 T365 H366 I367G324-I363 VanDerWaalsContact O-CD1 3.26Å; G324-I363 WeakPolarHBondContact O-CD1 3.3Å; N326-I363 WeakPolarHBondContact O-CG2 3.47Å; V329-I363 HydrophobicContact CG1-CD1 4.01Å; A330-I363 HydrophobicContact CB-CB 3.92Å; A330-I363 HydrophobicContact CB-CD1 4.41Å; A330-I363 HydrophobicContact CB-CG2 3.77Å; R359-I363 WeakPolarHBondContact O-CB 3.31Å; R359-I363 WeakPolarHBondContact O-CD1 3.4Å; R359-I363 VanDerWaalsContact O-CG1 3.24Å; R359-I363 WeakPolarHBondContact O-CG1 3.38Å; R359-I363 PolarHBondContact O-N 3.18Å; A360-I363 PolarHBondContact O-N 3.21Å; I361-I363 PolarHBondContact O-N 3.36Å; I363-T365 PolarHBondContact O-N 2.96Å; I363-H366 WeakPolarHBondContact O-CB 3.41Å; I363-H366 PolarHBondContact O-N 2.89Å; I363-H366 VanDerWaalsContact O-N 3.09Å; I363-I367 HydrophobicContact CG2-CD1 4.5Å; I363-I367 WeakPolarHBondContact O-CG1 3.34Å; I363-I367 PolarHBondContact O-N 2.84Å
364I96.7Very high95.6Very high3 Ų353.4 Ų53.42%0.01526%0.264CS..Hα-helixtrans-60.5-46.3-175.6-65.7163.1000111A330 A360 I361 H366 I367 L368 L374 L375A330-I364 HydrophobicContact CB-CD1 4.15Å; A330-I364 HydrophobicContact CB-CG1 3.67Å; A360-I364 WeakPolarHBondContact O-CB 3.49Å; A360-I364 WeakPolarHBondContact O-CD1 3.48Å; A360-I364 WeakPolarHBondContact O-CG1 3.34Å; A360-I364 PolarHBondContact O-N 3.46Å; I361-I364 PolarHBondContact O-N 3.23Å; I364-H366 PolarHBondContact O-N 2.81Å; I364-I367 PolarHBondContact O-N 3.38Å; I364-L368 HydrophobicContact CG2-CB 4.28Å; I364-L368 HydrophobicContact CG2-CD1 4.06Å; I364-L368 WeakPolarHBondContact O-CB 2.98Å; I364-L368 PolarHBondContact O-N 3.27Å; I364-L374 HydrophobicContact CD1-CB 4.39Å; I364-L374 HydrophobicContact CG2-CB 4.38Å; I364-L375 HydrophobicContact CB-CD2 3.69Å; I364-L375 HydrophobicContact CB-CG 4.35Å; I364-L375 HydrophobicContact CG2-CD1 4.33Å; I364-L375 HydrophobicContact CG2-CD2 3.4Å; I364-L375 HydrophobicContact CG2-CG 3.49Å; I364-L375 VanDerWaalsContact CG2-CG 3.49Å
365T95.7Very high95.5Very high61 Ų6152 Ų5237%0.37426%0.257SS..Hα-helixtrans-64.6-24.9178.452.50000113.1I361 D362 I363 L375I361-T365 HydrophobicContact CG2-CG2 4.1Å; I361-T365 WeakPolarHBondContact O-CB 3.44Å; I361-T365 WeakPolarHBondContact O-CG2 3.49Å; I361-T365 PolarHBondContact O-N 2.99Å; I361-T365 PolarHBondContact O-OG1 3.25Å; D362-T365 PolarHBondContact O-OG1 3.25Å; D362-T365 VanDerWaalsContact O-OG1 3.09Å; I363-T365 PolarHBondContact O-N 2.96Å; T365-L375 HydrophobicContact CG2-CD1 4.07Å; T365-L375 HydrophobicContact CG2-CD2 3.75Å
366H93.9Very high95.4Very high112 Ų11247.5 Ų47.552%0.51924%0.238SC..Hα-helixtrans-75.4-37175.4-166.878.5000113.3K325 D362 I363 I364K325-H366 PolarHBondContact NZ-CE1 2.95Å; K325-H366 PolarHBondContact NZ-NE2 2.63Å; D362-H366 WeakPolarHBondContact O-CB 3.35Å; D362-H366 PolarHBondContact O-N 3.22Å; D362-H366 VanDerWaalsContact O-N 3.12Å; I363-H366 WeakPolarHBondContact O-CB 3.41Å; I363-H366 PolarHBondContact O-N 2.89Å; I363-H366 VanDerWaalsContact O-N 3.09Å; I364-H366 PolarHBondContact O-N 2.81Å
367I93.4Very high95.1Very high44 Ų4449 Ų4923%0.22625%0.25CC..Hα-helixtrans-103.3-19.6-172.559.9158.6000114.4W135 K325 I327 I363 I364W135-I367 HydrophobicContact CH2-CG2 4.41Å; K325-I367 HydrophobicContact CB-CG2 4.48Å; I327-I367 HydrophobicContact CB-CD1 3.8Å; I327-I367 HydrophobicContact CG1-CD1 4.32Å; I363-I367 HydrophobicContact CG2-CD1 4.5Å; I363-I367 WeakPolarHBondContact O-CG1 3.34Å; I363-I367 PolarHBondContact O-N 2.84Å; I364-I367 PolarHBondContact O-N 3.38Å
368L94.1Very high95Very high31 Ų3149 Ų4916%0.16225%0.249CC..SBendtrans-127.9157.9-175.1-67.5168.2000111.3I327 I364 H372 L374I327-L368 HydrophobicContact CD1-CD1 3.83Å; I327-L368 HydrophobicContact CG1-CD1 4.32Å; I364-L368 HydrophobicContact CG2-CB 4.28Å; I364-L368 HydrophobicContact CG2-CD1 4.06Å; I364-L368 WeakPolarHBondContact O-CB 2.98Å; I364-L368 PolarHBondContact O-N 3.27Å; L368-H372 HydrophobicContact CB-CB 4.04Å; L368-L374 HydrophobicContact CD1-CD1 3.81Å
369P93.3Very high94.9Very high77 Ų7746.5 Ų46.550%0.524%0.237SC..  trans-57.3150.9176-24.234.4000113.2D371 H372P369-D371 PolarHBondContact O-N 2.97Å; P369-D371 VanDerWaalsContact O-N 3.12Å; P369-H372 WeakPolarHBondContact O-CB 3.09Å; P369-H372 PolarHBondContact O-N 3.35Å
370E89.5Confident94.9Very high164 Ų16442.4 Ų42.477%0.76622%0.222SC*.THydrogen-bonded Turntrans-61.8-22.3-178.9-65.3-175.9172.800114.2L375E370-L375 WeakPolarHBondContact O-CD1 3.48Å
371D90.2Very high94.9Very high88 Ų8842.4 Ų42.447%0.47122%0.222SC..THydrogen-bonded Turntrans-98.615.4176.879.6-39.3000113.4P369 L416 K419P369-D371 PolarHBondContact O-N 2.97Å; P369-D371 VanDerWaalsContact O-N 3.12Å; D371-L416 HydrophobicContact CB-CD2 4.24Å; D371-L416 WeakPolarHBondContact O-CD2 3.48Å; D371-K419 IonicContact OD2-NZ 2.96Å; D371-K419 PolarHBondContact OD2-NZ 3.16Å
372H95.3Very high94.9Very high26 Ų2643.2 Ų43.212%0.1222%0.224CC..  trans-70.8136.4178.8-163.7-86.3000111.8N176 L368 P369 L374 L375N176-H372 PolarHBondContact O-NE2 3.48Å; N176-H372 PolarHBondContact OD1-NE2 3.2Å; L368-H372 HydrophobicContact CB-CB 4.04Å; P369-H372 WeakPolarHBondContact O-CB 3.09Å; P369-H372 PolarHBondContact O-N 3.35Å; H372-L374 VanDerWaalsContact C-N 3.25Å; H372-L374 PolarHBondContact ND1-N 2.78Å; H372-L374 PolarHBondContact O-N 3.48Å; H372-L375 WeakPolarHBondContact O-CB 3.43Å; H372-L375 PolarHBondContact O-N 2.67Å
373L95.5Very high94.9Very high24 Ų2439.3 Ų39.313%0.12620%0.203CC..THydrogen-bonded Turntrans-61.4-30.1-174.1-177.162.2000113.8C177 Y179 L375 A376 L416 A420 F421C177-L373 HydrophobicContact CB-CB 3.82Å; C177-L373 HydrophobicContact CB-CD2 3.79Å; C177-L373 HydrophobicContact CB-CG 4.29Å; Y179-L373 HydrophobicContact CD2-CD2 4.38Å; Y179-L373 HydrophobicContact CE2-CD2 3.55Å; L373-L375 PolarHBondContact O-N 3Å; L373-L375 VanDerWaalsContact O-N 3.1Å; L373-A376 HydrophobicContact CD1-CB 4.04Å; L373-A376 WeakPolarHBondContact O-CB 3.43Å; L373-A376 PolarHBondContact O-N 3.48Å; L373-L416 HydrophobicContact CD1-CB 4.18Å; L373-A420 HydrophobicContact CD1-CB 3.67Å; L373-A420 HydrophobicContact CD2-CB 3.43Å; L373-A420 VanDerWaalsContact CD2-CB 3.43Å; L373-A420 HydrophobicContact CG-CB 4.1Å; L373-F421 HydrophobicContact CD1-CE2 4.23Å; L373-F421 HydrophobicContact CD2-CE1 4.45Å; L373-F421 HydrophobicContact CD2-CE2 4.01Å; L373-F421 HydrophobicContact CD2-CZ 3.75Å
374L94.2Very high94.9Very high35 Ų3539.2 Ų39.218%0.18320%0.203CC..Hα-helixtrans-57.2-23.9175.2-71.7172.5000113.3I327 I364 L368 H372 A376I327-L374 HydrophobicContact CD1-CD1 3.47Å; I327-L374 VanDerWaalsContact CD1-CD1 3.47Å; I327-L374 HydrophobicContact CG1-CD1 3.81Å; I364-L374 HydrophobicContact CD1-CB 4.39Å; I364-L374 HydrophobicContact CG2-CB 4.38Å; L368-L374 HydrophobicContact CD1-CD1 3.81Å; H372-L374 VanDerWaalsContact C-N 3.25Å; H372-L374 PolarHBondContact ND1-N 2.78Å; H372-L374 PolarHBondContact O-N 3.48Å; L374-A376 VanDerWaalsContact C-N 3.27Å; L374-A376 PolarHBondContact O-N 2.88Å
375L94.8Very high95Very high0 Ų039 Ų390%020%0.202CC..Hα-helixtrans-70.4-23.3174-71.9168.2000113I361 I364 T365 E370 H372 L373 S377 K379 L416I361-L375 HydrophobicContact CG2-CD2 4.35Å; I364-L375 HydrophobicContact CB-CD2 3.69Å; I364-L375 HydrophobicContact CB-CG 4.35Å; I364-L375 HydrophobicContact CG2-CD1 4.33Å; I364-L375 HydrophobicContact CG2-CD2 3.4Å; I364-L375 HydrophobicContact CG2-CG 3.49Å; I364-L375 VanDerWaalsContact CG2-CG 3.49Å; T365-L375 HydrophobicContact CG2-CD1 4.07Å; T365-L375 HydrophobicContact CG2-CD2 3.75Å; E370-L375 WeakPolarHBondContact O-CD1 3.48Å; H372-L375 WeakPolarHBondContact O-CB 3.43Å; H372-L375 PolarHBondContact O-N 2.67Å; L373-L375 PolarHBondContact O-N 3Å; L373-L375 VanDerWaalsContact O-N 3.1Å; L375-S377 PolarHBondContact O-N 2.91Å; L375-K379 HydrophobicContact CB-CD 4.16Å; L375-K379 HydrophobicContact CB-CG 4.5Å; L375-K379 WeakPolarHBondContact O-CB 3.4Å; L375-K379 WeakPolarHBondContact O-CG 3.49Å; L375-K379 PolarHBondContact O-N 2.89Å; L375-L416 HydrophobicContact CB-CD1 4.15Å
376A94.8Very high95Very high5 Ų536.6 Ų36.64%0.04119%0.187CC..Hα-helixtrans-63.2-41.9-172.600000112.4L373 L374 R380 S413 L416L373-A376 HydrophobicContact CD1-CB 4.04Å; L373-A376 WeakPolarHBondContact O-CB 3.43Å; L373-A376 PolarHBondContact O-N 3.48Å; L374-A376 VanDerWaalsContact C-N 3.27Å; L374-A376 PolarHBondContact O-N 2.88Å; A376-R380 VanDerWaalsContact O-CB 3.29Å; A376-R380 WeakPolarHBondContact O-CB 3.26Å; A376-R380 PolarHBondContact O-N 2.98Å; A376-R380 VanDerWaalsContact O-N 3.12Å; A376-S413 WeakPolarHBondContact O-CB 3.32Å; A376-S413 PolarHBondContact O-OG 3.48Å; A376-S413 VanDerWaalsContact O-OG 3.12Å; A376-L416 HydrophobicContact CB-CB 3.84Å; A376-L416 HydrophobicContact CB-CD1 4.03Å
377S93.2Very high95.1Very high39 Ų3931.4 Ų31.427%0.27316%0.163SC..Hα-helixtrans-77.1-46.7-178.8-174.90000111.5E334 L375 K379 R380 V381E334-S377 WeakPolarHBondContact OE1-CB 3.16Å; E334-S377 PolarHBondContact OE1-OG 2.87Å; L375-S377 PolarHBondContact O-N 2.91Å; S377-K379 PolarHBondContact O-N 3.45Å; S377-R380 WeakPolarHBondContact O-CB 3.44Å; S377-R380 PolarHBondContact O-N 3.22Å; S377-R380 VanDerWaalsContact O-N 3.14Å; S377-R380 PolarHBondContact OG-NH2 3.02Å; S377-V381 WeakPolarHBondContact O-CG2 3.36Å; S377-V381 PolarHBondContact O-N 3.27Å
378S94.3Very high95.1Very high0 Ų030.2 Ų30.20%016%0.156CC..Hα-helixtrans-55-45.3173-72.70000113.5E334 A360 V381 K382E334-S378 PolarHBondContact OE2-N 3.25Å; E334-S378 VanDerWaalsContact OE2-N 3.15Å; E334-S378 PolarHBondContact OE2-OG 3.36Å; A360-S378 WeakPolarHBondContact CB-OG 3.22Å; S378-V381 PolarHBondContact O-N 3.2Å; S378-K382 PolarHBondContact O-N 3.24Å
379K97.1Very high95.1Very high31 Ų3131.1 Ų31.114%0.13516%0.161CC..Hα-helixtrans-63.9-41.4175.6-74.7175.4172.4176.20112.1I361 L375 S377 K382 A383 L409 S412 S413I361-K379 HydrophobicContact CD1-CG 4.24Å; L375-K379 HydrophobicContact CB-CD 4.16Å; L375-K379 HydrophobicContact CB-CG 4.5Å; L375-K379 WeakPolarHBondContact O-CB 3.4Å; L375-K379 WeakPolarHBondContact O-CG 3.49Å; L375-K379 PolarHBondContact O-N 2.89Å; S377-K379 PolarHBondContact O-N 3.45Å; K379-K382 PolarHBondContact O-N 3Å; K379-A383 WeakPolarHBondContact O-CB 3.47Å; K379-A383 PolarHBondContact O-N 3Å; K379-L409 HydrophobicContact CB-CD2 3.98Å; K379-L409 HydrophobicContact CD-CD2 4.33Å; K379-L409 HydrophobicContact CG-CD2 3.82Å; K379-S412 PolarHBondContact NZ-OG 3.29Å; K379-S413 WeakPolarHBondContact CB-OG 3Å
380R97.5Very high95.2Very high33 Ų3327.5 Ų27.513%0.12514%0.137CC..Hα-helixtrans-61.3-43174.7179.5-167.660.278.44.8111.9A376 S377 A383 L384 S413A376-R380 VanDerWaalsContact O-CB 3.29Å; A376-R380 WeakPolarHBondContact O-CB 3.26Å; A376-R380 PolarHBondContact O-N 2.98Å; A376-R380 VanDerWaalsContact O-N 3.12Å; S377-R380 WeakPolarHBondContact O-CB 3.44Å; S377-R380 PolarHBondContact O-N 3.22Å; S377-R380 VanDerWaalsContact O-N 3.14Å; S377-R380 PolarHBondContact OG-NH2 3.02Å; R380-A383 PolarHBondContact O-N 3.41Å; R380-L384 WeakPolarHBondContact O-CG 3.24Å; R380-L384 PolarHBondContact O-N 3.24Å; R380-S413 PolarHBondContact N-OG 2.93Å
381V97.1Very high95.2Very high1 Ų123.8 Ų23.81%0.00612%0.121CC..Hα-helixtrans-64.5-45.3177.8173.60000110.7A337 Y338 A357 S377 S378 A383 L384 I385A337-V381 HydrophobicContact CB-CG1 3.98Å; Y338-V381 HydrophobicContact CD2-CG2 4.11Å; Y338-V381 HydrophobicContact CG-CG2 4.37Å; A357-V381 HydrophobicContact CB-CG1 4.31Å; S377-V381 WeakPolarHBondContact O-CG2 3.36Å; S377-V381 PolarHBondContact O-N 3.27Å; S378-V381 PolarHBondContact O-N 3.2Å; V381-A383 VanDerWaalsContact C-N 3.34Å; V381-A383 PolarHBondContact O-N 3.48Å; V381-L384 WeakPolarHBondContact O-CB 3.48Å; V381-L384 PolarHBondContact O-N 3.42Å; V381-I385 HydrophobicContact CG1-CD1 3.96Å; V381-I385 WeakPolarHBondContact O-CD1 3.38Å; V381-I385 WeakPolarHBondContact O-CG1 3.49Å; V381-I385 PolarHBondContact O-N 3.18Å; V381-I385 VanDerWaalsContact O-N 3.16Å
382K98.1Very high95.1Very high43 Ų4324.2 Ų24.219%0.18712%0.124CC..Hα-helixtrans-58.7-45.2174.1179.4168.4171.2159.40111.7L354 A357 E358 I361 S378 K379 L384 I385 L386 L409L354-K382 HydrophobicContact CD1-CG 4.12Å; A357-K382 HydrophobicContact CB-CB 4.08Å; E358-K382 HydrophobicContact CG-CD 4.08Å; E358-K382 IonicContact OE1-NZ 2.75Å; E358-K382 PolarHBondContact OE1-NZ 2.94Å; I361-K382 HydrophobicContact CD1-CB 3.93Å; I361-K382 HydrophobicContact CD1-CD 3.78Å; I361-K382 HydrophobicContact CD1-CG 4.47Å; S378-K382 PolarHBondContact O-N 3.24Å; K379-K382 PolarHBondContact O-N 3Å; K382-L384 PolarHBondContact O-N 2.99Å; K382-I385 PolarHBondContact O-N 2.89Å; K382-I385 VanDerWaalsContact O-N 3.16Å; K382-L386 HydrophobicContact CG-CD1 4.06Å; K382-L386 HydrophobicContact CG-CG 4.21Å; K382-L386 WeakPolarHBondContact O-CG 3.18Å; K382-L386 PolarHBondContact O-N 3.11Å; K382-L409 HydrophobicContact CB-CD1 4.23Å; K382-L409 HydrophobicContact CD-CD1 4.03Å; K382-L409 HydrophobicContact CG-CD1 3.82Å
383A98.3Very high94.8Very high0 Ų024.6 Ų24.60%013%0.129CC..Hα-helixtrans-59.9-43179.100000112.8K379 R380 V381 I385 L386 E387 A406 L409 H410K379-A383 WeakPolarHBondContact O-CB 3.47Å; K379-A383 PolarHBondContact O-N 3Å; R380-A383 PolarHBondContact O-N 3.41Å; V381-A383 VanDerWaalsContact C-N 3.34Å; V381-A383 PolarHBondContact O-N 3.48Å; A383-I385 VanDerWaalsContact C-N 3.3Å; A383-I385 PolarHBondContact O-N 3.1Å; A383-L386 PolarHBondContact O-N 3.33Å; A383-E387 WeakPolarHBondContact O-CB 3.45Å; A383-E387 PolarHBondContact O-N 2.91Å; A383-A406 HydrophobicContact CB-CB 4.24Å; A383-L409 HydrophobicContact CB-CB 3.78Å; A383-L409 HydrophobicContact CB-CD1 4.33Å; A383-H410 WeakPolarHBondContact CB-CE1 3.44Å; A383-H410 WeakPolarHBondContact CB-NE2 3.13Å
384L96.7Very high94.4Very high6 Ų632.6 Ų32.63%0.03117%0.165CC..Hα-helixtrans-57.5-42.6173.9-78.2173.2000112.4Y341 R380 V381 K382 E387 E388 N434Y341-L384 HydrophobicContact CE1-CB 4.4Å; Y341-L384 HydrophobicContact CE1-CD1 4.39Å; Y341-L384 HydrophobicContact CE2-CB 4.28Å; R380-L384 WeakPolarHBondContact O-CG 3.24Å; R380-L384 PolarHBondContact O-N 3.24Å; V381-L384 WeakPolarHBondContact O-CB 3.48Å; V381-L384 PolarHBondContact O-N 3.42Å; K382-L384 PolarHBondContact O-N 2.99Å; L384-E387 PolarHBondContact O-N 3.27Å; L384-E388 PolarHBondContact O-N 2.68Å; L384-N434 WeakPolarHBondContact CD2-ND2 3.37Å
385I97.1Very high94.4Very high0 Ų034.8 Ų34.80%018%0.177CC..Hα-helixtrans-68.3-43.7179.4-66.5159.1000110.9Y341 F350 A353 L354 A357 V381 K382 A383 E387 E388 I389Y341-I385 HydrophobicContact CD2-CG1 3.59Å; Y341-I385 HydrophobicContact CE2-CG1 4.36Å; Y341-I385 HydrophobicContact CG-CG1 4.11Å; F350-I385 HydrophobicContact CB-CG2 3.66Å; F350-I385 HydrophobicContact CG-CG2 4.33Å; A353-I385 HydrophobicContact CB-CD1 3.78Å; A353-I385 HydrophobicContact CB-CG1 4.32Å; L354-I385 HydrophobicContact CB-CG2 3.94Å; L354-I385 HydrophobicContact CD1-CG2 4.15Å; A357-I385 HydrophobicContact CB-CD1 4.12Å; V381-I385 HydrophobicContact CG1-CD1 3.96Å; V381-I385 WeakPolarHBondContact O-CD1 3.38Å; V381-I385 WeakPolarHBondContact O-CG1 3.49Å; V381-I385 PolarHBondContact O-N 3.18Å; V381-I385 VanDerWaalsContact O-N 3.16Å; K382-I385 PolarHBondContact O-N 2.89Å; K382-I385 VanDerWaalsContact O-N 3.16Å; A383-I385 VanDerWaalsContact C-N 3.3Å; A383-I385 PolarHBondContact O-N 3.1Å; I385-E387 VanDerWaalsContact C-N 3.29Å; I385-E387 PolarHBondContact O-N 3.01Å; I385-E388 PolarHBondContact O-N 3.44Å; I385-I389 HydrophobicContact CG2-CD1 3.67Å; I385-I389 HydrophobicContact CG2-CG1 4.34Å; I385-I389 VanDerWaalsContact O-CG1 3.29Å; I385-I389 WeakPolarHBondContact O-CG1 3.4Å; I385-I389 PolarHBondContact O-N 3.42Å
386L97.5Very high94.3Very high10 Ų1041.1 Ų41.15%0.05221%0.205CC..Hα-helixtrans-63.2-36.3177.9-66.5177.8000112L354 K382 A383 I389 A390 L402 D405 A406 L409L354-L386 HydrophobicContact CD1-CD2 4.25Å; K382-L386 HydrophobicContact CG-CD1 4.06Å; K382-L386 HydrophobicContact CG-CG 4.21Å; K382-L386 WeakPolarHBondContact O-CG 3.18Å; K382-L386 PolarHBondContact O-N 3.11Å; A383-L386 PolarHBondContact O-N 3.33Å; L386-I389 PolarHBondContact O-N 3.45Å; L386-A390 VanDerWaalsContact O-CB 3.3Å; L386-A390 WeakPolarHBondContact O-CB 3.34Å; L386-A390 PolarHBondContact O-N 3.48Å; L386-L402 HydrophobicContact CD2-CD2 3.92Å; L386-D405 HydrophobicContact CD1-CB 3.99Å; L386-A406 HydrophobicContact CB-CB 4.14Å; L386-L409 HydrophobicContact CD1-CD1 3.81Å
387E95.4Very high94.3Very high3 Ų348.3 Ų48.31%0.01424%0.237CC..Hα-helixtrans-58.3-51.8173.8-175.9-170142.400111.1A383 L384 I385 I389 A390 I391 R437 L438A383-E387 WeakPolarHBondContact O-CB 3.45Å; A383-E387 PolarHBondContact O-N 2.91Å; L384-E387 PolarHBondContact O-N 3.27Å; I385-E387 VanDerWaalsContact C-N 3.29Å; I385-E387 PolarHBondContact O-N 3.01Å; E387-I389 PolarHBondContact O-N 3.11Å; E387-A390 WeakPolarHBondContact O-CB 3.43Å; E387-A390 PolarHBondContact O-N 3.02Å; E387-I391 HydrophobicContact CG-CD1 4.16Å; E387-I391 WeakPolarHBondContact O-CG1 3.48Å; E387-I391 PolarHBondContact O-N 3.42Å; E387-R437 IonicContact OE1-CZ 2.82Å; E387-R437 IonicContact OE1-NE 3.2Å; E387-R437 PolarHBondContact OE1-NE 2.79Å; E387-R437 IonicContact OE1-NH2 2.6Å; E387-R437 PolarHBondContact OE1-NH2 2.83Å; E387-R437 IonicContact OE2-NH2 2.7Å; E387-L438 HydrophobicContact CB-CD1 4.45Å; E387-L438 HydrophobicContact CG-CD1 4.21Å
388E94.1Very high94.4Very high18 Ų1848.4 Ų48.48%0.08424%0.236CC..Hα-helixtrans-64.1-42.7179.4-57.5-58.5153.100112.2Y341 Y345 F350 L384 I385 A390 I391 D392 R437Y341-E388 HydrophobicContact CE2-CG 3.61Å; Y341-E388 PolarHBondContact OH-OE1 3.21Å; Y341-E388 VanDerWaalsContact OH-OE1 3.09Å; Y345-E388 HydrophobicContact CE2-CG 4.24Å; Y345-E388 VanDerWaalsContact CE2-OE1 3.29Å; Y345-E388 WeakPolarHBondContact CE2-OE1 3.48Å; F350-E388 HydrophobicContact CD2-CB 3.98Å; F350-E388 HydrophobicContact CE2-CB 3.35Å; F350-E388 HydrophobicContact CE2-CG 4.07Å; F350-E388 HydrophobicContact CZ-CB 3.73Å; F350-E388 HydrophobicContact CZ-CG 3.9Å; L384-E388 PolarHBondContact O-N 2.68Å; I385-E388 PolarHBondContact O-N 3.44Å; E388-A390 PolarHBondContact O-N 3.33Å; E388-I391 PolarHBondContact O-N 3.18Å; E388-D392 PolarHBondContact O-N 3.36Å; E388-D392 VanDerWaalsContact O-N 3.17Å; E388-R437 IonicContact OE1-CZ 2.65Å; E388-R437 IonicContact OE1-NH2 3.49Å; E388-R437 PolarHBondContact OE1-NH2 3.35Å
389I94.2Very high94.4Very high51 Ų5150.2 Ų50.226%0.26225%0.245SC..Hα-helixtrans-61.1-36.1176.9-65.1168.9000110.7F350 L354 I385 L386 E387 C393 L402F350-I389 HydrophobicContact CB-CD1 4.22Å; F350-I389 HydrophobicContact CB-CG1 4.21Å; F350-I389 HydrophobicContact CD2-CG1 3.99Å; L354-I389 HydrophobicContact CD2-CD1 4.04Å; I385-I389 HydrophobicContact CG2-CD1 3.67Å; I385-I389 HydrophobicContact CG2-CG1 4.34Å; I385-I389 VanDerWaalsContact O-CG1 3.29Å; I385-I389 WeakPolarHBondContact O-CG1 3.4Å; I385-I389 PolarHBondContact O-N 3.42Å; L386-I389 PolarHBondContact O-N 3.45Å; E387-I389 PolarHBondContact O-N 3.11Å; I389-C393 PolarHBondContact O-N 3.37Å; I389-L402 HydrophobicContact CG2-CD1 3.9Å
390A94.5Very high94.3Very high0 Ų054 Ų540%026%0.263CS..Hα-helixtrans-67.5-43177.300000111.9L386 E387 E388 D392 C393 E399 L402 L403L386-A390 VanDerWaalsContact O-CB 3.3Å; L386-A390 WeakPolarHBondContact O-CB 3.34Å; L386-A390 PolarHBondContact O-N 3.48Å; E387-A390 WeakPolarHBondContact O-CB 3.43Å; E387-A390 PolarHBondContact O-N 3.02Å; E388-A390 PolarHBondContact O-N 3.33Å; A390-D392 VanDerWaalsContact C-N 3.28Å; A390-D392 PolarHBondContact O-N 2.95Å; A390-C393 WeakPolarHBondContact O-CB 3.35Å; A390-C393 PolarHBondContact O-N 2.84Å; A390-E399 HydrophobicContact CB-CG 4.43Å; A390-L402 HydrophobicContact CB-CB 3.76Å; A390-L402 HydrophobicContact CB-CD1 4.28Å; A390-L403 HydrophobicContact CB-CD2 3.76Å; A390-L403 HydrophobicContact CB-CG 3.79Å
391I89.9Confident94.3Very high86 Ų8659.6 Ų59.644%0.44128%0.284SS..Hα-helixtrans-61.6-37.6179.8-66.9164000111.3E387 E388 C393E387-I391 HydrophobicContact CG-CD1 4.16Å; E387-I391 WeakPolarHBondContact O-CG1 3.48Å; E387-I391 PolarHBondContact O-N 3.42Å; E388-I391 PolarHBondContact O-N 3.18Å; I391-C393 VanDerWaalsContact C-N 3.28Å; I391-C393 PolarHBondContact O-N 3.43Å
392D88.6Confident94.4Very high98 Ų9860.5 Ų60.552%0.52429%0.289SS..THydrogen-bonded Turntrans-81.6-4.9177.1-74.9-17.5000113.3E388 A390E388-D392 PolarHBondContact O-N 3.36Å; E388-D392 VanDerWaalsContact O-N 3.17Å; A390-D392 VanDerWaalsContact C-N 3.28Å; A390-D392 PolarHBondContact O-N 2.95Å
393C88.1Confident94.4Very high33 Ų3358.9 Ų58.922%0.22328%0.282CS..  trans-77.6128.5-176.8-163.80000112.1I389 A390 I391 N395 E399I389-C393 PolarHBondContact O-N 3.37Å; A390-C393 WeakPolarHBondContact O-CB 3.35Å; A390-C393 PolarHBondContact O-N 2.84Å; I391-C393 VanDerWaalsContact C-N 3.28Å; I391-C393 PolarHBondContact O-N 3.43Å; C393-N395 VanDerWaalsContact C-N 3.33Å; C393-E399 HydrophobicContact CB-CB 4.4Å
394H86.6Confident94.4Very high193 Ų19362.5 Ų62.589%0.89430%0.299SS*.SBendtrans-84.4-5.9176.1-57.2-37.3000114.1
395N94.8Very high94.4Very high80 Ų8065.5 Ų65.543%0.42832%0.315SS..  trans-105.9113.8179.2-179.1-41.1000110.2C393 E397 T398 E399C393-N395 VanDerWaalsContact C-N 3.33Å; N395-E397 VanDerWaalsContact C-N 3.35Å; N395-E397 PolarHBondContact O-N 3.29Å; N395-E397 WeakPolarHBondContact OD1-CB 3.47Å; N395-E397 PolarHBondContact OD1-N 3.39Å; N395-T398 PolarHBondContact O-N 3.2Å; N395-T398 VanDerWaalsContact O-N 3.11Å; N395-T398 PolarHBondContact OD1-N 3.06Å; N395-E399 PolarHBondContact O-N 3.49Å
396K92Very high94.5Very high134 Ų13465.5 Ų65.558%0.58332%0.315SS*.Hα-helixtrans-59.8-37.6-176.7-165.7-178.2-176.1-151.20114.3T398 E400K396-T398 VanDerWaalsContact C-N 3.32Å; K396-E400 WeakPolarHBondContact CE-OE1 3.39Å; K396-E400 HydrophobicContact CG-CG 4.5Å; K396-E400 IonicContact NZ-OE1 3.71Å; K396-E400 PolarHBondContact NZ-OE1 3Å; K396-E400 WeakPolarHBondContact O-CB 3.39Å; K396-E400 VanDerWaalsContact O-CG 3.3Å; K396-E400 WeakPolarHBondContact O-CG 3.18Å; K396-E400 PolarHBondContact O-N 3.49Å
397E94.8Very high94.6Very high155 Ų15566.1 Ų66.172%0.72432%0.318SS*.Hα-helixtrans-67.6-37.8178-176-177.317900111N395 R401N395-E397 VanDerWaalsContact C-N 3.35Å; N395-E397 PolarHBondContact O-N 3.29Å; N395-E397 WeakPolarHBondContact OD1-CB 3.47Å; N395-E397 PolarHBondContact OD1-N 3.39Å; E397-R401 WeakPolarHBondContact O-CB 3.27Å; E397-R401 PolarHBondContact O-N 2.97Å; E397-R401 VanDerWaalsContact O-N 3.1Å
398T94.8Very high94.7Very high41 Ų4170.1 Ų70.125%0.25234%0.339SS..Hα-helixtrans-71.3-43176.8-57.50000111.4N395 K396 R401 L402N395-T398 PolarHBondContact O-N 3.2Å; N395-T398 VanDerWaalsContact O-N 3.11Å; N395-T398 PolarHBondContact OD1-N 3.06Å; K396-T398 VanDerWaalsContact C-N 3.32Å; T398-R401 PolarHBondContact O-N 3.13Å; T398-L402 HydrophobicContact CG2-CD1 3.93Å; T398-L402 HydrophobicContact CG2-CG 4.34Å; T398-L402 WeakPolarHBondContact O-CB 3.32Å; T398-L402 VanDerWaalsContact O-CG 3.26Å; T398-L402 WeakPolarHBondContact O-CG 3.42Å; T398-L402 PolarHBondContact O-N 2.79Å
399E95.6Very high94.9Very high39 Ų3970.8 Ų70.818%0.18234%0.343CS..Hα-helixtrans-53.9-54.6171.8177.9-169.3169.200110.8A390 C393 N395 R401 L402 L403A390-E399 HydrophobicContact CB-CG 4.43Å; C393-E399 HydrophobicContact CB-CB 4.4Å; N395-E399 PolarHBondContact O-N 3.49Å; E399-R401 VanDerWaalsContact C-N 3.32Å; E399-R401 PolarHBondContact O-N 3.31Å; E399-L402 PolarHBondContact O-N 3.03Å; E399-L403 HydrophobicContact CG-CD1 4.03Å; E399-L403 WeakPolarHBondContact O-CG 3.33Å; E399-L403 PolarHBondContact O-N 3.3Å
400E95.6Very high95.1Very high109 Ų10968.3 Ų68.351%0.50933%0.331SS..Hα-helixtrans-58.7-42-179.4-76175.3-172.300112K396 Q404K396-E400 WeakPolarHBondContact CE-OE1 3.39Å; K396-E400 HydrophobicContact CG-CG 4.5Å; K396-E400 IonicContact NZ-OE1 3.71Å; K396-E400 PolarHBondContact NZ-OE1 3Å; K396-E400 WeakPolarHBondContact O-CB 3.39Å; K396-E400 VanDerWaalsContact O-CG 3.3Å; K396-E400 WeakPolarHBondContact O-CG 3.18Å; K396-E400 PolarHBondContact O-N 3.49Å; E400-Q404 WeakPolarHBondContact O-CB 3.39Å; E400-Q404 PolarHBondContact O-N 3.47Å
401R97.5Very high95.2Very high151 Ų15171.7 Ų71.757%0.5735%0.348SS*.Hα-helixtrans-64.1-48176.3-176.2-174.564.3172.3-0.6112.2E397 T398 E399 L403 Q404 D405E397-R401 WeakPolarHBondContact O-CB 3.27Å; E397-R401 PolarHBondContact O-N 2.97Å; E397-R401 VanDerWaalsContact O-N 3.1Å; T398-R401 PolarHBondContact O-N 3.13Å; E399-R401 VanDerWaalsContact C-N 3.32Å; E399-R401 PolarHBondContact O-N 3.31Å; R401-L403 PolarHBondContact O-N 2.86Å; R401-Q404 PolarHBondContact O-N 3.46Å; R401-D405 PolarHBondContact O-N 2.98Å
402L97.9Very high95.6Very high21 Ų2169.7 Ų69.711%0.1134%0.342CS..Hα-helixtrans-64.9-39.7-178.8-70.5172000111.9L386 I389 A390 T398 E399 Q404 D405 A406L386-L402 HydrophobicContact CD2-CD2 3.92Å; I389-L402 HydrophobicContact CG2-CD1 3.9Å; A390-L402 HydrophobicContact CB-CB 3.76Å; A390-L402 HydrophobicContact CB-CD1 4.28Å; T398-L402 HydrophobicContact CG2-CD1 3.93Å; T398-L402 HydrophobicContact CG2-CG 4.34Å; T398-L402 WeakPolarHBondContact O-CB 3.32Å; T398-L402 VanDerWaalsContact O-CG 3.26Å; T398-L402 WeakPolarHBondContact O-CG 3.42Å; T398-L402 PolarHBondContact O-N 2.79Å; E399-L402 PolarHBondContact O-N 3.03Å; L402-Q404 VanDerWaalsContact C-N 3.32Å; L402-D405 PolarHBondContact O-N 2.82Å; L402-A406 WeakPolarHBondContact O-CB 3.48Å; L402-A406 PolarHBondContact O-N 3.44Å
403L98.1Very high95.9Very high8 Ų865 Ų654%0.04232%0.317CS..Hα-helixtrans-64.9-36.5174.2-68.9176.7000111.8A390 E399 R401 A406 H407 L438 M442A390-L403 HydrophobicContact CB-CD2 3.76Å; A390-L403 HydrophobicContact CB-CG 3.79Å; E399-L403 HydrophobicContact CG-CD1 4.03Å; E399-L403 WeakPolarHBondContact O-CG 3.33Å; E399-L403 PolarHBondContact O-N 3.3Å; R401-L403 PolarHBondContact O-N 2.86Å; L403-A406 PolarHBondContact O-N 3.44Å; L403-H407 WeakPolarHBondContact O-CB 3.5Å; L403-H407 PolarHBondContact O-N 2.75Å; L403-L438 HydrophobicContact CD2-CD1 3.76Å; L403-M442 HydrophobicContact CB-CG 4.13Å; L403-M442 HydrophobicContact CD1-CG 4.2Å
404Q98.2Very high96.4Very high76 Ų7664.2 Ų64.236%0.35531%0.31SS..Hα-helixtrans-68.5-41.7174.5-170.956.853.600112E400 R401 L402 A406 H407 D408E400-Q404 WeakPolarHBondContact O-CB 3.39Å; E400-Q404 PolarHBondContact O-N 3.47Å; R401-Q404 PolarHBondContact O-N 3.46Å; L402-Q404 VanDerWaalsContact C-N 3.32Å; Q404-A406 VanDerWaalsContact C-N 3.32Å; Q404-A406 PolarHBondContact O-N 2.91Å; Q404-H407 PolarHBondContact NE2-ND1 3.01Å; Q404-H407 WeakPolarHBondContact O-CB 3.32Å; Q404-H407 PolarHBondContact O-N 3.48Å; Q404-H407 VanDerWaalsContact O-N 3.15Å; Q404-D408 PolarHBondContact NE2-OD1 2.92Å; Q404-D408 PolarHBondContact O-N 3.04Å
405D98.1Very high96.9Very high70 Ų7060.7 Ų60.737%0.37429%0.294SS..Hα-helixtrans-61-42.7174.4-70.6-15000111.1L386 R401 L402 H407 D408 L409L386-D405 HydrophobicContact CD1-CB 3.99Å; R401-D405 PolarHBondContact O-N 2.98Å; L402-D405 PolarHBondContact O-N 2.82Å; D405-H407 VanDerWaalsContact C-N 3.33Å; D405-H407 PolarHBondContact O-N 2.82Å; D405-D408 PolarHBondContact O-N 3.22Å; D405-L409 WeakPolarHBondContact O-CB 3.45Å; D405-L409 VanDerWaalsContact O-CG 3.26Å; D405-L409 WeakPolarHBondContact O-CG 3.48Å; D405-L409 PolarHBondContact O-N 3.32Å; D405-L409 VanDerWaalsContact O-N 3.12Å
406A98.4Very high96.9Very high0 Ų057.6 Ų57.60%028%0.278CS..Hα-helixtrans-62.9-38.8174.300000112.1A383 L386 L402 L403 Q404 L409 H410 L438A383-A406 HydrophobicContact CB-CB 4.24Å; L386-A406 HydrophobicContact CB-CB 4.14Å; L402-A406 WeakPolarHBondContact O-CB 3.48Å; L402-A406 PolarHBondContact O-N 3.44Å; L403-A406 PolarHBondContact O-N 3.44Å; Q404-A406 VanDerWaalsContact C-N 3.32Å; Q404-A406 PolarHBondContact O-N 2.91Å; A406-L409 PolarHBondContact O-N 3.11Å; A406-H410 WeakPolarHBondContact O-CB 3.19Å; A406-H410 PolarHBondContact O-N 3.41Å; A406-L438 HydrophobicContact CB-CD1 3.85Å; A406-L438 HydrophobicContact CB-CD2 4.35Å
407H98.5Very high97.1Very high23 Ų2351.3 Ų51.311%0.10625%0.25CS..Hα-helixtrans-59.7-51.1176.5-175.3-108.2000111.9L403 Q404 D405 L409 H410 L411 L438 Y439L403-H407 WeakPolarHBondContact O-CB 3.5Å; L403-H407 PolarHBondContact O-N 2.75Å; Q404-H407 PolarHBondContact NE2-ND1 3.01Å; Q404-H407 WeakPolarHBondContact O-CB 3.32Å; Q404-H407 PolarHBondContact O-N 3.48Å; Q404-H407 VanDerWaalsContact O-N 3.15Å; D405-H407 VanDerWaalsContact C-N 3.33Å; D405-H407 PolarHBondContact O-N 2.82Å; H407-L409 VanDerWaalsContact C-N 3.31Å; H407-L409 PolarHBondContact O-N 3.43Å; H407-H410 PolarHBondContact O-N 2.98Å; H407-L411 WeakPolarHBondContact CE1-CD1 3.29Å; H407-L411 WeakPolarHBondContact O-CG 3.42Å; H407-L411 PolarHBondContact O-N 3.33Å; H407-L438 HydrophobicContact CB-CD2 3.66Å; H407-Y439 AromaticContact CD2-CE1 3.49Å; H407-Y439 VanDerWaalsContact CD2-CE1 3.49Å; H407-Y439 WeakPolarHBondContact CD2-CE1 3.5Å; H407-Y439 AromaticContact NE2-CE1 3.39Å; H407-Y439 WeakPolarHBondContact NE2-CE1 3.38Å; H407-Y439 AromaticContact NE2-CZ 3.64Å; H407-Y439 PolarHBondContact NE2-OH 3.36Å; H407-Y439 VanDerWaalsContact NE2-OH 3.07Å
408D98.2Very high97.2Very high87 Ų8747.1 Ų47.147%0.46523%0.23SC..Hα-helixtrans-63-40.6-179.2-68.3-11.9000111.2Q404 D405 S412Q404-D408 PolarHBondContact NE2-OD1 2.92Å; Q404-D408 PolarHBondContact O-N 3.04Å; D405-D408 PolarHBondContact O-N 3.22Å; D408-S412 VanDerWaalsContact O-CB 3.27Å; D408-S412 WeakPolarHBondContact O-CB 3.5Å; D408-S412 PolarHBondContact O-N 3.43Å
409L98.1Very high97.2Very high31 Ų3152 Ų5216%0.16225%0.248CC..Hα-helixtrans-65-44.2175.7-72.9170.6000112.3K379 K382 A383 L386 D405 A406 H407 S412 S413K379-L409 HydrophobicContact CB-CD2 3.98Å; K379-L409 HydrophobicContact CD-CD2 4.33Å; K379-L409 HydrophobicContact CG-CD2 3.82Å; K382-L409 HydrophobicContact CB-CD1 4.23Å; K382-L409 HydrophobicContact CD-CD1 4.03Å; K382-L409 HydrophobicContact CG-CD1 3.82Å; A383-L409 HydrophobicContact CB-CB 3.78Å; A383-L409 HydrophobicContact CB-CD1 4.33Å; L386-L409 HydrophobicContact CD1-CD1 3.81Å; D405-L409 WeakPolarHBondContact O-CB 3.45Å; D405-L409 VanDerWaalsContact O-CG 3.26Å; D405-L409 WeakPolarHBondContact O-CG 3.48Å; D405-L409 PolarHBondContact O-N 3.32Å; D405-L409 VanDerWaalsContact O-N 3.12Å; A406-L409 PolarHBondContact O-N 3.11Å; H407-L409 VanDerWaalsContact C-N 3.31Å; H407-L409 PolarHBondContact O-N 3.43Å; L409-S412 PolarHBondContact O-N 2.92Å; L409-S413 WeakPolarHBondContact O-CB 3.39Å; L409-S413 PolarHBondContact O-N 2.61Å; L409-S413 PolarHBondContact O-OG 3.26Å
410H98.3Very high97.1Very high0 Ų052.2 Ų52.20%026%0.256CS..Hα-helixtrans-65.4-42.7177.1-84-36.1000112.3A383 A406 H407 S413 L414 L435A383-H410 WeakPolarHBondContact CB-CE1 3.44Å; A383-H410 WeakPolarHBondContact CB-NE2 3.13Å; A406-H410 WeakPolarHBondContact O-CB 3.19Å; A406-H410 PolarHBondContact O-N 3.41Å; H407-H410 PolarHBondContact O-N 2.98Å; H410-S413 PolarHBondContact O-N 3.44Å; H410-L414 WeakPolarHBondContact O-CB 3.25Å; H410-L414 PolarHBondContact O-N 2.84Å; H410-L435 HydrophobicContact CB-CD2 3.59Å; H410-L435 HydrophobicContact CB-CG 4.01Å
411L98Very high97Very high71 Ų7149 Ų4937%0.37224%0.241SC..Hα-helixtrans-63.6-44.5175.4-74.9-174.9000112.1H407 S413 L414 Q415 L435H407-L411 WeakPolarHBondContact CE1-CD1 3.29Å; H407-L411 WeakPolarHBondContact O-CG 3.42Å; H407-L411 PolarHBondContact O-N 3.33Å; L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 3.41Å; L411-L414 PolarHBondContact O-N 3.41Å; L411-Q415 WeakPolarHBondContact O-CB 3.42Å; L411-Q415 PolarHBondContact O-N 3.4Å; L411-L435 HydrophobicContact CD2-CD1 4.04Å; L411-L435 HydrophobicContact CD2-CD2 4.19Å; L411-L435 HydrophobicContact CG-CD2 4.45Å
412S96.7Very high97Very high44 Ų4443.3 Ų43.331%0.30823%0.228SC..Hα-helixtrans-58.3-46175.1-176.10000111K379 D408 L409 Q415 L416K379-S412 PolarHBondContact NZ-OG 3.29Å; D408-S412 VanDerWaalsContact O-CB 3.27Å; D408-S412 WeakPolarHBondContact O-CB 3.5Å; D408-S412 PolarHBondContact O-N 3.43Å; L409-S412 PolarHBondContact O-N 2.92Å; S412-Q415 PolarHBondContact O-N 2.92Å; S412-L416 WeakPolarHBondContact O-CG 3.44Å; S412-L416 PolarHBondContact O-N 2.77Å; S412-L416 VanDerWaalsContact O-N 3.11Å
413S96.5Very high96.8Very high0 Ų045.5 Ų45.50%024%0.238CC..Hα-helixtrans-64.6-43.5179.4-53.50000112.5A376 K379 R380 L409 H410 L411 Q415 L416 A417 H431A376-S413 WeakPolarHBondContact O-CB 3.32Å; A376-S413 PolarHBondContact O-OG 3.48Å; A376-S413 VanDerWaalsContact O-OG 3.12Å; K379-S413 WeakPolarHBondContact CB-OG 3Å; R380-S413 PolarHBondContact N-OG 2.93Å; L409-S413 WeakPolarHBondContact O-CB 3.39Å; L409-S413 PolarHBondContact O-N 2.61Å; L409-S413 PolarHBondContact O-OG 3.26Å; H410-S413 PolarHBondContact O-N 3.44Å; L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 3.41Å; S413-Q415 VanDerWaalsContact C-N 3.33Å; S413-Q415 PolarHBondContact O-N 3.24Å; S413-L416 PolarHBondContact O-N 3.48Å; S413-A417 PolarHBondContact O-N 3.43Å; S413-H431 VanDerWaalsContact CB-CE1 3.45Å; S413-H431 WeakPolarHBondContact CB-CE1 3.49Å
414L97.4Very high96.8Very high15 Ų1549.2 Ų49.28%0.07925%0.254CS..Hα-helixtrans-59.5-44.1175.3174.563000111.2H410 L411 L416 A417 K418 T428 H431 Y432 L435H410-L414 WeakPolarHBondContact O-CB 3.25Å; H410-L414 PolarHBondContact O-N 2.84Å; L411-L414 PolarHBondContact O-N 3.41Å; L414-L416 VanDerWaalsContact C-N 3.34Å; L414-L416 PolarHBondContact O-N 3.34Å; L414-A417 PolarHBondContact O-N 3.2Å; L414-K418 HydrophobicContact CD1-CD 3.95Å; L414-K418 HydrophobicContact CD1-CG 4.05Å; L414-K418 HydrophobicContact CG-CD 3.93Å; L414-K418 HydrophobicContact CG-CG 4.4Å; L414-K418 WeakPolarHBondContact O-CB 3.47Å; L414-K418 WeakPolarHBondContact O-CG 3.48Å; L414-K418 PolarHBondContact O-N 2.93Å; L414-T428 HydrophobicContact CD1-CG2 3.83Å; L414-H431 HydrophobicContact CB-CB 3.98Å; L414-H431 HydrophobicContact CD1-CB 3.79Å; L414-H431 HydrophobicContact CG-CB 4.46Å; L414-Y432 HydrophobicContact CD1-CD1 4.26Å; L414-Y432 HydrophobicContact CD1-CE1 3.92Å; L414-Y432 HydrophobicContact CD1-CE2 4.28Å; L414-Y432 HydrophobicContact CD2-CD1 4Å; L414-Y432 HydrophobicContact CD2-CE1 3.51Å; L414-Y432 HydrophobicContact CG-CE1 4.36Å; L414-L435 HydrophobicContact CD2-CD1 3.64Å
415Q97Very high96.7Very high120 Ų12046.1 Ų46.156%0.56124%0.24SC*.Hα-helixtrans-64.3-39.7-179.9-176.45920.600112L411 S412 S413 K419L411-Q415 WeakPolarHBondContact O-CB 3.42Å; L411-Q415 PolarHBondContact O-N 3.4Å; S412-Q415 PolarHBondContact O-N 2.92Å; S413-Q415 VanDerWaalsContact C-N 3.33Å; S413-Q415 PolarHBondContact O-N 3.24Å; Q415-K419 WeakPolarHBondContact O-CB 3.25Å; Q415-K419 PolarHBondContact O-N 3.01Å
416L96.1Very high96.6Very high15 Ų1542.9 Ų42.98%0.07922%0.222CC..Hα-helixtrans-62.8-47.2173.9-69.2175.4000111.6D371 L373 L375 A376 S412 S413 L414 K418 K419 A420D371-L416 HydrophobicContact CB-CD2 4.24Å; D371-L416 WeakPolarHBondContact O-CD2 3.48Å; L373-L416 HydrophobicContact CD1-CB 4.18Å; L375-L416 HydrophobicContact CB-CD1 4.15Å; A376-L416 HydrophobicContact CB-CB 3.84Å; A376-L416 HydrophobicContact CB-CD1 4.03Å; S412-L416 WeakPolarHBondContact O-CG 3.44Å; S412-L416 PolarHBondContact O-N 2.77Å; S412-L416 VanDerWaalsContact O-N 3.11Å; S413-L416 PolarHBondContact O-N 3.48Å; L414-L416 VanDerWaalsContact C-N 3.34Å; L414-L416 PolarHBondContact O-N 3.34Å; L416-K418 PolarHBondContact O-N 3.38Å; L416-K419 PolarHBondContact O-N 3.49Å; L416-A420 WeakPolarHBondContact O-CB 3.49Å; L416-A420 PolarHBondContact O-N 2.96Å
417A96.1Very high96.5Very high1 Ų145.2 Ų45.21%0.00823%0.234CC..Hα-helixtrans-61.4-44.3177.300000112S413 L414 K419 A420 F421 H431S413-A417 PolarHBondContact O-N 3.43Å; L414-A417 PolarHBondContact O-N 3.2Å; A417-K419 PolarHBondContact O-N 2.88Å; A417-A420 PolarHBondContact O-N 3.4Å; A417-F421 HydrophobicContact CB-CD2 4.26Å; A417-F421 WeakPolarHBondContact O-CB 3.49Å; A417-F421 WeakPolarHBondContact O-CD2 3.45Å; A417-F421 PolarHBondContact O-N 2.93Å; A417-H431 VanDerWaalsContact CB-CD2 3.48Å; A417-H431 WeakPolarHBondContact CB-CD2 3.48Å
418K96Very high96.4Very high67 Ų6744.1 Ų44.129%0.29123%0.228SC..Hα-helixtrans-60.8-41.9175.7-76.4176.158.9136.40112.5L414 L416 A420 G422 E423 T428L414-K418 HydrophobicContact CD1-CD 3.95Å; L414-K418 HydrophobicContact CD1-CG 4.05Å; L414-K418 HydrophobicContact CG-CD 3.93Å; L414-K418 HydrophobicContact CG-CG 4.4Å; L414-K418 WeakPolarHBondContact O-CB 3.47Å; L414-K418 WeakPolarHBondContact O-CG 3.48Å; L414-K418 PolarHBondContact O-N 2.93Å; L416-K418 PolarHBondContact O-N 3.38Å; K418-A420 VanDerWaalsContact C-N 3.33Å; K418-G422 WeakPolarHBondContact O-CA 3.47Å; K418-G422 PolarHBondContact O-N 3.02Å; K418-E423 VanDerWaalsContact CE-OE2 3.25Å; K418-E423 WeakPolarHBondContact CE-OE2 3.29Å; K418-E423 IonicContact NZ-OE2 3.8Å; K418-E423 PolarHBondContact NZ-OE2 3.47Å; K418-T428 HydrophobicContact CG-CG2 3.66Å
419K94.5Very high96.4Very high145 Ų14540 Ų4063%0.6321%0.206SC*.Hα-helixtrans-63.7-38.8176.7-177.9-179.8175.2-177.70111.7D371 Q415 L416 A417D371-K419 IonicContact OD2-NZ 2.96Å; D371-K419 PolarHBondContact OD2-NZ 3.16Å; Q415-K419 WeakPolarHBondContact O-CB 3.25Å; Q415-K419 PolarHBondContact O-N 3.01Å; L416-K419 PolarHBondContact O-N 3.49Å; A417-K419 PolarHBondContact O-N 2.88Å
420A93.4Very high96.3Very high43 Ų4341 Ų4136%0.35521%0.21SC..Hα-helixtrans-82.8-40.5-176.100000114.1L373 L416 A417 K418L373-A420 HydrophobicContact CD1-CB 3.67Å; L373-A420 HydrophobicContact CD2-CB 3.43Å; L373-A420 VanDerWaalsContact CD2-CB 3.43Å; L373-A420 HydrophobicContact CG-CB 4.1Å; L416-A420 WeakPolarHBondContact O-CB 3.49Å; L416-A420 PolarHBondContact O-N 2.96Å; A417-A420 PolarHBondContact O-N 3.4Å; K418-A420 VanDerWaalsContact C-N 3.33Å
421F94.8Very high96.3Very high42 Ų4241.4 Ų41.418%0.18421%0.211CC..Hα-helixtrans-117.3-15.5-169-53.5-64.3000114.1Y179 A218 L373 A417 N425 Q427Y179-F421 HydrophobicContact CD2-CD1 4.44Å; Y179-F421 AromaticContact CD2-CE1 3.7Å; Y179-F421 HydrophobicContact CD2-CE1 3.7Å; Y179-F421 HydrophobicContact CD2-CZ 4.39Å; Y179-F421 HydrophobicContact CE2-CD1 4.49Å; Y179-F421 AromaticContact CE2-CE1 3.41Å; Y179-F421 HydrophobicContact CE2-CE1 3.41Å; Y179-F421 VanDerWaalsContact CE2-CE1 3.41Å; Y179-F421 AromaticContact CE2-CZ 3.69Å; Y179-F421 HydrophobicContact CE2-CZ 3.69Å; A218-F421 VanDerWaalsContact O-CE1 3.31Å; A218-F421 WeakPolarHBondContact O-CE1 3.49Å; L373-F421 HydrophobicContact CD1-CE2 4.23Å; L373-F421 HydrophobicContact CD2-CE1 4.45Å; L373-F421 HydrophobicContact CD2-CE2 4.01Å; L373-F421 HydrophobicContact CD2-CZ 3.75Å; A417-F421 HydrophobicContact CB-CD2 4.26Å; A417-F421 WeakPolarHBondContact O-CB 3.49Å; A417-F421 WeakPolarHBondContact O-CD2 3.45Å; A417-F421 PolarHBondContact O-N 2.93Å; F421-N425 HydrophobicContact CB-CB 3.67Å; F421-N425 VanDerWaalsContact CB-CG 3.46Å; F421-Q427 HydrophobicContact CD2-CB 4.08Å; F421-Q427 HydrophobicContact CE2-CB 4.03Å; F421-Q427 HydrophobicContact CE2-CG 4.18Å
422G95.8Very high96.3Very high30 Ų3038.4 Ų38.431%0.30920%0.195SC..  trans85.7179.8-172.100000113.7K418 T428K418-G422 WeakPolarHBondContact O-CA 3.47Å; K418-G422 PolarHBondContact O-N 3.02Å; G422-T428 PolarHBondContact O-OG1 3.29Å
423E95.6Very high96.4Very high67 Ų6736.6 Ų36.631%0.31318%0.183SC..SBendtrans-67.6-40.9-178.6-172.867.4-16400112K418 N425 Y432 K454K418-E423 VanDerWaalsContact CE-OE2 3.25Å; K418-E423 WeakPolarHBondContact CE-OE2 3.29Å; K418-E423 IonicContact NZ-OE2 3.8Å; K418-E423 PolarHBondContact NZ-OE2 3.47Å; E423-N425 PolarHBondContact O-N 3.2Å; E423-Y432 WeakPolarHBondContact OE1-CE2 3.49Å; E423-Y432 PolarHBondContact OE1-OH 3.38Å; E423-Y432 PolarHBondContact OE2-OH 3.18Å; E423-Y432 VanDerWaalsContact OE2-OH 3.08Å; E423-K454 WeakPolarHBondContact OE1-CE 3.15Å; E423-K454 IonicContact OE1-NZ 2.66Å; E423-K454 PolarHBondContact OE1-NZ 2.82Å
424F96.5Very high96.5Very high87 Ų8737.6 Ų37.638%0.38219%0.189SC..SBendtrans-97.469.5-171.3-160.9-103.2000110.9I458 Q461 L462F424-I458 HydrophobicContact CD2-CB 4.44Å; F424-I458 HydrophobicContact CD2-CG1 4.1Å; F424-I458 HydrophobicContact CD2-CG2 3.99Å; F424-I458 HydrophobicContact CE2-CB 4.22Å; F424-I458 HydrophobicContact CE2-CG1 4.17Å; F424-I458 HydrophobicContact CE2-CG2 3.97Å; F424-Q461 HydrophobicContact CE1-CG 4.18Å; F424-Q461 HydrophobicContact CE2-CB 4.12Å; F424-Q461 HydrophobicContact CE2-CG 4.1Å; F424-Q461 HydrophobicContact CZ-CB 3.59Å; F424-Q461 HydrophobicContact CZ-CG 3.36Å; F424-Q461 VanDerWaalsContact CZ-OE1 3.25Å; F424-L462 HydrophobicContact CD1-CD1 4.33Å; F424-L462 HydrophobicContact CD1-CD2 3.7Å; F424-L462 HydrophobicContact CD1-CG 4.06Å; F424-L462 HydrophobicContact CE1-CD1 4.15Å; F424-L462 HydrophobicContact CE1-CD2 3.19Å; F424-L462 HydrophobicContact CE1-CG 3.43Å; F424-L462 VanDerWaalsContact CE1-CG 3.43Å; F424-L462 HydrophobicContact CZ-CD1 4.35Å; F424-L462 HydrophobicContact CZ-CD2 3.93Å; F424-L462 HydrophobicContact CZ-CG 3.62Å
425N96.8Very high96.5Very high10 Ų1037 Ų375%0.05319%0.186CC..SBendtrans-143.4148.6-179.4-172.8-88.6000111.5K219 F421 E423 Q427 T428 A429K219-N425 PolarHBondContact O-ND2 3.01Å; F421-N425 HydrophobicContact CB-CB 3.67Å; F421-N425 VanDerWaalsContact CB-CG 3.46Å; E423-N425 PolarHBondContact O-N 3.2Å; N425-Q427 PolarHBondContact O-N 3.42Å; N425-Q427 WeakPolarHBondContact OD1-CB 3.37Å; N425-Q427 PolarHBondContact OD1-N 3.22Å; N425-T428 PolarHBondContact O-N 2.88Å; N425-A429 PolarHBondContact O-N 2.88Å
426V96.4Very high96.6Very high2 Ų231.3 Ų31.31%0.01216%0.159CC..Hα-helixtrans-60.1-42.2-179.9-179.70000112.1Y222 A429 K430 L462 L463Y222-V426 HydrophobicContact CE2-CB 4.47Å; Y222-V426 HydrophobicContact CE2-CG1 4.35Å; Y222-V426 HydrophobicContact CE2-CG2 4.18Å; V426-A429 PolarHBondContact O-N 2.87Å; V426-K430 WeakPolarHBondContact O-CG 3.34Å; V426-K430 PolarHBondContact O-N 3.34Å; V426-L462 HydrophobicContact CG2-CB 4.33Å; V426-L462 HydrophobicContact CG2-CD1 3.92Å; V426-L463 HydrophobicContact CG1-CD1 4.15Å; V426-L463 HydrophobicContact CG2-CD1 3.98Å; V426-L463 HydrophobicContact CG2-CD2 3.96Å; V426-L463 HydrophobicContact CG2-CG 4.03Å
427Q95.2Very high96.6Very high50 Ų5031.9 Ų31.923%0.23416%0.16CC..Hα-helixtrans-66.3-41.5179.1-56.3-54.9-34.500111.3S220 Y222 F421 N425 A429 K430 H431S220-Q427 PolarHBondContact OG-NE2 2.89Å; Y222-Q427 PolarHBondContact OH-NE2 3.45Å; F421-Q427 HydrophobicContact CD2-CB 4.08Å; F421-Q427 HydrophobicContact CE2-CB 4.03Å; F421-Q427 HydrophobicContact CE2-CG 4.18Å; N425-Q427 PolarHBondContact O-N 3.42Å; N425-Q427 WeakPolarHBondContact OD1-CB 3.37Å; N425-Q427 PolarHBondContact OD1-N 3.22Å; Q427-A429 VanDerWaalsContact C-N 3.33Å; Q427-A429 PolarHBondContact O-N 2.99Å; Q427-K430 WeakPolarHBondContact O-CB 3.07Å; Q427-K430 PolarHBondContact O-N 3.48Å; Q427-H431 PolarHBondContact O-CD2 3.46Å; Q427-H431 PolarHBondContact O-N 3.04Å
428T97.6Very high96.7Very high0 Ų031.9 Ų31.90%016%0.16CC..Hα-helixtrans-60-43.5173.3-56.30000111.2L414 K418 G422 N425 K430 H431 Y432L414-T428 HydrophobicContact CD1-CG2 3.83Å; K418-T428 HydrophobicContact CG-CG2 3.66Å; G422-T428 PolarHBondContact O-OG1 3.29Å; N425-T428 PolarHBondContact O-N 2.88Å; T428-K430 VanDerWaalsContact C-N 3.34Å; T428-K430 PolarHBondContact O-N 3.46Å; T428-H431 PolarHBondContact O-N 3.45Å; T428-Y432 HydrophobicContact CG2-CD2 4.36Å; T428-Y432 HydrophobicContact CG2-CE2 3.8Å; T428-Y432 PolarHBondContact O-N 3.14Å
429A98Very high96.8Very high0 Ų030.3 Ų30.30%015%0.152CC..Hα-helixtrans-64.4-34.517700000113.4N425 V426 Q427 H431 Y432 G433 A455 I458 K459N425-A429 PolarHBondContact O-N 2.88Å; V426-A429 PolarHBondContact O-N 2.87Å; Q427-A429 VanDerWaalsContact C-N 3.33Å; Q427-A429 PolarHBondContact O-N 2.99Å; A429-H431 VanDerWaalsContact C-N 3.34Å; A429-H431 PolarHBondContact O-N 3.05Å; A429-Y432 PolarHBondContact O-N 3.07Å; A429-G433 PolarHBondContact O-N 2.84Å; A429-A455 WeakPolarHBondContact O-CB 3.39Å; A429-I458 HydrophobicContact CB-CB 3.98Å; A429-I458 HydrophobicContact CB-CG2 3.79Å; A429-K459 HydrophobicContact CB-CG 3.88Å
430K96.8Very high97Very high53 Ų5324.7 Ų24.723%0.2313%0.128CC..Hα-helixtrans-58-47.1172.6-73.4-177.9-179.9-154.20111.2V426 Q427 T428 Y432 G433 N434 E469V426-K430 WeakPolarHBondContact O-CG 3.34Å; V426-K430 PolarHBondContact O-N 3.34Å; Q427-K430 WeakPolarHBondContact O-CB 3.07Å; Q427-K430 PolarHBondContact O-N 3.48Å; T428-K430 VanDerWaalsContact C-N 3.34Å; T428-K430 PolarHBondContact O-N 3.46Å; K430-Y432 VanDerWaalsContact C-N 3.32Å; K430-Y432 PolarHBondContact O-N 2.74Å; K430-G433 PolarHBondContact O-N 3.37Å; K430-G433 VanDerWaalsContact O-N 3.1Å; K430-N434 PolarHBondContact O-N 3.16Å; K430-N434 PolarHBondContact O-OD1 3.41Å; K430-E469 WeakPolarHBondContact CE-OE1 3.22Å; K430-E469 VanDerWaalsContact CE-OE2 3.23Å; K430-E469 WeakPolarHBondContact CE-OE2 3.43Å; K430-E469 IonicContact NZ-OE1 2.67Å; K430-E469 PolarHBondContact NZ-OE1 3.21Å; K430-E469 IonicContact NZ-OE2 2.85Å
431H97.6Very high97.1Very high8 Ų823.9 Ų23.94%0.03712%0.12CC..Hα-helixtrans-62-36.8177.8-66.7-67.9000113.1S413 L414 A417 Q427 T428 A429 N434 L435S413-H431 VanDerWaalsContact CB-CE1 3.45Å; S413-H431 WeakPolarHBondContact CB-CE1 3.49Å; L414-H431 HydrophobicContact CB-CB 3.98Å; L414-H431 HydrophobicContact CD1-CB 3.79Å; L414-H431 HydrophobicContact CG-CB 4.46Å; A417-H431 VanDerWaalsContact CB-CD2 3.48Å; A417-H431 WeakPolarHBondContact CB-CD2 3.48Å; Q427-H431 PolarHBondContact O-CD2 3.46Å; Q427-H431 PolarHBondContact O-N 3.04Å; T428-H431 PolarHBondContact O-N 3.45Å; A429-H431 VanDerWaalsContact C-N 3.34Å; A429-H431 PolarHBondContact O-N 3.05Å; H431-N434 PolarHBondContact O-N 3.38Å; H431-L435 PolarHBondContact O-N 3.49Å
432Y98.6Very high97.3Very high8 Ų823.8 Ų23.83%0.03112%0.12CC..Hα-helixtrans-61.9-45.6171.2-72-51.4000111.9L414 E423 T428 A429 K430 N434 L435 G436 M451 K454 I458L414-Y432 HydrophobicContact CD1-CD1 4.26Å; L414-Y432 HydrophobicContact CD1-CE1 3.92Å; L414-Y432 HydrophobicContact CD1-CE2 4.28Å; L414-Y432 HydrophobicContact CD2-CD1 4Å; L414-Y432 HydrophobicContact CD2-CE1 3.51Å; L414-Y432 HydrophobicContact CG-CE1 4.36Å; E423-Y432 WeakPolarHBondContact OE1-CE2 3.49Å; E423-Y432 PolarHBondContact OE1-OH 3.38Å; E423-Y432 PolarHBondContact OE2-OH 3.18Å; E423-Y432 VanDerWaalsContact OE2-OH 3.08Å; T428-Y432 HydrophobicContact CG2-CD2 4.36Å; T428-Y432 HydrophobicContact CG2-CE2 3.8Å; T428-Y432 PolarHBondContact O-N 3.14Å; A429-Y432 PolarHBondContact O-N 3.07Å; K430-Y432 VanDerWaalsContact C-N 3.32Å; K430-Y432 PolarHBondContact O-N 2.74Å; Y432-N434 VanDerWaalsContact C-N 3.3Å; Y432-N434 PolarHBondContact O-N 2.88Å; Y432-L435 PolarHBondContact O-N 3.45Å; Y432-G436 PolarHBondContact O-N 3.22Å; Y432-M451 HydrophobicContact CD1-SD 3.64Å; Y432-M451 HydrophobicContact CE1-SD 4.2Å; Y432-M451 WeakPolarHBondContact O-CB 3.3Å; Y432-K454 HydrophobicContact CD1-CD 4.32Å; Y432-K454 HydrophobicContact CD2-CD 4.16Å; Y432-K454 HydrophobicContact CD2-CG 4.28Å; Y432-K454 HydrophobicContact CE1-CD 4.2Å; Y432-K454 HydrophobicContact CE2-CD 4.03Å; Y432-K454 HydrophobicContact CE2-CG 4.47Å; Y432-K454 HydrophobicContact CG-CD 4.33Å; Y432-K454 VanDerWaalsContact CZ-NZ 3.29Å; Y432-K454 PolarHBondContact OH-NZ 3.17Å; Y432-I458 HydrophobicContact CD2-CD1 4.15Å; Y432-I458 HydrophobicContact CE2-CD1 4.17Å
433G97.9Very high97.3Very high6 Ų630.7 Ų30.76%0.06214%0.137CC..Hα-helixtrans-60-38.7176.200000113.3A429 K430 G436 R437 H452A429-G433 PolarHBondContact O-N 2.84Å; K430-G433 PolarHBondContact O-N 3.37Å; K430-G433 VanDerWaalsContact O-N 3.1Å; G433-G436 PolarHBondContact O-N 3.44Å; G433-R437 PolarHBondContact O-N 3.33Å; G433-R437 VanDerWaalsContact O-N 3.15Å; G433-H452 PolarHBondContact O-CE1 3.37Å
434N97.7Very high97.4Very high21 Ų2131 Ų3111%0.11214%0.138CC..Hα-helixtrans-67.7-40.8174.6-69119000112.6L384 K430 H431 Y432 G436 R437 L438L384-N434 WeakPolarHBondContact CD2-ND2 3.37Å; K430-N434 PolarHBondContact O-N 3.16Å; K430-N434 PolarHBondContact O-OD1 3.41Å; H431-N434 PolarHBondContact O-N 3.38Å; Y432-N434 VanDerWaalsContact C-N 3.3Å; Y432-N434 PolarHBondContact O-N 2.88Å; N434-G436 VanDerWaalsContact C-N 3.29Å; N434-G436 PolarHBondContact O-N 3.16Å; N434-R437 WeakPolarHBondContact O-CB 3.48Å; N434-R437 PolarHBondContact O-N 3.21Å; N434-L438 PolarHBondContact O-N 2.91Å
435L98.3Very high97.5Very high2 Ų229.7 Ų29.71%0.0113%0.132CC..Hα-helixtrans-63.3-36.3172.5-79.7167.8000112.2H410 L411 L414 H431 Y432 L438 Y439 M451H410-L435 HydrophobicContact CB-CD2 3.59Å; H410-L435 HydrophobicContact CB-CG 4.01Å; L411-L435 HydrophobicContact CD2-CD1 4.04Å; L411-L435 HydrophobicContact CD2-CD2 4.19Å; L411-L435 HydrophobicContact CG-CD2 4.45Å; L414-L435 HydrophobicContact CD2-CD1 3.64Å; H431-L435 PolarHBondContact O-N 3.49Å; Y432-L435 PolarHBondContact O-N 3.45Å; L435-L438 PolarHBondContact O-N 3.15Å; L435-Y439 HydrophobicContact CB-CE2 4.46Å; L435-Y439 WeakPolarHBondContact O-CB 3.43Å; L435-Y439 WeakPolarHBondContact O-CD2 3.35Å; L435-Y439 VanDerWaalsContact O-CG 3.32Å; L435-Y439 PolarHBondContact O-N 3.19Å; L435-M451 HydrophobicContact CB-CG 4.24Å
436G98.2Very high97.6Very high0 Ų036.3 Ų36.30%016%0.16CC..Hα-helixtrans-58-50.1174.200000111.7Y432 G433 N434 L438 Y439 Q440 A448 H452Y432-G436 PolarHBondContact O-N 3.22Å; G433-G436 PolarHBondContact O-N 3.44Å; N434-G436 VanDerWaalsContact C-N 3.29Å; N434-G436 PolarHBondContact O-N 3.16Å; G436-L438 PolarHBondContact O-N 3.08Å; G436-Y439 PolarHBondContact O-N 3.06Å; G436-Q440 PolarHBondContact O-N 3.19Å; G436-A448 VanDerWaalsContact O-CB 3.22Å; G436-A448 WeakPolarHBondContact O-CB 3.42Å; G436-H452 VanDerWaalsContact C-NE2 3.26Å
437R97.4Very high97.7Very high28 Ų2840.1 Ų40.111%0.10618%0.178CC..Hα-helixtrans-57.8-49174-79.5-171.347.1-177.6-10.4112.6E387 E388 G433 N434 Y439 Q440 S441 H452 H476E387-R437 IonicContact OE1-CZ 2.82Å; E387-R437 IonicContact OE1-NE 3.2Å; E387-R437 PolarHBondContact OE1-NE 2.79Å; E387-R437 IonicContact OE1-NH2 2.6Å; E387-R437 PolarHBondContact OE1-NH2 2.83Å; E387-R437 IonicContact OE2-NH2 2.7Å; E388-R437 IonicContact OE1-CZ 2.65Å; E388-R437 IonicContact OE1-NH2 3.49Å; E388-R437 PolarHBondContact OE1-NH2 3.35Å; G433-R437 PolarHBondContact O-N 3.33Å; G433-R437 VanDerWaalsContact O-N 3.15Å; N434-R437 WeakPolarHBondContact O-CB 3.48Å; N434-R437 PolarHBondContact O-N 3.21Å; R437-Y439 VanDerWaalsContact C-N 3.32Å; R437-Y439 PolarHBondContact O-N 2.81Å; R437-Q440 VanDerWaalsContact O-CB 3.29Å; R437-Q440 WeakPolarHBondContact O-CB 3.07Å; R437-Q440 PolarHBondContact O-N 3.24Å; R437-Q440 VanDerWaalsContact O-N 3.12Å; R437-S441 PolarHBondContact O-N 3.28Å; R437-S441 PolarHBondContact O-OG 3.21Å; R437-H452 PolarHBondContact N-CE1 3.35Å; R437-H452 PolarHBondContact N-NE2 3.06Å; R437-H476 HydrophobicContact CG-CB 4.4Å
438L98.4Very high97.9Very high0 Ų037.7 Ų37.70%017%0.167CC..Hα-helixtrans-60.3-42.9179179.169.2000111.8E387 L403 A406 H407 N434 L435 G436 Q440 S441 M442E387-L438 HydrophobicContact CB-CD1 4.45Å; E387-L438 HydrophobicContact CG-CD1 4.21Å; L403-L438 HydrophobicContact CD2-CD1 3.76Å; A406-L438 HydrophobicContact CB-CD1 3.85Å; A406-L438 HydrophobicContact CB-CD2 4.35Å; H407-L438 HydrophobicContact CB-CD2 3.66Å; N434-L438 PolarHBondContact O-N 2.91Å; L435-L438 PolarHBondContact O-N 3.15Å; G436-L438 PolarHBondContact O-N 3.08Å; L438-Q440 VanDerWaalsContact C-N 3.29Å; L438-Q440 PolarHBondContact O-N 3.09Å; L438-S441 WeakPolarHBondContact O-CB 3.38Å; L438-S441 PolarHBondContact O-N 3.42Å; L438-S441 VanDerWaalsContact O-N 3.15Å; L438-M442 HydrophobicContact CG-CG 4.43Å; L438-M442 HydrophobicContact CG-SD 4.3Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 2.92Å
439Y98.6Very high97.9Very high35 Ų3539.8 Ų39.814%0.13718%0.176CC..Hα-helixtrans-64.9-33.3177.2-73.1-30.5000112.6H407 L435 G436 R437 M442 R443 K444 E447 M451H407-Y439 AromaticContact CD2-CE1 3.49Å; H407-Y439 VanDerWaalsContact CD2-CE1 3.49Å; H407-Y439 WeakPolarHBondContact CD2-CE1 3.5Å; H407-Y439 AromaticContact NE2-CE1 3.39Å; H407-Y439 WeakPolarHBondContact NE2-CE1 3.38Å; H407-Y439 AromaticContact NE2-CZ 3.64Å; H407-Y439 PolarHBondContact NE2-OH 3.36Å; H407-Y439 VanDerWaalsContact NE2-OH 3.07Å; L435-Y439 HydrophobicContact CB-CE2 4.46Å; L435-Y439 WeakPolarHBondContact O-CB 3.43Å; L435-Y439 WeakPolarHBondContact O-CD2 3.35Å; L435-Y439 VanDerWaalsContact O-CG 3.32Å; L435-Y439 PolarHBondContact O-N 3.19Å; G436-Y439 PolarHBondContact O-N 3.06Å; R437-Y439 VanDerWaalsContact C-N 3.32Å; R437-Y439 PolarHBondContact O-N 2.81Å; Y439-M442 HydrophobicContact CD1-SD 4.06Å; Y439-M442 HydrophobicContact CE1-SD 4.41Å; Y439-M442 CarbonylContact O-C 3.59Å; Y439-M442 PolarHBondContact O-N 3.42Å; Y439-R443 PolarHBondContact O-N 3.49Å; Y439-R443 VanDerWaalsContact O-N 3.12Å; Y439-K444 HydrophobicContact CD1-CD 4.02Å; Y439-K444 HydrophobicContact CE1-CD 4.41Å; Y439-K444 HydrophobicContact CG-CB 4.5Å; Y439-K444 WeakPolarHBondContact O-CA 3.25Å; Y439-K444 PolarHBondContact O-N 2.88Å; Y439-E447 HydrophobicContact CD2-CB 3.68Å; Y439-E447 HydrophobicContact CE2-CB 4.08Å; Y439-E447 HydrophobicContact CG-CB 4.09Å; Y439-M451 HydrophobicContact CD2-CG 3.93Å; Y439-M451 HydrophobicContact CE2-CG 3.91Å
440Q97.6Very high97.9Very high26 Ų2645.6 Ų45.612%0.12120%0.204CC..Hα-helixtrans-59.8-49.1169.5-176.6-178.24.300110.5G436 R437 L438 M442 R443 A448 L480 D484G436-Q440 PolarHBondContact O-N 3.19Å; R437-Q440 VanDerWaalsContact O-CB 3.29Å; R437-Q440 WeakPolarHBondContact O-CB 3.07Å; R437-Q440 PolarHBondContact O-N 3.24Å; R437-Q440 VanDerWaalsContact O-N 3.12Å; L438-Q440 VanDerWaalsContact C-N 3.29Å; L438-Q440 PolarHBondContact O-N 3.09Å; Q440-M442 VanDerWaalsContact C-N 3.28Å; Q440-M442 PolarHBondContact O-N 2.97Å; Q440-R443 WeakPolarHBondContact O-CA 3.45Å; Q440-R443 PolarHBondContact O-N 3.4Å; Q440-A448 HydrophobicContact CB-CB 4.18Å; Q440-L480 HydrophobicContact CB-CD1 4.14Å; Q440-L480 HydrophobicContact CG-CD1 3.76Å; Q440-D484 WeakPolarHBondContact CG-OD2 3.45Å; Q440-D484 PolarHBondContact NE2-OD2 3.12Å
441S96.6Very high98Very high26 Ų2644.6 Ų44.618%0.18220%0.2CC..Hα-helixtrans-61.2-34.6176.3-54.60000112.9R437 L438 R443R437-S441 PolarHBondContact O-N 3.28Å; R437-S441 PolarHBondContact O-OG 3.21Å; L438-S441 WeakPolarHBondContact O-CB 3.38Å; L438-S441 PolarHBondContact O-N 3.42Å; L438-S441 VanDerWaalsContact O-N 3.15Å; S441-R443 PolarHBondContact O-N 3.09Å
442M97.3Very high98.1Very high40 Ų4044.2 Ų44.220%0.19720%0.198CC..THydrogen-bonded Turntrans-77.30.6172.4-64-177.892.300114.2L403 L438 Y439 Q440 K444L403-M442 HydrophobicContact CB-CG 4.13Å; L403-M442 HydrophobicContact CD1-CG 4.2Å; L438-M442 HydrophobicContact CG-CG 4.43Å; L438-M442 HydrophobicContact CG-SD 4.3Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 2.92Å; Y439-M442 HydrophobicContact CD1-SD 4.06Å; Y439-M442 HydrophobicContact CE1-SD 4.41Å; Y439-M442 CarbonylContact O-C 3.59Å; Y439-M442 PolarHBondContact O-N 3.42Å; Q440-M442 VanDerWaalsContact C-N 3.28Å; Q440-M442 PolarHBondContact O-N 2.97Å; M442-K444 VanDerWaalsContact C-N 3.27Å; M442-K444 HydrophobicContact CB-CD 4.29Å; M442-K444 HydrophobicContact CB-CG 4.24Å; M442-K444 PolarHBondContact O-N 3.36Å
443R96.8Very high98.1Very high176 Ų17646.6 Ų46.666%0.66421%0.211SC*.THydrogen-bonded Turntrans63.726.5-177.4-46177-170.7-155.30.4114.4Y439 Q440 S441 F445Y439-R443 PolarHBondContact O-N 3.49Å; Y439-R443 VanDerWaalsContact O-N 3.12Å; Q440-R443 WeakPolarHBondContact O-CA 3.45Å; Q440-R443 PolarHBondContact O-N 3.4Å; S441-R443 PolarHBondContact O-N 3.09Å; R443-F445 HydrophobicContact CB-CE1 4.31Å; R443-F445 HydrophobicContact CB-CE2 4.4Å; R443-F445 HydrophobicContact CB-CZ 3.91Å; R443-F445 HydrophobicContact CG-CZ 4.37Å; R443-F445 PolarHBondContact O-N 2.85Å
444K98.2Very high98.1Very high74 Ų7449.3 Ų49.332%0.32222%0.221SC..  trans-99.366.4176.1-65.2179.1-175.2170.70109.9Y439 M442 K446 E447 A448Y439-K444 HydrophobicContact CD1-CD 4.02Å; Y439-K444 HydrophobicContact CE1-CD 4.41Å; Y439-K444 HydrophobicContact CG-CB 4.5Å; Y439-K444 WeakPolarHBondContact O-CA 3.25Å; Y439-K444 PolarHBondContact O-N 2.88Å; M442-K444 VanDerWaalsContact C-N 3.27Å; M442-K444 HydrophobicContact CB-CD 4.29Å; M442-K444 HydrophobicContact CB-CG 4.24Å; M442-K444 PolarHBondContact O-N 3.36Å; K444-K446 VanDerWaalsContact C-N 3.34Å; K444-K446 PolarHBondContact O-N 3.23Å; K444-E447 HydrophobicContact CB-CB 4.28Å; K444-E447 PolarHBondContact O-N 3.29Å; K444-A448 WeakPolarHBondContact O-CB 3.44Å; K444-A448 PolarHBondContact O-N 3Å
445F98.4Very high98.1Very high58 Ų5848.3 Ų48.325%0.25422%0.216SC..Hα-helixtrans-66.1-31.2-164.9-53.7-50.6000114.5R443 A448 E449 L480 D484 M485R443-F445 HydrophobicContact CB-CE1 4.31Å; R443-F445 HydrophobicContact CB-CE2 4.4Å; R443-F445 HydrophobicContact CB-CZ 3.91Å; R443-F445 HydrophobicContact CG-CZ 4.37Å; R443-F445 PolarHBondContact O-N 2.85Å; F445-A448 WeakPolarHBondContact O-CB 3.43Å; F445-A448 PolarHBondContact O-N 3.25Å; F445-E449 WeakPolarHBondContact O-CB 3.26Å; F445-E449 PolarHBondContact O-N 3.12Å; F445-L480 HydrophobicContact CB-CD1 4.07Å; F445-L480 HydrophobicContact CD1-CD1 3.72Å; F445-L480 HydrophobicContact CG-CD1 4.29Å; F445-D484 HydrophobicContact CD1-CB 3.61Å; F445-D484 HydrophobicContact CD2-CB 4.3Å; F445-D484 HydrophobicContact CE1-CB 3.41Å; F445-D484 VanDerWaalsContact CE1-CB 3.41Å; F445-D484 VanDerWaalsContact CE1-OD1 3.32Å; F445-D484 WeakPolarHBondContact CE1-OD1 3.33Å; F445-D484 HydrophobicContact CE2-CB 4.14Å; F445-D484 HydrophobicContact CG-CB 4.05Å; F445-D484 HydrophobicContact CZ-CB 3.69Å; F445-D484 WeakPolarHBondContact CZ-OD1 3.42Å; F445-M485 HydrophobicContact CB-CE 4.49Å; F445-M485 HydrophobicContact CB-CG 4.38Å
446K98.1Very high98.2Very high149 Ų14948.9 Ų48.965%0.64822%0.219SC*.Hα-helixtrans-69.7-46176.9-69.8-176.1177.4-177.70111.1K444 A448 E449 E450K444-K446 VanDerWaalsContact C-N 3.34Å; K444-K446 PolarHBondContact O-N 3.23Å; K446-A448 VanDerWaalsContact C-N 3.27Å; K446-A448 PolarHBondContact O-N 2.84Å; K446-E449 PolarHBondContact O-N 3.12Å; K446-E450 WeakPolarHBondContact O-CG 3.41Å; K446-E450 PolarHBondContact O-N 2.83Å
447E98.4Very high98.2Very high82 Ų8254.4 Ų54.438%0.38324%0.244SC..Hα-helixtrans-63.2-37.1175.4-61.293141.300111.1Y439 K444 M451Y439-E447 HydrophobicContact CD2-CB 3.68Å; Y439-E447 HydrophobicContact CE2-CB 4.08Å; Y439-E447 HydrophobicContact CG-CB 4.09Å; K444-E447 HydrophobicContact CB-CB 4.28Å; K444-E447 PolarHBondContact O-N 3.29Å; E447-M451 VanDerWaalsContact O-CG 3.28Å; E447-M451 WeakPolarHBondContact O-CG 3.38Å; E447-M451 PolarHBondContact O-N 3.24Å; E447-M451 VanDerWaalsContact O-N 3.12Å
448A98.6Very high98.2Very high0 Ų053.7 Ų53.70%024%0.243CC..Hα-helixtrans-60.3-50.1173.800000112.1G436 Q440 K444 F445 K446 E450 M451 H452 L480G436-A448 VanDerWaalsContact O-CB 3.22Å; G436-A448 WeakPolarHBondContact O-CB 3.42Å; Q440-A448 HydrophobicContact CB-CB 4.18Å; K444-A448 WeakPolarHBondContact O-CB 3.44Å; K444-A448 PolarHBondContact O-N 3Å; F445-A448 WeakPolarHBondContact O-CB 3.43Å; F445-A448 PolarHBondContact O-N 3.25Å; K446-A448 VanDerWaalsContact C-N 3.27Å; K446-A448 PolarHBondContact O-N 2.84Å; A448-E450 PolarHBondContact O-N 3.43Å; A448-M451 PolarHBondContact O-N 2.98Å; A448-H452 PolarHBondContact O-CD2 3.09Å; A448-H452 PolarHBondContact O-N 2.8Å; A448-L480 HydrophobicContact CB-CD1 4.09Å; A448-L480 HydrophobicContact CB-CD2 3.83Å
449E98.6Very high98.2Very high44 Ų4454 Ų5421%0.20624%0.244CC..Hα-helixtrans-58.6-48.4178.3-178.9176.3-152.700111.5F445 K446 M451 H452 I453 L477 L480 Y481F445-E449 WeakPolarHBondContact O-CB 3.26Å; F445-E449 PolarHBondContact O-N 3.12Å; K446-E449 PolarHBondContact O-N 3.12Å; E449-M451 VanDerWaalsContact C-N 3.31Å; E449-M451 PolarHBondContact O-N 3.21Å; E449-H452 PolarHBondContact O-N 2.82Å; E449-I453 HydrophobicContact CG-CD1 3.71Å; E449-I453 HydrophobicContact CG-CG1 4.37Å; E449-I453 WeakPolarHBondContact O-CB 3.32Å; E449-I453 WeakPolarHBondContact O-CG1 3.38Å; E449-I453 PolarHBondContact O-N 2.94Å; E449-L477 HydrophobicContact CG-CD1 4.29Å; E449-L480 HydrophobicContact CB-CD2 3.75Å; E449-Y481 HydrophobicContact CG-CE1 4.14Å; E449-Y481 WeakPolarHBondContact OE1-CE1 3.48Å; E449-Y481 VanDerWaalsContact OE1-CZ 3.27Å; E449-Y481 PolarHBondContact OE1-OH 3.34Å
450E98.6Very high98.2Very high122 Ų12254.6 Ų54.657%0.5725%0.248SC*.Hα-helixtrans-56.3-44.8177.5-74.5177.8-173.200112K446 A448 K454K446-E450 WeakPolarHBondContact O-CG 3.41Å; K446-E450 PolarHBondContact O-N 2.83Å; A448-E450 PolarHBondContact O-N 3.43Å; E450-K454 WeakPolarHBondContact O-CB 3.19Å; E450-K454 PolarHBondContact O-N 3.42Å
451M98.7Very high98.1Very high32 Ų3260.4 Ų60.416%0.15828%0.275CS..Hα-helixtrans-68.6-39.9179.8-69-54.295.600112.3Y432 L435 Y439 E447 A448 E449 A455Y432-M451 HydrophobicContact CD1-SD 3.64Å; Y432-M451 HydrophobicContact CE1-SD 4.2Å; Y432-M451 WeakPolarHBondContact O-CB 3.3Å; L435-M451 HydrophobicContact CB-CG 4.24Å; Y439-M451 HydrophobicContact CD2-CG 3.93Å; Y439-M451 HydrophobicContact CE2-CG 3.91Å; E447-M451 VanDerWaalsContact O-CG 3.28Å; E447-M451 WeakPolarHBondContact O-CG 3.38Å; E447-M451 PolarHBondContact O-N 3.24Å; E447-M451 VanDerWaalsContact O-N 3.12Å; A448-M451 PolarHBondContact O-N 2.98Å; E449-M451 VanDerWaalsContact C-N 3.31Å; E449-M451 PolarHBondContact O-N 3.21Å; M451-A455 WeakPolarHBondContact O-CB 3.47Å; M451-A455 PolarHBondContact O-N 3.44Å
452H98.6Very high98.1Very high0 Ų062.3 Ų62.30%028%0.283CS..Hα-helixtrans-64.6-49.2175.7-77.2-47.5000112.3G433 G436 R437 A448 E449 K454 A455 I456 L477G433-H452 PolarHBondContact O-CE1 3.37Å; G436-H452 VanDerWaalsContact C-NE2 3.26Å; R437-H452 PolarHBondContact N-CE1 3.35Å; R437-H452 PolarHBondContact N-NE2 3.06Å; A448-H452 PolarHBondContact O-CD2 3.09Å; A448-H452 PolarHBondContact O-N 2.8Å; E449-H452 PolarHBondContact O-N 2.82Å; H452-K454 VanDerWaalsContact C-N 3.3Å; H452-K454 PolarHBondContact O-N 2.9Å; H452-A455 PolarHBondContact O-N 3.31Å; H452-I456 VanDerWaalsContact O-CG1 3.28Å; H452-I456 WeakPolarHBondContact O-CG1 3.48Å; H452-I456 PolarHBondContact O-N 2.82Å; H452-L477 HydrophobicContact CB-CB 4.12Å; H452-L477 HydrophobicContact CB-CD1 3.92Å; H452-L477 HydrophobicContact CB-CG 4.45Å
453I98.7Very high98Very high58 Ų5862.5 Ų62.530%0.29729%0.285SS..Hα-helixtrans-58.4-45.7177.9-70.4173.3000110.1E449 A455 I456 Q457 L477E449-I453 HydrophobicContact CG-CD1 3.71Å; E449-I453 HydrophobicContact CG-CG1 4.37Å; E449-I453 WeakPolarHBondContact O-CB 3.32Å; E449-I453 WeakPolarHBondContact O-CG1 3.38Å; E449-I453 PolarHBondContact O-N 2.94Å; I453-A455 PolarHBondContact O-N 2.95Å; I453-I456 PolarHBondContact O-N 3.22Å; I453-Q457 HydrophobicContact CG2-CG 4.28Å; I453-Q457 WeakPolarHBondContact O-CB 3.42Å; I453-Q457 VanDerWaalsContact O-CG 3.29Å; I453-Q457 WeakPolarHBondContact O-CG 3.41Å; I453-Q457 PolarHBondContact O-N 3.15Å; I453-L477 HydrophobicContact CG1-CD2 4.08Å
454K98.4Very high97.9Very high63 Ų6355.6 Ų55.627%0.27427%0.268SS..Hα-helixtrans-60.3-43.9177.8-173.3175.2-175-178.30112.4E423 Y432 E450 H452 I458E423-K454 WeakPolarHBondContact OE1-CE 3.15Å; E423-K454 IonicContact OE1-NZ 2.66Å; E423-K454 PolarHBondContact OE1-NZ 2.82Å; Y432-K454 HydrophobicContact CD1-CD 4.32Å; Y432-K454 HydrophobicContact CD2-CD 4.16Å; Y432-K454 HydrophobicContact CD2-CG 4.28Å; Y432-K454 HydrophobicContact CE1-CD 4.2Å; Y432-K454 HydrophobicContact CE2-CD 4.03Å; Y432-K454 HydrophobicContact CE2-CG 4.47Å; Y432-K454 HydrophobicContact CG-CD 4.33Å; Y432-K454 VanDerWaalsContact CZ-NZ 3.29Å; Y432-K454 PolarHBondContact OH-NZ 3.17Å; E450-K454 WeakPolarHBondContact O-CB 3.19Å; E450-K454 PolarHBondContact O-N 3.42Å; H452-K454 VanDerWaalsContact C-N 3.3Å; H452-K454 PolarHBondContact O-N 2.9Å; K454-I458 HydrophobicContact CG-CD1 4.18Å; K454-I458 WeakPolarHBondContact O-CG1 3.42Å; K454-I458 PolarHBondContact O-N 2.82Å
455A98.5Very high97.8Very high0 Ų058 Ų580%028%0.28CS..Hα-helixtrans-62.3-44.4176.500000112A429 M451 H452 I453 K459A429-A455 WeakPolarHBondContact O-CB 3.39Å; M451-A455 WeakPolarHBondContact O-CB 3.47Å; M451-A455 PolarHBondContact O-N 3.44Å; H452-A455 PolarHBondContact O-N 3.31Å; I453-A455 PolarHBondContact O-N 2.95Å; A455-K459 WeakPolarHBondContact O-CB 3.15Å; A455-K459 VanDerWaalsContact O-CG 3.26Å; A455-K459 WeakPolarHBondContact O-CG 3.1Å; A455-K459 PolarHBondContact O-N 3.28Å
456I98.7Very high97.6Very high14 Ų1459.7 Ų59.77%0.07229%0.289CS..Hα-helixtrans-61.6-50.5178.3-67.6164.7000110.2H452 I453 I458 K459 E460 V474 L477H452-I456 VanDerWaalsContact O-CG1 3.28Å; H452-I456 WeakPolarHBondContact O-CG1 3.48Å; H452-I456 PolarHBondContact O-N 2.82Å; I453-I456 PolarHBondContact O-N 3.22Å; I456-I458 VanDerWaalsContact C-N 3.35Å; I456-I458 PolarHBondContact O-N 3.4Å; I456-K459 PolarHBondContact O-N 3.05Å; I456-K459 VanDerWaalsContact O-N 3.16Å; I456-E460 HydrophobicContact CG2-CG 4Å; I456-E460 WeakPolarHBondContact O-CB 3.46Å; I456-E460 WeakPolarHBondContact O-CG 3.27Å; I456-E460 PolarHBondContact O-N 3.13Å; I456-V474 HydrophobicContact CD1-CG2 3.99Å; I456-V474 HydrophobicContact CG1-CG2 4.24Å; I456-V474 HydrophobicContact CG2-CG2 4.31Å; I456-L477 HydrophobicContact CD1-CB 4.12Å; I456-L477 HydrophobicContact CD1-CD2 3.72Å
457Q98.5Very high97.4Very high116 Ų11654.1 Ų54.154%0.54227%0.266SS..Hα-helixtrans-56.1-46.7-179.3-74.8173.2-9.700112.4I453 Q461I453-Q457 HydrophobicContact CG2-CG 4.28Å; I453-Q457 WeakPolarHBondContact O-CB 3.42Å; I453-Q457 VanDerWaalsContact O-CG 3.29Å; I453-Q457 WeakPolarHBondContact O-CG 3.41Å; I453-Q457 PolarHBondContact O-N 3.15Å; Q457-Q461 WeakPolarHBondContact O-CB 3.36Å; Q457-Q461 PolarHBondContact O-N 3.02Å; Q457-Q461 VanDerWaalsContact O-N 3.11Å
458I98.4Very high97.1Very high13 Ų1352 Ų527%0.06726%0.255CS..Hα-helixtrans-64.1-45.5178.7-65.2167000110.6F424 A429 Y432 K454 I456 Q461 L462F424-I458 HydrophobicContact CD2-CB 4.44Å; F424-I458 HydrophobicContact CD2-CG1 4.1Å; F424-I458 HydrophobicContact CD2-CG2 3.99Å; F424-I458 HydrophobicContact CE2-CB 4.22Å; F424-I458 HydrophobicContact CE2-CG1 4.17Å; F424-I458 HydrophobicContact CE2-CG2 3.97Å; A429-I458 HydrophobicContact CB-CB 3.98Å; A429-I458 HydrophobicContact CB-CG2 3.79Å; Y432-I458 HydrophobicContact CD2-CD1 4.15Å; Y432-I458 HydrophobicContact CE2-CD1 4.17Å; K454-I458 HydrophobicContact CG-CD1 4.18Å; K454-I458 WeakPolarHBondContact O-CG1 3.42Å; K454-I458 PolarHBondContact O-N 2.82Å; I456-I458 VanDerWaalsContact C-N 3.35Å; I456-I458 PolarHBondContact O-N 3.4Å; I458-Q461 PolarHBondContact O-N 3.48Å; I458-L462 HydrophobicContact CG2-CD1 3.72Å; I458-L462 HydrophobicContact CG2-CG 4.48Å; I458-L462 WeakPolarHBondContact O-CB 3.46Å; I458-L462 WeakPolarHBondContact O-CG 3.29Å; I458-L462 PolarHBondContact O-N 2.99Å
459K98Very high96.9Very high6 Ų653.3 Ų53.33%0.02626%0.261CS..Hα-helixtrans-66-43-179.2-73.3171.7166.7-163.90112.2A429 A455 I456 Q461 L462 L463 E469 V470 S473A429-K459 HydrophobicContact CB-CG 3.88Å; A455-K459 WeakPolarHBondContact O-CB 3.15Å; A455-K459 VanDerWaalsContact O-CG 3.26Å; A455-K459 WeakPolarHBondContact O-CG 3.1Å; A455-K459 PolarHBondContact O-N 3.28Å; I456-K459 PolarHBondContact O-N 3.05Å; I456-K459 VanDerWaalsContact O-N 3.16Å; K459-Q461 VanDerWaalsContact C-N 3.34Å; K459-Q461 PolarHBondContact O-N 2.92Å; K459-L462 PolarHBondContact O-N 3.4Å; K459-L463 WeakPolarHBondContact O-CB 3.5Å; K459-L463 PolarHBondContact O-N 3.36Å; K459-E469 HydrophobicContact CD-CB 4.09Å; K459-E469 WeakPolarHBondContact CD-O 3.15Å; K459-E469 PolarHBondContact NZ-O 3.31Å; K459-E469 IonicContact NZ-OE2 3.75Å; K459-E469 PolarHBondContact NZ-OE2 3.05Å; K459-V470 HydrophobicContact CB-CG2 3.73Å; K459-S473 PolarHBondContact NZ-OG 3.03Å
460E97.8Very high96.8Very high47 Ų4751.2 Ų51.222%0.2225%0.251CS..Hα-helixtrans-62-42.1177.1-73.9-175.2158.200111.8I456 G464 Q465 V470 R497I456-E460 HydrophobicContact CG2-CG 4Å; I456-E460 WeakPolarHBondContact O-CB 3.46Å; I456-E460 WeakPolarHBondContact O-CG 3.27Å; I456-E460 PolarHBondContact O-N 3.13Å; E460-G464 WeakPolarHBondContact O-CA 3.34Å; E460-G464 PolarHBondContact O-N 2.69Å; E460-Q465 HydrophobicContact CB-CG 4.48Å; E460-Q465 HydrophobicContact CG-CG 4.31Å; E460-V470 HydrophobicContact CG-CG1 3.79Å; E460-V470 HydrophobicContact CG-CG2 3.85Å; E460-R497 IonicContact OE1-CZ 3.77Å; E460-R497 IonicContact OE1-NH1 3.23Å; E460-R497 PolarHBondContact OE1-NH1 2.92Å; E460-R497 IonicContact OE1-NH2 3.53Å; E460-R497 PolarHBondContact OE1-NH2 3.25Å
461Q97Very high96.7Very high148 Ų14845.5 Ų45.569%0.69223%0.225SC*.Hα-helixtrans-71.4-29.8179.4-178.3-169.5-18.400112.4F424 Q457 I458 K459F424-Q461 HydrophobicContact CE1-CG 4.18Å; F424-Q461 HydrophobicContact CE2-CB 4.12Å; F424-Q461 HydrophobicContact CE2-CG 4.1Å; F424-Q461 HydrophobicContact CZ-CB 3.59Å; F424-Q461 HydrophobicContact CZ-CG 3.36Å; F424-Q461 VanDerWaalsContact CZ-OE1 3.25Å; Q457-Q461 WeakPolarHBondContact O-CB 3.36Å; Q457-Q461 PolarHBondContact O-N 3.02Å; Q457-Q461 VanDerWaalsContact O-N 3.11Å; I458-Q461 PolarHBondContact O-N 3.48Å; K459-Q461 VanDerWaalsContact C-N 3.34Å; K459-Q461 PolarHBondContact O-N 2.92Å
462L95.8Very high96.5Very high66 Ų6646.6 Ų46.635%0.34623%0.231SC..Hα-helixtrans-87.3-39.3179.1-75.1173.6000114.6F424 V426 I458 K459F424-L462 HydrophobicContact CD1-CD1 4.33Å; F424-L462 HydrophobicContact CD1-CD2 3.7Å; F424-L462 HydrophobicContact CD1-CG 4.06Å; F424-L462 HydrophobicContact CE1-CD1 4.15Å; F424-L462 HydrophobicContact CE1-CD2 3.19Å; F424-L462 HydrophobicContact CE1-CG 3.43Å; F424-L462 VanDerWaalsContact CE1-CG 3.43Å; F424-L462 HydrophobicContact CZ-CD1 4.35Å; F424-L462 HydrophobicContact CZ-CD2 3.93Å; F424-L462 HydrophobicContact CZ-CG 3.62Å; V426-L462 HydrophobicContact CG2-CB 4.33Å; V426-L462 HydrophobicContact CG2-CD1 3.92Å; I458-L462 HydrophobicContact CG2-CD1 3.72Å; I458-L462 HydrophobicContact CG2-CG 4.48Å; I458-L462 WeakPolarHBondContact O-CB 3.46Å; I458-L462 WeakPolarHBondContact O-CG 3.29Å; I458-L462 PolarHBondContact O-N 2.99Å; K459-L462 PolarHBondContact O-N 3.4Å
463L94.4Very high96.5Very high45 Ų4546.7 Ų46.724%0.23623%0.232CC..Hα-helixtrans-114.5-17.7-168.4-57173.8000113Y222 V426 K459 D467 E469Y222-L463 HydrophobicContact CD2-CD2 3.82Å; Y222-L463 HydrophobicContact CE2-CD2 4.14Å; V426-L463 HydrophobicContact CG1-CD1 4.15Å; V426-L463 HydrophobicContact CG2-CD1 3.98Å; V426-L463 HydrophobicContact CG2-CD2 3.96Å; V426-L463 HydrophobicContact CG2-CG 4.03Å; K459-L463 WeakPolarHBondContact O-CB 3.5Å; K459-L463 PolarHBondContact O-N 3.36Å; L463-D467 HydrophobicContact CB-CB 3.61Å; L463-D467 HydrophobicContact CD1-CB 4.45Å; L463-E469 HydrophobicContact CD1-CB 3.84Å; L463-E469 HydrophobicContact CD1-CG 4.17Å
464G95.3Very high96.5Very high30 Ų3044 Ų4431%0.30922%0.218SC..  trans94.4161.1-172.200000113.1E460 E466 D467 V470E460-G464 WeakPolarHBondContact O-CA 3.34Å; E460-G464 PolarHBondContact O-N 2.69Å; G464-E466 PolarHBondContact O-N 3.46Å; G464-D467 PolarHBondContact O-N 2.92Å; G464-V470 WeakPolarHBondContact O-CG2 3.32Å
465Q96.1Very high96.4Very high125 Ų12541 Ų4158%0.58421%0.205SC*.THydrogen-bonded Turntrans-69-18.5-172.8-69.3-179.2-2.100115E460 R497 I501E460-Q465 HydrophobicContact CB-CG 4.48Å; E460-Q465 HydrophobicContact CG-CG 4.31Å; Q465-R497 PolarHBondContact O-NH2 3.25Å; Q465-I501 WeakPolarHBondContact O-CD1 3.44Å
466E94.9Very high96.4Very high94 Ų9442.8 Ų42.844%0.43921%0.214SC..THydrogen-bonded Turntrans-104.28.8-174.5-64.7-75.2123.800112G464 I501 K504G464-E466 PolarHBondContact O-N 3.46Å; E466-I501 VanDerWaalsContact O-CG2 3.27Å; E466-I501 WeakPolarHBondContact O-CG2 3.35Å; E466-K504 IonicContact OE2-NZ 3.49Å; E466-K504 PolarHBondContact OE2-NZ 3.04Å
467D93.8Very high96.4Very high31 Ų3142.5 Ų42.517%0.16621%0.212CC..  trans-74.9146.4178.5-167.6-85.3000111.5L463 G464 E469 V470 A471L463-D467 HydrophobicContact CB-CB 3.61Å; L463-D467 HydrophobicContact CD1-CB 4.45Å; G464-D467 PolarHBondContact O-N 2.92Å; D467-E469 VanDerWaalsContact C-N 3.29Å; D467-E469 PolarHBondContact O-N 3.14Å; D467-E469 WeakPolarHBondContact OD1-CB 3.44Å; D467-E469 PolarHBondContact OD1-N 3.29Å; D467-V470 HydrophobicContact CB-CG2 4.35Å; D467-V470 WeakPolarHBondContact O-CA 3.41Å; D467-V470 WeakPolarHBondContact O-CB 3.49Å; D467-V470 PolarHBondContact O-N 3.01Å; D467-A471 PolarHBondContact O-N 3.28Å; D467-A471 VanDerWaalsContact O-N 3.09Å
468Y92.1Very high96.4Very high39 Ų3937 Ų3715%0.15319%0.186CC..Hα-helixtrans-54.9-40.9176.1167.8-108.7000113.9R260 V470 A471 L472 F506 Y510R260-Y468 VanDerWaalsContact NH2-CD1 3.31Å; Y468-V470 PolarHBondContact O-N 2.84Å; Y468-A471 WeakPolarHBondContact O-CB 3.46Å; Y468-A471 PolarHBondContact O-N 2.96Å; Y468-A471 VanDerWaalsContact O-N 3.13Å; Y468-L472 HydrophobicContact CD1-CD1 4.23Å; Y468-L472 HydrophobicContact CD2-CG 4.35Å; Y468-L472 HydrophobicContact CE1-CD1 3.46Å; Y468-L472 VanDerWaalsContact CE1-CD1 3.46Å; Y468-L472 HydrophobicContact CE1-CG 4.02Å; Y468-L472 HydrophobicContact CE2-CD1 4.14Å; Y468-L472 HydrophobicContact CE2-CD2 3.96Å; Y468-L472 HydrophobicContact CE2-CG 3.82Å; Y468-L472 VanDerWaalsContact CZ-CD1 3.45Å; Y468-L472 PolarHBondContact O-N 3.4Å; Y468-F506 HydrophobicContact CD1-CZ 4.43Å; Y468-F506 HydrophobicContact CD2-CD2 4.34Å; Y468-F506 AromaticContact CD2-CE2 3.23Å; Y468-F506 HydrophobicContact CD2-CE2 3.23Å; Y468-F506 AromaticContact CD2-CZ 3.53Å; Y468-F506 HydrophobicContact CD2-CZ 3.53Å; Y468-F506 AromaticContact CE2-CE2 3.73Å; Y468-F506 HydrophobicContact CE2-CE2 3.73Å; Y468-F506 AromaticContact CE2-CZ 3.82Å; Y468-F506 HydrophobicContact CE2-CZ 3.82Å; Y468-F506 AromaticContact CG-CE2 3.83Å; Y468-F506 HydrophobicContact CG-CE2 3.83Å; Y468-F506 AromaticContact CG-CZ 3.8Å; Y468-F506 HydrophobicContact CG-CZ 3.8Å; Y468-Y510 HydrophobicContact CE2-CE1 4.18Å; Y468-Y510 AromaticContact CE2-CZ 3.74Å; Y468-Y510 WeakPolarHBondContact CE2-OH 3.49Å; Y468-Y510 PolarHBondContact OH-OH 3.4Å
469E94.4Very high96.3Very high26 Ų2636.7 Ų36.712%0.12119%0.186CC..Hα-helixtrans-64.9-28.2179.6-73.4-72.216800111.6K430 K459 L463 D467 S473K430-E469 WeakPolarHBondContact CE-OE1 3.22Å; K430-E469 VanDerWaalsContact CE-OE2 3.23Å; K430-E469 WeakPolarHBondContact CE-OE2 3.43Å; K430-E469 IonicContact NZ-OE1 2.67Å; K430-E469 PolarHBondContact NZ-OE1 3.21Å; K430-E469 IonicContact NZ-OE2 2.85Å; K459-E469 HydrophobicContact CD-CB 4.09Å; K459-E469 WeakPolarHBondContact CD-O 3.15Å; K459-E469 PolarHBondContact NZ-O 3.31Å; K459-E469 IonicContact NZ-OE2 3.75Å; K459-E469 PolarHBondContact NZ-OE2 3.05Å; L463-E469 HydrophobicContact CD1-CB 3.84Å; L463-E469 HydrophobicContact CD1-CG 4.17Å; D467-E469 VanDerWaalsContact C-N 3.29Å; D467-E469 PolarHBondContact O-N 3.14Å; D467-E469 WeakPolarHBondContact OD1-CB 3.44Å; D467-E469 PolarHBondContact OD1-N 3.29Å; E469-S473 PolarHBondContact O-N 3.25Å; E469-S473 PolarHBondContact O-OG 3.37Å
470V96.9Very high96.3Very high0 Ų036.4 Ų36.40%018%0.184CC..Hα-helixtrans-71.9-46.3172175.70000110K459 E460 G464 D467 Y468 L472 S473 V474K459-V470 HydrophobicContact CB-CG2 3.73Å; E460-V470 HydrophobicContact CG-CG1 3.79Å; E460-V470 HydrophobicContact CG-CG2 3.85Å; G464-V470 WeakPolarHBondContact O-CG2 3.32Å; D467-V470 HydrophobicContact CB-CG2 4.35Å; D467-V470 WeakPolarHBondContact O-CA 3.41Å; D467-V470 WeakPolarHBondContact O-CB 3.49Å; D467-V470 PolarHBondContact O-N 3.01Å; Y468-V470 PolarHBondContact O-N 2.84Å; V470-L472 PolarHBondContact O-N 3.14Å; V470-S473 PolarHBondContact O-N 3.23Å; V470-S473 VanDerWaalsContact O-N 3.11Å; V470-V474 HydrophobicContact CG1-CG2 3.94Å; V470-V474 WeakPolarHBondContact O-CB 3.43Å; V470-V474 VanDerWaalsContact O-CG2 3.31Å; V470-V474 WeakPolarHBondContact O-CG2 3.47Å; V470-V474 PolarHBondContact O-N 3.26Å
471A96.2Very high96.4Very high3 Ų335.2 Ų35.23%0.02518%0.178CC..Hα-helixtrans-53.8-50177.400000112.1D467 Y468 S473 V474 G475 S498 I501D467-A471 PolarHBondContact O-N 3.28Å; D467-A471 VanDerWaalsContact O-N 3.09Å; Y468-A471 WeakPolarHBondContact O-CB 3.46Å; Y468-A471 PolarHBondContact O-N 2.96Å; Y468-A471 VanDerWaalsContact O-N 3.13Å; A471-S473 VanDerWaalsContact C-N 3.34Å; A471-S473 PolarHBondContact O-N 3.03Å; A471-V474 PolarHBondContact O-N 3.34Å; A471-G475 PolarHBondContact O-N 3.32Å; A471-S498 PolarHBondContact O-OG 3.48Å; A471-I501 HydrophobicContact CB-CB 3.83Å; A471-I501 HydrophobicContact CB-CD1 4.13Å; A471-I501 HydrophobicContact CB-CG2 3.72Å
472L94.9Very high96.4Very high54 Ų5428.2 Ų28.228%0.28315%0.145SC..Hα-helixtrans-56.4-45.4175.9-72.2-177.6000112.8Y468 V470 H476Y468-L472 HydrophobicContact CD1-CD1 4.23Å; Y468-L472 HydrophobicContact CD2-CG 4.35Å; Y468-L472 HydrophobicContact CE1-CD1 3.46Å; Y468-L472 VanDerWaalsContact CE1-CD1 3.46Å; Y468-L472 HydrophobicContact CE1-CG 4.02Å; Y468-L472 HydrophobicContact CE2-CD1 4.14Å; Y468-L472 HydrophobicContact CE2-CD2 3.96Å; Y468-L472 HydrophobicContact CE2-CG 3.82Å; Y468-L472 VanDerWaalsContact CZ-CD1 3.45Å; Y468-L472 PolarHBondContact O-N 3.4Å; V470-L472 PolarHBondContact O-N 3.14Å; L472-H476 PolarHBondContact O-N 3.35Å; L472-H476 PolarHBondContact O-ND1 2.9Å
473S97.3Very high96.4Very high3 Ų330.2 Ų30.22%0.02115%0.149CC..Hα-helixtrans-69.5-36.3-179.2-79.10000112.5K459 E469 V470 A471 L477K459-S473 PolarHBondContact NZ-OG 3.03Å; E469-S473 PolarHBondContact O-N 3.25Å; E469-S473 PolarHBondContact O-OG 3.37Å; V470-S473 PolarHBondContact O-N 3.23Å; V470-S473 VanDerWaalsContact O-N 3.11Å; A471-S473 VanDerWaalsContact C-N 3.34Å; A471-S473 PolarHBondContact O-N 3.03Å; S473-L477 PolarHBondContact O-N 3.44Å; S473-L477 VanDerWaalsContact O-N 3.16Å
474V98.3Very high96.6Very high0 Ų030.6 Ų30.60%015%0.151CC..Hα-helixtrans-66.6-43175.6164.80000111.2I456 V470 A471 H476 L477 A478 L494 R497I456-V474 HydrophobicContact CD1-CG2 3.99Å; I456-V474 HydrophobicContact CG1-CG2 4.24Å; I456-V474 HydrophobicContact CG2-CG2 4.31Å; V470-V474 HydrophobicContact CG1-CG2 3.94Å; V470-V474 WeakPolarHBondContact O-CB 3.43Å; V470-V474 VanDerWaalsContact O-CG2 3.31Å; V470-V474 WeakPolarHBondContact O-CG2 3.47Å; V470-V474 PolarHBondContact O-N 3.26Å; A471-V474 PolarHBondContact O-N 3.34Å; V474-H476 PolarHBondContact O-N 3.37Å; V474-L477 PolarHBondContact O-N 3.28Å; V474-A478 PolarHBondContact O-N 3.04Å; V474-L494 HydrophobicContact CG1-CB 3.76Å; V474-L494 HydrophobicContact CG1-CD2 3.79Å; V474-L494 HydrophobicContact CG1-CG 4.32Å; V474-L494 WeakPolarHBondContact CG1-O 3.41Å; V474-R497 HydrophobicContact CG1-CB 4.36Å; V474-R497 HydrophobicContact CG1-CG 4.5Å
475G97.6Very high96.6Very high1 Ų131.5 Ų31.51%0.0115%0.148CC..Hα-helixtrans-62.1-38.6175.800000113.2A471 A478 S479A471-G475 PolarHBondContact O-N 3.32Å; G475-A478 WeakPolarHBondContact O-CB 3.43Å; G475-A478 PolarHBondContact O-N 2.79Å; G475-S479 PolarHBondContact O-N 3.4Å
476H97.5Very high96.6Very high38 Ų3830.5 Ų30.518%0.17615%0.147CC..Hα-helixtrans-66.2-40.9173.5-64147.3000112.7R437 L472 V474 A478 S479 L480R437-H476 HydrophobicContact CG-CB 4.4Å; L472-H476 PolarHBondContact O-N 3.35Å; L472-H476 PolarHBondContact O-ND1 2.9Å; V474-H476 PolarHBondContact O-N 3.37Å; H476-A478 VanDerWaalsContact C-N 3.32Å; H476-A478 PolarHBondContact O-N 2.93Å; H476-S479 WeakPolarHBondContact O-CB 3.34Å; H476-S479 PolarHBondContact O-N 3.38Å; H476-L480 PolarHBondContact O-N 3.37Å; H476-L480 VanDerWaalsContact O-N 3.14Å
477L98.6Very high96.8Very high8 Ų829.1 Ų29.14%0.04214%0.14CC..Hα-helixtrans-64.2-38.7174.4-177.858.3000111.7E449 H452 I453 I456 S473 V474 S479 L480 Y481 L494E449-L477 HydrophobicContact CG-CD1 4.29Å; H452-L477 HydrophobicContact CB-CB 4.12Å; H452-L477 HydrophobicContact CB-CD1 3.92Å; H452-L477 HydrophobicContact CB-CG 4.45Å; I453-L477 HydrophobicContact CG1-CD2 4.08Å; I456-L477 HydrophobicContact CD1-CB 4.12Å; I456-L477 HydrophobicContact CD1-CD2 3.72Å; S473-L477 PolarHBondContact O-N 3.44Å; S473-L477 VanDerWaalsContact O-N 3.16Å; V474-L477 PolarHBondContact O-N 3.28Å; L477-S479 VanDerWaalsContact C-N 3.26Å; L477-S479 PolarHBondContact O-N 3.26Å; L477-L480 HydrophobicContact CD1-CD2 4.2Å; L477-L480 WeakPolarHBondContact O-CB 3.28Å; L477-L480 PolarHBondContact O-N 2.86Å; L477-Y481 HydrophobicContact CD1-CD1 4.4Å; L477-Y481 HydrophobicContact CD1-CE1 3.9Å; L477-Y481 HydrophobicContact CD1-CE2 4.13Å; L477-Y481 HydrophobicContact CD2-CE2 4.24Å; L477-Y481 HydrophobicContact CG-CD2 4.36Å; L477-Y481 HydrophobicContact CG-CE2 3.92Å; L477-Y481 PolarHBondContact O-N 3.3Å; L477-Y481 VanDerWaalsContact O-N 3.08Å; L477-L494 HydrophobicContact CB-CD1 4.19Å; L477-L494 HydrophobicContact CD2-CD1 3.9Å; L477-L494 HydrophobicContact CG-CD1 3.78Å
478A98.4Very high96.9Very high0 Ų029.9 Ų29.90%014%0.141CC..Hα-helixtrans-59.1-40.4174.300000111.8V474 G475 H476 Y481 N482 A491 L494 Y495V474-A478 PolarHBondContact O-N 3.04Å; G475-A478 WeakPolarHBondContact O-CB 3.43Å; G475-A478 PolarHBondContact O-N 2.79Å; H476-A478 VanDerWaalsContact C-N 3.32Å; H476-A478 PolarHBondContact O-N 2.93Å; A478-Y481 PolarHBondContact O-N 3.4Å; A478-N482 VanDerWaalsContact O-CB 3.23Å; A478-N482 WeakPolarHBondContact O-CB 3.41Å; A478-N482 PolarHBondContact O-N 2.98Å; A478-A491 WeakPolarHBondContact O-CB 3.09Å; A478-L494 HydrophobicContact CB-CB 3.59Å; A478-L494 HydrophobicContact CB-CD1 4.48Å; A478-Y495 HydrophobicContact CB-CD1 3.57Å; A478-Y495 HydrophobicContact CB-CD2 3.75Å; A478-Y495 HydrophobicContact CB-CE1 3.63Å; A478-Y495 HydrophobicContact CB-CE2 3.81Å; A478-Y495 HydrophobicContact CB-CG 3.64Å
479S97.8Very high97.2Very high7 Ų735.2 Ų35.25%0.04917%0.167CC..Hα-helixtrans-60.2-49.1174.6-175.20000112.6G475 H476 L477 Y481 N482 Y483 Y495 Y515G475-S479 PolarHBondContact O-N 3.4Å; H476-S479 WeakPolarHBondContact O-CB 3.34Å; H476-S479 PolarHBondContact O-N 3.38Å; L477-S479 VanDerWaalsContact C-N 3.26Å; L477-S479 PolarHBondContact O-N 3.26Å; S479-Y481 VanDerWaalsContact C-N 3.3Å; S479-Y481 PolarHBondContact O-N 3.14Å; S479-N482 PolarHBondContact O-N 2.94Å; S479-N482 VanDerWaalsContact O-N 3.16Å; S479-Y483 WeakPolarHBondContact O-CB 3.48Å; S479-Y483 WeakPolarHBondContact O-CD2 3.5Å; S479-Y483 PolarHBondContact O-N 2.81Å; S479-Y495 WeakPolarHBondContact CA-OH 3.43Å; S479-Y495 PolarHBondContact N-OH 2.86Å; S479-Y515 WeakPolarHBondContact CB-OH 3.49Å; S479-Y515 PolarHBondContact OG-OH 3.18Å
480L98.3Very high97.4Very high0 Ų036.5 Ų36.50%018%0.175CC..Hα-helixtrans-55.3-45.9175.6177.866.9000112.1Q440 F445 A448 E449 H476 L477 D484 M485Q440-L480 HydrophobicContact CB-CD1 4.14Å; Q440-L480 HydrophobicContact CG-CD1 3.76Å; F445-L480 HydrophobicContact CB-CD1 4.07Å; F445-L480 HydrophobicContact CD1-CD1 3.72Å; F445-L480 HydrophobicContact CG-CD1 4.29Å; A448-L480 HydrophobicContact CB-CD1 4.09Å; A448-L480 HydrophobicContact CB-CD2 3.83Å; E449-L480 HydrophobicContact CB-CD2 3.75Å; H476-L480 PolarHBondContact O-N 3.37Å; H476-L480 VanDerWaalsContact O-N 3.14Å; L477-L480 HydrophobicContact CD1-CD2 4.2Å; L477-L480 WeakPolarHBondContact O-CB 3.28Å; L477-L480 PolarHBondContact O-N 2.86Å; L480-D484 HydrophobicContact CD1-CB 4.19Å; L480-D484 PolarHBondContact O-N 3.37Å; L480-D484 VanDerWaalsContact O-N 3.13Å; L480-M485 HydrophobicContact CD2-SD 4.23Å; L480-M485 HydrophobicContact CG-CG 4.32Å; L480-M485 HydrophobicContact CG-SD 4.05Å; L480-M485 PolarHBondContact O-N 3.35Å; L480-M485 VanDerWaalsContact O-N 3.14Å
481Y98.6Very high97.5Very high21 Ų2136.5 Ų36.58%0.08218%0.175CC..Hα-helixtrans-65-39.5178.1-72.3-13.3000113.4E449 L477 A478 S479 M485 N486 Q487 D490 L494E449-Y481 HydrophobicContact CG-CE1 4.14Å; E449-Y481 WeakPolarHBondContact OE1-CE1 3.48Å; E449-Y481 VanDerWaalsContact OE1-CZ 3.27Å; E449-Y481 PolarHBondContact OE1-OH 3.34Å; L477-Y481 HydrophobicContact CD1-CD1 4.4Å; L477-Y481 HydrophobicContact CD1-CE1 3.9Å; L477-Y481 HydrophobicContact CD1-CE2 4.13Å; L477-Y481 HydrophobicContact CD2-CE2 4.24Å; L477-Y481 HydrophobicContact CG-CD2 4.36Å; L477-Y481 HydrophobicContact CG-CE2 3.92Å; L477-Y481 PolarHBondContact O-N 3.3Å; L477-Y481 VanDerWaalsContact O-N 3.08Å; A478-Y481 PolarHBondContact O-N 3.4Å; S479-Y481 VanDerWaalsContact C-N 3.3Å; S479-Y481 PolarHBondContact O-N 3.14Å; Y481-M485 HydrophobicContact CD1-CB 4.45Å; Y481-M485 HydrophobicContact CD1-CG 4.5Å; Y481-M485 HydrophobicContact CD1-SD 3.74Å; Y481-M485 HydrophobicContact CE1-SD 3.86Å; Y481-N486 PolarHBondContact O-N 3.06Å; Y481-Q487 HydrophobicContact CD1-CB 4.41Å; Y481-Q487 HydrophobicContact CG-CB 4.14Å; Y481-Q487 PolarHBondContact O-N 2.98Å; Y481-D490 HydrophobicContact CD2-CB 3.68Å; Y481-D490 HydrophobicContact CE2-CB 3.95Å; Y481-L494 HydrophobicContact CD2-CD1 3.71Å; Y481-L494 HydrophobicContact CE2-CD1 3.72Å
482N97.9Very high97.6Very high2 Ų239 Ų391%0.01119%0.186CC..Hα-helixtrans-74.5-49.3-177.5-17321.1000112.8A478 S479 Y488 A491 Y495 G519 L523A478-N482 VanDerWaalsContact O-CB 3.23Å; A478-N482 WeakPolarHBondContact O-CB 3.41Å; A478-N482 PolarHBondContact O-N 2.98Å; S479-N482 PolarHBondContact O-N 2.94Å; S479-N482 VanDerWaalsContact O-N 3.16Å; N482-Y488 WeakPolarHBondContact O-CE1 3.44Å; N482-A491 HydrophobicContact CB-CB 3.88Å; N482-Y495 HydrophobicContact CB-CE2 3.99Å; N482-G519 PolarHBondContact ND2-O 2.9Å; N482-L523 WeakPolarHBondContact OD1-CA 3.5Å; N482-L523 WeakPolarHBondContact OD1-CB 3.44Å
483Y96.1Very high97.7Very high107 Ų10743.6 Ų43.642%0.4220%0.2SC..Hα-helixtrans-86.3-32.8-170.4-75.1-89.1000113S479 K522S479-Y483 WeakPolarHBondContact O-CB 3.48Å; S479-Y483 WeakPolarHBondContact O-CD2 3.5Å; S479-Y483 PolarHBondContact O-N 2.81Å; Y483-K522 HydrophobicContact CD1-CG 4.34Å; Y483-K522 HydrophobicContact CE1-CB 4.37Å; Y483-K522 HydrophobicContact CE1-CD 4.29Å; Y483-K522 HydrophobicContact CE1-CG 3.67Å
484D96.8Very high97.8Very high53 Ų5345 Ų4528%0.28321%0.207SC..THydrogen-bonded Turntrans-120.3-32.1-166.4-59.1-68.6000114.1Q440 F445 L480Q440-D484 WeakPolarHBondContact CG-OD2 3.45Å; Q440-D484 PolarHBondContact NE2-OD2 3.12Å; F445-D484 HydrophobicContact CD1-CB 3.61Å; F445-D484 HydrophobicContact CD2-CB 4.3Å; F445-D484 HydrophobicContact CE1-CB 3.41Å; F445-D484 VanDerWaalsContact CE1-CB 3.41Å; F445-D484 VanDerWaalsContact CE1-OD1 3.32Å; F445-D484 WeakPolarHBondContact CE1-OD1 3.33Å; F445-D484 HydrophobicContact CE2-CB 4.14Å; F445-D484 HydrophobicContact CG-CB 4.05Å; F445-D484 HydrophobicContact CZ-CB 3.69Å; F445-D484 WeakPolarHBondContact CZ-OD1 3.42Å; L480-D484 HydrophobicContact CD1-CB 4.19Å; L480-D484 PolarHBondContact O-N 3.37Å; L480-D484 VanDerWaalsContact O-N 3.13Å
485M97.1Very high97.8Very high49 Ų4945 Ų4524%0.24121%0.207CC..SBendtrans-103.9-7.1-175.9-53.6-172.994.100114.7F445 L480 Y481 Q487F445-M485 HydrophobicContact CB-CE 4.49Å; F445-M485 HydrophobicContact CB-CG 4.38Å; L480-M485 HydrophobicContact CD2-SD 4.23Å; L480-M485 HydrophobicContact CG-CG 4.32Å; L480-M485 HydrophobicContact CG-SD 4.05Å; L480-M485 PolarHBondContact O-N 3.35Å; L480-M485 VanDerWaalsContact O-N 3.14Å; Y481-M485 HydrophobicContact CD1-CB 4.45Å; Y481-M485 HydrophobicContact CD1-CG 4.5Å; Y481-M485 HydrophobicContact CD1-SD 3.74Å; Y481-M485 HydrophobicContact CE1-SD 3.86Å; M485-Q487 HydrophobicContact CB-CG 4.13Å; M485-Q487 PolarHBondContact O-N 3.08Å
486N95.8Very high97.9Very high104 Ų10448.2 Ų48.256%0.55622%0.224SC*.  trans55.929.8-176.5-57.6-79000114.1Y481 Y488Y481-N486 PolarHBondContact O-N 3.06Å; N486-Y488 HydrophobicContact CB-CE2 3.98Å; N486-Y488 PolarHBondContact O-N 2.88Å; N486-Y488 PolarHBondContact OD1-OH 3.42Å
487Q97.7Very high97.9Very high66 Ų6649.6 Ų49.631%0.30823%0.227SC..  trans-94.467.1177.6-65.3-174.157.600109.8Y481 M485 E489 D490 A491Y481-Q487 HydrophobicContact CD1-CB 4.41Å; Y481-Q487 HydrophobicContact CG-CB 4.14Å; Y481-Q487 PolarHBondContact O-N 2.98Å; M485-Q487 HydrophobicContact CB-CG 4.13Å; M485-Q487 PolarHBondContact O-N 3.08Å; Q487-E489 PolarHBondContact O-N 3.28Å; Q487-D490 HydrophobicContact CB-CB 4.44Å; Q487-D490 PolarHBondContact O-N 2.94Å; Q487-A491 WeakPolarHBondContact O-CB 3.41Å; Q487-A491 PolarHBondContact O-N 2.93Å
488Y97.8Very high97.9Very high46 Ų4649.6 Ų49.618%0.1823%0.228CC..Hα-helixtrans-65-37.5-169.1-59.3-63.9000113.7N482 N486 D490 A491 E492 L523 L527N482-Y488 WeakPolarHBondContact O-CE1 3.44Å; N486-Y488 HydrophobicContact CB-CE2 3.98Å; N486-Y488 PolarHBondContact O-N 2.88Å; N486-Y488 PolarHBondContact OD1-OH 3.42Å; Y488-D490 PolarHBondContact O-N 2.64Å; Y488-A491 PolarHBondContact O-N 2.87Å; Y488-E492 WeakPolarHBondContact O-CB 3.43Å; Y488-E492 PolarHBondContact O-N 3.29Å; Y488-L523 HydrophobicContact CD1-CG 3.93Å; Y488-L523 HydrophobicContact CG-CG 4.45Å; Y488-L523 WeakPolarHBondContact O-CD1 3.27Å; Y488-L527 HydrophobicContact CD2-CD2 3.78Å; Y488-L527 HydrophobicContact CG-CD2 4.07Å; Y488-L527 HydrophobicContact CG-CG 4.41Å
489E97.6Very high97.9Very high151 Ų15150.2 Ų50.271%0.70623%0.231SC*.Hα-helixtrans-66.9-36.7179.6-65.3179.8-175.800112.8Q487 R493Q487-E489 PolarHBondContact O-N 3.28Å; E489-R493 WeakPolarHBondContact O-CG 3.42Å; E489-R493 PolarHBondContact O-N 3.18Å; E489-R493 PolarHBondContact O-NE 3.14Å
490D98.1Very high97.9Very high54 Ų5452.7 Ų52.729%0.28925%0.252SS..Hα-helixtrans-71.7-44.2174-69.7-64.5000110.8Y481 Q487 Y488 E492 R493 L494Y481-D490 HydrophobicContact CD2-CB 3.68Å; Y481-D490 HydrophobicContact CE2-CB 3.95Å; Q487-D490 HydrophobicContact CB-CB 4.44Å; Q487-D490 PolarHBondContact O-N 2.94Å; Y488-D490 PolarHBondContact O-N 2.64Å; D490-E492 PolarHBondContact O-N 3.32Å; D490-R493 PolarHBondContact O-N 3.1Å; D490-R493 IonicContact OD1-CZ 2.71Å; D490-R493 IonicContact OD1-NH1 3.22Å; D490-R493 IonicContact OD1-NH2 2.68Å; D490-R493 PolarHBondContact OD1-NH2 3.1Å; D490-L494 WeakPolarHBondContact O-CG 3.5Å; D490-L494 PolarHBondContact O-N 3.43Å
491A98.4Very high97.8Very high0 Ų052.8 Ų52.80%025%0.252CS..Hα-helixtrans-58.3-46.2176.900000112.6A478 N482 Q487 Y488 R493 L494 Y495 L523A478-A491 WeakPolarHBondContact O-CB 3.09Å; N482-A491 HydrophobicContact CB-CB 3.88Å; Q487-A491 WeakPolarHBondContact O-CB 3.41Å; Q487-A491 PolarHBondContact O-N 2.93Å; Y488-A491 PolarHBondContact O-N 2.87Å; A491-R493 PolarHBondContact O-N 3.09Å; A491-L494 PolarHBondContact O-N 3.4Å; A491-Y495 HydrophobicContact CB-CD2 4.47Å; A491-Y495 HydrophobicContact CB-CE2 4.42Å; A491-Y495 VanDerWaalsContact O-CD2 3.23Å; A491-Y495 WeakPolarHBondContact O-CD2 3.37Å; A491-Y495 PolarHBondContact O-N 2.91Å; A491-L523 HydrophobicContact CB-CD1 3.74Å
492E98.4Very high97.6Very high54 Ų5451.9 Ų51.925%0.25225%0.249SC..Hα-helixtrans-58.8-47.5178.9-176.6-179.9-165.500111.1Y488 D490 L494 Y495 L496 L520 L523 Y524Y488-E492 WeakPolarHBondContact O-CB 3.43Å; Y488-E492 PolarHBondContact O-N 3.29Å; D490-E492 PolarHBondContact O-N 3.32Å; E492-L494 VanDerWaalsContact C-N 3.33Å; E492-L494 PolarHBondContact O-N 3.01Å; E492-Y495 PolarHBondContact O-N 3.28Å; E492-L496 HydrophobicContact CG-CD1 3.98Å; E492-L496 HydrophobicContact CG-CG 4.46Å; E492-L496 WeakPolarHBondContact O-CB 3.47Å; E492-L496 VanDerWaalsContact O-CG 3.25Å; E492-L496 WeakPolarHBondContact O-CG 3.38Å; E492-L496 PolarHBondContact O-N 3.05Å; E492-L520 HydrophobicContact CB-CD2 4.46Å; E492-L520 HydrophobicContact CG-CD2 4.12Å; E492-L523 HydrophobicContact CB-CD1 3.91Å; E492-L523 HydrophobicContact CB-CD2 4.37Å; E492-Y524 WeakPolarHBondContact OE1-CE1 3.47Å; E492-Y524 VanDerWaalsContact OE1-CZ 3.23Å; E492-Y524 PolarHBondContact OE1-OH 3.29Å
493R98.6Very high97.4Very high152 Ų15255.2 Ų55.257%0.57426%0.264SS*.Hα-helixtrans-59.3-43.3177.7-76.6-175-76.7153.6-11.5112.2E489 D490 A491 R497E489-R493 WeakPolarHBondContact O-CG 3.42Å; E489-R493 PolarHBondContact O-N 3.18Å; E489-R493 PolarHBondContact O-NE 3.14Å; D490-R493 PolarHBondContact O-N 3.1Å; D490-R493 IonicContact OD1-CZ 2.71Å; D490-R493 IonicContact OD1-NH1 3.22Å; D490-R493 IonicContact OD1-NH2 2.68Å; D490-R493 PolarHBondContact OD1-NH2 3.1Å; A491-R493 PolarHBondContact O-N 3.09Å; R493-R497 WeakPolarHBondContact O-CB 3.41Å; R493-R497 PolarHBondContact O-N 3.34Å
494L98.6Very high97.3Very high32 Ų3256.8 Ų56.817%0.16827%0.273CS..Hα-helixtrans-69.8-43.9-180-66.8176.3000111.9V474 L477 A478 Y481 D490 A491 E492 L496 R497 S498V474-L494 HydrophobicContact CG1-CB 3.76Å; V474-L494 HydrophobicContact CG1-CD2 3.79Å; V474-L494 HydrophobicContact CG1-CG 4.32Å; V474-L494 WeakPolarHBondContact CG1-O 3.41Å; L477-L494 HydrophobicContact CB-CD1 4.19Å; L477-L494 HydrophobicContact CD2-CD1 3.9Å; L477-L494 HydrophobicContact CG-CD1 3.78Å; A478-L494 HydrophobicContact CB-CB 3.59Å; A478-L494 HydrophobicContact CB-CD1 4.48Å; Y481-L494 HydrophobicContact CD2-CD1 3.71Å; Y481-L494 HydrophobicContact CE2-CD1 3.72Å; D490-L494 WeakPolarHBondContact O-CG 3.5Å; D490-L494 PolarHBondContact O-N 3.43Å; A491-L494 PolarHBondContact O-N 3.4Å; E492-L494 VanDerWaalsContact C-N 3.33Å; E492-L494 PolarHBondContact O-N 3.01Å; L494-L496 PolarHBondContact O-N 3.24Å; L494-R497 WeakPolarHBondContact O-CB 3.24Å; L494-R497 PolarHBondContact O-N 2.92Å; L494-S498 PolarHBondContact O-N 2.88Å
495Y98.6Very high97Very high0 Ų056.5 Ų56.50%027%0.271CS..Hα-helixtrans-59.8-47174.8-79.8-52.4000112.1A478 S479 N482 A491 E492 R497 S498 I499 Y515 D516 G519 L520 L523A478-Y495 HydrophobicContact CB-CD1 3.57Å; A478-Y495 HydrophobicContact CB-CD2 3.75Å; A478-Y495 HydrophobicContact CB-CE1 3.63Å; A478-Y495 HydrophobicContact CB-CE2 3.81Å; A478-Y495 HydrophobicContact CB-CG 3.64Å; S479-Y495 WeakPolarHBondContact CA-OH 3.43Å; S479-Y495 PolarHBondContact N-OH 2.86Å; N482-Y495 HydrophobicContact CB-CE2 3.99Å; A491-Y495 HydrophobicContact CB-CD2 4.47Å; A491-Y495 HydrophobicContact CB-CE2 4.42Å; A491-Y495 VanDerWaalsContact O-CD2 3.23Å; A491-Y495 WeakPolarHBondContact O-CD2 3.37Å; A491-Y495 PolarHBondContact O-N 2.91Å; E492-Y495 PolarHBondContact O-N 3.28Å; Y495-R497 VanDerWaalsContact C-N 3.26Å; Y495-R497 PolarHBondContact O-N 2.93Å; Y495-S498 PolarHBondContact O-N 3.34Å; Y495-I499 WeakPolarHBondContact O-CB 3.47Å; Y495-I499 WeakPolarHBondContact O-CD1 3.48Å; Y495-I499 VanDerWaalsContact O-CG1 3.3Å; Y495-I499 WeakPolarHBondContact O-CG1 3.39Å; Y495-I499 PolarHBondContact O-N 2.83Å; Y495-Y515 HydrophobicContact CE1-CE1 4.42Å; Y495-D516 HydrophobicContact CD1-CB 3.84Å; Y495-D516 WeakPolarHBondContact CD1-OD1 3.35Å; Y495-D516 HydrophobicContact CE1-CB 4.47Å; Y495-G519 WeakPolarHBondContact OH-CA 3.39Å; Y495-L520 HydrophobicContact CD2-CD2 3.96Å; Y495-L520 HydrophobicContact CD2-CG 4.21Å; Y495-L520 HydrophobicContact CG-CD2 4.21Å; Y495-L520 HydrophobicContact CG-CG 4.18Å; Y495-L523 HydrophobicContact CD2-CD1 4.49Å
496L98.4Very high96.6Very high69 Ų6956.1 Ų56.136%0.36127%0.268SS..Hα-helixtrans-61-37.5177.7-70.7175000112E492 L494 A500 L520 Y536E492-L496 HydrophobicContact CG-CD1 3.98Å; E492-L496 HydrophobicContact CG-CG 4.46Å; E492-L496 WeakPolarHBondContact O-CB 3.47Å; E492-L496 VanDerWaalsContact O-CG 3.25Å; E492-L496 WeakPolarHBondContact O-CG 3.38Å; E492-L496 PolarHBondContact O-N 3.05Å; L494-L496 PolarHBondContact O-N 3.24Å; L496-A500 VanDerWaalsContact O-CB 3.31Å; L496-A500 WeakPolarHBondContact O-CB 3.46Å; L496-A500 PolarHBondContact O-N 3.35Å; L496-L520 HydrophobicContact CD2-CD1 4.03Å; L496-Y536 VanDerWaalsContact CD2-OH 3.32Å; L496-Y536 WeakPolarHBondContact CD2-OH 3.34Å
497R98.1Very high96.3Very high67 Ų6752.6 Ų52.625%0.25326%0.256SS..Hα-helixtrans-63.7-47.9173.6-178.5179.6175.3-158.5-4.7111.8E460 Q465 V474 R493 L494 Y495 I499 A500 I501E460-R497 IonicContact OE1-CZ 3.77Å; E460-R497 IonicContact OE1-NH1 3.23Å; E460-R497 PolarHBondContact OE1-NH1 2.92Å; E460-R497 IonicContact OE1-NH2 3.53Å; E460-R497 PolarHBondContact OE1-NH2 3.25Å; Q465-R497 PolarHBondContact O-NH2 3.25Å; V474-R497 HydrophobicContact CG1-CB 4.36Å; V474-R497 HydrophobicContact CG1-CG 4.5Å; R493-R497 WeakPolarHBondContact O-CB 3.41Å; R493-R497 PolarHBondContact O-N 3.34Å; L494-R497 WeakPolarHBondContact O-CB 3.24Å; L494-R497 PolarHBondContact O-N 2.92Å; Y495-R497 VanDerWaalsContact C-N 3.26Å; Y495-R497 PolarHBondContact O-N 2.93Å; R497-I499 PolarHBondContact O-N 3.41Å; R497-A500 PolarHBondContact O-N 3.23Å; R497-I501 HydrophobicContact CG-CD1 4.11Å; R497-I501 WeakPolarHBondContact O-CG1 3.03Å; R497-I501 PolarHBondContact O-N 3.48Å; R497-I501 VanDerWaalsContact O-N 3.13Å
498S98.2Very high96Very high8 Ų853.9 Ų53.96%0.05626%0.262CS..Hα-helixtrans-58.1-48.1176.7179.50000111.5A471 L494 Y495 A500 I501 G502 D516A471-S498 PolarHBondContact O-OG 3.48Å; L494-S498 PolarHBondContact O-N 2.88Å; Y495-S498 PolarHBondContact O-N 3.34Å; S498-A500 PolarHBondContact O-N 2.9Å; S498-I501 PolarHBondContact O-N 2.88Å; S498-G502 PolarHBondContact O-N 2.88Å; S498-D516 WeakPolarHBondContact CB-OD2 3.4Å; S498-D516 PolarHBondContact OG-OD2 3.15Å
499I98.1Very high95.5Very high13 Ų1352.1 Ų52.17%0.06726%0.258CS..Hα-helixtrans-59.7-45.3177.6-70.8161.6000111.4Y495 R497 I501 G502 K503 L513 D516 Y517 L520Y495-I499 WeakPolarHBondContact O-CB 3.47Å; Y495-I499 WeakPolarHBondContact O-CD1 3.48Å; Y495-I499 VanDerWaalsContact O-CG1 3.3Å; Y495-I499 WeakPolarHBondContact O-CG1 3.39Å; Y495-I499 PolarHBondContact O-N 2.83Å; R497-I499 PolarHBondContact O-N 3.41Å; I499-I501 PolarHBondContact O-N 3.02Å; I499-G502 PolarHBondContact O-N 3.13Å; I499-K503 HydrophobicContact CG2-CD 3.66Å; I499-K503 HydrophobicContact CG2-CG 4.26Å; I499-K503 WeakPolarHBondContact O-CB 3.45Å; I499-K503 VanDerWaalsContact O-CG 3.32Å; I499-K503 WeakPolarHBondContact O-CG 3.43Å; I499-K503 PolarHBondContact O-N 3.41Å; I499-L513 HydrophobicContact CB-CD2 4.42Å; I499-L513 HydrophobicContact CG1-CD2 4.38Å; I499-L513 HydrophobicContact CG2-CD2 4.31Å; I499-D516 HydrophobicContact CD1-CB 3.73Å; I499-D516 HydrophobicContact CG1-CB 3.48Å; I499-D516 VanDerWaalsContact CG1-CB 3.48Å; I499-Y517 HydrophobicContact CD1-CD1 3.72Å; I499-Y517 HydrophobicContact CD1-CE1 3.71Å; I499-Y517 HydrophobicContact CG1-CD1 4.34Å; I499-Y517 HydrophobicContact CG1-CE1 4.04Å; I499-Y517 HydrophobicContact CG2-CE1 3.94Å; I499-L520 HydrophobicContact CD1-CD1 3.5Å; I499-L520 VanDerWaalsContact CD1-CD1 3.5Å
500A97.9Very high95.1Very high59 Ų5946 Ų4649%0.48823%0.228SC..Hα-helixtrans-60.9-45.3-179.400000111.7L496 R497 S498 K504L496-A500 VanDerWaalsContact O-CB 3.31Å; L496-A500 WeakPolarHBondContact O-CB 3.46Å; L496-A500 PolarHBondContact O-N 3.35Å; R497-A500 PolarHBondContact O-N 3.23Å; S498-A500 PolarHBondContact O-N 2.9Å; A500-K504 WeakPolarHBondContact O-CB 3.34Å; A500-K504 PolarHBondContact O-N 3.16Å; A500-K504 VanDerWaalsContact O-N 3.13Å
501I96.8Very high94.6Very high1 Ų145 Ų451%0.00523%0.225CC..Hα-helixtrans-65.4-47.8176.5-62.7166.4000110.4Q465 E466 A471 R497 S498 I499 K503 K504 L505Q465-I501 WeakPolarHBondContact O-CD1 3.44Å; E466-I501 VanDerWaalsContact O-CG2 3.27Å; E466-I501 WeakPolarHBondContact O-CG2 3.35Å; A471-I501 HydrophobicContact CB-CB 3.83Å; A471-I501 HydrophobicContact CB-CD1 4.13Å; A471-I501 HydrophobicContact CB-CG2 3.72Å; R497-I501 HydrophobicContact CG-CD1 4.11Å; R497-I501 WeakPolarHBondContact O-CG1 3.03Å; R497-I501 PolarHBondContact O-N 3.48Å; R497-I501 VanDerWaalsContact O-N 3.13Å; S498-I501 PolarHBondContact O-N 2.88Å; I499-I501 PolarHBondContact O-N 3.02Å; I501-K503 PolarHBondContact O-N 3.42Å; I501-K504 PolarHBondContact O-N 3.14Å; I501-L505 HydrophobicContact CG2-CD1 3.77Å; I501-L505 HydrophobicContact CG2-CG 4.32Å; I501-L505 WeakPolarHBondContact O-CG 3.24Å; I501-L505 PolarHBondContact O-N 2.97Å
502G94.4Very high94.1Very high2 Ų245.9 Ų45.92%0.02123%0.234CC..Hα-helixtrans-57.4-48.1179.800000112.6S498 I499 K504 L505 F506S498-G502 PolarHBondContact O-N 2.88Å; I499-G502 PolarHBondContact O-N 3.13Å; G502-K504 PolarHBondContact O-N 3.4Å; G502-L505 PolarHBondContact O-N 3.37Å; G502-F506 PolarHBondContact O-N 3.29Å
503K94.3Very high93.8Very high72 Ų7243.3 Ų43.331%0.31322%0.223SC..Hα-helixtrans-61.4-42176.7-75.4173.956.6131.40112.6I499 I501 L505 G507 E508 L513I499-K503 HydrophobicContact CG2-CD 3.66Å; I499-K503 HydrophobicContact CG2-CG 4.26Å; I499-K503 WeakPolarHBondContact O-CB 3.45Å; I499-K503 VanDerWaalsContact O-CG 3.32Å; I499-K503 WeakPolarHBondContact O-CG 3.43Å; I499-K503 PolarHBondContact O-N 3.41Å; I501-K503 PolarHBondContact O-N 3.42Å; K503-L505 VanDerWaalsContact C-N 3.34Å; K503-L505 PolarHBondContact O-N 2.8Å; K503-G507 WeakPolarHBondContact O-CA 3.33Å; K503-G507 PolarHBondContact O-N 3.22Å; K503-E508 VanDerWaalsContact CE-CD 3.43Å; K503-E508 WeakPolarHBondContact CE-OE1 3.3Å; K503-E508 WeakPolarHBondContact CE-OE2 3.35Å; K503-E508 IonicContact NZ-OE1 3.59Å; K503-E508 PolarHBondContact NZ-OE1 2.79Å; K503-E508 IonicContact NZ-OE2 3.88Å; K503-E508 PolarHBondContact NZ-OE2 2.9Å; K503-L513 HydrophobicContact CG-CD1 3.9Å; K503-L513 HydrophobicContact CG-CD2 4.2Å
504K93.9Very high93.6Very high141 Ų14138 Ų3861%0.61320%0.204SC*.Hα-helixtrans-64.2-37.9179.6178.3179.3170.8-175.30112.4E466 A500 I501 G502E466-K504 IonicContact OE2-NZ 3.49Å; E466-K504 PolarHBondContact OE2-NZ 3.04Å; A500-K504 WeakPolarHBondContact O-CB 3.34Å; A500-K504 PolarHBondContact O-N 3.16Å; A500-K504 VanDerWaalsContact O-N 3.13Å; I501-K504 PolarHBondContact O-N 3.14Å; G502-K504 PolarHBondContact O-N 3.4Å
505L91Very high93.3Very high46 Ų4640.3 Ų40.324%0.24121%0.211CC..Hα-helixtrans-89.9-34.2-174.8-64.4-179.2000114.1R260 I501 G502 K503R260-L505 HydrophobicContact CG-CD2 4.32Å; I501-L505 HydrophobicContact CG2-CD1 3.77Å; I501-L505 HydrophobicContact CG2-CG 4.32Å; I501-L505 WeakPolarHBondContact O-CG 3.24Å; I501-L505 PolarHBondContact O-N 2.97Å; G502-L505 PolarHBondContact O-N 3.37Å; K503-L505 VanDerWaalsContact C-N 3.34Å; K503-L505 PolarHBondContact O-N 2.8Å
506F87.9Confident93.2Very high42 Ų4240.7 Ų40.718%0.18421%0.213CC..Hα-helixtrans-123.5-11-171.1-57.8-88.4000113.9F262 N300 Y468 G502 Y510F262-F506 AromaticContact CE2-CD1 3.87Å; F262-F506 HydrophobicContact CE2-CD1 3.87Å; F262-F506 AromaticContact CE2-CE1 3.79Å; F262-F506 HydrophobicContact CE2-CE1 3.79Å; F262-F506 AromaticContact CZ-CD1 4Å; F262-F506 HydrophobicContact CZ-CD1 4Å; F262-F506 AromaticContact CZ-CE1 3.45Å; F262-F506 HydrophobicContact CZ-CE1 3.45Å; F262-F506 VanDerWaalsContact CZ-CE1 3.45Å; F262-F506 HydrophobicContact CZ-CZ 4.21Å; N300-F506 WeakPolarHBondContact O-CE1 3.44Å; Y468-F506 HydrophobicContact CD1-CZ 4.43Å; Y468-F506 HydrophobicContact CD2-CD2 4.34Å; Y468-F506 AromaticContact CD2-CE2 3.23Å; Y468-F506 HydrophobicContact CD2-CE2 3.23Å; Y468-F506 AromaticContact CD2-CZ 3.53Å; Y468-F506 HydrophobicContact CD2-CZ 3.53Å; Y468-F506 AromaticContact CE2-CE2 3.73Å; Y468-F506 HydrophobicContact CE2-CE2 3.73Å; Y468-F506 AromaticContact CE2-CZ 3.82Å; Y468-F506 HydrophobicContact CE2-CZ 3.82Å; Y468-F506 AromaticContact CG-CE2 3.83Å; Y468-F506 HydrophobicContact CG-CE2 3.83Å; Y468-F506 AromaticContact CG-CZ 3.8Å; Y468-F506 HydrophobicContact CG-CZ 3.8Å; G502-F506 PolarHBondContact O-N 3.29Å; F506-Y510 HydrophobicContact CB-CD1 4.4Å; F506-Y510 HydrophobicContact CB-CD2 3.91Å; F506-Y510 HydrophobicContact CB-CG 3.69Å; F506-Y510 HydrophobicContact CD1-CD2 4.19Å; F506-Y510 HydrophobicContact CD1-CE2 4.49Å; F506-Y510 HydrophobicContact CD2-CD1 4.27Å; F506-Y510 HydrophobicContact CD2-CD2 4.35Å; F506-Y510 HydrophobicContact CD2-CE1 4.49Å; F506-Y510 HydrophobicContact CD2-CG 4.23Å; F506-Y510 HydrophobicContact CG-CD1 4.48Å; F506-Y510 AromaticContact CG-CD2 3.9Å; F506-Y510 HydrophobicContact CG-CD2 3.9Å; F506-Y510 HydrophobicContact CG-CE2 4.4Å; F506-Y510 AromaticContact CG-CG 3.99Å; F506-Y510 HydrophobicContact CG-CG 3.99Å
507G89.9Confident93.2Very high29 Ų2937.7 Ų37.730%0.29920%0.197SC..  trans85.2-177.2-176.200000114.2K503 G509K503-G507 WeakPolarHBondContact O-CA 3.33Å; K503-G507 PolarHBondContact O-N 3.22Å; G507-G509 VanDerWaalsContact C-N 3.25Å; G507-G509 PolarHBondContact O-N 2.88Å
508E90.4Very high93.1Very high94 Ų9440.5 Ų40.544%0.43921%0.208SC..THydrogen-bonded Turntrans-71.5-15.4-173.2-58.6-71.5174.500114K503 W543 L546K503-E508 VanDerWaalsContact CE-CD 3.43Å; K503-E508 WeakPolarHBondContact CE-OE1 3.3Å; K503-E508 WeakPolarHBondContact CE-OE2 3.35Å; K503-E508 IonicContact NZ-OE1 3.59Å; K503-E508 PolarHBondContact NZ-OE1 2.79Å; K503-E508 IonicContact NZ-OE2 3.88Å; K503-E508 PolarHBondContact NZ-OE2 2.9Å; E508-W543 VanDerWaalsContact O-CD1 3.27Å; E508-L546 HydrophobicContact CB-CD1 3.95Å
509G87.3Confident93Very high8 Ų840.2 Ų40.28%0.08221%0.206CC..THydrogen-bonded Turntrans-96.59.8-177.700000114.5G507 R547G507-G509 VanDerWaalsContact C-N 3.25Å; G507-G509 PolarHBondContact O-N 2.88Å; G509-R547 WeakPolarHBondContact O-CD 3.31Å; G509-R547 PolarHBondContact O-NH1 2.92Å
510Y89.4Confident93Very high24 Ų2439.6 Ų39.69%0.09420%0.203CC..  trans-71.1135.2-176.8173.2-123.2000112.6D302 Y468 F506 G512 L513 W543D302-Y510 HydrophobicContact CB-CD2 4.36Å; D302-Y510 VanDerWaalsContact OD2-CD2 3.32Å; D302-Y510 WeakPolarHBondContact OD2-CD2 3.49Å; Y468-Y510 HydrophobicContact CE2-CE1 4.18Å; Y468-Y510 AromaticContact CE2-CZ 3.74Å; Y468-Y510 WeakPolarHBondContact CE2-OH 3.49Å; Y468-Y510 PolarHBondContact OH-OH 3.4Å; F506-Y510 HydrophobicContact CB-CD1 4.4Å; F506-Y510 HydrophobicContact CB-CD2 3.91Å; F506-Y510 HydrophobicContact CB-CG 3.69Å; F506-Y510 HydrophobicContact CD1-CD2 4.19Å; F506-Y510 HydrophobicContact CD1-CE2 4.49Å; F506-Y510 HydrophobicContact CD2-CD1 4.27Å; F506-Y510 HydrophobicContact CD2-CD2 4.35Å; F506-Y510 HydrophobicContact CD2-CE1 4.49Å; F506-Y510 HydrophobicContact CD2-CG 4.23Å; F506-Y510 HydrophobicContact CG-CD1 4.48Å; F506-Y510 AromaticContact CG-CD2 3.9Å; F506-Y510 HydrophobicContact CG-CD2 3.9Å; F506-Y510 HydrophobicContact CG-CE2 4.4Å; F506-Y510 AromaticContact CG-CG 3.99Å; F506-Y510 HydrophobicContact CG-CG 3.99Å; Y510-G512 VanDerWaalsContact CE1-CA 3.41Å; Y510-G512 PolarHBondContact O-N 3.39Å; Y510-L513 HydrophobicContact CD1-CD2 4.37Å; Y510-L513 HydrophobicContact CD1-CG 3.99Å; Y510-L513 WeakPolarHBondContact O-CB 3.08Å; Y510-L513 PolarHBondContact O-N 3.23Å; Y510-W543 PolarHBondContact O-NE1 2.84Å
511S87.3Confident93.1Very high31 Ų3137.7 Ų37.722%0.21718%0.184CC..THydrogen-bonded Turntrans-62.1-40.4-174.154.70000113.6D302 L513 E514D302-S511 WeakPolarHBondContact OD1-CB 3.19Å; D302-S511 PolarHBondContact OD1-OG 3.15Å; D302-S511 WeakPolarHBondContact OD2-CB 3.38Å; D302-S511 PolarHBondContact OD2-N 3.24Å; D302-S511 PolarHBondContact OD2-OG 3.45Å; D302-S511 VanDerWaalsContact OD2-OG 3.09Å; S511-L513 PolarHBondContact O-N 3.28Å; S511-L513 VanDerWaalsContact O-N 3.12Å; S511-E514 WeakPolarHBondContact O-CB 3.49Å; S511-E514 PolarHBondContact O-N 3.02Å; S511-E514 VanDerWaalsContact O-N 3.12Å
512G87.9Confident93.1Very high19 Ų1941.9 Ų41.920%0.19620%0.202CC..THydrogen-bonded Turntrans-63.5-19.5-178.700000114Y510 E514 Y515Y510-G512 VanDerWaalsContact CE1-CA 3.41Å; Y510-G512 PolarHBondContact O-N 3.39Å; G512-E514 PolarHBondContact O-N 3.12Å; G512-Y515 PolarHBondContact O-N 2.94Å
513L93.3Very high93.2Very high1 Ų141.8 Ų41.81%0.00520%0.201CC..Hα-helixtrans-64.4-27176.2-61.4177.6000112.4I499 K503 Y510 S511 Y515 D516 Y517I499-L513 HydrophobicContact CB-CD2 4.42Å; I499-L513 HydrophobicContact CG1-CD2 4.38Å; I499-L513 HydrophobicContact CG2-CD2 4.31Å; K503-L513 HydrophobicContact CG-CD1 3.9Å; K503-L513 HydrophobicContact CG-CD2 4.2Å; Y510-L513 HydrophobicContact CD1-CD2 4.37Å; Y510-L513 HydrophobicContact CD1-CG 3.99Å; Y510-L513 WeakPolarHBondContact O-CB 3.08Å; Y510-L513 PolarHBondContact O-N 3.23Å; S511-L513 PolarHBondContact O-N 3.28Å; S511-L513 VanDerWaalsContact O-N 3.12Å; L513-Y515 VanDerWaalsContact C-N 3.3Å; L513-Y515 PolarHBondContact O-N 2.81Å; L513-D516 PolarHBondContact O-N 3.49Å; L513-Y517 HydrophobicContact CB-CD2 4.08Å; L513-Y517 HydrophobicContact CB-CE2 3.59Å; L513-Y517 HydrophobicContact CD1-CE2 4.37Å; L513-Y517 WeakPolarHBondContact O-CB 3.47Å; L513-Y517 WeakPolarHBondContact O-CD2 3.33Å; L513-Y517 PolarHBondContact O-N 2.85Å
514E93.3Very high93.4Very high41 Ų4138.7 Ų38.719%0.19219%0.188CC..Hα-helixtrans-57.3-44.9177.2176.3170.8-160.300111.8S511 G512 D516 Y517 R518 L540 W543S511-E514 WeakPolarHBondContact O-CB 3.49Å; S511-E514 PolarHBondContact O-N 3.02Å; S511-E514 VanDerWaalsContact O-N 3.12Å; G512-E514 PolarHBondContact O-N 3.12Å; E514-D516 PolarHBondContact O-N 3.44Å; E514-Y517 PolarHBondContact O-N 2.85Å; E514-R518 HydrophobicContact CG-CG 4.37Å; E514-R518 WeakPolarHBondContact O-CB 3.46Å; E514-R518 VanDerWaalsContact O-CG 3.29Å; E514-R518 WeakPolarHBondContact O-CG 3.4Å; E514-R518 PolarHBondContact O-N 2.96Å; E514-R518 IonicContact OE1-CZ 3.88Å; E514-R518 VanDerWaalsContact OE1-CZ 3.23Å; E514-R518 IonicContact OE1-NE 2.76Å; E514-R518 PolarHBondContact OE1-NE 3.26Å; E514-R518 IonicContact OE1-NH2 3.84Å; E514-R518 PolarHBondContact OE1-NH2 2.7Å; E514-L540 HydrophobicContact CB-CD1 4.41Å; E514-L540 HydrophobicContact CG-CD1 4.04Å; E514-W543 HydrophobicContact CB-CE3 4.38Å; E514-W543 HydrophobicContact CB-CH2 3.53Å; E514-W543 HydrophobicContact CB-CZ2 3.75Å; E514-W543 HydrophobicContact CB-CZ3 3.83Å; E514-W543 HydrophobicContact CG-CH2 3.99Å; E514-W543 HydrophobicContact CG-CZ3 3.97Å; E514-W543 VanDerWaalsContact OE2-CH2 3.25Å; E514-W543 WeakPolarHBondContact OE2-CH2 3.33Å
515Y92.8Very high93.6Very high80 Ų8035.9 Ų35.931%0.31418%0.18SC..Hα-helixtrans-59.6-48.6-178.8-176-92.6000111.1S479 Y495 G512 L513 R518 G519S479-Y515 WeakPolarHBondContact CB-OH 3.49Å; S479-Y515 PolarHBondContact OG-OH 3.18Å; Y495-Y515 HydrophobicContact CE1-CE1 4.42Å; G512-Y515 PolarHBondContact O-N 2.94Å; L513-Y515 VanDerWaalsContact C-N 3.3Å; L513-Y515 PolarHBondContact O-N 2.81Å; Y515-R518 PolarHBondContact O-N 3.2Å; Y515-G519 PolarHBondContact O-N 2.72Å
516D96.5Very high93.8Very high7 Ų736.2 Ų36.24%0.03719%0.186CC..Hα-helixtrans-69.3-40.4-178.6-64.3-29.5000112.1Y495 S498 I499 L513 E514 G519 L520Y495-D516 HydrophobicContact CD1-CB 3.84Å; Y495-D516 WeakPolarHBondContact CD1-OD1 3.35Å; Y495-D516 HydrophobicContact CE1-CB 4.47Å; S498-D516 WeakPolarHBondContact CB-OD2 3.4Å; S498-D516 PolarHBondContact OG-OD2 3.15Å; I499-D516 HydrophobicContact CD1-CB 3.73Å; I499-D516 HydrophobicContact CG1-CB 3.48Å; I499-D516 VanDerWaalsContact CG1-CB 3.48Å; L513-D516 PolarHBondContact O-N 3.49Å; E514-D516 PolarHBondContact O-N 3.44Å; D516-G519 WeakPolarHBondContact O-CA 3.17Å; D516-G519 PolarHBondContact O-N 2.51Å; D516-L520 PolarHBondContact O-N 3.34Å
517Y97.5Very high94.2Very high7 Ų738.7 Ų38.73%0.02720%0.2CC..Hα-helixtrans-63.4-42.8175.9-66.7-32.8000112.2I499 L513 E514 G519 L520 I521 Y536 I539 L540 W543I499-Y517 HydrophobicContact CD1-CD1 3.72Å; I499-Y517 HydrophobicContact CD1-CE1 3.71Å; I499-Y517 HydrophobicContact CG1-CD1 4.34Å; I499-Y517 HydrophobicContact CG1-CE1 4.04Å; I499-Y517 HydrophobicContact CG2-CE1 3.94Å; L513-Y517 HydrophobicContact CB-CD2 4.08Å; L513-Y517 HydrophobicContact CB-CE2 3.59Å; L513-Y517 HydrophobicContact CD1-CE2 4.37Å; L513-Y517 WeakPolarHBondContact O-CB 3.47Å; L513-Y517 WeakPolarHBondContact O-CD2 3.33Å; L513-Y517 PolarHBondContact O-N 2.85Å; E514-Y517 PolarHBondContact O-N 2.85Å; Y517-G519 VanDerWaalsContact C-N 3.29Å; Y517-G519 PolarHBondContact O-N 3.41Å; Y517-L520 PolarHBondContact O-N 2.98Å; Y517-I521 VanDerWaalsContact O-CG1 3.29Å; Y517-I521 WeakPolarHBondContact O-CG1 3.35Å; Y517-I521 PolarHBondContact O-N 3.47Å; Y517-Y536 AromaticContact CD1-CD1 3.85Å; Y517-Y536 HydrophobicContact CD1-CD1 3.85Å; Y517-Y536 AromaticContact CD1-CE1 3.98Å; Y517-Y536 HydrophobicContact CD1-CE1 3.98Å; Y517-Y536 HydrophobicContact CE1-CD1 4.49Å; Y517-Y536 HydrophobicContact CE1-CE1 4.32Å; Y517-I539 HydrophobicContact CD1-CG2 4.08Å; Y517-I539 HydrophobicContact CD2-CG2 4.02Å; Y517-I539 HydrophobicContact CE1-CG2 3.73Å; Y517-I539 HydrophobicContact CE2-CG2 3.64Å; Y517-I539 HydrophobicContact CG-CG2 4.23Å; Y517-L540 HydrophobicContact CD2-CD1 4.37Å; Y517-W543 HydrophobicContact CE2-CB 4.36Å; Y517-W543 HydrophobicContact CE2-CG 4.41Å
518R96.6Very high94.6Very high126 Ų12639 Ų3948%0.47520%0.204SC..Hα-helixtrans-63.1-39174.1-72.7177.7179.9-81.32.2111.4E514 Y515 I521 K522 L540E514-R518 HydrophobicContact CG-CG 4.37Å; E514-R518 WeakPolarHBondContact O-CB 3.46Å; E514-R518 VanDerWaalsContact O-CG 3.29Å; E514-R518 WeakPolarHBondContact O-CG 3.4Å; E514-R518 PolarHBondContact O-N 2.96Å; E514-R518 IonicContact OE1-CZ 3.88Å; E514-R518 VanDerWaalsContact OE1-CZ 3.23Å; E514-R518 IonicContact OE1-NE 2.76Å; E514-R518 PolarHBondContact OE1-NE 3.26Å; E514-R518 IonicContact OE1-NH2 3.84Å; E514-R518 PolarHBondContact OE1-NH2 2.7Å; Y515-R518 PolarHBondContact O-N 3.2Å; R518-I521 PolarHBondContact O-N 3.07Å; R518-K522 PolarHBondContact O-N 3.21Å; R518-L540 HydrophobicContact CG-CD2 3.99Å
519G97.2Very high94.9Very high1 Ų137.6 Ų37.61%0.0120%0.199CC..Hα-helixtrans-54.9-52.3171.400000112.3N482 Y495 Y515 D516 Y517 I521 K522 L523N482-G519 PolarHBondContact ND2-O 2.9Å; Y495-G519 WeakPolarHBondContact OH-CA 3.39Å; Y515-G519 PolarHBondContact O-N 2.72Å; D516-G519 WeakPolarHBondContact O-CA 3.17Å; D516-G519 PolarHBondContact O-N 2.51Å; Y517-G519 VanDerWaalsContact C-N 3.29Å; Y517-G519 PolarHBondContact O-N 3.41Å; G519-I521 PolarHBondContact O-N 3.11Å; G519-K522 WeakPolarHBondContact O-CB 3.39Å; G519-K522 PolarHBondContact O-N 2.68Å; G519-L523 WeakPolarHBondContact O-CB 3.32Å; G519-L523 PolarHBondContact O-N 2.74Å
520L98.3Very high95.3Very high0 Ų044.9 Ų44.90%023%0.225CC..Hα-helixtrans-63.7-40.7178.2-72.3176.1000113E492 Y495 L496 I499 D516 Y517 K522 L523 Y524 Y536E492-L520 HydrophobicContact CB-CD2 4.46Å; E492-L520 HydrophobicContact CG-CD2 4.12Å; Y495-L520 HydrophobicContact CD2-CD2 3.96Å; Y495-L520 HydrophobicContact CD2-CG 4.21Å; Y495-L520 HydrophobicContact CG-CD2 4.21Å; Y495-L520 HydrophobicContact CG-CG 4.18Å; L496-L520 HydrophobicContact CD2-CD1 4.03Å; I499-L520 HydrophobicContact CD1-CD1 3.5Å; I499-L520 VanDerWaalsContact CD1-CD1 3.5Å; D516-L520 PolarHBondContact O-N 3.34Å; Y517-L520 PolarHBondContact O-N 2.98Å; L520-K522 VanDerWaalsContact C-N 3.32Å; L520-K522 PolarHBondContact O-N 3.08Å; L520-L523 HydrophobicContact CD2-CD1 4.45Å; L520-L523 WeakPolarHBondContact O-CB 3.44Å; L520-L523 PolarHBondContact O-N 2.95Å; L520-Y524 HydrophobicContact CB-CD2 4.36Å; L520-Y524 HydrophobicContact CB-CE2 4.09Å; L520-Y524 HydrophobicContact CD2-CE2 4.26Å; L520-Y524 WeakPolarHBondContact O-CD2 3.4Å; L520-Y524 PolarHBondContact O-N 2.87Å; L520-Y536 HydrophobicContact CB-CD1 4.23Å; L520-Y536 HydrophobicContact CB-CD2 4.42Å; L520-Y536 HydrophobicContact CB-CE1 4.3Å; L520-Y536 HydrophobicContact CB-CE2 4.49Å; L520-Y536 HydrophobicContact CB-CG 4.29Å; L520-Y536 HydrophobicContact CD1-CD1 4.12Å; L520-Y536 HydrophobicContact CD1-CE1 3.41Å; L520-Y536 VanDerWaalsContact CD1-CE1 3.41Å; L520-Y536 HydrophobicContact CD1-CE2 4.26Å; L520-Y536 VanDerWaalsContact CD1-CZ 3.49Å; L520-Y536 HydrophobicContact CG-CE1 4.5Å
521I98.1Very high95.7Very high20 Ų2051.4 Ų51.410%0.10326%0.257CS..Hα-helixtrans-57.3-48.1174.4-70.4165.1000110.5Y517 R518 G519 L523 N525 V533 L540Y517-I521 VanDerWaalsContact O-CG1 3.29Å; Y517-I521 WeakPolarHBondContact O-CG1 3.35Å; Y517-I521 PolarHBondContact O-N 3.47Å; R518-I521 PolarHBondContact O-N 3.07Å; G519-I521 PolarHBondContact O-N 3.11Å; I521-L523 VanDerWaalsContact C-N 3.35Å; I521-L523 PolarHBondContact O-N 3.13Å; I521-N525 VanDerWaalsContact O-CB 3.3Å; I521-N525 WeakPolarHBondContact O-CB 3.38Å; I521-N525 PolarHBondContact O-N 3.38Å; I521-V533 HydrophobicContact CG2-CG1 4.4Å; I521-L540 HydrophobicContact CD1-CB 4.43Å; I521-L540 HydrophobicContact CD1-CD2 3.98Å
522K97.3Very high96.2Very high89 Ų8952.8 Ų52.839%0.38726%0.259SS..Hα-helixtrans-60.4-45.9177.9175.463.2174.8174.40111.4Y483 R518 G519 L520 N525 S526Y483-K522 HydrophobicContact CD1-CG 4.34Å; Y483-K522 HydrophobicContact CE1-CB 4.37Å; Y483-K522 HydrophobicContact CE1-CD 4.29Å; Y483-K522 HydrophobicContact CE1-CG 3.67Å; R518-K522 PolarHBondContact O-N 3.21Å; G519-K522 WeakPolarHBondContact O-CB 3.39Å; G519-K522 PolarHBondContact O-N 2.68Å; L520-K522 VanDerWaalsContact C-N 3.32Å; L520-K522 PolarHBondContact O-N 3.08Å; K522-N525 PolarHBondContact O-N 3.42Å; K522-S526 PolarHBondContact O-N 3.21Å; K522-S526 PolarHBondContact O-OG 3.44Å
523L97.9Very high96.7Very high0 Ų052.8 Ų52.80%026%0.255CS..Hα-helixtrans-57.9-54.1180-176.2155.4000111.4N482 Y488 A491 E492 Y495 G519 L520 I521 N525 S526 L527N482-L523 WeakPolarHBondContact OD1-CA 3.5Å; N482-L523 WeakPolarHBondContact OD1-CB 3.44Å; Y488-L523 HydrophobicContact CD1-CG 3.93Å; Y488-L523 HydrophobicContact CG-CG 4.45Å; Y488-L523 WeakPolarHBondContact O-CD1 3.27Å; A491-L523 HydrophobicContact CB-CD1 3.74Å; E492-L523 HydrophobicContact CB-CD1 3.91Å; E492-L523 HydrophobicContact CB-CD2 4.37Å; Y495-L523 HydrophobicContact CD2-CD1 4.49Å; G519-L523 WeakPolarHBondContact O-CB 3.32Å; G519-L523 PolarHBondContact O-N 2.74Å; L520-L523 HydrophobicContact CD2-CD1 4.45Å; L520-L523 WeakPolarHBondContact O-CB 3.44Å; L520-L523 PolarHBondContact O-N 2.95Å; I521-L523 VanDerWaalsContact C-N 3.35Å; I521-L523 PolarHBondContact O-N 3.13Å; L523-N525 VanDerWaalsContact C-N 3.28Å; L523-N525 PolarHBondContact O-N 3.38Å; L523-S526 WeakPolarHBondContact O-CB 3.34Å; L523-S526 PolarHBondContact O-N 3.04Å; L523-S526 VanDerWaalsContact O-N 3.14Å; L523-L527 HydrophobicContact CD2-CD1 3.68Å; L523-L527 HydrophobicContact CD2-CG 4.41Å; L523-L527 PolarHBondContact O-N 3.32Å
524Y98.3Very high96.9Very high6 Ų659.4 Ų59.42%0.02428%0.284CS..Hα-helixtrans-67.7-30.1-178.7-67.5-58.1000112.7E492 L520 L527 G528 N529 K532 Y536E492-Y524 WeakPolarHBondContact OE1-CE1 3.47Å; E492-Y524 VanDerWaalsContact OE1-CZ 3.23Å; E492-Y524 PolarHBondContact OE1-OH 3.29Å; L520-Y524 HydrophobicContact CB-CD2 4.36Å; L520-Y524 HydrophobicContact CB-CE2 4.09Å; L520-Y524 HydrophobicContact CD2-CE2 4.26Å; L520-Y524 WeakPolarHBondContact O-CD2 3.4Å; L520-Y524 PolarHBondContact O-N 2.87Å; Y524-L527 CarbonylContact O-C 3.57Å; Y524-L527 PolarHBondContact O-N 3.18Å; Y524-G528 PolarHBondContact O-N 3.19Å; Y524-N529 HydrophobicContact CD1-CB 4.22Å; Y524-N529 PolarHBondContact O-N 3.29Å; Y524-K532 HydrophobicContact CD1-CB 3.7Å; Y524-K532 HydrophobicContact CD1-CG 4.04Å; Y524-K532 HydrophobicContact CD2-CB 3.53Å; Y524-K532 HydrophobicContact CD2-CG 4.37Å; Y524-K532 HydrophobicContact CE1-CB 4Å; Y524-K532 HydrophobicContact CE1-CD 4.21Å; Y524-K532 HydrophobicContact CE1-CG 3.89Å; Y524-K532 HydrophobicContact CE2-CB 3.83Å; Y524-K532 HydrophobicContact CE2-CD 4.02Å; Y524-K532 HydrophobicContact CE2-CG 4.23Å; Y524-K532 HydrophobicContact CG-CB 3.44Å; Y524-K532 VanDerWaalsContact CG-CB 3.44Å; Y524-K532 HydrophobicContact CG-CG 4.27Å; Y524-Y536 AromaticContact CD2-CD2 3.95Å; Y524-Y536 HydrophobicContact CD2-CD2 3.95Å; Y524-Y536 HydrophobicContact CD2-CE2 4.2Å; Y524-Y536 AromaticContact CE2-CD2 3.58Å; Y524-Y536 HydrophobicContact CE2-CD2 3.58Å; Y524-Y536 AromaticContact CE2-CE2 3.37Å; Y524-Y536 HydrophobicContact CE2-CE2 3.37Å
525N96.9Very high97.1Very high83 Ų8361.1 Ų61.144%0.44429%0.292SS..Hα-helixtrans-64.8-42.7172.5-168.240.8000111.2I521 K522 L523 L527 G528 V533I521-N525 VanDerWaalsContact O-CB 3.3Å; I521-N525 WeakPolarHBondContact O-CB 3.38Å; I521-N525 PolarHBondContact O-N 3.38Å; K522-N525 PolarHBondContact O-N 3.42Å; L523-N525 VanDerWaalsContact C-N 3.28Å; L523-N525 PolarHBondContact O-N 3.38Å; N525-L527 VanDerWaalsContact C-N 3.26Å; N525-L527 PolarHBondContact O-N 2.81Å; N525-G528 PolarHBondContact O-N 3.36Å; N525-G528 VanDerWaalsContact O-N 3.1Å; N525-V533 HydrophobicContact CB-CG2 3.95Å
526S96.6Very high97.4Very high53 Ų5358.1 Ų58.137%0.37128%0.28SS..Hα-helixtrans-62.4-32.6174.1-64.70000112.8K522 L523 G528K522-S526 PolarHBondContact O-N 3.21Å; K522-S526 PolarHBondContact O-OG 3.44Å; L523-S526 WeakPolarHBondContact O-CB 3.34Å; L523-S526 PolarHBondContact O-N 3.04Å; L523-S526 VanDerWaalsContact O-N 3.14Å; S526-G528 VanDerWaalsContact C-N 3.34Å
527L96.5Very high97.4Very high94 Ų9462.3 Ų62.349%0.49230%0.299SS..THydrogen-bonded Turntrans-82.4-6.3175.6-64.2179.8000113.9Y488 L523 Y524 N525 N529Y488-L527 HydrophobicContact CD2-CD2 3.78Å; Y488-L527 HydrophobicContact CG-CD2 4.07Å; Y488-L527 HydrophobicContact CG-CG 4.41Å; L523-L527 HydrophobicContact CD2-CD1 3.68Å; L523-L527 HydrophobicContact CD2-CG 4.41Å; L523-L527 PolarHBondContact O-N 3.32Å; Y524-L527 CarbonylContact O-C 3.57Å; Y524-L527 PolarHBondContact O-N 3.18Å; N525-L527 VanDerWaalsContact C-N 3.26Å; N525-L527 PolarHBondContact O-N 2.81Å; L527-N529 VanDerWaalsContact C-N 3.26Å; L527-N529 PolarHBondContact O-N 2.99Å
528G96.6Very high97.4Very high36 Ų3665.2 Ų65.237%0.37132%0.315SS..THydrogen-bonded Turntrans7017.5-174.900000114.6Y524 N525 S526 Y530Y524-G528 PolarHBondContact O-N 3.19Å; N525-G528 PolarHBondContact O-N 3.36Å; N525-G528 VanDerWaalsContact O-N 3.1Å; S526-G528 VanDerWaalsContact C-N 3.34Å; G528-Y530 VanDerWaalsContact O-CD2 3.27Å; G528-Y530 WeakPolarHBondContact O-CD2 3.48Å; G528-Y530 PolarHBondContact O-N 3.06Å; G528-Y530 VanDerWaalsContact O-N 3.17Å
529N97.6Very high97.4Very high63 Ų6361.7 Ų61.734%0.33731%0.305SS..  trans-8777.1177.1-171-20000110.8Y524 L527 E531 K532 V533Y524-N529 HydrophobicContact CD1-CB 4.22Å; Y524-N529 PolarHBondContact O-N 3.29Å; L527-N529 VanDerWaalsContact C-N 3.26Å; L527-N529 PolarHBondContact O-N 2.99Å; N529-E531 PolarHBondContact O-N 2.93Å; N529-K532 HydrophobicContact CB-CB 4.43Å; N529-K532 WeakPolarHBondContact ND2-CG 3.32Å; N529-K532 PolarHBondContact O-N 3.21Å; N529-K532 PolarHBondContact OD1-N 3.36Å; N529-V533 WeakPolarHBondContact O-CG2 3.07Å; N529-V533 PolarHBondContact O-N 2.87Å; N529-V533 VanDerWaalsContact O-N 3.12Å
530Y96.4Very high97.3Very high161 Ų16162.1 Ų62.163%0.63131%0.307SS*.Hα-helixtrans-66-23.7-176-60.1-71.3000114.3G528 V533 F534G528-Y530 VanDerWaalsContact O-CD2 3.27Å; G528-Y530 WeakPolarHBondContact O-CD2 3.48Å; G528-Y530 PolarHBondContact O-N 3.06Å; G528-Y530 VanDerWaalsContact O-N 3.17Å; Y530-V533 PolarHBondContact O-N 2.91Å; Y530-F534 PolarHBondContact O-N 3.27Å
531E98.1Very high97.1Very high162 Ų16265.7 Ų65.776%0.75733%0.332SS*.Hα-helixtrans-63.6-49.9174.1-175.9179.9-179.300110.4N529 V533 F534 E535N529-E531 PolarHBondContact O-N 2.93Å; E531-V533 PolarHBondContact O-N 3.02Å; E531-F534 PolarHBondContact O-N 2.95Å; E531-E535 PolarHBondContact O-N 2.83Å
532K97.5Very high96.9Very high60 Ų6068.6 Ų68.626%0.26135%0.348SS..Hα-helixtrans-65.8-36.9176.1-78-77172.7-162.10112.8Y524 N529 F534 E535 Y536Y524-K532 HydrophobicContact CD1-CB 3.7Å; Y524-K532 HydrophobicContact CD1-CG 4.04Å; Y524-K532 HydrophobicContact CD2-CB 3.53Å; Y524-K532 HydrophobicContact CD2-CG 4.37Å; Y524-K532 HydrophobicContact CE1-CB 4Å; Y524-K532 HydrophobicContact CE1-CD 4.21Å; Y524-K532 HydrophobicContact CE1-CG 3.89Å; Y524-K532 HydrophobicContact CE2-CB 3.83Å; Y524-K532 HydrophobicContact CE2-CD 4.02Å; Y524-K532 HydrophobicContact CE2-CG 4.23Å; Y524-K532 HydrophobicContact CG-CB 3.44Å; Y524-K532 VanDerWaalsContact CG-CB 3.44Å; Y524-K532 HydrophobicContact CG-CG 4.27Å; N529-K532 HydrophobicContact CB-CB 4.43Å; N529-K532 WeakPolarHBondContact ND2-CG 3.32Å; N529-K532 PolarHBondContact O-N 3.21Å; N529-K532 PolarHBondContact OD1-N 3.36Å; K532-F534 VanDerWaalsContact C-N 3.33Å; K532-F534 PolarHBondContact O-N 3.07Å; K532-E535 WeakPolarHBondContact CD-OE2 3.44Å; K532-E535 WeakPolarHBondContact CE-OE2 3.23Å; K532-E535 IonicContact NZ-OE1 2.89Å; K532-E535 PolarHBondContact NZ-OE1 3.01Å; K532-E535 IonicContact NZ-OE2 3.54Å; K532-E535 PolarHBondContact NZ-OE2 3.39Å; K532-E535 WeakPolarHBondContact O-CB 3.35Å; K532-E535 PolarHBondContact O-N 3.34Å; K532-Y536 HydrophobicContact CD-CE2 4.15Å; K532-Y536 WeakPolarHBondContact O-CD2 3.42Å; K532-Y536 PolarHBondContact O-N 3.07Å
533V98Very high96.8Very high18 Ų1865 Ų6511%0.10933%0.332CS..Hα-helixtrans-57.3-47.4172.9170.20000110.8I521 N525 N529 Y530 E531 Y536 H537I521-V533 HydrophobicContact CG2-CG1 4.4Å; N525-V533 HydrophobicContact CB-CG2 3.95Å; N529-V533 WeakPolarHBondContact O-CG2 3.07Å; N529-V533 PolarHBondContact O-N 2.87Å; N529-V533 VanDerWaalsContact O-N 3.12Å; Y530-V533 PolarHBondContact O-N 2.91Å; E531-V533 PolarHBondContact O-N 3.02Å; V533-Y536 PolarHBondContact O-N 3.37Å; V533-H537 WeakPolarHBondContact O-CB 3.3Å; V533-H537 PolarHBondContact O-CD2 2.89Å; V533-H537 VanDerWaalsContact O-CD2 3.27Å; V533-H537 PolarHBondContact O-N 3.28Å
534F97.8Very high96.4Very high141 Ų14167.8 Ų67.862%0.61835%0.347SS*.Hα-helixtrans-64-42.3177.4-177.4-102.7000112.2Y530 E531 K532 H537 N538Y530-F534 PolarHBondContact O-N 3.27Å; E531-F534 PolarHBondContact O-N 2.95Å; K532-F534 VanDerWaalsContact C-N 3.33Å; K532-F534 PolarHBondContact O-N 3.07Å; F534-H537 PolarHBondContact O-N 2.79Å; F534-N538 WeakPolarHBondContact CD1-ND2 3.33Å; F534-N538 WeakPolarHBondContact CE1-ND2 3.45Å; F534-N538 WeakPolarHBondContact CZ-ND2 3.32Å; F534-N538 PolarHBondContact O-N 3.47Å; F534-N538 VanDerWaalsContact O-N 3.07Å; F534-N538 PolarHBondContact O-ND2 3.22Å
535E97.9Very high95.9Very high76 Ų7673.6 Ų73.636%0.35537%0.369SS..Hα-helixtrans-55.2-54.4174.9-175-172.8155.100111.6E531 K532 H537 N538 I539E531-E535 PolarHBondContact O-N 2.83Å; K532-E535 WeakPolarHBondContact CD-OE2 3.44Å; K532-E535 WeakPolarHBondContact CE-OE2 3.23Å; K532-E535 IonicContact NZ-OE1 2.89Å; K532-E535 PolarHBondContact NZ-OE1 3.01Å; K532-E535 IonicContact NZ-OE2 3.54Å; K532-E535 PolarHBondContact NZ-OE2 3.39Å; K532-E535 WeakPolarHBondContact O-CB 3.35Å; K532-E535 PolarHBondContact O-N 3.34Å; E535-H537 PolarHBondContact O-N 3.39Å; E535-N538 WeakPolarHBondContact O-CB 3.39Å; E535-N538 PolarHBondContact O-N 3.08Å; E535-N538 VanDerWaalsContact O-N 3.15Å; E535-I539 HydrophobicContact CG-CD1 4.2Å; E535-I539 WeakPolarHBondContact O-CG1 3.41Å; E535-I539 PolarHBondContact O-N 3.5Å
536Y97.4Very high95.4Very high17 Ų1773 Ų737%0.06737%0.365CS..Hα-helixtrans-72.3-27.9-177.2-80.4-81.6000113.6L496 Y517 L520 Y524 K532 V533 N538 I539 L540L496-Y536 VanDerWaalsContact CD2-OH 3.32Å; L496-Y536 WeakPolarHBondContact CD2-OH 3.34Å; Y517-Y536 AromaticContact CD1-CD1 3.85Å; Y517-Y536 HydrophobicContact CD1-CD1 3.85Å; Y517-Y536 AromaticContact CD1-CE1 3.98Å; Y517-Y536 HydrophobicContact CD1-CE1 3.98Å; Y517-Y536 HydrophobicContact CE1-CD1 4.49Å; Y517-Y536 HydrophobicContact CE1-CE1 4.32Å; L520-Y536 HydrophobicContact CB-CD1 4.23Å; L520-Y536 HydrophobicContact CB-CD2 4.42Å; L520-Y536 HydrophobicContact CB-CE1 4.3Å; L520-Y536 HydrophobicContact CB-CE2 4.49Å; L520-Y536 HydrophobicContact CB-CG 4.29Å; L520-Y536 HydrophobicContact CD1-CD1 4.12Å; L520-Y536 HydrophobicContact CD1-CE1 3.41Å; L520-Y536 VanDerWaalsContact CD1-CE1 3.41Å; L520-Y536 HydrophobicContact CD1-CE2 4.26Å; L520-Y536 VanDerWaalsContact CD1-CZ 3.49Å; L520-Y536 HydrophobicContact CG-CE1 4.5Å; Y524-Y536 AromaticContact CD2-CD2 3.95Å; Y524-Y536 HydrophobicContact CD2-CD2 3.95Å; Y524-Y536 HydrophobicContact CD2-CE2 4.2Å; Y524-Y536 AromaticContact CE2-CD2 3.58Å; Y524-Y536 HydrophobicContact CE2-CD2 3.58Å; Y524-Y536 AromaticContact CE2-CE2 3.37Å; Y524-Y536 HydrophobicContact CE2-CE2 3.37Å; K532-Y536 HydrophobicContact CD-CE2 4.15Å; K532-Y536 WeakPolarHBondContact O-CD2 3.42Å; K532-Y536 PolarHBondContact O-N 3.07Å; V533-Y536 PolarHBondContact O-N 3.37Å; Y536-N538 VanDerWaalsContact C-N 3.33Å; Y536-I539 HydrophobicContact CD1-CD1 3.86Å; Y536-I539 HydrophobicContact CE1-CD1 3.96Å; Y536-I539 HydrophobicContact CG-CD1 4.35Å; Y536-I539 PolarHBondContact O-N 2.93Å; Y536-L540 WeakPolarHBondContact O-CB 2.89Å; Y536-L540 PolarHBondContact O-N 3.28Å
537H97.5Very high94.8Very high95 Ų9572.5 Ų72.544%0.4436%0.355SS..Hα-helixtrans-62.1-40.8167.9-90.7-61.4000112.1V533 F534 E535 L540 S541V533-H537 WeakPolarHBondContact O-CB 3.3Å; V533-H537 PolarHBondContact O-CD2 2.89Å; V533-H537 VanDerWaalsContact O-CD2 3.27Å; V533-H537 PolarHBondContact O-N 3.28Å; F534-H537 PolarHBondContact O-N 2.79Å; E535-H537 PolarHBondContact O-N 3.39Å; H537-L540 PolarHBondContact O-N 3.4Å; H537-S541 WeakPolarHBondContact O-CB 3.26Å; H537-S541 PolarHBondContact O-N 2.98Å
538N97Very high93.9Very high68 Ų6874.1 Ų74.136%0.36436%0.364SS..Hα-helixtrans-67.2-40.5175.2-70-34000111.8F534 E535 Y536 S541 N542F534-N538 WeakPolarHBondContact CD1-ND2 3.33Å; F534-N538 WeakPolarHBondContact CE1-ND2 3.45Å; F534-N538 WeakPolarHBondContact CZ-ND2 3.32Å; F534-N538 PolarHBondContact O-N 3.47Å; F534-N538 VanDerWaalsContact O-N 3.07Å; F534-N538 PolarHBondContact O-ND2 3.22Å; E535-N538 WeakPolarHBondContact O-CB 3.39Å; E535-N538 PolarHBondContact O-N 3.08Å; E535-N538 VanDerWaalsContact O-N 3.15Å; Y536-N538 VanDerWaalsContact C-N 3.33Å; N538-S541 PolarHBondContact O-N 2.87Å; N538-N542 WeakPolarHBondContact O-CB 3.18Å; N538-N542 PolarHBondContact O-N 2.92Å; N538-N542 PolarHBondContact O-ND2 3.38Å; N538-N542 VanDerWaalsContact O-ND2 3.15Å
539I96.5Very high93Very high52 Ų5280.3 Ų80.327%0.26738%0.377SS..Hα-helixtrans-58.6-50.1173.5-67.8169.6000110Y517 E535 Y536 S541 N542 W543Y517-I539 HydrophobicContact CD1-CG2 4.08Å; Y517-I539 HydrophobicContact CD2-CG2 4.02Å; Y517-I539 HydrophobicContact CE1-CG2 3.73Å; Y517-I539 HydrophobicContact CE2-CG2 3.64Å; Y517-I539 HydrophobicContact CG-CG2 4.23Å; E535-I539 HydrophobicContact CG-CD1 4.2Å; E535-I539 WeakPolarHBondContact O-CG1 3.41Å; E535-I539 PolarHBondContact O-N 3.5Å; Y536-I539 HydrophobicContact CD1-CD1 3.86Å; Y536-I539 HydrophobicContact CE1-CD1 3.96Å; Y536-I539 HydrophobicContact CG-CD1 4.35Å; Y536-I539 PolarHBondContact O-N 2.93Å; I539-S541 VanDerWaalsContact C-N 3.34Å; I539-S541 PolarHBondContact O-N 3.32Å; I539-N542 PolarHBondContact O-N 2.93Å; I539-W543 WeakPolarHBondContact O-CB 3.36Å; I539-W543 PolarHBondContact O-N 2.94Å
540L95.3Very high91.6Very high10 Ų1083.2 Ų83.25%0.05239%0.388CS..Hα-helixtrans-63.2-38.2179.8-176.463.9000112.3E514 Y517 R518 I521 Y536 H537 W543 N544E514-L540 HydrophobicContact CB-CD1 4.41Å; E514-L540 HydrophobicContact CG-CD1 4.04Å; Y517-L540 HydrophobicContact CD2-CD1 4.37Å; R518-L540 HydrophobicContact CG-CD2 3.99Å; I521-L540 HydrophobicContact CD1-CB 4.43Å; I521-L540 HydrophobicContact CD1-CD2 3.98Å; Y536-L540 WeakPolarHBondContact O-CB 2.89Å; Y536-L540 PolarHBondContact O-N 3.28Å; H537-L540 PolarHBondContact O-N 3.4Å; L540-W543 HydrophobicContact CD1-CD2 4.38Å; L540-W543 HydrophobicContact CD1-CE3 3.62Å; L540-W543 HydrophobicContact CD1-CZ3 4.06Å; L540-W543 PolarHBondContact O-N 3.31Å; L540-N544 PolarHBondContact O-N 2.92Å; L540-N544 PolarHBondContact O-ND2 3.41Å
541S94.4Very high90.1Very high76 Ų7678.7 Ų78.753%0.53137%0.372SS..Hα-helixtrans-65.8-42.3175-175.80000112.1H537 N538 I539 N544 R545H537-S541 WeakPolarHBondContact O-CB 3.26Å; H537-S541 PolarHBondContact O-N 2.98Å; N538-S541 PolarHBondContact O-N 2.87Å; I539-S541 VanDerWaalsContact C-N 3.34Å; I539-S541 PolarHBondContact O-N 3.32Å; S541-N544 PolarHBondContact O-N 3.45Å; S541-R545 PolarHBondContact O-N 3.4Å; S541-R545 VanDerWaalsContact O-N 3.16Å
542N93.7Very high88Confident81 Ų8174.5 Ų74.543%0.43337%0.365SS..Hα-helixtrans-64.3-42.4174.9-78.1-40.8000112N538 I539 R545 L546N538-N542 WeakPolarHBondContact O-CB 3.18Å; N538-N542 PolarHBondContact O-N 2.92Å; N538-N542 PolarHBondContact O-ND2 3.38Å; N538-N542 VanDerWaalsContact O-ND2 3.15Å; I539-N542 PolarHBondContact O-N 2.93Å; N542-R545 PolarHBondContact O-N 2.94Å; N542-L546 WeakPolarHBondContact O-CG 3.49Å; N542-L546 PolarHBondContact O-N 3.28Å
543W94Very high86Confident13 Ų1378.5 Ų78.55%0.04939%0.394CS..Hα-helixtrans-56.9-48.5174.3167.690000111.5E508 Y510 E514 Y517 I539 L540 R545 L546 R547E508-W543 VanDerWaalsContact O-CD1 3.27Å; Y510-W543 PolarHBondContact O-NE1 2.84Å; E514-W543 HydrophobicContact CB-CE3 4.38Å; E514-W543 HydrophobicContact CB-CH2 3.53Å; E514-W543 HydrophobicContact CB-CZ2 3.75Å; E514-W543 HydrophobicContact CB-CZ3 3.83Å; E514-W543 HydrophobicContact CG-CH2 3.99Å; E514-W543 HydrophobicContact CG-CZ3 3.97Å; E514-W543 VanDerWaalsContact OE2-CH2 3.25Å; E514-W543 WeakPolarHBondContact OE2-CH2 3.33Å; Y517-W543 HydrophobicContact CE2-CB 4.36Å; Y517-W543 HydrophobicContact CE2-CG 4.41Å; I539-W543 WeakPolarHBondContact O-CB 3.36Å; I539-W543 PolarHBondContact O-N 2.94Å; L540-W543 HydrophobicContact CD1-CD2 4.38Å; L540-W543 HydrophobicContact CD1-CE3 3.62Å; L540-W543 HydrophobicContact CD1-CZ3 4.06Å; L540-W543 PolarHBondContact O-N 3.31Å; W543-R545 VanDerWaalsContact C-N 3.3Å; W543-R545 PolarHBondContact O-N 3.12Å; W543-L546 WeakPolarHBondContact O-CB 3.48Å; W543-L546 PolarHBondContact O-N 3.09Å; W543-L546 VanDerWaalsContact O-N 3.07Å; W543-R547 HydrophobicContact CD2-CG 4.21Å; W543-R547 HydrophobicContact CH2-CG 4.21Å; W543-R547 HydrophobicContact CZ2-CG 3.66Å; W543-R547 WeakPolarHBondContact O-CG 3.46Å; W543-R547 PolarHBondContact O-N 3.08Å
544N89.6Confident84.3Confident59 Ų5980.9 Ų80.932%0.31642%0.415SS..Hα-helixtrans-55.5-45.5176.1-83.3-64.3000111.7L540 S541 L546 R547 D548L540-N544 PolarHBondContact O-N 2.92Å; L540-N544 PolarHBondContact O-ND2 3.41Å; S541-N544 PolarHBondContact O-N 3.45Å; N544-L546 VanDerWaalsContact C-N 3.31Å; N544-L546 PolarHBondContact O-N 3.47Å; N544-R547 WeakPolarHBondContact O-CB 3.39Å; N544-R547 PolarHBondContact O-N 3.07Å; N544-D548 PolarHBondContact O-N 2.86Å
545R88.5Confident83.2Confident127 Ų12777.5 Ų77.548%0.47940%0.404SS..Hα-helixtrans-65-33178.8-171.4-179.265.5149.7-1.4113.1S541 N542 W543 R549S541-R545 PolarHBondContact O-N 3.4Å; S541-R545 VanDerWaalsContact O-N 3.16Å; N542-R545 PolarHBondContact O-N 2.94Å; W543-R545 VanDerWaalsContact C-N 3.3Å; W543-R545 PolarHBondContact O-N 3.12Å; R545-R549 WeakPolarHBondContact O-CD 3.26Å; R545-R549 WeakPolarHBondContact O-CG 3.27Å; R545-R549 PolarHBondContact O-N 3.2Å
546L87.6Confident82.2Confident71 Ų7174.1 Ų74.137%0.37239%0.389SS..Hα-helixtrans-67.7-45175.1-71.4171.9000110.8E508 N542 W543 N544 R549 Q550E508-L546 HydrophobicContact CB-CD1 3.95Å; N542-L546 WeakPolarHBondContact O-CG 3.49Å; N542-L546 PolarHBondContact O-N 3.28Å; W543-L546 WeakPolarHBondContact O-CB 3.48Å; W543-L546 PolarHBondContact O-N 3.09Å; W543-L546 VanDerWaalsContact O-N 3.07Å; N544-L546 VanDerWaalsContact C-N 3.31Å; N544-L546 PolarHBondContact O-N 3.47Å; L546-R549 PolarHBondContact O-N 3.39Å; L546-Q550 WeakPolarHBondContact O-CB 3.45Å; L546-Q550 PolarHBondContact O-N 3.14Å
547R83.4Confident81.2Confident43 Ų4375.1 Ų75.116%0.16240%0.395CS..Hα-helixtrans-57.1-51.1176.4-70.2-75.7-62.2-168.5-5.1112.5D302 G509 W543 N544 R549 Q550 F551D302-R547 IonicContact OD1-CZ 2.65Å; D302-R547 IonicContact OD1-NH1 3.49Å; D302-R547 PolarHBondContact OD1-NH1 3.41Å; D302-R547 IonicContact OD1-NH2 3.37Å; D302-R547 IonicContact OD2-CZ 2.75Å; D302-R547 IonicContact OD2-NH1 2.6Å; D302-R547 PolarHBondContact OD2-NH1 3.49Å; G509-R547 WeakPolarHBondContact O-CD 3.31Å; G509-R547 PolarHBondContact O-NH1 2.92Å; W543-R547 HydrophobicContact CD2-CG 4.21Å; W543-R547 HydrophobicContact CH2-CG 4.21Å; W543-R547 HydrophobicContact CZ2-CG 3.66Å; W543-R547 WeakPolarHBondContact O-CG 3.46Å; W543-R547 PolarHBondContact O-N 3.08Å; N544-R547 WeakPolarHBondContact O-CB 3.39Å; N544-R547 PolarHBondContact O-N 3.07Å; R547-R549 PolarHBondContact O-N 3.27Å; R547-R549 VanDerWaalsContact O-N 3.15Å; R547-Q550 PolarHBondContact O-N 2.86Å; R547-Q550 VanDerWaalsContact O-N 3.08Å; R547-F551 WeakPolarHBondContact O-CD2 3.5Å; R547-F551 PolarHBondContact O-N 3.03Å
548D78.2Confident80Confident127 Ų12776.8 Ų76.868%0.67940%0.403SS*.Hα-helixtrans-58.6-30.9-178.3-71.1-16.5000112.3N544N544-D548 PolarHBondContact O-N 2.86Å
549R76.8Confident78.6Confident167 Ų16777.2 Ų77.263%0.6341%0.405SS*.Hα-helixtrans-80.1-36.4177.2-69.9173.4179.4-170.8-2.5113.1R545 L546 R547R545-R549 WeakPolarHBondContact O-CD 3.26Å; R545-R549 WeakPolarHBondContact O-CG 3.27Å; R545-R549 PolarHBondContact O-N 3.2Å; L546-R549 PolarHBondContact O-N 3.39Å; R547-R549 PolarHBondContact O-N 3.27Å; R547-R549 VanDerWaalsContact O-N 3.15Å
550Q69.1Low77.2Confident124 Ų12474.9 Ų74.958%0.57939%0.394SS*.Hα-helixtrans-77.6-25.4-171.2-168.4169.17.300113L546 R547L546-Q550 WeakPolarHBondContact O-CB 3.45Å; L546-Q550 PolarHBondContact O-N 3.14Å; R547-Q550 PolarHBondContact O-N 2.86Å; R547-Q550 VanDerWaalsContact O-N 3.08Å
551F64.3Low75.6Confident65 Ų6578.6 Ų78.629%0.28541%0.414SS..THydrogen-bonded Turntrans-113.828.9-174.6-61.5-74.3000114.3D302 N303 R547 V553D302-F551 HydrophobicContact CB-CZ 4.48Å; D302-F551 VanDerWaalsContact O-CE1 3.28Å; D302-F551 WeakPolarHBondContact O-CE1 3.4Å; D302-F551 WeakPolarHBondContact O-CZ 3.19Å; N303-F551 HydrophobicContact CB-CD1 4.23Å; N303-F551 HydrophobicContact CB-CE1 3.86Å; R547-F551 WeakPolarHBondContact O-CD2 3.5Å; R547-F551 PolarHBondContact O-N 3.03Å; F551-V553 PolarHBondContact O-N 3.38Å
552A54.4Low73.8Confident74 Ų7480 Ų8061%0.61242%0.419SS*.  trans-67.5100.5172.800000111.5A554A552-A554 PolarHBondContact O-N 3.29Å
553V54.9Low72.1Confident144 Ų14477.4 Ų77.487%0.87341%0.407SS*.  trans24.856.3155.8-1560000117.2F551F551-V553 PolarHBondContact O-N 3.38Å
554A62.5Low70.6Confident68 Ų6882.7 Ų82.756%0.56244%0.443SS*.  trans-94.3124.8158.100000108.1Q306 A552 A556Q306-A554 VanDerWaalsContact CD-O 3.28Å; Q306-A554 PolarHBondContact NE2-O 3.15Å; Q306-A554 VanDerWaalsContact NE2-O 3.15Å; A552-A554 PolarHBondContact O-N 3.29Å; A554-A556 PolarHBondContact O-N 3.31Å
555D75.3Confident70.2Confident71 Ų7184.2 Ų84.238%0.3845%0.448SS..  trans-68.4116.7172.5-177.6-17.6000108.8L557 E558 D559D555-L557 PolarHBondContact O-N 3.45Å; D555-L557 WeakPolarHBondContact OD1-CB 3.37Å; D555-L557 PolarHBondContact OD1-N 2.71Å; D555-E558 HydrophobicContact CB-CB 4.05Å; D555-E558 HydrophobicContact CB-CG 3.8Å; D555-E558 PolarHBondContact O-N 3.13Å; D555-D559 PolarHBondContact O-N 3.04Å
556A76.6Confident70.2Confident4 Ų480.1 Ų80.13%0.03344%0.442CS..Hα-helixtrans-61-26.7-178.200000112.7Y294 L298 Q306 I310 A554 V560Y294-A556 HydrophobicContact CE1-CB 3.94Å; Y294-A556 PolarHBondContact OH-O 3.4Å; L298-A556 HydrophobicContact CD1-CB 4.11Å; Q306-A556 HydrophobicContact CB-CB 3.94Å; Q306-A556 HydrophobicContact CG-CB 4.11Å; I310-A556 HydrophobicContact CD1-CB 4.32Å; I310-A556 HydrophobicContact CG1-CB 4.36Å; A554-A556 PolarHBondContact O-N 3.31Å; A556-V560 WeakPolarHBondContact O-CG2 3.48Å
557L75.5Confident70.4Confident39 Ų3977.9 Ų77.920%0.20443%0.431CS..Hα-helixtrans-79.2-28.9175.9-68178.1000112.6L291 I310 D555 V560 N561L291-L557 HydrophobicContact CD2-CD2 3.78Å; I310-L557 HydrophobicContact CD1-CD1 4.15Å; I310-L557 HydrophobicContact CD1-CD2 3.32Å; I310-L557 HydrophobicContact CD1-CG 3.46Å; I310-L557 VanDerWaalsContact CD1-CG 3.46Å; D555-L557 PolarHBondContact O-N 3.45Å; D555-L557 WeakPolarHBondContact OD1-CB 3.37Å; D555-L557 PolarHBondContact OD1-N 2.71Å; L557-V560 PolarHBondContact O-N 3.49Å; L557-N561 PolarHBondContact O-OD1 3.2Å
558E72.4Confident70.8Confident129 Ų12980.4 Ų80.460%0.60345%0.445SS*.Hα-helixtrans-67.1-40.3173.7-71.3-173.9163.700111.4D555 V560 N561D555-E558 HydrophobicContact CB-CB 4.05Å; D555-E558 HydrophobicContact CB-CG 3.8Å; D555-E558 PolarHBondContact O-N 3.13Å; E558-V560 VanDerWaalsContact C-N 3.25Å; E558-V560 PolarHBondContact O-N 2.93Å; E558-N561 VanDerWaalsContact O-CB 3.25Å; E558-N561 WeakPolarHBondContact O-CB 3.34Å; E558-N561 PolarHBondContact O-N 3.32Å
559D67.1Low71.4Confident77 Ų7779.5 Ų79.541%0.41244%0.437SS..Hα-helixtrans-64.2-27.4178.8-172.417.7000113K270 D555 N561 T562K270-D559 WeakPolarHBondContact CE-OD2 3.42Å; K270-D559 VanDerWaalsContact NZ-CG 3.29Å; K270-D559 IonicContact NZ-OD1 2.65Å; K270-D559 PolarHBondContact NZ-OD1 3.43Å; K270-D559 IonicContact NZ-OD2 2.77Å; K270-D559 PolarHBondContact NZ-OD2 3.46Å; D555-D559 PolarHBondContact O-N 3.04Å; D559-N561 VanDerWaalsContact C-N 3.31Å; D559-T562 PolarHBondContact O-OG1 3.2Å
560V67.2Low72.1Confident3 Ų371.6 Ų71.62%0.01841%0.407CS..G310 helixtrans-83.8-6.1176.5-174.10000112.6K270 V273 F274 Y294 A556 L557 E558 T562K270-V560 HydrophobicContact CB-CG2 4.35Å; K270-V560 HydrophobicContact CD-CG2 4.43Å; K270-V560 HydrophobicContact CG-CG2 3.97Å; K270-V560 WeakPolarHBondContact O-CG1 3.46Å; V273-V560 HydrophobicContact CB-CG1 3.85Å; V273-V560 HydrophobicContact CG1-CB 4.44Å; V273-V560 HydrophobicContact CG1-CG1 3.6Å; F274-V560 HydrophobicContact CB-CG1 4.38Å; Y294-V560 HydrophobicContact CE1-CG2 3.92Å; A556-V560 WeakPolarHBondContact O-CG2 3.48Å; L557-V560 PolarHBondContact O-N 3.49Å; E558-V560 VanDerWaalsContact C-N 3.25Å; E558-V560 PolarHBondContact O-N 2.93Å; V560-T562 PolarHBondContact O-N 2.86Å
561N61.6Low73.3Confident89 Ų8966.2 Ų66.248%0.47638%0.382SS..G310 helixtrans-70.8-13.6177.3-68-28.1000113.8R277 L557 E558 D559R277-N561 PolarHBondContact NH1-OD1 3.14Å; L557-N561 PolarHBondContact O-OD1 3.2Å; E558-N561 VanDerWaalsContact O-CB 3.25Å; E558-N561 WeakPolarHBondContact O-CB 3.34Å; E558-N561 PolarHBondContact O-N 3.32Å; D559-N561 VanDerWaalsContact C-N 3.31Å
562T57.8Low74.6Confident105 Ų10568.7 Ų68.764%0.64440%0.395SS*.G310 helixtrans-118.334.8-165.750.30000115.7D559 V560 P564D559-T562 PolarHBondContact O-OG1 3.2Å; V560-T562 PolarHBondContact O-N 2.86Å; T562-P564 VanDerWaalsContact C-CD 3.41Å; T562-P564 WeakPolarHBondContact O-CD 3.45Å
563S57.8Low76.4Confident27 Ų2767.8 Ų67.819%0.18938%0.384CS..  trans-10285.4173.3-166.50000112.8Q565S563-Q565 PolarHBondContact O-N 3.04Å
564P62.8Low78.2Confident123 Ų12361 Ų6180%0.79934%0.343SS*.  trans-80.46.5176.235.5-38000113.4T562T562-P564 VanDerWaalsContact C-CD 3.41Å; T562-P564 WeakPolarHBondContact O-CD 3.45Å
565Q80.3Confident79.6Confident91 Ų9159.8 Ų59.843%0.42533%0.327SS..  trans-71.8142.8-175.8-70.1-176.1-16.900111.6H271 S563 V570H271-Q565 PolarHBondContact CE1-O 3.18Å; S563-Q565 PolarHBondContact O-N 3.04Å; Q565-V570 HydrophobicContact CB-CG2 4.05Å
566A88.8Confident80.4Confident41 Ų4160.8 Ų60.834%0.33933%0.331SS..  trans-69148.3174.200000110.3E568 E569 V570A566-E568 PolarHBondContact O-N 2.96Å; A566-E569 HydrophobicContact CB-CG 4.12Å; A566-E569 PolarHBondContact N-OE2 2.7Å; A566-E569 WeakPolarHBondContact O-CB 3.31Å; A566-E569 PolarHBondContact O-N 3.09Å; A566-E569 VanDerWaalsContact O-N 3.07Å; A566-V570 PolarHBondContact O-N 2.97Å
567T91.3Very high80.8Confident25 Ų2562.6 Ų62.615%0.15334%0.344CS..Hα-helixtrans-59.7-36.7-179.7-61.80000111.1I236 V245 H271 E569 V570 V571I236-T567 HydrophobicContact CG2-CG2 4.34Å; V245-T567 HydrophobicContact CG1-CG2 3.63Å; H271-T567 WeakPolarHBondContact NE2-CA 3.36Å; H271-T567 PolarHBondContact NE2-OG1 2.94Å; T567-E569 VanDerWaalsContact C-N 3.32Å; T567-E569 PolarHBondContact O-N 2.87Å; T567-V570 PolarHBondContact O-N 3.26Å; T567-V571 HydrophobicContact CG2-CG2 4.23Å; T567-V571 VanDerWaalsContact O-CG2 3.26Å; T567-V571 WeakPolarHBondContact O-CG2 3.46Å; T567-V571 PolarHBondContact O-N 2.79Å
568E91.5Very high80.6Confident96 Ų9662.9 Ų62.945%0.44934%0.344SS..Hα-helixtrans-60.5-41177.1-61.378.7-171.100111.7V238 A566 V571 Q572V238-E568 HydrophobicContact CG2-CG 4.34Å; V238-E568 WeakPolarHBondContact CG2-OE1 3.42Å; A566-E568 PolarHBondContact O-N 2.96Å; E568-V571 PolarHBondContact O-N 2.63Å; E568-Q572 WeakPolarHBondContact O-CB 3.47Å; E568-Q572 PolarHBondContact O-N 3.09Å
569E91.4Very high80Confident108 Ų10862.7 Ų62.751%0.50535%0.347SS..Hα-helixtrans-66.4-42.8178.8-66174.8171.300111.4A566 T567 Q572 S573A566-E569 HydrophobicContact CB-CG 4.12Å; A566-E569 PolarHBondContact N-OE2 2.7Å; A566-E569 WeakPolarHBondContact O-CB 3.31Å; A566-E569 PolarHBondContact O-N 3.09Å; A566-E569 VanDerWaalsContact O-N 3.07Å; T567-E569 VanDerWaalsContact C-N 3.32Å; T567-E569 PolarHBondContact O-N 2.87Å; E569-Q572 PolarHBondContact O-N 2.84Å; E569-S573 VanDerWaalsContact O-CB 3.25Å; E569-S573 WeakPolarHBondContact O-CB 3.28Å; E569-S573 PolarHBondContact O-N 3.2Å
570V92.2Very high79.2Confident1 Ų166.6 Ų66.61%0.00636%0.363CS..Hα-helixtrans-62.4-47.1176.5174.30000110.8Q267 L268 H271 Q565 A566 T567 S573 F574Q267-V570 HydrophobicContact CG-CG1 4.07Å; L268-V570 HydrophobicContact CD2-CG1 4.18Å; H271-V570 HydrophobicContact CB-CG1 4.31Å; H271-V570 HydrophobicContact CB-CG2 4.5Å; Q565-V570 HydrophobicContact CB-CG2 4.05Å; A566-V570 PolarHBondContact O-N 2.97Å; T567-V570 PolarHBondContact O-N 3.26Å; V570-S573 PolarHBondContact O-N 3.04Å; V570-F574 WeakPolarHBondContact O-CB 3.26Å; V570-F574 PolarHBondContact O-N 3.45Å
571V93Very high77.9Confident10 Ų1069.7 Ų69.76%0.06140%0.395CS..Hα-helixtrans-63.8-43.7178.1172.50000110.9M233 I236 T567 E568 F574 L575M233-V571 HydrophobicContact CE-CB 4.16Å; M233-V571 HydrophobicContact CE-CG1 4.17Å; M233-V571 HydrophobicContact CE-CG2 3.71Å; M233-V571 WeakPolarHBondContact O-CG1 3.45Å; I236-V571 HydrophobicContact CB-CG2 4.41Å; I236-V571 HydrophobicContact CD1-CG2 3.87Å; I236-V571 HydrophobicContact CG2-CG2 4.25Å; T567-V571 HydrophobicContact CG2-CG2 4.23Å; T567-V571 VanDerWaalsContact O-CG2 3.26Å; T567-V571 WeakPolarHBondContact O-CG2 3.46Å; T567-V571 PolarHBondContact O-N 2.79Å; E568-V571 PolarHBondContact O-N 2.63Å; V571-F574 WeakPolarHBondContact O-CB 3.1Å; V571-F574 PolarHBondContact O-N 3.39Å; V571-L575 HydrophobicContact CG1-CD1 3.9Å; V571-L575 HydrophobicContact CG1-CG 4.4Å; V571-L575 WeakPolarHBondContact O-CG 3.27Å; V571-L575 PolarHBondContact O-N 3.16Å
572Q92.4Very high76.5Confident118 Ų11870.4 Ų70.455%0.55141%0.413SS*.Hα-helixtrans-65.7-44179.6-171.6178.44.200111.7E568 E569 F574 L575 L576E568-Q572 WeakPolarHBondContact O-CB 3.47Å; E568-Q572 PolarHBondContact O-N 3.09Å; E569-Q572 PolarHBondContact O-N 2.84Å; Q572-F574 VanDerWaalsContact C-N 3.33Å; Q572-F574 PolarHBondContact O-N 2.96Å; Q572-L575 PolarHBondContact O-N 3.34Å; Q572-L576 HydrophobicContact CG-CD1 3.96Å; Q572-L576 HydrophobicContact CG-CG 4.31Å; Q572-L576 WeakPolarHBondContact O-CB 3.03Å; Q572-L576 VanDerWaalsContact O-CG 3.3Å; Q572-L576 WeakPolarHBondContact O-CG 3.39Å; Q572-L576 PolarHBondContact O-N 2.92Å
573S92.2Very high75.1Confident55 Ų5567.9 Ų67.939%0.38541%0.409SS..Hα-helixtrans-54.8-49.2172.9174.10000111.1Q267 E569 V570 L575 L576 S577Q267-S573 PolarHBondContact OE1-OG 2.96Å; E569-S573 VanDerWaalsContact O-CB 3.25Å; E569-S573 WeakPolarHBondContact O-CB 3.28Å; E569-S573 PolarHBondContact O-N 3.2Å; V570-S573 PolarHBondContact O-N 3.04Å; S573-L575 PolarHBondContact O-N 2.64Å; S573-L576 PolarHBondContact O-N 2.97Å; S573-S577 PolarHBondContact O-N 3.09Å
574F92.8Very high73.7Confident2 Ų272.4 Ų72.41%0.00944%0.437CS..Hα-helixtrans-57.7-48.8176.7175-98.8000112.1I230 M233 C256 K264 L268 V570 V571 Q572 S577I230-F574 HydrophobicContact CG1-CE1 4.09Å; I230-F574 HydrophobicContact CG1-CZ 4.23Å; M233-F574 HydrophobicContact CB-CD1 4.37Å; M233-F574 HydrophobicContact CB-CE1 4.38Å; M233-F574 HydrophobicContact CE-CB 4.22Å; M233-F574 HydrophobicContact CE-CD1 3.78Å; M233-F574 HydrophobicContact CE-CE1 4.45Å; M233-F574 HydrophobicContact CE-CG 4.08Å; M233-F574 HydrophobicContact CG-CD1 4.16Å; M233-F574 HydrophobicContact CG-CE1 4.02Å; C256-F574 VanDerWaalsContact SG-CE2 3.59Å; K264-F574 HydrophobicContact CB-CD2 4.04Å; K264-F574 HydrophobicContact CB-CE2 4.09Å; K264-F574 HydrophobicContact CD-CD2 3.87Å; K264-F574 HydrophobicContact CD-CE2 3.82Å; K264-F574 HydrophobicContact CG-CD2 4.37Å; L268-F574 HydrophobicContact CD1-CD2 3.84Å; L268-F574 HydrophobicContact CD1-CE2 3.85Å; L268-F574 HydrophobicContact CD1-CG 4.48Å; L268-F574 HydrophobicContact CD1-CZ 4.49Å; L268-F574 HydrophobicContact CD2-CB 4.38Å; L268-F574 HydrophobicContact CD2-CD2 4.36Å; L268-F574 HydrophobicContact CD2-CG 4.36Å; L268-F574 HydrophobicContact CG-CD2 4.34Å; V570-F574 WeakPolarHBondContact O-CB 3.26Å; V570-F574 PolarHBondContact O-N 3.45Å; V571-F574 WeakPolarHBondContact O-CB 3.1Å; V571-F574 PolarHBondContact O-N 3.39Å; Q572-F574 VanDerWaalsContact C-N 3.33Å; Q572-F574 PolarHBondContact O-N 2.96Å; F574-S577 PolarHBondContact O-N 3.49Å; F574-S577 PolarHBondContact O-OG 3.42Å
575L92.8Very high72.4Confident42 Ų4272.9 Ų72.922%0.2244%0.44CS..Hα-helixtrans-69.3-38.2-177.3-68.2174.2000113I230 M233 K234 V571 Q572 S573 S577 Q578I230-L575 HydrophobicContact CG2-CD2 4.03Å; M233-L575 HydrophobicContact CB-CD2 4.26Å; K234-L575 HydrophobicContact CG-CD1 4.11Å; K234-L575 HydrophobicContact CG-CD2 4.02Å; V571-L575 HydrophobicContact CG1-CD1 3.9Å; V571-L575 HydrophobicContact CG1-CG 4.4Å; V571-L575 WeakPolarHBondContact O-CG 3.27Å; V571-L575 PolarHBondContact O-N 3.16Å; Q572-L575 PolarHBondContact O-N 3.34Å; S573-L575 PolarHBondContact O-N 2.64Å; L575-S577 VanDerWaalsContact C-N 3.3Å; L575-S577 PolarHBondContact O-N 2.88Å; L575-Q578 VanDerWaalsContact O-CB 3.29Å; L575-Q578 WeakPolarHBondContact O-CB 2.91Å; L575-Q578 PolarHBondContact O-N 2.93Å; L575-Q578 VanDerWaalsContact O-N 3.14Å
576L90.3Very high70.1Confident91 Ų9176.9 Ų76.948%0.47649%0.489SS..Hα-helixtrans-64.6-36.3178.2-74.2172.7000112.2Q572 S573 Q578 N579 H580Q572-L576 HydrophobicContact CG-CD1 3.96Å; Q572-L576 HydrophobicContact CG-CG 4.31Å; Q572-L576 WeakPolarHBondContact O-CB 3.03Å; Q572-L576 VanDerWaalsContact O-CG 3.3Å; Q572-L576 WeakPolarHBondContact O-CG 3.39Å; Q572-L576 PolarHBondContact O-N 2.92Å; S573-L576 PolarHBondContact O-N 2.97Å; L576-Q578 PolarHBondContact O-N 3.36Å; L576-N579 PolarHBondContact O-N 3.45Å; L576-H580 PolarHBondContact O-ND1 2.88Å
577S84.9Confident69.1Low43 Ų4378.7 Ų78.730%0.30150%0.497SS..THydrogen-bonded Turntrans-65.9-15.7176.676.90000113.6K264 S573 F574 L575K264-S577 WeakPolarHBondContact CD-OG 3.35Å; K264-S577 WeakPolarHBondContact CE-OG 3.09Å; K264-S577 PolarHBondContact NZ-OG 3.18Å; S573-S577 PolarHBondContact O-N 3.09Å; F574-S577 PolarHBondContact O-N 3.49Å; F574-S577 PolarHBondContact O-OG 3.42Å; L575-S577 VanDerWaalsContact C-N 3.3Å; L575-S577 PolarHBondContact O-N 2.88Å
578Q72.9Confident68Low44 Ų4481.5 Ų81.521%0.20652%0.515CS..THydrogen-bonded Turntrans-73.4-32.7175-58-58.8-32.100112.3Y226 I230 L575 L576 H580Y226-Q578 PolarHBondContact OH-NE2 3.25Å; Y226-Q578 PolarHBondContact OH-OE1 2.89Å; I230-Q578 HydrophobicContact CD1-CG 4.25Å; L575-Q578 VanDerWaalsContact O-CB 3.29Å; L575-Q578 WeakPolarHBondContact O-CB 2.91Å; L575-Q578 PolarHBondContact O-N 2.93Å; L575-Q578 VanDerWaalsContact O-N 3.14Å; L576-Q578 PolarHBondContact O-N 3.36Å; Q578-H580 PolarHBondContact O-N 2.78Å
579N58.4Low66.7Low126 Ų12680.7 Ų80.767%0.67452%0.518SS*.THydrogen-bonded Turntrans-75.1-11.3-175.7-67.8-23.9000113.6L576L576-N579 PolarHBondContact O-N 3.45Å
580H50.5Low65.2Low159 Ų15979.1 Ų79.174%0.73652%0.519SS*.THydrogen-bonded Turntrans-96.9-0.8-175.7-66.963.2000113.2L576 Q578L576-H580 PolarHBondContact O-ND1 2.88Å; Q578-H580 PolarHBondContact O-N 2.78Å
581G41.4Very low63.5Low68 Ų6884 Ų8470%0.70155%0.551SS**  trans-94.13-178.500000116.2G583G581-G583 PolarHBondContact O-N 2.72Å
582A30.5Very low61.5Low103 Ų10388.9 Ų88.985%0.85158%0.584SS**  trans-95.227.9-178.500000113.9
583G28.8Very low59.3Low53 Ų5386.9 Ų86.955%0.54659%0.586SS.*SBendtrans-106.5136170.500000110.4G581G581-G583 PolarHBondContact O-N 2.72Å
584P28.2Very low56.8Low121 Ų12189.3 Ų89.379%0.78660%0.602SS**  trans-62.4142.2172.127.5-31000109.2A586P584-A586 PolarHBondContact O-N 3.36Å
585P35.4Very low53.8Low133 Ų13396.6 Ų96.686%0.86465%0.651SS**  trans-61.4130.7174.624.8-30.9000109.4
586A31.9Very low50.3Low176 Ų176101.5 Ų101.5100%1.45569%0.69SS**  trans-74.80174.900000111.8P584P584-A586 PolarHBondContact O-N 3.36Å

Retrieved 586 of 586 residues in 772.9 ms (Link to these results)