A0A077ZJY9_TRITR Loading...

BAR domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJY9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 223 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
1M56.8Low84.7Confident180 Ų18096.5 Ų96.589%0.88745%0.453SS*.  01390-84.2-167.3176.900109.7L6M1-L6 HydrophobicContact CB-CD2 4.45Å; M1-L6 HydrophobicContact CB-CG 4.22Å; M1-L6 HydrophobicContact SD-CD2 4.1Å
2P78.2Confident85.4Confident87 Ų8795.8 Ų95.857%0.56545%0.448SS*.  trans-57.9141.5172.8-19.630.4000111.1Q4 C5 L6P2-Q4 PolarHBondContact O-N 2.72Å; P2-Q4 VanDerWaalsContact O-N 3.09Å; P2-C5 WeakPolarHBondContact O-CB 3.45Å; P2-C5 PolarHBondContact O-N 3Å; P2-L6 PolarHBondContact O-N 3.28Å
3R83.7Confident86Confident231 Ų23194.8 Ų94.887%0.87245%0.446SS*.Hα-helixtrans-51.4-36.5-178.2-75.9-175.6179.7178.90.2113.2C5 L6 R7R3-C5 VanDerWaalsContact C-N 3.35Å; R3-C5 PolarHBondContact O-N 3.27Å; R3-L6 PolarHBondContact O-N 3.25Å; R3-R7 PolarHBondContact O-N 3.13Å
4Q83.8Confident86.5Confident111 Ų11188.2 Ų88.252%0.51942%0.415SS..Hα-helixtrans-63.7-36177.4-67.4176.3-2.300113P2 R7 R8P2-Q4 PolarHBondContact O-N 2.72Å; P2-Q4 VanDerWaalsContact O-N 3.09Å; Q4-R7 PolarHBondContact O-N 3.2Å; Q4-R8 WeakPolarHBondContact O-CB 3.48Å; Q4-R8 VanDerWaalsContact O-CG 3.29Å; Q4-R8 WeakPolarHBondContact O-CG 3.26Å; Q4-R8 PolarHBondContact O-N 3.22Å
5C84.9Confident87Confident54 Ų5485.3 Ų85.337%0.36540%0.399SS..Hα-helixtrans-66.1-42.8177.7-63.50000111.4P2 R3 R8 L9P2-C5 WeakPolarHBondContact O-CB 3.45Å; P2-C5 PolarHBondContact O-N 3Å; R3-C5 VanDerWaalsContact C-N 3.35Å; R3-C5 PolarHBondContact O-N 3.27Å; C5-R8 PolarHBondContact O-N 2.79Å; C5-L9 WeakPolarHBondContact O-CB 3.45Å; C5-L9 PolarHBondContact O-N 2.88Å
6L87.7Confident87.3Confident95 Ų9589.1 Ų89.150%0.49742%0.421SS..Hα-helixtrans-64.1-43.4175.8-69.1172.4000111.3M1 P2 R3 R8 L9 Y10M1-L6 HydrophobicContact CB-CD2 4.45Å; M1-L6 HydrophobicContact CB-CG 4.22Å; M1-L6 HydrophobicContact SD-CD2 4.1Å; P2-L6 PolarHBondContact O-N 3.28Å; R3-L6 PolarHBondContact O-N 3.25Å; L6-R8 PolarHBondContact O-N 3.42Å; L6-L9 PolarHBondContact O-N 3.37Å; L6-Y10 WeakPolarHBondContact O-CB 3.32Å; L6-Y10 PolarHBondContact O-N 3.28Å
7R88.5Confident87.6Confident69 Ų6989.6 Ų89.626%0.2643%0.426SS..Hα-helixtrans-57.3-49.1175.4-171.817773.5179.2-8.9111.9R3 Q4 L9 Y10 T11 D140 H143 E144R3-R7 PolarHBondContact O-N 3.13Å; Q4-R7 PolarHBondContact O-N 3.2Å; R7-L9 VanDerWaalsContact C-N 3.34Å; R7-L9 PolarHBondContact O-N 2.99Å; R7-Y10 WeakPolarHBondContact O-CB 3.46Å; R7-Y10 PolarHBondContact O-N 3.16Å; R7-T11 PolarHBondContact O-N 2.98Å; R7-T11 PolarHBondContact O-OG1 3.17Å; R7-T11 VanDerWaalsContact O-OG1 3.1Å; R7-D140 IonicContact CZ-OD1 2.87Å; R7-D140 IonicContact NE-OD1 3.51Å; R7-D140 PolarHBondContact NE-OD1 3.2Å; R7-D140 IonicContact NH2-OD1 3.38Å; R7-D140 PolarHBondContact NH2-OD1 3.34Å; R7-D140 IonicContact NH2-OD2 2.79Å; R7-H143 WeakPolarHBondContact CD-CD2 3.45Å; R7-H143 HydrophobicContact CG-CB 4.27Å; R7-E144 IonicContact CZ-OE1 2.69Å; R7-E144 IonicContact NH1-OE1 3.88Å; R7-E144 PolarHBondContact NH1-OE1 3.06Å
8R91.7Very high87.7Confident44 Ų4488.2 Ų88.217%0.16644%0.44CS..Hα-helixtrans-65.8-35.8179.1-70.7172.5-173.5160.82.6112.6Q4 C5 L6 T11 K12 N136 L139 D140Q4-R8 WeakPolarHBondContact O-CB 3.48Å; Q4-R8 VanDerWaalsContact O-CG 3.29Å; Q4-R8 WeakPolarHBondContact O-CG 3.26Å; Q4-R8 PolarHBondContact O-N 3.22Å; C5-R8 PolarHBondContact O-N 2.79Å; L6-R8 PolarHBondContact O-N 3.42Å; R8-T11 PolarHBondContact O-N 2.97Å; R8-K12 WeakPolarHBondContact O-CG 3.31Å; R8-K12 PolarHBondContact O-N 2.94Å; R8-K12 VanDerWaalsContact O-N 3.1Å; R8-N136 VanDerWaalsContact NH1-CG 3.35Å; R8-N136 PolarHBondContact NH1-ND2 2.91Å; R8-L139 HydrophobicContact CB-CB 4.42Å; R8-L139 HydrophobicContact CB-CD1 4.12Å; R8-L139 HydrophobicContact CG-CB 4.03Å; R8-L139 HydrophobicContact CG-CD1 4.32Å; R8-D140 WeakPolarHBondContact CG-OD1 3.43Å; R8-D140 IonicContact CZ-OD2 3.73Å; R8-D140 IonicContact NE-OD1 2.66Å; R8-D140 PolarHBondContact NE-OD1 3.38Å; R8-D140 VanDerWaalsContact NE-OD1 3.15Å; R8-D140 IonicContact NE-OD2 3.55Å; R8-D140 PolarHBondContact NE-OD2 3.16Å; R8-D140 VanDerWaalsContact NE-OD2 3.12Å; R8-D140 IonicContact NH2-OD1 3.71Å; R8-D140 IonicContact NH2-OD2 2.73Å; R8-D140 PolarHBondContact NH2-OD2 3.43Å
9L92.2Very high87.8Confident84 Ų8492.1 Ų92.144%0.4445%0.448SS..Hα-helixtrans-65.2-44.4173.4-176.764.6000110.9C5 L6 R7 T11 K12 I13C5-L9 WeakPolarHBondContact O-CB 3.45Å; C5-L9 PolarHBondContact O-N 2.88Å; L6-L9 PolarHBondContact O-N 3.37Å; R7-L9 VanDerWaalsContact C-N 3.34Å; R7-L9 PolarHBondContact O-N 2.99Å; L9-T11 VanDerWaalsContact C-N 3.34Å; L9-T11 PolarHBondContact O-N 3.04Å; L9-K12 WeakPolarHBondContact O-CB 3.31Å; L9-K12 PolarHBondContact O-N 3.21Å; L9-I13 HydrophobicContact CG-CD1 4.21Å; L9-I13 WeakPolarHBondContact O-CG1 3.41Å; L9-I13 PolarHBondContact O-N 3.43Å
10Y92.2Very high87.9Confident106 Ų10688 Ų8842%0.41643%0.429SS..Hα-helixtrans-57.4-45.5174.6178.9-90.8000111.7L6 R7 K12 I13 N14 H143 F146L6-Y10 WeakPolarHBondContact O-CB 3.32Å; L6-Y10 PolarHBondContact O-N 3.28Å; R7-Y10 WeakPolarHBondContact O-CB 3.46Å; R7-Y10 PolarHBondContact O-N 3.16Å; Y10-K12 PolarHBondContact O-N 3.35Å; Y10-I13 PolarHBondContact O-N 3.38Å; Y10-N14 WeakPolarHBondContact CD1-ND2 3.35Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.12Å; Y10-N14 WeakPolarHBondContact CE2-ND2 3.49Å; Y10-N14 PolarHBondContact O-N 3.44Å; Y10-N14 PolarHBondContact O-ND2 3.05Å; Y10-H143 AromaticContact CD1-CE1 3.78Å; Y10-H143 AromaticContact CD1-ND1 3.89Å; Y10-F146 HydrophobicContact CE1-CE1 4.4Å
11T91.7Very high87.8Confident0 Ų092.3 Ų92.30%045%0.448CS..Hα-helixtrans-58.9-46175.6-51.40000111.6R7 R8 L9 I13 N14 Y15 I20 L139 D142 H143R7-T11 PolarHBondContact O-N 2.98Å; R7-T11 PolarHBondContact O-OG1 3.17Å; R7-T11 VanDerWaalsContact O-OG1 3.1Å; R8-T11 PolarHBondContact O-N 2.97Å; L9-T11 VanDerWaalsContact C-N 3.34Å; L9-T11 PolarHBondContact O-N 3.04Å; T11-I13 PolarHBondContact O-N 2.94Å; T11-N14 PolarHBondContact O-N 3.31Å; T11-N14 VanDerWaalsContact O-N 3.15Å; T11-Y15 HydrophobicContact CG2-CD1 4.44Å; T11-Y15 HydrophobicContact CG2-CE1 3.87Å; T11-Y15 HydrophobicContact CG2-CE2 4.28Å; T11-Y15 PolarHBondContact O-N 3.02Å; T11-I20 HydrophobicContact CG2-CD1 4.04Å; T11-I20 HydrophobicContact CG2-CG2 4.46Å; T11-L139 HydrophobicContact CG2-CD2 4.05Å; T11-L139 PolarHBondContact OG1-O 3.09Å; T11-D142 HydrophobicContact CG2-CB 4.24Å; T11-H143 WeakPolarHBondContact OG1-CB 3.39Å; T11-H143 PolarHBondContact OG1-ND1 3.15Å
12K93.4Very high89.4Confident89 Ų8991.9 Ų91.939%0.38744%0.437SS..Hα-helixtrans-60.5-42.1177.9-71.4173.5-175.7176.50112.8R8 L9 Y10 N14 Y15 I16 L139R8-K12 WeakPolarHBondContact O-CG 3.31Å; R8-K12 PolarHBondContact O-N 2.94Å; R8-K12 VanDerWaalsContact O-N 3.1Å; L9-K12 WeakPolarHBondContact O-CB 3.31Å; L9-K12 PolarHBondContact O-N 3.21Å; Y10-K12 PolarHBondContact O-N 3.35Å; K12-N14 VanDerWaalsContact C-N 3.31Å; K12-N14 PolarHBondContact O-N 3.48Å; K12-Y15 WeakPolarHBondContact O-CB 3.39Å; K12-Y15 PolarHBondContact O-N 3.44Å; K12-I16 WeakPolarHBondContact O-CG1 3.14Å; K12-I16 PolarHBondContact O-N 3.3Å; K12-L139 HydrophobicContact CG-CD1 4.39Å; K12-L139 HydrophobicContact CG-CD2 3.8Å
13I93.7Very high89.9Confident83 Ų8389.1 Ų89.143%0.42642%0.418SS..Hα-helixtrans-61.7-43.8176.2-68.5167.7000109.8L9 Y10 T11 Y15 I16 L17L9-I13 HydrophobicContact CG-CD1 4.21Å; L9-I13 WeakPolarHBondContact O-CG1 3.41Å; L9-I13 PolarHBondContact O-N 3.43Å; Y10-I13 PolarHBondContact O-N 3.38Å; T11-I13 PolarHBondContact O-N 2.94Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.44Å; I13-I16 WeakPolarHBondContact O-CB 3.36Å; I13-I16 PolarHBondContact O-N 3Å; I13-I16 VanDerWaalsContact O-N 3.1Å; I13-L17 HydrophobicContact CG2-CD1 3.86Å; I13-L17 HydrophobicContact CG2-CG 4.3Å; I13-L17 WeakPolarHBondContact O-CG 3.5Å; I13-L17 PolarHBondContact O-N 3.05Å
14N92.4Very high90.2Very high2 Ų285.2 Ų85.21%0.01141%0.41CS..Hα-helixtrans-71.6-23.3179.7-75-82.1000113.8Y10 T11 K12 G18 R19 I20Y10-N14 WeakPolarHBondContact CD1-ND2 3.35Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.12Å; Y10-N14 WeakPolarHBondContact CE2-ND2 3.49Å; Y10-N14 PolarHBondContact O-N 3.44Å; Y10-N14 PolarHBondContact O-ND2 3.05Å; T11-N14 PolarHBondContact O-N 3.31Å; T11-N14 VanDerWaalsContact O-N 3.15Å; K12-N14 VanDerWaalsContact C-N 3.31Å; K12-N14 PolarHBondContact O-N 3.48Å; N14-G18 PolarHBondContact O-N 3.44Å; N14-R19 HydrophobicContact CB-CB 4.1Å; N14-R19 PolarHBondContact O-N 2.84Å; N14-R19 VanDerWaalsContact OD1-CD 3.24Å; N14-R19 WeakPolarHBondContact OD1-CD 3.42Å; N14-I20 HydrophobicContact CB-CB 4.22Å; N14-I20 HydrophobicContact CB-CD1 3.61Å; N14-I20 HydrophobicContact CB-CG1 3.66Å; N14-I20 PolarHBondContact O-N 2.93Å
15Y94.1Very high90.6Very high44 Ų4481.4 Ų81.417%0.17339%0.393CS..Hα-helixtrans-61.8-48.4164.5-66.3-28.1000111.1T11 K12 I13 L17 G18 I20 R22 L139 D142T11-Y15 HydrophobicContact CG2-CD1 4.44Å; T11-Y15 HydrophobicContact CG2-CE1 3.87Å; T11-Y15 HydrophobicContact CG2-CE2 4.28Å; T11-Y15 PolarHBondContact O-N 3.02Å; K12-Y15 WeakPolarHBondContact O-CB 3.39Å; K12-Y15 PolarHBondContact O-N 3.44Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.44Å; Y15-L17 VanDerWaalsContact C-N 3.27Å; Y15-L17 PolarHBondContact O-N 2.82Å; Y15-G18 PolarHBondContact O-N 3.27Å; Y15-I20 HydrophobicContact CD1-CB 3.87Å; Y15-I20 HydrophobicContact CD1-CG2 3.8Å; Y15-I20 WeakPolarHBondContact CD1-O 3.38Å; Y15-I20 HydrophobicContact CE1-CB 4.15Å; Y15-I20 HydrophobicContact CE1-CG2 3.53Å; Y15-R22 HydrophobicContact CD1-CB 4.09Å; Y15-R22 HydrophobicContact CE1-CB 3.81Å; Y15-R22 HydrophobicContact CE1-CG 4.22Å; Y15-R22 HydrophobicContact CE2-CB 4.41Å; Y15-R22 HydrophobicContact CE2-CG 4.1Å; Y15-L139 HydrophobicContact CD2-CD2 4.34Å; Y15-L139 HydrophobicContact CE2-CD2 3.41Å; Y15-L139 VanDerWaalsContact CE2-CD2 3.41Å; Y15-D142 HydrophobicContact CE1-CB 4.19Å; Y15-D142 PolarHBondContact OH-OD2 2.97Å
16I92.1Very high91.1Very high147 Ų14781.5 Ų81.575%0.75439%0.39SS*.Hα-helixtrans-62.6-38.2-178.9-63.6166.5000110.7K12 I13 G18K12-I16 WeakPolarHBondContact O-CG1 3.14Å; K12-I16 PolarHBondContact O-N 3.3Å; I13-I16 WeakPolarHBondContact O-CB 3.36Å; I13-I16 PolarHBondContact O-N 3Å; I13-I16 VanDerWaalsContact O-N 3.1Å; I16-G18 PolarHBondContact O-N 2.87Å
17L92.1Very high91.3Very high97 Ų9782.8 Ų82.851%0.50840%0.396SS..THydrogen-bonded Turntrans-77.1-0.2176.9-61.8176.4000113.7I13 Y15 R19I13-L17 HydrophobicContact CG2-CD1 3.86Å; I13-L17 HydrophobicContact CG2-CG 4.3Å; I13-L17 WeakPolarHBondContact O-CG 3.5Å; I13-L17 PolarHBondContact O-N 3.05Å; Y15-L17 VanDerWaalsContact C-N 3.27Å; Y15-L17 PolarHBondContact O-N 2.82Å; L17-R19 HydrophobicContact CB-CG 4.07Å; L17-R19 PolarHBondContact O-N 3.47Å
18G89.7Confident91.6Very high65 Ų6587.2 Ų87.267%0.6741%0.413SS*.THydrogen-bonded Turntrans67.216.4-177.900000114.7N14 Y15 I16N14-G18 PolarHBondContact O-N 3.44Å; Y15-G18 PolarHBondContact O-N 3.27Å; I16-G18 PolarHBondContact O-N 2.87Å
19R89.3Confident91.7Very high161 Ų16185.3 Ų85.361%0.60841%0.407SS*.SBendtrans-89.4-25.8-176.5-67.6178.2178.4-176.9-0113.6N14 L17 F146N14-R19 HydrophobicContact CB-CB 4.1Å; N14-R19 PolarHBondContact O-N 2.84Å; N14-R19 VanDerWaalsContact OD1-CD 3.24Å; N14-R19 WeakPolarHBondContact OD1-CD 3.42Å; L17-R19 HydrophobicContact CB-CG 4.07Å; L17-R19 PolarHBondContact O-N 3.47Å; R19-F146 WeakPolarHBondContact O-CE2 3.39Å
20I89.6Confident91.8Very high11 Ų1185.3 Ų85.36%0.05640%0.403CS..SBendtrans-118128.5173.3-64.6178.5000107.3T11 N14 Y15 D142 F146T11-I20 HydrophobicContact CG2-CD1 4.04Å; T11-I20 HydrophobicContact CG2-CG2 4.46Å; N14-I20 HydrophobicContact CB-CB 4.22Å; N14-I20 HydrophobicContact CB-CD1 3.61Å; N14-I20 HydrophobicContact CB-CG1 3.66Å; N14-I20 PolarHBondContact O-N 2.93Å; Y15-I20 HydrophobicContact CD1-CB 3.87Å; Y15-I20 HydrophobicContact CD1-CG2 3.8Å; Y15-I20 WeakPolarHBondContact CD1-O 3.38Å; Y15-I20 HydrophobicContact CE1-CB 4.15Å; Y15-I20 HydrophobicContact CE1-CG2 3.53Å; I20-D142 HydrophobicContact CG2-CB 4.04Å; I20-F146 HydrophobicContact CD1-CB 3.73Å; I20-F146 HydrophobicContact CD1-CD1 3.91Å; I20-F146 HydrophobicContact CD1-CD2 4.11Å; I20-F146 HydrophobicContact CD1-CG 3.64Å; I20-F146 HydrophobicContact CG1-CB 3.73Å; I20-F146 HydrophobicContact CG1-CD1 4.12Å; I20-F146 HydrophobicContact CG1-CD2 3.4Å; I20-F146 HydrophobicContact CG1-CE2 3.96Å; I20-F146 HydrophobicContact CG1-CG 3.47Å; I20-F146 VanDerWaalsContact CG1-CG 3.47Å
21E86.2Confident91.9Very high179 Ų17984 Ų8484%0.83640%0.403SS*.PPolyproline II helixtrans-75.1131.7168.8-170.1176.2-171.200109.6
22R89.4Confident92Very high170 Ų17085 Ų8564%0.64241%0.411SS*.PPolyproline II helixtrans-81.3125.2-179.8-179.7176.6178.2-171.8-4109.5Y15 E24Y15-R22 HydrophobicContact CD1-CB 4.09Å; Y15-R22 HydrophobicContact CE1-CB 3.81Å; Y15-R22 HydrophobicContact CE1-CG 4.22Å; Y15-R22 HydrophobicContact CE2-CB 4.41Å; Y15-R22 HydrophobicContact CE2-CG 4.1Å; R22-E24 PolarHBondContact O-N 2.82Å
23T90Very high92.1Very high29 Ų2982.2 Ų82.218%0.17840%0.4CS..PPolyproline II helixtrans-61.3123.8171.5-68.70000110.2M141 D142 R145T23-M141 HydrophobicContact CG2-CE 3.64Å; T23-M141 WeakPolarHBondContact OG1-CE 3.11Å; T23-D142 VanDerWaalsContact CB-OD1 3.27Å; T23-D142 WeakPolarHBondContact CB-OD1 3.18Å; T23-D142 PolarHBondContact N-OD2 2.91Å; T23-D142 PolarHBondContact OG1-OD1 3.09Å; T23-R145 PolarHBondContact OG1-NH1 2.92Å; T23-R145 VanDerWaalsContact OG1-NH1 3.09Å
24E90.1Very high92.2Very high150 Ų15086 Ų8670%0.70141%0.41SS*.PPolyproline II helixtrans-79.5130.8171-70.8-148.3179.700111.3R22 K30R22-E24 PolarHBondContact O-N 2.82Å; E24-K30 IonicContact OE2-NZ 2.84Å; E24-K30 PolarHBondContact OE2-NZ 3.37Å
25L92.4Very high92.2Very high31 Ų3189.6 Ų89.616%0.16243%0.429CS..PPolyproline II helixtrans-67.4141.8166.7-62178000109.3T29 K30 L33 L134 V138 F170L25-T29 HydrophobicContact CB-CG2 4.25Å; L25-T29 HydrophobicContact CD1-CG2 4.05Å; L25-T29 HydrophobicContact CD2-CG2 4.28Å; L25-T29 HydrophobicContact CG-CG2 4.42Å; L25-K30 HydrophobicContact CB-CG 3.86Å; L25-K30 WeakPolarHBondContact O-CD 3.45Å; L25-K30 WeakPolarHBondContact O-CE 3.36Å; L25-K30 PolarHBondContact O-NZ 2.68Å; L25-L33 HydrophobicContact CD1-CD1 3.76Å; L25-L134 HydrophobicContact CD1-CD2 4.32Å; L25-L134 HydrophobicContact CD2-CD2 4.44Å; L25-V138 HydrophobicContact CD2-CG2 3.98Å; L25-F170 HydrophobicContact CD2-CE2 3.66Å; L25-F170 HydrophobicContact CD2-CZ 3.88Å
26D93.7Very high92.2Very high55 Ų5587.7 Ų87.729%0.29442%0.421SS..PPolyproline II helixtrans-61.5158.6172.464.989.4000111.3R28 T29 K30 K174D26-R28 VanDerWaalsContact C-N 3.26Å; D26-R28 PolarHBondContact O-N 2.93Å; D26-R28 WeakPolarHBondContact OD1-CB 3.42Å; D26-R28 PolarHBondContact OD1-N 3.25Å; D26-R28 VanDerWaalsContact OD1-N 3.14Å; D26-T29 VanDerWaalsContact CG-OG1 3.24Å; D26-T29 PolarHBondContact O-N 3.49Å; D26-T29 PolarHBondContact OD1-N 2.98Å; D26-T29 PolarHBondContact OD1-OG1 2.84Å; D26-T29 VanDerWaalsContact OD1-OG1 3.11Å; D26-T29 WeakPolarHBondContact OD2-CB 3.32Å; D26-T29 PolarHBondContact OD2-OG1 3.28Å; D26-K30 PolarHBondContact O-N 3.08Å; D26-K174 VanDerWaalsContact OD2-CE 3.3Å; D26-K174 WeakPolarHBondContact OD2-CE 3.42Å; D26-K174 IonicContact OD2-NZ 3.34Å; D26-K174 PolarHBondContact OD2-NZ 2.98Å
27L93.4Very high92.4Very high122 Ų12282.3 Ų82.364%0.63939%0.393SS*.Hα-helixtrans-58.7-37.2-174.7-173.363.7000112.6K30 N31L27-K30 PolarHBondContact O-N 2.95Å; L27-N31 WeakPolarHBondContact O-CB 3.46Å; L27-N31 PolarHBondContact O-N 3.34Å; L27-N31 PolarHBondContact O-ND2 2.72Å
28R93.8Very high92.5Very high162 Ų16278.8 Ų78.861%0.61138%0.378SS*.Hα-helixtrans-65.8-43.1180-175.7-179.2-179.9-139.9-6.1111.1D26 S32 E178D26-R28 VanDerWaalsContact C-N 3.26Å; D26-R28 PolarHBondContact O-N 2.93Å; D26-R28 WeakPolarHBondContact OD1-CB 3.42Å; D26-R28 PolarHBondContact OD1-N 3.25Å; D26-R28 VanDerWaalsContact OD1-N 3.14Å; R28-S32 WeakPolarHBondContact O-CB 2.87Å; R28-S32 PolarHBondContact O-N 3.36Å; R28-S32 PolarHBondContact O-OG 3.41Å; R28-E178 IonicContact CZ-OE1 2.74Å; R28-E178 IonicContact NH1-OE1 3.39Å; R28-E178 PolarHBondContact NH1-OE1 2.94Å; R28-E178 IonicContact NH2-OE1 2.65Å
29T93.9Very high92.8Very high5 Ų577.1 Ų77.13%0.03135%0.353CS..Hα-helixtrans-65.3-44.8175.2-57.10000111.5L25 D26 N31 S32 L33 L134 K174 L177L25-T29 HydrophobicContact CB-CG2 4.25Å; L25-T29 HydrophobicContact CD1-CG2 4.05Å; L25-T29 HydrophobicContact CD2-CG2 4.28Å; L25-T29 HydrophobicContact CG-CG2 4.42Å; D26-T29 VanDerWaalsContact CG-OG1 3.24Å; D26-T29 PolarHBondContact O-N 3.49Å; D26-T29 PolarHBondContact OD1-N 2.98Å; D26-T29 PolarHBondContact OD1-OG1 2.84Å; D26-T29 VanDerWaalsContact OD1-OG1 3.11Å; D26-T29 WeakPolarHBondContact OD2-CB 3.32Å; D26-T29 PolarHBondContact OD2-OG1 3.28Å; T29-N31 PolarHBondContact O-N 3.44Å; T29-S32 WeakPolarHBondContact O-CB 3.33Å; T29-S32 PolarHBondContact O-N 3.46Å; T29-L33 WeakPolarHBondContact O-CG 3.34Å; T29-L33 PolarHBondContact O-N 2.98Å; T29-L33 VanDerWaalsContact O-N 3.07Å; T29-L134 HydrophobicContact CG2-CD2 3.87Å; T29-K174 VanDerWaalsContact OG1-CE 3.32Å; T29-K174 WeakPolarHBondContact OG1-CE 3.4Å; T29-L177 HydrophobicContact CG2-CD2 3.81Å
30K94.9Very high93Very high83 Ų8370.2 Ų70.236%0.36133%0.327SS..Hα-helixtrans-58-48.5175.8-73.5174.3173.1160.10111.3E24 L25 D26 L27 S32 L33 Y34E24-K30 IonicContact OE2-NZ 2.84Å; E24-K30 PolarHBondContact OE2-NZ 3.37Å; L25-K30 HydrophobicContact CB-CG 3.86Å; L25-K30 WeakPolarHBondContact O-CD 3.45Å; L25-K30 WeakPolarHBondContact O-CE 3.36Å; L25-K30 PolarHBondContact O-NZ 2.68Å; D26-K30 PolarHBondContact O-N 3.08Å; L27-K30 PolarHBondContact O-N 2.95Å; K30-S32 VanDerWaalsContact C-N 3.32Å; K30-S32 PolarHBondContact O-N 2.91Å; K30-L33 PolarHBondContact O-N 3.23Å; K30-Y34 PolarHBondContact O-N 3.23Å
31N94.6Very high93.3Very high78 Ų7873.4 Ų73.442%0.41734%0.344SS..Hα-helixtrans-62.7-39.1178.6-72.4-9000112.1L27 T29 Y34 N35L27-N31 WeakPolarHBondContact O-CB 3.46Å; L27-N31 PolarHBondContact O-N 3.34Å; L27-N31 PolarHBondContact O-ND2 2.72Å; T29-N31 PolarHBondContact O-N 3.44Å; N31-Y34 PolarHBondContact O-N 3.22Å; N31-N35 VanDerWaalsContact O-CB 3.31Å; N31-N35 WeakPolarHBondContact O-CB 3.31Å; N31-N35 PolarHBondContact O-N 3.06Å; N31-N35 PolarHBondContact O-ND2 3.04Å; N31-N35 PolarHBondContact O-OD1 3.39Å
32S93.3Very high93.7Very high23 Ų2368.7 Ų68.716%0.16133%0.33CS..Hα-helixtrans-60.8-48.8176.8-65.60000112R28 T29 K30 Y34 N35 F36 M181R28-S32 WeakPolarHBondContact O-CB 2.87Å; R28-S32 PolarHBondContact O-N 3.36Å; R28-S32 PolarHBondContact O-OG 3.41Å; T29-S32 WeakPolarHBondContact O-CB 3.33Å; T29-S32 PolarHBondContact O-N 3.46Å; K30-S32 VanDerWaalsContact C-N 3.32Å; K30-S32 PolarHBondContact O-N 2.91Å; S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.18Å; S32-N35 PolarHBondContact O-N 3.27Å; S32-F36 PolarHBondContact O-N 3.15Å; S32-M181 VanDerWaalsContact O-CE 3.3Å; S32-M181 WeakPolarHBondContact O-CE 3.14Å
33L94.4Very high94Very high30 Ų3060.9 Ų60.916%0.15730%0.301CS..Hα-helixtrans-59.8-41.7176.2-70172.8000112.2L25 T29 K30 Q37 F127 R131 L177L25-L33 HydrophobicContact CD1-CD1 3.76Å; T29-L33 WeakPolarHBondContact O-CG 3.34Å; T29-L33 PolarHBondContact O-N 2.98Å; T29-L33 VanDerWaalsContact O-N 3.07Å; K30-L33 PolarHBondContact O-N 3.23Å; L33-Q37 WeakPolarHBondContact O-CB 3.47Å; L33-Q37 PolarHBondContact O-N 3.34Å; L33-F127 HydrophobicContact CD2-CE2 3.82Å; L33-F127 HydrophobicContact CD2-CZ 4.14Å; L33-F127 WeakPolarHBondContact O-CZ 3.48Å; L33-R131 HydrophobicContact CD2-CB 4.06Å; L33-R131 HydrophobicContact CD2-CG 3.91Å; L33-L177 HydrophobicContact CD2-CD1 3.87Å; L33-L177 HydrophobicContact CD2-CD2 3.78Å; L33-L177 HydrophobicContact CG-CD2 3.88Å
34Y95.6Very high94.3Very high162 Ų16264.1 Ų64.164%0.63531%0.314SS*.Hα-helixtrans-65.4-51.9177.9176.9-99.1000111.6K30 N31 S32 F36 Q37 A38K30-Y34 PolarHBondContact O-N 3.23Å; N31-Y34 PolarHBondContact O-N 3.22Å; S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.18Å; Y34-F36 PolarHBondContact O-N 3.06Å; Y34-Q37 PolarHBondContact O-N 3.27Å; Y34-A38 HydrophobicContact CE1-CB 4.21Å; Y34-A38 VanDerWaalsContact O-CB 3.29Å; Y34-A38 WeakPolarHBondContact O-CB 3.43Å; Y34-A38 PolarHBondContact O-N 2.84Å
35N94.3Very high94.5Very high78 Ų7866.1 Ų66.142%0.41732%0.315SS..Hα-helixtrans-61.8-41.5-173.2-71.8-13.3000112.8N31 S32 F39 L184N31-N35 VanDerWaalsContact O-CB 3.31Å; N31-N35 WeakPolarHBondContact O-CB 3.31Å; N31-N35 PolarHBondContact O-N 3.06Å; N31-N35 PolarHBondContact O-ND2 3.04Å; N31-N35 PolarHBondContact O-OD1 3.39Å; S32-N35 PolarHBondContact O-N 3.27Å; N35-F39 WeakPolarHBondContact O-CB 3.45Å; N35-F39 PolarHBondContact O-N 3.18Å; N35-L184 HydrophobicContact CB-CD2 4.03Å
36F94.3Very high94.7Very high3 Ų366.9 Ų66.91%0.01332%0.319CS..Hα-helixtrans-67.1-43.5178.9-154.4-66.7000111.3S32 Y34 F39 K40 E123 Y124 F127 V180 M181 L184S32-F36 PolarHBondContact O-N 3.15Å; Y34-F36 PolarHBondContact O-N 3.06Å; F36-F39 PolarHBondContact O-N 3.43Å; F36-K40 PolarHBondContact O-N 3.32Å; F36-K40 VanDerWaalsContact O-N 3.14Å; F36-E123 HydrophobicContact CZ-CB 3.85Å; F36-Y124 AromaticContact CD1-CD2 3.95Å; F36-Y124 HydrophobicContact CD1-CD2 3.95Å; F36-Y124 AromaticContact CE1-CD2 3.85Å; F36-Y124 HydrophobicContact CE1-CD2 3.85Å; F36-Y124 HydrophobicContact CE1-CG 4.47Å; F36-F127 HydrophobicContact CB-CD2 3.82Å; F36-F127 HydrophobicContact CB-CE1 4.39Å; F36-F127 HydrophobicContact CB-CE2 3.64Å; F36-F127 HydrophobicContact CB-CG 4.27Å; F36-F127 HydrophobicContact CB-CZ 3.95Å; F36-F127 HydrophobicContact CD1-CB 3.96Å; F36-F127 AromaticContact CD1-CD1 3.87Å; F36-F127 HydrophobicContact CD1-CD1 3.87Å; F36-F127 HydrophobicContact CD1-CD2 4.06Å; F36-F127 HydrophobicContact CD1-CE1 4.39Å; F36-F127 AromaticContact CD1-CG 3.68Å; F36-F127 HydrophobicContact CD1-CG 3.68Å; F36-F127 HydrophobicContact CD2-CD2 4.23Å; F36-F127 HydrophobicContact CE1-CB 3.94Å; F36-F127 HydrophobicContact CE1-CG 4.19Å; F36-F127 HydrophobicContact CG-CB 4.33Å; F36-F127 HydrophobicContact CG-CD1 4.36Å; F36-F127 AromaticContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CE2 4.12Å; F36-F127 AromaticContact CG-CG 3.89Å; F36-F127 HydrophobicContact CG-CG 3.89Å; F36-F127 HydrophobicContact CZ-CB 4.25Å; F36-V180 HydrophobicContact CE2-CG1 4.04Å; F36-V180 HydrophobicContact CZ-CG1 4.5Å; F36-M181 HydrophobicContact CB-CE 4.23Å; F36-M181 HydrophobicContact CB-SD 3.81Å; F36-M181 HydrophobicContact CD2-CE 4.27Å; F36-M181 HydrophobicContact CD2-SD 3.69Å; F36-M181 HydrophobicContact CG-SD 4.21Å; F36-L184 HydrophobicContact CD2-CB 3.99Å; F36-L184 HydrophobicContact CD2-CD1 4.03Å; F36-L184 HydrophobicContact CD2-CD2 4.45Å; F36-L184 HydrophobicContact CD2-CG 4.38Å; F36-L184 HydrophobicContact CE2-CB 4.13Å; F36-L184 HydrophobicContact CE2-CD1 4.33Å; F36-L184 HydrophobicContact CG-CD1 4.27Å
37Q94.8Very high94.8Very high34 Ų3466 Ų6616%0.15931%0.313CS..Hα-helixtrans-64.1-47.6177.4-174.96259.100110.9L33 Y34 F39 K40 D41 Y124 F127L33-Q37 WeakPolarHBondContact O-CB 3.47Å; L33-Q37 PolarHBondContact O-N 3.34Å; Y34-Q37 PolarHBondContact O-N 3.27Å; Q37-F39 VanDerWaalsContact C-N 3.31Å; Q37-F39 PolarHBondContact O-N 3.03Å; Q37-K40 PolarHBondContact O-N 3.03Å; Q37-K40 VanDerWaalsContact O-N 3.12Å; Q37-D41 PolarHBondContact NE2-OD1 3.12Å; Q37-D41 PolarHBondContact NE2-OD2 3.27Å; Q37-D41 VanDerWaalsContact O-CG 3.23Å; Q37-D41 PolarHBondContact O-N 3.31Å; Q37-Y124 PolarHBondContact NE2-OH 2.98Å; Q37-Y124 PolarHBondContact OE1-OH 3.16Å; Q37-F127 HydrophobicContact CB-CE1 4.32Å; Q37-F127 HydrophobicContact CB-CZ 4.42Å
38A95.5Very high94.9Very high23 Ų2361.8 Ų61.819%0.1930%0.3CS..Hα-helixtrans-59.5-41.4177.800000111.9Y34 K40 D41 C42Y34-A38 HydrophobicContact CE1-CB 4.21Å; Y34-A38 VanDerWaalsContact O-CB 3.29Å; Y34-A38 WeakPolarHBondContact O-CB 3.43Å; Y34-A38 PolarHBondContact O-N 2.84Å; A38-K40 VanDerWaalsContact C-N 3.34Å; A38-K40 PolarHBondContact O-N 3.38Å; A38-D41 PolarHBondContact O-N 2.92Å; A38-C42 VanDerWaalsContact O-CB 3.3Å; A38-C42 WeakPolarHBondContact O-CB 3.44Å; A38-C42 PolarHBondContact O-N 3.48Å; A38-C42 PolarHBondContact O-SG 3.4Å
39F95.5Very high94.9Very high31 Ų3155.8 Ų55.814%0.13629%0.285CS..Hα-helixtrans-59.9-44175.2173.1-101.3000112.1N35 F36 Q37 T43 L184 C187 M188 Q191N35-F39 WeakPolarHBondContact O-CB 3.45Å; N35-F39 PolarHBondContact O-N 3.18Å; F36-F39 PolarHBondContact O-N 3.43Å; Q37-F39 VanDerWaalsContact C-N 3.31Å; Q37-F39 PolarHBondContact O-N 3.03Å; F39-T43 VanDerWaalsContact O-CB 3.3Å; F39-T43 WeakPolarHBondContact O-CB 3.33Å; F39-T43 PolarHBondContact O-N 3.13Å; F39-T43 PolarHBondContact O-OG1 3.02Å; F39-L184 HydrophobicContact CB-CD1 3.7Å; F39-L184 HydrophobicContact CD1-CD1 3.67Å; F39-L184 HydrophobicContact CD2-CD1 4.48Å; F39-L184 HydrophobicContact CE1-CD1 4.49Å; F39-L184 HydrophobicContact CG-CD1 3.67Å; F39-C187 HydrophobicContact CD1-CB 4.37Å; F39-C187 HydrophobicContact CE1-CB 3.52Å; F39-C187 HydrophobicContact CZ-CB 3.8Å; F39-C187 WeakPolarHBondContact CZ-O 3.38Å; F39-M188 HydrophobicContact CD2-CG 3.63Å; F39-M188 HydrophobicContact CE2-CB 4.24Å; F39-M188 HydrophobicContact CE2-CG 3.67Å; F39-M188 HydrophobicContact CG-CG 4.33Å; F39-M188 HydrophobicContact CZ-CG 4.4Å; F39-Q191 HydrophobicContact CE2-CB 3.88Å; F39-Q191 HydrophobicContact CE2-CG 4.22Å; F39-Q191 HydrophobicContact CZ-CB 3.98Å
40K94.2Very high95Very high16 Ų1656 Ų567%0.0729%0.286CS..Hα-helixtrans-64.6-48178-175.151.9163.6140.90111.5F36 Q37 A38 C42 T43 E44 Y124F36-K40 PolarHBondContact O-N 3.32Å; F36-K40 VanDerWaalsContact O-N 3.14Å; Q37-K40 PolarHBondContact O-N 3.03Å; Q37-K40 VanDerWaalsContact O-N 3.12Å; A38-K40 VanDerWaalsContact C-N 3.34Å; A38-K40 PolarHBondContact O-N 3.38Å; K40-C42 PolarHBondContact O-N 3.46Å; K40-T43 PolarHBondContact O-N 3.43Å; K40-E44 HydrophobicContact CD-CG 4.15Å; K40-E44 WeakPolarHBondContact CE-OE1 3.43Å; K40-E44 IonicContact NZ-OE1 2.76Å; K40-E44 PolarHBondContact NZ-OE1 3.19Å; K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.16Å; K40-Y124 HydrophobicContact CB-CD2 3.96Å; K40-Y124 HydrophobicContact CB-CE2 3.87Å; K40-Y124 HydrophobicContact CD-CD1 4.37Å; K40-Y124 HydrophobicContact CD-CG 4.35Å; K40-Y124 HydrophobicContact CG-CD1 3.98Å; K40-Y124 HydrophobicContact CG-CD2 3.86Å; K40-Y124 HydrophobicContact CG-CE1 3.87Å; K40-Y124 HydrophobicContact CG-CE2 3.8Å; K40-Y124 HydrophobicContact CG-CG 3.97Å
41D94.8Very high94.9Very high77 Ų7754.6 Ų54.641%0.41228%0.282SS..Hα-helixtrans-61.2-45.9-179.2-62.7-18.7000111.1Q37 A38 T43 E44 W45Q37-D41 PolarHBondContact NE2-OD1 3.12Å; Q37-D41 PolarHBondContact NE2-OD2 3.27Å; Q37-D41 VanDerWaalsContact O-CG 3.23Å; Q37-D41 PolarHBondContact O-N 3.31Å; A38-D41 PolarHBondContact O-N 2.92Å; D41-T43 VanDerWaalsContact C-N 3.35Å; D41-T43 PolarHBondContact O-N 2.92Å; D41-E44 PolarHBondContact O-N 3.35Å; D41-W45 VanDerWaalsContact O-CB 3.3Å; D41-W45 WeakPolarHBondContact O-CB 3.49Å; D41-W45 PolarHBondContact O-N 2.65Å
42C95.4Very high94.7Very high81 Ų8158.2 Ų58.255%0.54730%0.297SS..Hα-helixtrans-65-37176.8-70.20000112.6A38 K40 L46A38-C42 VanDerWaalsContact O-CB 3.3Å; A38-C42 WeakPolarHBondContact O-CB 3.44Å; A38-C42 PolarHBondContact O-N 3.48Å; A38-C42 PolarHBondContact O-SG 3.4Å; K40-C42 PolarHBondContact O-N 3.46Å; C42-L46 VanDerWaalsContact O-CB 3.27Å; C42-L46 WeakPolarHBondContact O-CB 3.49Å; C42-L46 PolarHBondContact O-N 3.29Å
43T95.5Very high94.4Very high5 Ų563 Ų633%0.03132%0.315CS..Hα-helixtrans-68.1-42.2178.3-61.20000111.4F39 K40 D41 H47 M116F39-T43 VanDerWaalsContact O-CB 3.3Å; F39-T43 WeakPolarHBondContact O-CB 3.33Å; F39-T43 PolarHBondContact O-N 3.13Å; F39-T43 PolarHBondContact O-OG1 3.02Å; K40-T43 PolarHBondContact O-N 3.43Å; D41-T43 VanDerWaalsContact C-N 3.35Å; D41-T43 PolarHBondContact O-N 2.92Å; T43-H47 WeakPolarHBondContact O-CB 3.49Å; T43-H47 PolarHBondContact O-N 2.76Å; T43-M116 HydrophobicContact CG2-CE 4.47Å
44E94.9Very high94Very high97 Ų9762.1 Ų62.145%0.45331%0.31SS..Hα-helixtrans-67.6-41.9176-72.3-179.6171.200111.8K40 D41 H47 G48K40-E44 HydrophobicContact CD-CG 4.15Å; K40-E44 WeakPolarHBondContact CE-OE1 3.43Å; K40-E44 IonicContact NZ-OE1 2.76Å; K40-E44 PolarHBondContact NZ-OE1 3.19Å; K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.16Å; D41-E44 PolarHBondContact O-N 3.35Å; E44-H47 WeakPolarHBondContact O-CB 3.26Å; E44-H47 PolarHBondContact O-N 3.45Å; E44-G48 PolarHBondContact O-N 3.15Å
45W96.1Very high92.8Very high192 Ų19257.5 Ų57.573%0.72730%0.301SS*.Hα-helixtrans-61.4-47.6175.3-179.779.5000111.7D41 H47 G48 A49D41-W45 VanDerWaalsContact O-CB 3.3Å; D41-W45 WeakPolarHBondContact O-CB 3.49Å; D41-W45 PolarHBondContact O-N 2.65Å; W45-H47 VanDerWaalsContact C-N 3.33Å; W45-H47 PolarHBondContact O-N 2.94Å; W45-G48 PolarHBondContact O-N 2.92Å; W45-A49 PolarHBondContact O-N 2.73Å
46L96.5Very high91.4Very high47 Ų4755.7 Ų55.725%0.24630%0.297CS..Hα-helixtrans-64.1-38.4177.7-178.760.8000111.9C42 G48 A49 I50 M116C42-L46 VanDerWaalsContact O-CB 3.27Å; C42-L46 WeakPolarHBondContact O-CB 3.49Å; C42-L46 PolarHBondContact O-N 3.29Å; L46-G48 VanDerWaalsContact C-N 3.34Å; L46-A49 PolarHBondContact O-N 3.14Å; L46-I50 HydrophobicContact CD1-CD1 4.1Å; L46-I50 HydrophobicContact CD1-CG1 4.18Å; L46-I50 HydrophobicContact CG-CD1 3.94Å; L46-I50 HydrophobicContact CG-CG1 4.44Å; L46-I50 WeakPolarHBondContact O-CG1 3.47Å; L46-I50 PolarHBondContact O-N 3.32Å; L46-M116 HydrophobicContact CB-CE 4.19Å; L46-M116 HydrophobicContact CD2-CE 4.15Å; L46-M116 HydrophobicContact CG-CE 4Å
47H95.9Very high90.4Very high36 Ų3662.7 Ų62.717%0.16733%0.33CS..Hα-helixtrans-57.4-48.9172.5173.5-68.9000110.8T43 E44 W45 A49 I50 D51 L113 M116T43-H47 WeakPolarHBondContact O-CB 3.49Å; T43-H47 PolarHBondContact O-N 2.76Å; E44-H47 WeakPolarHBondContact O-CB 3.26Å; E44-H47 PolarHBondContact O-N 3.45Å; W45-H47 VanDerWaalsContact C-N 3.33Å; W45-H47 PolarHBondContact O-N 2.94Å; H47-A49 PolarHBondContact O-N 3.47Å; H47-I50 PolarHBondContact O-N 3.48Å; H47-D51 WeakPolarHBondContact O-CB 3.42Å; H47-D51 PolarHBondContact O-N 3.02Å; H47-L113 PolarHBondContact CD2-O 3.22Å; H47-L113 VanDerWaalsContact CD2-O 3.31Å; H47-L113 PolarHBondContact NE2-O 2.9Å; H47-L113 WeakPolarHBondContact O-CD2 3.49Å; H47-M116 HydrophobicContact CB-CE 4.02Å
48G94.5Very high89.5Confident34 Ų3465.6 Ų65.635%0.35135%0.346SS..Hα-helixtrans-58.2-46.2177.100000112.4E44 W45 L46 I50 D51 E52E44-G48 PolarHBondContact O-N 3.15Å; W45-G48 PolarHBondContact O-N 2.92Å; L46-G48 VanDerWaalsContact C-N 3.34Å; G48-I50 PolarHBondContact O-N 3.42Å; G48-D51 PolarHBondContact O-N 3.34Å; G48-E52 WeakPolarHBondContact O-CB 3.31Å; G48-E52 PolarHBondContact O-N 2.98Å
49A94.8Very high88.9Confident37 Ų3770.2 Ų70.231%0.30636%0.364SS..Hα-helixtrans-63.4-40.1178.900000113W45 L46 H47 F53W45-A49 PolarHBondContact O-N 2.73Å; L46-A49 PolarHBondContact O-N 3.14Å; H47-A49 PolarHBondContact O-N 3.47Å; A49-F53 VanDerWaalsContact O-CB 3.27Å; A49-F53 WeakPolarHBondContact O-CB 3.2Å; A49-F53 PolarHBondContact O-N 3.03Å
50I94.9Very high88.4Confident9 Ų970.1 Ų70.15%0.04636%0.364CS..Hα-helixtrans-68-41.3175.9-68.3169.9000110.8L46 H47 G48 F53 N54 I108 L113 M116 F198L46-I50 HydrophobicContact CD1-CD1 4.1Å; L46-I50 HydrophobicContact CD1-CG1 4.18Å; L46-I50 HydrophobicContact CG-CD1 3.94Å; L46-I50 HydrophobicContact CG-CG1 4.44Å; L46-I50 WeakPolarHBondContact O-CG1 3.47Å; L46-I50 PolarHBondContact O-N 3.32Å; H47-I50 PolarHBondContact O-N 3.48Å; G48-I50 PolarHBondContact O-N 3.42Å; I50-F53 PolarHBondContact O-N 2.81Å; I50-N54 WeakPolarHBondContact O-CB 3.07Å; I50-N54 PolarHBondContact O-N 3.13Å; I50-I108 HydrophobicContact CG2-CG2 3.95Å; I50-L113 HydrophobicContact CB-CD2 3.85Å; I50-L113 HydrophobicContact CG2-CD1 4.32Å; I50-L113 HydrophobicContact CG2-CD2 3.67Å; I50-L113 HydrophobicContact CG2-CG 4.06Å; I50-M116 HydrophobicContact CD1-CE 4.3Å; I50-M116 HydrophobicContact CD1-SD 4.05Å; I50-F198 HydrophobicContact CD1-CD1 4.45Å; I50-F198 HydrophobicContact CD1-CD2 4.44Å; I50-F198 HydrophobicContact CD1-CG 4.29Å; I50-F198 HydrophobicContact CG1-CE1 4.5Å; I50-F198 HydrophobicContact CG1-CE2 4.39Å; I50-F198 HydrophobicContact CG1-CZ 4.36Å; I50-F198 HydrophobicContact CG2-CD2 3.82Å; I50-F198 HydrophobicContact CG2-CE2 3.6Å; I50-F198 HydrophobicContact CG2-CZ 4.28Å
51D93.1Very high88.2Confident53 Ų5372.5 Ų72.528%0.28338%0.38SS..Hα-helixtrans-66.4-41.6179.9-165.841.8000111.7H47 G48 N54 C55 R109 L113H47-D51 WeakPolarHBondContact O-CB 3.42Å; H47-D51 PolarHBondContact O-N 3.02Å; G48-D51 PolarHBondContact O-N 3.34Å; D51-N54 CarbonylContact O-C 3.58Å; D51-N54 PolarHBondContact O-N 3.45Å; D51-C55 WeakPolarHBondContact O-CB 3.19Å; D51-C55 PolarHBondContact O-N 3.47Å; D51-C55 VanDerWaalsContact O-N 3.08Å; D51-R109 IonicContact OD1-CZ 3.29Å; D51-R109 IonicContact OD1-NH1 3.58Å; D51-R109 PolarHBondContact OD1-NH1 2.95Å; D51-L113 HydrophobicContact CB-CD1 3.82Å; D51-L113 HydrophobicContact CB-CD2 4.16Å; D51-L113 WeakPolarHBondContact OD1-CD1 3.5Å
52E90.4Very high88Confident155 Ų15574.2 Ų74.272%0.72438%0.384SS*.Hα-helixtrans-62.5-48.4174.2-175.7175.7-169.400111.5G48 N54 C55G48-E52 WeakPolarHBondContact O-CB 3.31Å; G48-E52 PolarHBondContact O-N 2.98Å; E52-N54 PolarHBondContact O-N 3.38Å; E52-C55 WeakPolarHBondContact O-CB 3.32Å; E52-C55 PolarHBondContact O-N 3.37Å
53F87.7Confident87.9Confident122 Ų12272 Ų7254%0.53537%0.366SS..Hα-helixtrans-56.5-37.5175176.9-94.1000112.1A49 I50 C55 F198 M202A49-F53 VanDerWaalsContact O-CB 3.27Å; A49-F53 WeakPolarHBondContact O-CB 3.2Å; A49-F53 PolarHBondContact O-N 3.03Å; I50-F53 PolarHBondContact O-N 2.81Å; F53-C55 VanDerWaalsContact C-N 3.31Å; F53-C55 PolarHBondContact O-N 2.83Å; F53-F198 HydrophobicContact CD1-CZ 4.17Å; F53-F198 HydrophobicContact CE1-CZ 4.34Å; F53-M202 HydrophobicContact CE1-CE 3.59Å; F53-M202 HydrophobicContact CE1-SD 3.88Å; F53-M202 HydrophobicContact CZ-CE 3.76Å
54N84.4Confident87.8Confident13 Ų1374.7 Ų74.77%0.0738%0.382CS..THydrogen-bonded Turntrans-87.44.4-178.5-160.545.1000113.8I50 D51 E52 S105 R109I50-N54 WeakPolarHBondContact O-CB 3.07Å; I50-N54 PolarHBondContact O-N 3.13Å; D51-N54 CarbonylContact O-C 3.58Å; D51-N54 PolarHBondContact O-N 3.45Å; E52-N54 PolarHBondContact O-N 3.38Å; N54-S105 WeakPolarHBondContact ND2-CA 3.43Å; N54-S105 PolarHBondContact ND2-O 3.02Å; N54-S105 WeakPolarHBondContact OD1-CA 3.12Å; N54-S105 WeakPolarHBondContact OD1-CB 3.22Å; N54-S105 PolarHBondContact OD1-OG 3.18Å; N54-R109 PolarHBondContact O-NH2 3.41Å; N54-R109 VanDerWaalsContact O-NH2 3.07Å
55C72.1Confident87.8Confident64 Ų6476.1 Ų76.143%0.43239%0.389SS..THydrogen-bonded Turntrans-103.920.3179.5-115.70000112.5D51 E52 F53 E57 R109D51-C55 WeakPolarHBondContact O-CB 3.19Å; D51-C55 PolarHBondContact O-N 3.47Å; D51-C55 VanDerWaalsContact O-N 3.08Å; E52-C55 WeakPolarHBondContact O-CB 3.32Å; E52-C55 PolarHBondContact O-N 3.37Å; F53-C55 VanDerWaalsContact C-N 3.31Å; F53-C55 PolarHBondContact O-N 2.83Å; C55-E57 PolarHBondContact O-N 2.92Å; C55-R109 PolarHBondContact SG-NH2 3.13Å
56A65.1Low87.8Confident40 Ų4070.9 Ų70.933%0.33138%0.375SS..  trans-73.663.3-179.800000112.5D58 E59 E60A56-D58 PolarHBondContact O-N 3.47Å; A56-D58 VanDerWaalsContact O-N 3.15Å; A56-E59 HydrophobicContact CB-CB 4.34Å; A56-E59 HydrophobicContact CB-CG 4.37Å; A56-E59 PolarHBondContact O-N 3.43Å; A56-E60 PolarHBondContact O-N 3.49Å
57E72.4Confident87.8Confident151 Ų15168.7 Ų68.771%0.70636%0.363SS*.Hα-helixtrans-53-29.9167.4-70.7-174.4162.400111C55 T61C55-E57 PolarHBondContact O-N 2.92Å; E57-T61 WeakPolarHBondContact O-CB 3.13Å; E57-T61 PolarHBondContact O-N 3.26Å; E57-T61 PolarHBondContact O-OG1 3.34Å
58D75.7Confident87.9Confident94 Ų9471 Ų7150%0.50337%0.374SS..Hα-helixtrans-65.6-43.3179.6-169.827.8000112.8A56 T61 K62A56-D58 PolarHBondContact O-N 3.47Å; A56-D58 VanDerWaalsContact O-N 3.15Å; D58-T61 PolarHBondContact O-N 2.99Å; D58-K62 VanDerWaalsContact CG-NZ 3.28Å; D58-K62 WeakPolarHBondContact O-CB 3.46Å; D58-K62 WeakPolarHBondContact O-CD 3.41Å; D58-K62 WeakPolarHBondContact O-CG 3.44Å; D58-K62 PolarHBondContact O-N 2.88Å; D58-K62 WeakPolarHBondContact OD1-CE 3.35Å; D58-K62 IonicContact OD1-NZ 3.12Å; D58-K62 PolarHBondContact OD1-NZ 3.22Å; D58-K62 WeakPolarHBondContact OD2-CE 3.42Å; D58-K62 IonicContact OD2-NZ 3.26Å; D58-K62 PolarHBondContact OD2-NZ 2.91Å
59E82.2Confident88Confident121 Ų12172 Ų7257%0.56538%0.378SS*.Hα-helixtrans-68.6-42.9178.8-75-168.6172.900112A56 T61 K62 M63A56-E59 HydrophobicContact CB-CB 4.34Å; A56-E59 HydrophobicContact CB-CG 4.37Å; A56-E59 PolarHBondContact O-N 3.43Å; E59-T61 VanDerWaalsContact C-N 3.31Å; E59-T61 PolarHBondContact O-N 3Å; E59-K62 PolarHBondContact O-N 3.22Å; E59-M63 HydrophobicContact CB-CE 4.27Å; E59-M63 WeakPolarHBondContact O-CB 3.33Å; E59-M63 PolarHBondContact O-N 3.46Å
60E86.6Confident88.1Confident29 Ų2970.9 Ų70.914%0.13637%0.368CS..Hα-helixtrans-64.1-39.4176.9-65.3-170.8169.100111.7A56 T64 V98 S101 K102A56-E60 PolarHBondContact O-N 3.49Å; E60-T64 WeakPolarHBondContact O-CB 3.44Å; E60-T64 PolarHBondContact O-N 2.92Å; E60-T64 PolarHBondContact O-OG1 2.97Å; E60-V98 HydrophobicContact CB-CG1 4.3Å; E60-S101 WeakPolarHBondContact OE1-CB 3.43Å; E60-S101 PolarHBondContact OE1-OG 3.02Å; E60-K102 WeakPolarHBondContact OE1-CG 3.47Å; E60-K102 PolarHBondContact OE1-N 3.38Å; E60-K102 WeakPolarHBondContact OE2-CE 3.34Å; E60-K102 WeakPolarHBondContact OE2-CG 3.37Å
61T88.5Confident88.2Confident66 Ų6672.7 Ų72.741%0.40538%0.377SS..Hα-helixtrans-65-50.1176.4-59.20000110.3E57 D58 E59 M63 T64 E65E57-T61 WeakPolarHBondContact O-CB 3.13Å; E57-T61 PolarHBondContact O-N 3.26Å; E57-T61 PolarHBondContact O-OG1 3.34Å; D58-T61 PolarHBondContact O-N 2.99Å; E59-T61 VanDerWaalsContact C-N 3.31Å; E59-T61 PolarHBondContact O-N 3Å; T61-M63 PolarHBondContact O-N 3.18Å; T61-T64 WeakPolarHBondContact O-CB 3.33Å; T61-T64 PolarHBondContact O-N 3.18Å; T61-T64 VanDerWaalsContact O-N 3.08Å; T61-E65 HydrophobicContact CG2-CG 4.39Å; T61-E65 WeakPolarHBondContact O-CG 3.29Å; T61-E65 PolarHBondContact O-N 2.66Å
62K91.4Very high88.3Confident113 Ų11375.1 Ų75.149%0.49139%0.387SS..Hα-helixtrans-57.7-43.8176.9-75.9167.1173.8164.10112.8D58 E59 T64 E65 L66D58-K62 VanDerWaalsContact CG-NZ 3.28Å; D58-K62 WeakPolarHBondContact O-CB 3.46Å; D58-K62 WeakPolarHBondContact O-CD 3.41Å; D58-K62 WeakPolarHBondContact O-CG 3.44Å; D58-K62 PolarHBondContact O-N 2.88Å; D58-K62 WeakPolarHBondContact OD1-CE 3.35Å; D58-K62 IonicContact OD1-NZ 3.12Å; D58-K62 PolarHBondContact OD1-NZ 3.22Å; D58-K62 WeakPolarHBondContact OD2-CE 3.42Å; D58-K62 IonicContact OD2-NZ 3.26Å; D58-K62 PolarHBondContact OD2-NZ 2.91Å; E59-K62 PolarHBondContact O-N 3.22Å; K62-T64 VanDerWaalsContact C-N 3.33Å; K62-E65 PolarHBondContact O-N 3.07Å; K62-L66 VanDerWaalsContact O-CB 3.31Å; K62-L66 WeakPolarHBondContact O-CB 3.18Å; K62-L66 PolarHBondContact O-N 3.05Å
63M92.5Very high88.5Confident35 Ų3572.8 Ų72.817%0.17238%0.377CS..Hα-helixtrans-65.9-36.7176.4-79.7-172.1-87.200112.2E59 T61 A67 I97 V98E59-M63 HydrophobicContact CB-CE 4.27Å; E59-M63 WeakPolarHBondContact O-CB 3.33Å; E59-M63 PolarHBondContact O-N 3.46Å; T61-M63 PolarHBondContact O-N 3.18Å; M63-A67 WeakPolarHBondContact O-CB 3.05Å; M63-A67 PolarHBondContact O-N 3.41Å; M63-I97 HydrophobicContact CE-CG2 4.34Å; M63-I97 HydrophobicContact SD-CB 4.44Å; M63-I97 HydrophobicContact SD-CG2 3.67Å; M63-V98 HydrophobicContact CB-CG2 3.45Å; M63-V98 VanDerWaalsContact CB-CG2 3.45Å; M63-V98 HydrophobicContact CE-CG2 4.49Å; M63-V98 HydrophobicContact CG-CG2 4.47Å; M63-V98 HydrophobicContact SD-CG2 4.3Å
64T93.9Very high88.8Confident61 Ų6167.4 Ų67.437%0.37436%0.355SS..Hα-helixtrans-67.8-44.1176.4-57.30000111.3E60 T61 K62 A67 E68E60-T64 WeakPolarHBondContact O-CB 3.44Å; E60-T64 PolarHBondContact O-N 2.92Å; E60-T64 PolarHBondContact O-OG1 2.97Å; T61-T64 WeakPolarHBondContact O-CB 3.33Å; T61-T64 PolarHBondContact O-N 3.18Å; T61-T64 VanDerWaalsContact O-N 3.08Å; K62-T64 VanDerWaalsContact C-N 3.33Å; T64-A67 WeakPolarHBondContact O-CB 3.35Å; T64-A67 PolarHBondContact O-N 2.9Å; T64-E68 PolarHBondContact O-N 3.48Å
65E95.4Very high89.3Confident127 Ų12771 Ų7159%0.59339%0.387SS*.Hα-helixtrans-62.4-42.8175.4-72.2177.5174.600111.7T61 K62 A67 E68 A69T61-E65 HydrophobicContact CG2-CG 4.39Å; T61-E65 WeakPolarHBondContact O-CG 3.29Å; T61-E65 PolarHBondContact O-N 2.66Å; K62-E65 PolarHBondContact O-N 3.07Å; E65-A67 VanDerWaalsContact C-N 3.35Å; E65-A67 PolarHBondContact O-N 3.07Å; E65-E68 PolarHBondContact O-N 2.73Å; E65-A69 WeakPolarHBondContact O-CB 3.47Å; E65-A69 PolarHBondContact O-N 3.09Å
66L96.2Very high90.4Very high82 Ų8276.2 Ų76.243%0.42940%0.402SS..Hα-helixtrans-62.5-42175.1-176.963.1000111.5K62 E68 A69 T70 L94K62-L66 VanDerWaalsContact O-CB 3.31Å; K62-L66 WeakPolarHBondContact O-CB 3.18Å; K62-L66 PolarHBondContact O-N 3.05Å; L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 3.08Å; L66-A69 PolarHBondContact O-N 3.5Å; L66-T70 WeakPolarHBondContact O-CB 3.44Å; L66-T70 PolarHBondContact O-N 3.43Å; L66-T70 PolarHBondContact O-OG1 2.94Å; L66-L94 HydrophobicContact CB-CD1 4.13Å; L66-L94 HydrophobicContact CD2-CD1 3.82Å; L66-L94 HydrophobicContact CD2-CD2 4.28Å; L66-L94 HydrophobicContact CG-CD1 3.68Å
67A96.9Very high91.7Very high0 Ų075.3 Ų75.30%040%0.395CS..Hα-helixtrans-61.7-40.4175.900000111.8M63 T64 E65 T70 L71 A91 L94 R95M63-A67 WeakPolarHBondContact O-CB 3.05Å; M63-A67 PolarHBondContact O-N 3.41Å; T64-A67 WeakPolarHBondContact O-CB 3.35Å; T64-A67 PolarHBondContact O-N 2.9Å; E65-A67 VanDerWaalsContact C-N 3.35Å; E65-A67 PolarHBondContact O-N 3.07Å; A67-T70 PolarHBondContact O-N 3.06Å; A67-L71 PolarHBondContact O-N 2.83Å; A67-A91 HydrophobicContact CB-CB 4.39Å; A67-A91 WeakPolarHBondContact O-CB 3.4Å; A67-L94 HydrophobicContact CB-CB 3.83Å; A67-L94 HydrophobicContact CB-CD1 4.13Å; A67-R95 HydrophobicContact CB-CG 3.87Å
68E97.2Very high92.6Very high86 Ų8673.2 Ų73.240%0.40239%0.392SS..Hα-helixtrans-68.3-44.6178.3-166.659.5-153.800112.1T64 E65 L66 T70 L71 Q72 R95T64-E68 PolarHBondContact O-N 3.48Å; E65-E68 PolarHBondContact O-N 2.73Å; L66-E68 VanDerWaalsContact C-N 3.31Å; L66-E68 PolarHBondContact O-N 3.08Å; E68-T70 VanDerWaalsContact C-N 3.25Å; E68-T70 PolarHBondContact O-N 2.91Å; E68-L71 PolarHBondContact O-N 2.59Å; E68-L71 VanDerWaalsContact O-N 3.16Å; E68-Q72 WeakPolarHBondContact O-CG 3.48Å; E68-Q72 PolarHBondContact O-N 2.85Å; E68-R95 IonicContact OE2-NH2 2.79Å; E68-R95 PolarHBondContact OE2-NH2 3.33Å
69A97.4Very high93.4Very high53 Ų5374.2 Ų74.244%0.43840%0.404SS..Hα-helixtrans-58.9-39.5173.700000111.8E65 L66 Q72 M73E65-A69 WeakPolarHBondContact O-CB 3.47Å; E65-A69 PolarHBondContact O-N 3.09Å; L66-A69 PolarHBondContact O-N 3.5Å; A69-Q72 PolarHBondContact O-N 3.48Å; A69-M73 PolarHBondContact O-N 3.02Å
70T96.2Very high93.7Very high14 Ų1471.1 Ų71.19%0.08640%0.404CS..Hα-helixtrans-65-39.5176.6-53.20000111.6L66 A67 E68 Q72 M73 A74 A87 Y90 A91L66-T70 WeakPolarHBondContact O-CB 3.44Å; L66-T70 PolarHBondContact O-N 3.43Å; L66-T70 PolarHBondContact O-OG1 2.94Å; A67-T70 PolarHBondContact O-N 3.06Å; E68-T70 VanDerWaalsContact C-N 3.25Å; E68-T70 PolarHBondContact O-N 2.91Å; T70-Q72 VanDerWaalsContact C-N 3.35Å; T70-M73 WeakPolarHBondContact O-CB 3.37Å; T70-M73 PolarHBondContact O-N 3.47Å; T70-A74 PolarHBondContact O-N 2.87Å; T70-A87 HydrophobicContact CG2-CB 3.96Å; T70-A87 WeakPolarHBondContact CG2-O 3.32Å; T70-Y90 HydrophobicContact CG2-CD1 3.7Å; T70-Y90 HydrophobicContact CG2-CG 4.38Å; T70-A91 HydrophobicContact CG2-CB 4.21Å
71L96.2Very high93.9Very high47 Ų4771.2 Ų71.225%0.24641%0.408CS..Hα-helixtrans-66.9-36.2174.2-75.4166.7000112.7A67 E68 M73 A74 A75 A91A67-L71 PolarHBondContact O-N 2.83Å; E68-L71 PolarHBondContact O-N 2.59Å; E68-L71 VanDerWaalsContact O-N 3.16Å; L71-M73 VanDerWaalsContact C-N 3.26Å; L71-M73 PolarHBondContact O-N 3.38Å; L71-A74 WeakPolarHBondContact O-CB 3.43Å; L71-A74 PolarHBondContact O-N 3.06Å; L71-A75 WeakPolarHBondContact O-CB 3.5Å; L71-A75 PolarHBondContact O-N 3.41Å; L71-A91 HydrophobicContact CD1-CB 4.1Å; L71-A91 HydrophobicContact CD2-CB 3.82Å; L71-A91 HydrophobicContact CG-CB 3.5Å; L71-A91 VanDerWaalsContact CG-CB 3.5Å
72Q96.6Very high94Very high104 Ų10475.3 Ų75.349%0.48642%0.422SS..Hα-helixtrans-64.3-33.9173.5-68.9-177.611.600112E68 A69 T70 K76E68-Q72 WeakPolarHBondContact O-CG 3.48Å; E68-Q72 PolarHBondContact O-N 2.85Å; A69-Q72 PolarHBondContact O-N 3.48Å; T70-Q72 VanDerWaalsContact C-N 3.35Å; Q72-K76 VanDerWaalsContact O-CG 3.32Å; Q72-K76 WeakPolarHBondContact O-CG 3.18Å; Q72-K76 PolarHBondContact O-N 3.14Å
73M93.7Very high94Very high106 Ų10674.5 Ų74.552%0.52242%0.423SS..Hα-helixtrans-64.1-48.2170.8-177.3-173.9-65.500110.7A69 T70 L71 A75 K76 A77 L83A69-M73 PolarHBondContact O-N 3.02Å; T70-M73 WeakPolarHBondContact O-CB 3.37Å; T70-M73 PolarHBondContact O-N 3.47Å; L71-M73 VanDerWaalsContact C-N 3.26Å; L71-M73 PolarHBondContact O-N 3.38Å; M73-A75 VanDerWaalsContact C-N 3.31Å; M73-A75 PolarHBondContact O-N 2.96Å; M73-K76 PolarHBondContact O-N 3.44Å; M73-K76 VanDerWaalsContact O-N 3.13Å; M73-A77 PolarHBondContact O-N 2.99Å; M73-L83 HydrophobicContact SD-CD1 4.27Å
74A93.7Very high94Very high9 Ų975.6 Ų75.67%0.07443%0.429CS..Hα-helixtrans-56.9-44.9177.300000111.8T70 L71 K76 A77 M84 A87 A88T70-A74 PolarHBondContact O-N 2.87Å; L71-A74 WeakPolarHBondContact O-CB 3.43Å; L71-A74 PolarHBondContact O-N 3.06Å; A74-K76 PolarHBondContact O-N 3.07Å; A74-A77 WeakPolarHBondContact O-CB 3.26Å; A74-A77 PolarHBondContact O-N 3.3Å; A74-A77 VanDerWaalsContact O-N 3.17Å; A74-M84 HydrophobicContact CB-CG 4.4Å; A74-A87 HydrophobicContact CB-CB 3.8Å; A74-A88 HydrophobicContact CB-CB 4.47Å
75A94.6Very high93.9Very high89 Ų8978.2 Ų78.274%0.73644%0.436SS*.Hα-helixtrans-65.6-23.1-179.900000114.1L71 M73L71-A75 WeakPolarHBondContact O-CB 3.5Å; L71-A75 PolarHBondContact O-N 3.41Å; M73-A75 VanDerWaalsContact C-N 3.31Å; M73-A75 PolarHBondContact O-N 2.96Å
76K95.2Very high93.7Very high174 Ų17474.3 Ų74.376%0.75742%0.423SS*.Hα-helixtrans-95.3-11.8177.4-69.2174.1-176.6175.20113.1Q72 M73 A74Q72-K76 VanDerWaalsContact O-CG 3.32Å; Q72-K76 WeakPolarHBondContact O-CG 3.18Å; Q72-K76 PolarHBondContact O-N 3.14Å; M73-K76 PolarHBondContact O-N 3.44Å; M73-K76 VanDerWaalsContact O-N 3.13Å; A74-K76 PolarHBondContact O-N 3.07Å
77A93.4Very high93.6Very high20 Ų2070.7 Ų70.717%0.16540%0.404CS..SBendtrans-72162.2176.700000111M73 A74 P79 L83 M84M73-A77 PolarHBondContact O-N 2.99Å; A74-A77 WeakPolarHBondContact O-CB 3.26Å; A74-A77 PolarHBondContact O-N 3.3Å; A74-A77 VanDerWaalsContact O-N 3.17Å; A77-P79 WeakPolarHBondContact O-CD 3.36Å; A77-L83 HydrophobicContact CB-CD2 4.4Å; A77-L83 HydrophobicContact CB-CG 4.48Å; A77-M84 HydrophobicContact CB-CB 4.01Å
78V91.8Very high93.4Very high107 Ų10772.5 Ų72.565%0.64842%0.42SS*.PPolyproline II helixtrans-61.5128174.8178.60000108.4G80 S81V78-G80 PolarHBondContact O-N 3.39Å; V78-S81 VanDerWaalsContact O-CB 3.26Å; V78-S81 WeakPolarHBondContact O-CB 3.4Å; V78-S81 PolarHBondContact O-N 2.99Å; V78-S81 PolarHBondContact O-OG 2.92Å
79P91.9Very high93.2Very high116 Ų11670.4 Ų70.475%0.75342%0.415SS*.THydrogen-bonded Turntrans-54.9128178.4-27.635.3000111.7A77 S81A77-P79 WeakPolarHBondContact O-CD 3.36Å; P79-S81 VanDerWaalsContact C-N 3.34Å
80G88.5Confident93.1Very high55 Ų5571.7 Ų71.757%0.56741%0.409SS*.THydrogen-bonded Turntrans79.49.3-178.100000115.2V78V78-G80 PolarHBondContact O-N 3.39Å
81S91.3Very high93.1Very high32 Ų3271 Ų7122%0.22441%0.405CS..  trans-76.1149.2171.162.10000112V78 P79 L83 M84 E85V78-S81 VanDerWaalsContact O-CB 3.26Å; V78-S81 WeakPolarHBondContact O-CB 3.4Å; V78-S81 PolarHBondContact O-N 2.99Å; V78-S81 PolarHBondContact O-OG 2.92Å; P79-S81 VanDerWaalsContact C-N 3.34Å; S81-L83 PolarHBondContact O-N 3.24Å; S81-L83 VanDerWaalsContact O-N 3.16Å; S81-M84 VanDerWaalsContact O-CB 3.31Å; S81-M84 WeakPolarHBondContact O-CB 3.5Å; S81-M84 PolarHBondContact O-N 3.06Å; S81-M84 PolarHBondContact OG-N 3.36Å; S81-E85 PolarHBondContact O-N 3.25Å
82E90.8Very high93Very high151 Ų15171.6 Ų71.671%0.70642%0.416SS*.Hα-helixtrans-54.9-33.6173.8-67.1176.2-17800112.1E85 C86E82-E85 PolarHBondContact O-N 3.28Å; E82-C86 WeakPolarHBondContact O-CB 3.46Å; E82-C86 PolarHBondContact O-N 2.94Å
83L90.4Very high92.9Very high97 Ų9767 Ų6751%0.50840%0.396SS..Hα-helixtrans-63.9-42.1174.8179.662.7000112.1M73 A77 S81 E85 A87M73-L83 HydrophobicContact SD-CD1 4.27Å; A77-L83 HydrophobicContact CB-CD2 4.4Å; A77-L83 HydrophobicContact CB-CG 4.48Å; S81-L83 PolarHBondContact O-N 3.24Å; S81-L83 VanDerWaalsContact O-N 3.16Å; L83-E85 VanDerWaalsContact C-N 3.34Å; L83-A87 WeakPolarHBondContact O-CB 3.25Å; L83-A87 PolarHBondContact O-N 3.48Å
84M92.5Very high93Very high58 Ų5862.5 Ų62.529%0.28637%0.373SS..Hα-helixtrans-60.3-47.4177.5-175.9-169.478.100110.4A74 A77 S81 A88A74-M84 HydrophobicContact CB-CG 4.4Å; A77-M84 HydrophobicContact CB-CB 4.01Å; S81-M84 VanDerWaalsContact O-CB 3.31Å; S81-M84 WeakPolarHBondContact O-CB 3.5Å; S81-M84 PolarHBondContact O-N 3.06Å; S81-M84 PolarHBondContact OG-N 3.36Å; M84-A88 VanDerWaalsContact O-CB 3.31Å; M84-A88 WeakPolarHBondContact O-CB 3.49Å; M84-A88 PolarHBondContact O-N 3.31Å
85E91.2Very high93.1Very high115 Ų11567.6 Ų67.654%0.53739%0.391SS..Hα-helixtrans-68-43.8-178.7-64.3-176.7176.200112S81 E82 L83 A88 S89S81-E85 PolarHBondContact O-N 3.25Å; E82-E85 PolarHBondContact O-N 3.28Å; L83-E85 VanDerWaalsContact C-N 3.34Å; E85-A88 PolarHBondContact O-N 3.35Å; E85-S89 WeakPolarHBondContact O-CB 3.45Å; E85-S89 PolarHBondContact O-N 3.47Å; E85-S89 PolarHBondContact O-OG 3.01Å
86C92.4Very high93.1Very high46 Ų4665 Ų6531%0.31137%0.37SS..Hα-helixtrans-62.7-47.4176.3179.20000111.4E82 S89 Y90 T220E82-C86 WeakPolarHBondContact O-CB 3.46Å; E82-C86 PolarHBondContact O-N 2.94Å; C86-S89 PolarHBondContact O-N 2.96Å; C86-Y90 WeakPolarHBondContact O-CB 3.27Å; C86-Y90 PolarHBondContact O-N 2.93Å; C86-T220 HydrophobicContact CB-CG2 4.13Å; C86-T220 VanDerWaalsContact SG-CG2 3.57Å
87A93.8Very high93.1Very high5 Ų557.2 Ų57.24%0.04134%0.336CS..Hα-helixtrans-64-43.5178.400000111.8T70 A74 L83 S89 Y90 A91T70-A87 HydrophobicContact CG2-CB 3.96Å; T70-A87 WeakPolarHBondContact CG2-O 3.32Å; A74-A87 HydrophobicContact CB-CB 3.8Å; L83-A87 WeakPolarHBondContact O-CB 3.25Å; L83-A87 PolarHBondContact O-N 3.48Å; A87-S89 VanDerWaalsContact C-N 3.33Å; A87-S89 PolarHBondContact O-N 3.46Å; A87-Y90 PolarHBondContact O-N 3.32Å; A87-A91 PolarHBondContact O-N 3.42Å
88A92.9Very high93.1Very high39 Ų3956.7 Ų56.732%0.32233%0.33SS..Hα-helixtrans-60.7-42.8175.100000111.9A74 M84 E85 A91 A92A74-A88 HydrophobicContact CB-CB 4.47Å; M84-A88 VanDerWaalsContact O-CB 3.31Å; M84-A88 WeakPolarHBondContact O-CB 3.49Å; M84-A88 PolarHBondContact O-N 3.31Å; E85-A88 PolarHBondContact O-N 3.35Å; A88-A91 PolarHBondContact O-N 2.98Å; A88-A92 PolarHBondContact O-N 2.88Å
89S93.2Very high93.2Very high42 Ų4259.3 Ų59.329%0.29433%0.333SS..Hα-helixtrans-66-39.1177.1-60.10000112.2E85 C86 A87 A92 C93E85-S89 WeakPolarHBondContact O-CB 3.45Å; E85-S89 PolarHBondContact O-N 3.47Å; E85-S89 PolarHBondContact O-OG 3.01Å; C86-S89 PolarHBondContact O-N 2.96Å; A87-S89 VanDerWaalsContact C-N 3.33Å; A87-S89 PolarHBondContact O-N 3.46Å; S89-A92 PolarHBondContact O-N 3.01Å; S89-C93 WeakPolarHBondContact O-CB 3.34Å; S89-C93 PolarHBondContact O-N 3.41Å
90Y94.7Very high93.3Very high79 Ų7956.1 Ų56.131%0.3131%0.309SS..Hα-helixtrans-66-42.4177.2-175.6-132.9000111.6T70 C86 A87 A92 C93 L94 F216T70-Y90 HydrophobicContact CG2-CD1 3.7Å; T70-Y90 HydrophobicContact CG2-CG 4.38Å; C86-Y90 WeakPolarHBondContact O-CB 3.27Å; C86-Y90 PolarHBondContact O-N 2.93Å; A87-Y90 PolarHBondContact O-N 3.32Å; Y90-A92 VanDerWaalsContact C-N 3.33Å; Y90-A92 PolarHBondContact O-N 3.22Å; Y90-C93 WeakPolarHBondContact O-CB 3.39Å; Y90-C93 PolarHBondContact O-N 3.22Å; Y90-L94 HydrophobicContact CD1-CD1 4.26Å; Y90-L94 HydrophobicContact CD2-CG 4.44Å; Y90-L94 HydrophobicContact CE1-CD1 3.86Å; Y90-L94 HydrophobicContact CE2-CD1 4.3Å; Y90-L94 HydrophobicContact CE2-CD2 4.17Å; Y90-L94 HydrophobicContact CE2-CG 4.07Å; Y90-L94 WeakPolarHBondContact O-CG 3.44Å; Y90-L94 PolarHBondContact O-N 3.22Å; Y90-F216 VanDerWaalsContact CA-CE2 3.45Å; Y90-F216 HydrophobicContact CD2-CD1 4.29Å; Y90-F216 AromaticContact CD2-CE1 3.83Å; Y90-F216 HydrophobicContact CD2-CE1 3.83Å; Y90-F216 HydrophobicContact CD2-CE2 4.2Å; Y90-F216 AromaticContact CD2-CZ 3.79Å; Y90-F216 HydrophobicContact CD2-CZ 3.79Å; Y90-F216 HydrophobicContact CG-CE1 4.46Å; Y90-F216 HydrophobicContact CG-CE2 4.28Å; Y90-F216 AromaticContact CG-CZ 3.98Å; Y90-F216 HydrophobicContact CG-CZ 3.98Å
91A95.5Very high93.5Very high1 Ų154.3 Ų54.31%0.00829%0.288CS..Hα-helixtrans-62.8-39.3174.700000112.6A67 T70 L71 A87 A88 L94 R95A67-A91 HydrophobicContact CB-CB 4.39Å; A67-A91 WeakPolarHBondContact O-CB 3.4Å; T70-A91 HydrophobicContact CG2-CB 4.21Å; L71-A91 HydrophobicContact CD1-CB 4.1Å; L71-A91 HydrophobicContact CD2-CB 3.82Å; L71-A91 HydrophobicContact CG-CB 3.5Å; L71-A91 VanDerWaalsContact CG-CB 3.5Å; A87-A91 PolarHBondContact O-N 3.42Å; A88-A91 PolarHBondContact O-N 2.98Å; A91-L94 PolarHBondContact O-N 3.24Å; A91-R95 WeakPolarHBondContact O-CG 3.37Å; A91-R95 PolarHBondContact O-N 3.2Å
92A94.3Very high93.5Very high58 Ų5858.3 Ų58.348%0.47930%0.301SS..Hα-helixtrans-63.5-41.9174.500000111.7A88 S89 Y90 R95 A96A88-A92 PolarHBondContact O-N 2.88Å; S89-A92 PolarHBondContact O-N 3.01Å; Y90-A92 VanDerWaalsContact C-N 3.33Å; Y90-A92 PolarHBondContact O-N 3.22Å; A92-R95 PolarHBondContact O-N 3.5Å; A92-A96 WeakPolarHBondContact O-CB 3.43Å; A92-A96 PolarHBondContact O-N 2.9Å
93C95.3Very high93.6Very high9 Ų954 Ų546%0.06129%0.287CS..Hα-helixtrans-57.2-51.6174.2171.10000111.8S89 Y90 R95 A96 I97 I212 F216S89-C93 WeakPolarHBondContact O-CB 3.34Å; S89-C93 PolarHBondContact O-N 3.41Å; Y90-C93 WeakPolarHBondContact O-CB 3.39Å; Y90-C93 PolarHBondContact O-N 3.22Å; C93-R95 PolarHBondContact O-N 3.03Å; C93-A96 WeakPolarHBondContact O-CB 3.27Å; C93-A96 PolarHBondContact O-N 3.32Å; C93-A96 VanDerWaalsContact O-N 3.12Å; C93-I97 WeakPolarHBondContact O-CG1 3.42Å; C93-I97 PolarHBondContact O-N 3.23Å; C93-I212 HydrophobicContact CB-CG2 4.32Å; C93-I212 VanDerWaalsContact SG-CG2 3.58Å; C93-F216 HydrophobicContact CB-CB 4.12Å; C93-F216 HydrophobicContact CB-CD2 4.44Å; C93-F216 HydrophobicContact CB-CG 4.31Å
94L95.7Very high93.7Very high10 Ų1049.7 Ų49.75%0.05227%0.265CS..Hα-helixtrans-58.7-44.6177.3-69.4172.2000112.3L66 A67 Y90 A91 A96 I97 V98L66-L94 HydrophobicContact CB-CD1 4.13Å; L66-L94 HydrophobicContact CD2-CD1 3.82Å; L66-L94 HydrophobicContact CD2-CD2 4.28Å; L66-L94 HydrophobicContact CG-CD1 3.68Å; A67-L94 HydrophobicContact CB-CB 3.83Å; A67-L94 HydrophobicContact CB-CD1 4.13Å; Y90-L94 HydrophobicContact CD1-CD1 4.26Å; Y90-L94 HydrophobicContact CD2-CG 4.44Å; Y90-L94 HydrophobicContact CE1-CD1 3.86Å; Y90-L94 HydrophobicContact CE2-CD1 4.3Å; Y90-L94 HydrophobicContact CE2-CD2 4.17Å; Y90-L94 HydrophobicContact CE2-CG 4.07Å; Y90-L94 WeakPolarHBondContact O-CG 3.44Å; Y90-L94 PolarHBondContact O-N 3.22Å; A91-L94 PolarHBondContact O-N 3.24Å; L94-A96 VanDerWaalsContact C-N 3.31Å; L94-A96 PolarHBondContact O-N 3.03Å; L94-I97 PolarHBondContact O-N 3.29Å; L94-V98 WeakPolarHBondContact O-CG2 3.48Å; L94-V98 PolarHBondContact O-N 2.88Å
95R94.6Very high93.7Very high117 Ų11747.9 Ų47.944%0.44226%0.258SS..Hα-helixtrans-63.9-35.3176.9-74.2174.9173.8180-2.7112.4A67 E68 A91 A92 C93 K99A67-R95 HydrophobicContact CB-CG 3.87Å; E68-R95 IonicContact OE2-NH2 2.79Å; E68-R95 PolarHBondContact OE2-NH2 3.33Å; A91-R95 WeakPolarHBondContact O-CG 3.37Å; A91-R95 PolarHBondContact O-N 3.2Å; A92-R95 PolarHBondContact O-N 3.5Å; C93-R95 PolarHBondContact O-N 3.03Å; R95-K99 WeakPolarHBondContact O-CB 2.91Å; R95-K99 PolarHBondContact O-N 2.91Å
96A94.9Very high93.8Very high35 Ų3545 Ų4529%0.28925%0.254SS..Hα-helixtrans-66.1-42.3175.500000111.6A92 C93 L94 K99 I100 I212A92-A96 WeakPolarHBondContact O-CB 3.43Å; A92-A96 PolarHBondContact O-N 2.9Å; C93-A96 WeakPolarHBondContact O-CB 3.27Å; C93-A96 PolarHBondContact O-N 3.32Å; C93-A96 VanDerWaalsContact O-N 3.12Å; L94-A96 VanDerWaalsContact C-N 3.31Å; L94-A96 PolarHBondContact O-N 3.03Å; A96-K99 PolarHBondContact O-N 2.9Å; A96-I100 WeakPolarHBondContact O-CG1 3.47Å; A96-I100 PolarHBondContact O-N 2.97Å; A96-I212 HydrophobicContact CB-CD1 4.07Å; A96-I212 HydrophobicContact CB-CG2 4.2Å
97I95.2Very high93.9Very high10 Ų1045.2 Ų45.25%0.05125%0.251CS..Hα-helixtrans-60.1-48.3174.9-66.9169.5000110.6M63 C93 L94 K99 I100 S101 V209 I212 L213M63-I97 HydrophobicContact CE-CG2 4.34Å; M63-I97 HydrophobicContact SD-CB 4.44Å; M63-I97 HydrophobicContact SD-CG2 3.67Å; C93-I97 WeakPolarHBondContact O-CG1 3.42Å; C93-I97 PolarHBondContact O-N 3.23Å; L94-I97 PolarHBondContact O-N 3.29Å; I97-K99 VanDerWaalsContact C-N 3.3Å; I97-K99 PolarHBondContact O-N 2.69Å; I97-I100 PolarHBondContact O-N 3.18Å; I97-I100 VanDerWaalsContact O-N 3.15Å; I97-S101 PolarHBondContact O-N 3.34Å; I97-V209 HydrophobicContact CD1-CG1 4.17Å; I97-V209 HydrophobicContact CG1-CG1 4.3Å; I97-V209 HydrophobicContact CG1-CG2 4.42Å; I97-V209 HydrophobicContact CG2-CG2 4.05Å; I97-I212 HydrophobicContact CD1-CG2 4.42Å; I97-I212 HydrophobicContact CG1-CB 4.49Å; I97-I212 HydrophobicContact CG1-CD1 4.36Å; I97-I212 HydrophobicContact CG1-CG2 3.97Å; I97-L213 HydrophobicContact CD1-CD2 3.97Å; I97-L213 HydrophobicContact CD1-CG 4.12Å
98V93.9Very high94Very high8 Ų845 Ų455%0.04825%0.249CC..Hα-helixtrans-58.2-42.4177172.40000111.5E60 M63 L94 I100 S101 K102E60-V98 HydrophobicContact CB-CG1 4.3Å; M63-V98 HydrophobicContact CB-CG2 3.45Å; M63-V98 VanDerWaalsContact CB-CG2 3.45Å; M63-V98 HydrophobicContact CE-CG2 4.49Å; M63-V98 HydrophobicContact CG-CG2 4.47Å; M63-V98 HydrophobicContact SD-CG2 4.3Å; L94-V98 WeakPolarHBondContact O-CG2 3.48Å; L94-V98 PolarHBondContact O-N 2.88Å; V98-I100 VanDerWaalsContact C-N 3.33Å; V98-I100 PolarHBondContact O-N 3.48Å; V98-S101 WeakPolarHBondContact O-CB 3.46Å; V98-S101 PolarHBondContact O-N 3.02Å; V98-K102 HydrophobicContact CG1-CD 4.34Å; V98-K102 WeakPolarHBondContact O-CG 3.33Å; V98-K102 PolarHBondContact O-N 3.1Å
99K93.7Very high94Very high163 Ų16347.7 Ų47.771%0.70925%0.251SS*.Hα-helixtrans-61.5-42178-176.2-179.2178-176.60112R95 A96 I97 S103R95-K99 WeakPolarHBondContact O-CB 2.91Å; R95-K99 PolarHBondContact O-N 2.91Å; A96-K99 PolarHBondContact O-N 2.9Å; I97-K99 VanDerWaalsContact C-N 3.3Å; I97-K99 PolarHBondContact O-N 2.69Å; K99-S103 PolarHBondContact O-N 3.44Å
100I93.8Very high94Very high49 Ų4952 Ų5225%0.25127%0.266SS..Hα-helixtrans-69.5-40.8177.9-68.4-65.3000111.1A96 I97 V98 K102 S103 I104 Y205 T208 I212A96-I100 WeakPolarHBondContact O-CG1 3.47Å; A96-I100 PolarHBondContact O-N 2.97Å; I97-I100 PolarHBondContact O-N 3.18Å; I97-I100 VanDerWaalsContact O-N 3.15Å; V98-I100 VanDerWaalsContact C-N 3.33Å; V98-I100 PolarHBondContact O-N 3.48Å; I100-K102 PolarHBondContact O-N 2.94Å; I100-S103 PolarHBondContact O-N 2.94Å; I100-I104 HydrophobicContact CG2-CG1 4.23Å; I100-I104 WeakPolarHBondContact O-CG1 3.47Å; I100-I104 PolarHBondContact O-N 2.94Å; I100-Y205 HydrophobicContact CG2-CD2 3.88Å; I100-Y205 HydrophobicContact CG2-CE2 4.32Å; I100-T208 HydrophobicContact CD1-CG2 4.05Å; I100-T208 HydrophobicContact CG1-CG2 3.97Å; I100-T208 HydrophobicContact CG2-CG2 4.2Å; I100-I212 HydrophobicContact CG1-CD1 4.19Å
101S92.8Very high94Very high17 Ų1751.1 Ų51.112%0.11927%0.267CS..Hα-helixtrans-51.4-57172.9-175.90000110.9E60 I97 V98 S103 I104 S105E60-S101 WeakPolarHBondContact OE1-CB 3.43Å; E60-S101 PolarHBondContact OE1-OG 3.02Å; I97-S101 PolarHBondContact O-N 3.34Å; V98-S101 WeakPolarHBondContact O-CB 3.46Å; V98-S101 PolarHBondContact O-N 3.02Å; S101-S103 VanDerWaalsContact C-N 3.28Å; S101-S103 PolarHBondContact O-N 3.35Å; S101-I104 PolarHBondContact O-N 2.84Å; S101-I104 VanDerWaalsContact O-N 3.13Å; S101-S105 WeakPolarHBondContact O-CB 3.25Å; S101-S105 PolarHBondContact O-N 3.07Å; S101-S105 PolarHBondContact O-OG 3.47Å
102K91.5Very high94Very high116 Ų11651 Ų5150%0.50427%0.266SS..Hα-helixtrans-55.3-42.8179-72.2-179.3177-179.90113E60 V98 I100 A106E60-K102 WeakPolarHBondContact OE1-CG 3.47Å; E60-K102 PolarHBondContact OE1-N 3.38Å; E60-K102 WeakPolarHBondContact OE2-CE 3.34Å; E60-K102 WeakPolarHBondContact OE2-CG 3.37Å; V98-K102 HydrophobicContact CG1-CD 4.34Å; V98-K102 WeakPolarHBondContact O-CG 3.33Å; V98-K102 PolarHBondContact O-N 3.1Å; I100-K102 PolarHBondContact O-N 2.94Å; K102-A106 WeakPolarHBondContact O-CB 3.41Å; K102-A106 PolarHBondContact O-N 2.84Å
103S92.9Very high94.1Very high59 Ų5948.6 Ų48.641%0.41325%0.245SC..Hα-helixtrans-64.6-47.3179.3-170.40000111.7K99 I100 S101 A106 E107K99-S103 PolarHBondContact O-N 3.44Å; I100-S103 PolarHBondContact O-N 2.94Å; S101-S103 VanDerWaalsContact C-N 3.28Å; S101-S103 PolarHBondContact O-N 3.35Å; S103-A106 PolarHBondContact O-N 3.13Å; S103-E107 WeakPolarHBondContact O-CG 3.41Å; S103-E107 PolarHBondContact O-N 3.21Å
104I93.7Very high94Very high7 Ų750.3 Ų50.34%0.03626%0.257CS..Hα-helixtrans-67.6-40.4179.8-67.2-68.2000110.5I100 S101 A106 E107 I108 Y201 K204 Y205I100-I104 HydrophobicContact CG2-CG1 4.23Å; I100-I104 WeakPolarHBondContact O-CG1 3.47Å; I100-I104 PolarHBondContact O-N 2.94Å; S101-I104 PolarHBondContact O-N 2.84Å; S101-I104 VanDerWaalsContact O-N 3.13Å; I104-A106 VanDerWaalsContact C-N 3.3Å; I104-A106 PolarHBondContact O-N 2.95Å; I104-E107 WeakPolarHBondContact O-CB 3.37Å; I104-E107 PolarHBondContact O-N 3.34Å; I104-E107 VanDerWaalsContact O-N 3.13Å; I104-I108 HydrophobicContact CG2-CD1 3.66Å; I104-I108 HydrophobicContact CG2-CG1 4.23Å; I104-I108 WeakPolarHBondContact O-CG1 3.44Å; I104-I108 PolarHBondContact O-N 3.16Å; I104-Y201 HydrophobicContact CD1-CD1 4.42Å; I104-K204 HydrophobicContact CD1-CD 4.09Å; I104-K204 HydrophobicContact CD1-CG 4.4Å; I104-Y205 HydrophobicContact CB-CD2 4.48Å; I104-Y205 HydrophobicContact CG1-CD2 4.25Å
105S92.6Very high93.9Very high20 Ų2053.8 Ų53.814%0.1427%0.273CS..Hα-helixtrans-60.6-39.9176-66.50000112.3N54 S101 I108 R109N54-S105 WeakPolarHBondContact ND2-CA 3.43Å; N54-S105 PolarHBondContact ND2-O 3.02Å; N54-S105 WeakPolarHBondContact OD1-CA 3.12Å; N54-S105 WeakPolarHBondContact OD1-CB 3.22Å; N54-S105 PolarHBondContact OD1-OG 3.18Å; S101-S105 WeakPolarHBondContact O-CB 3.25Å; S101-S105 PolarHBondContact O-N 3.07Å; S101-S105 PolarHBondContact O-OG 3.47Å; S105-I108 PolarHBondContact O-N 3.22Å; S105-R109 WeakPolarHBondContact O-CG 3.48Å; S105-R109 PolarHBondContact O-N 3.37Å
106A92.3Very high93.9Very high56 Ų5648.3 Ų48.346%0.46325%0.253SS..Hα-helixtrans-64.2-44.5172.800000111.9K102 S103 I104 I108 R109 Q110K102-A106 WeakPolarHBondContact O-CB 3.41Å; K102-A106 PolarHBondContact O-N 2.84Å; S103-A106 PolarHBondContact O-N 3.13Å; I104-A106 VanDerWaalsContact C-N 3.3Å; I104-A106 PolarHBondContact O-N 2.95Å; A106-I108 PolarHBondContact O-N 3.05Å; A106-R109 PolarHBondContact O-N 3.32Å; A106-Q110 WeakPolarHBondContact O-CB 3.47Å; A106-Q110 PolarHBondContact O-N 2.89Å
107E94.4Very high93.7Very high49 Ų4951.3 Ų51.323%0.22926%0.263CS..Hα-helixtrans-60.4-42176.1-72.9-178.7170.300111.9S103 I104 Q110 N111 Y201 K204S103-E107 WeakPolarHBondContact O-CG 3.41Å; S103-E107 PolarHBondContact O-N 3.21Å; I104-E107 WeakPolarHBondContact O-CB 3.37Å; I104-E107 PolarHBondContact O-N 3.34Å; I104-E107 VanDerWaalsContact O-N 3.13Å; E107-Q110 PolarHBondContact O-N 3Å; E107-N111 VanDerWaalsContact O-CB 3.27Å; E107-N111 WeakPolarHBondContact O-CB 3.48Å; E107-N111 PolarHBondContact O-N 2.97Å; E107-N111 PolarHBondContact O-ND2 3.09Å; E107-Y201 HydrophobicContact CB-CD1 4.12Å; E107-Y201 HydrophobicContact CB-CE1 3.73Å; E107-Y201 HydrophobicContact CB-CE2 4.42Å; E107-Y201 HydrophobicContact CG-CE1 4.27Å; E107-Y201 VanDerWaalsContact OE2-CD1 3.29Å; E107-Y201 WeakPolarHBondContact OE2-CD1 3.46Å; E107-Y201 WeakPolarHBondContact OE2-CE1 3.46Å; E107-K204 IonicContact OE1-NZ 3.4Å; E107-K204 IonicContact OE2-NZ 2.72Å
108I95.8Very high93.5Very high1 Ų155 Ų551%0.00528%0.283CS..Hα-helixtrans-65-46.1177.2-70.5166.7000110.8I50 I104 S105 A106 Q110 V112 L113 F198 Y201 M202I50-I108 HydrophobicContact CG2-CG2 3.95Å; I104-I108 HydrophobicContact CG2-CD1 3.66Å; I104-I108 HydrophobicContact CG2-CG1 4.23Å; I104-I108 WeakPolarHBondContact O-CG1 3.44Å; I104-I108 PolarHBondContact O-N 3.16Å; S105-I108 PolarHBondContact O-N 3.22Å; A106-I108 PolarHBondContact O-N 3.05Å; I108-Q110 VanDerWaalsContact C-N 3.33Å; I108-Q110 PolarHBondContact O-N 2.98Å; I108-V112 HydrophobicContact CG2-CB 4.3Å; I108-V112 WeakPolarHBondContact O-CA 3.22Å; I108-V112 VanDerWaalsContact O-CB 3.26Å; I108-V112 WeakPolarHBondContact O-CB 3.3Å; I108-V112 PolarHBondContact O-N 2.99Å; I108-L113 HydrophobicContact CG2-CD1 4.44Å; I108-L113 HydrophobicContact CG2-CG 4.49Å; I108-L113 PolarHBondContact O-N 3.29Å; I108-F198 HydrophobicContact CD1-CD2 4.11Å; I108-F198 HydrophobicContact CD1-CE2 3.93Å; I108-F198 HydrophobicContact CG1-CD2 4.25Å; I108-F198 HydrophobicContact CG2-CD2 3.93Å; I108-F198 HydrophobicContact CG2-CE2 4.13Å; I108-Y201 HydrophobicContact CG1-CD2 3.88Å; I108-Y201 HydrophobicContact CG1-CG 4.06Å; I108-M202 HydrophobicContact CD1-SD 3.92Å
109R93.9Very high93.5Very high95 Ų9554.7 Ų54.736%0.35828%0.281SS..Iπ-helixtrans-59.5-46.1177.5-74.9-179.8-164.3-98.47.3111.5D51 N54 C55 S105 A106 L113 S114D51-R109 IonicContact OD1-CZ 3.29Å; D51-R109 IonicContact OD1-NH1 3.58Å; D51-R109 PolarHBondContact OD1-NH1 2.95Å; N54-R109 PolarHBondContact O-NH2 3.41Å; N54-R109 VanDerWaalsContact O-NH2 3.07Å; C55-R109 PolarHBondContact SG-NH2 3.13Å; S105-R109 WeakPolarHBondContact O-CG 3.48Å; S105-R109 PolarHBondContact O-N 3.37Å; A106-R109 PolarHBondContact O-N 3.32Å; R109-L113 HydrophobicContact CG-CD1 3.95Å; R109-S114 PolarHBondContact O-N 3.14Å; R109-S114 VanDerWaalsContact O-N 3.09Å
110Q93Very high93.2Very high132 Ų13247.2 Ų47.262%0.61725%0.25SS*.Iπ-helixtrans-70.9-46.4-177.5-173.3177.3200112.5A106 E107 I108 S114A106-Q110 WeakPolarHBondContact O-CB 3.47Å; A106-Q110 PolarHBondContact O-N 2.89Å; E107-Q110 PolarHBondContact O-N 3Å; I108-Q110 VanDerWaalsContact C-N 3.33Å; I108-Q110 PolarHBondContact O-N 2.98Å; Q110-S114 PolarHBondContact O-OG 3.07Å
111N94.5Very high93.2Very high61 Ų6152.4 Ų52.433%0.32627%0.267SS..Iπ-helixtrans-102.2-15.8-166-59.7-46.2000114.1E107 Q115 Y201E107-N111 VanDerWaalsContact O-CB 3.27Å; E107-N111 WeakPolarHBondContact O-CB 3.48Å; E107-N111 PolarHBondContact O-N 2.97Å; E107-N111 PolarHBondContact O-ND2 3.09Å; N111-Q115 WeakPolarHBondContact O-CG 3.11Å; N111-Y201 HydrophobicContact CB-CE2 4Å; N111-Y201 PolarHBondContact ND2-OH 3.36Å
112V96.3Very high93.3Very high0 Ų059.4 Ų59.40%030%0.297CS..Iπ-helixtrans-111.7-64178.5-1770000110.1I108 S114 Q115 M116 T197 F198 Y201I108-V112 HydrophobicContact CG2-CB 4.3Å; I108-V112 WeakPolarHBondContact O-CA 3.22Å; I108-V112 VanDerWaalsContact O-CB 3.26Å; I108-V112 WeakPolarHBondContact O-CB 3.3Å; I108-V112 PolarHBondContact O-N 2.99Å; V112-S114 PolarHBondContact O-N 2.96Å; V112-Q115 PolarHBondContact O-N 2.93Å; V112-M116 HydrophobicContact CG1-CG 4.4Å; V112-M116 HydrophobicContact CG1-SD 3.7Å; V112-M116 WeakPolarHBondContact O-CB 3.3Å; V112-M116 WeakPolarHBondContact O-CG 3.44Å; V112-M116 PolarHBondContact O-N 3.2Å; V112-T197 HydrophobicContact CG2-CG2 3.92Å; V112-F198 HydrophobicContact CG1-CB 4.05Å; V112-F198 HydrophobicContact CG2-CB 4.14Å; V112-Y201 HydrophobicContact CG2-CD2 4.05Å; V112-Y201 HydrophobicContact CG2-CE2 4.12Å
113L95.5Very high93.4Very high6 Ų655.6 Ų55.63%0.03128%0.281CS..Iπ-helixtrans-64.9-47.3-170.3-69.5170.9000112.2H47 I50 D51 I108 R109 Q115 M116 L117H47-L113 PolarHBondContact CD2-O 3.22Å; H47-L113 VanDerWaalsContact CD2-O 3.31Å; H47-L113 PolarHBondContact NE2-O 2.9Å; H47-L113 WeakPolarHBondContact O-CD2 3.49Å; I50-L113 HydrophobicContact CB-CD2 3.85Å; I50-L113 HydrophobicContact CG2-CD1 4.32Å; I50-L113 HydrophobicContact CG2-CD2 3.67Å; I50-L113 HydrophobicContact CG2-CG 4.06Å; D51-L113 HydrophobicContact CB-CD1 3.82Å; D51-L113 HydrophobicContact CB-CD2 4.16Å; D51-L113 WeakPolarHBondContact OD1-CD1 3.5Å; I108-L113 HydrophobicContact CG2-CD1 4.44Å; I108-L113 HydrophobicContact CG2-CG 4.49Å; I108-L113 PolarHBondContact O-N 3.29Å; R109-L113 HydrophobicContact CG-CD1 3.95Å; L113-Q115 PolarHBondContact O-N 3.36Å; L113-M116 PolarHBondContact O-N 3.14Å; L113-L117 PolarHBondContact O-N 2.92Å
114S93.3Very high93.5Very high45 Ų4554 Ų5432%0.31527%0.266SS..Hα-helixtrans-58.8-34.417885.90000113R109 Q110 V112 N118R109-S114 PolarHBondContact O-N 3.14Å; R109-S114 VanDerWaalsContact O-N 3.09Å; Q110-S114 PolarHBondContact O-OG 3.07Å; V112-S114 PolarHBondContact O-N 2.96Å; S114-N118 PolarHBondContact O-ND2 3.46Å
115Q93.9Very high93.6Very high84 Ų8457 Ų5739%0.39329%0.285SS..Hα-helixtrans-78.6-42.1-179.2-61.7-63.1-37.900111.1N111 V112 L113 L117 N118 N119 Y194N111-Q115 WeakPolarHBondContact O-CG 3.11Å; V112-Q115 PolarHBondContact O-N 2.93Å; L113-Q115 PolarHBondContact O-N 3.36Å; Q115-L117 VanDerWaalsContact C-N 3.31Å; Q115-L117 PolarHBondContact O-N 2.9Å; Q115-N118 PolarHBondContact O-N 3.42Å; Q115-N119 PolarHBondContact O-N 3.41Å; Q115-Y194 HydrophobicContact CB-CD1 3.92Å; Q115-Y194 HydrophobicContact CB-CE1 3.43Å; Q115-Y194 VanDerWaalsContact CB-CE1 3.43Å; Q115-Y194 HydrophobicContact CB-CE2 4.37Å; Q115-Y194 HydrophobicContact CG-CE1 4.18Å
116M95.2Very high93.8Very high1 Ų157.7 Ų57.71%0.00529%0.292CS..Hα-helixtrans-60.1-40174.9-77.2-178.158.100112.2T43 L46 H47 I50 V112 L113 N118 N119 Q191 Y194T43-M116 HydrophobicContact CG2-CE 4.47Å; L46-M116 HydrophobicContact CB-CE 4.19Å; L46-M116 HydrophobicContact CD2-CE 4.15Å; L46-M116 HydrophobicContact CG-CE 4Å; H47-M116 HydrophobicContact CB-CE 4.02Å; I50-M116 HydrophobicContact CD1-CE 4.3Å; I50-M116 HydrophobicContact CD1-SD 4.05Å; V112-M116 HydrophobicContact CG1-CG 4.4Å; V112-M116 HydrophobicContact CG1-SD 3.7Å; V112-M116 WeakPolarHBondContact O-CB 3.3Å; V112-M116 WeakPolarHBondContact O-CG 3.44Å; V112-M116 PolarHBondContact O-N 3.2Å; L113-M116 PolarHBondContact O-N 3.14Å; M116-N118 VanDerWaalsContact C-N 3.25Å; M116-N118 PolarHBondContact O-N 2.9Å; M116-N119 WeakPolarHBondContact O-CB 3.27Å; M116-N119 PolarHBondContact O-N 2.95Å; M116-Q191 PolarHBondContact SD-NE2 3.47Å; M116-Y194 HydrophobicContact CG-CD2 3.7Å; M116-Y194 HydrophobicContact CG-CG 3.92Å
117L90.6Very high94Very high98 Ų9855 Ų5551%0.51327%0.27SS..Hα-helixtrans-60.2-37178.3-170.171.4000112.4L113 Q115L113-L117 PolarHBondContact O-N 2.92Å; Q115-L117 VanDerWaalsContact C-N 3.31Å; Q115-L117 PolarHBondContact O-N 2.9Å
118N89.8Confident94.1Very high87 Ų8758.2 Ų58.247%0.46528%0.284SS..Hα-helixtrans-88.4-12-179.4-68.9-51000113.3S114 Q115 M116 G120 R121S114-N118 PolarHBondContact O-ND2 3.46Å; Q115-N118 PolarHBondContact O-N 3.42Å; M116-N118 VanDerWaalsContact C-N 3.25Å; M116-N118 PolarHBondContact O-N 2.9Å; N118-G120 PolarHBondContact O-N 2.89Å; N118-G120 VanDerWaalsContact O-N 3.13Å; N118-R121 PolarHBondContact O-N 3.07Å
119N93.8Very high94.1Very high3 Ų365.3 Ų65.32%0.01631%0.314CS..THydrogen-bonded Turntrans-62.7116.9-177.2-170.923.1000111.3Q115 M116 R121 C187 R190 Q191 Y194Q115-N119 PolarHBondContact O-N 3.41Å; M116-N119 WeakPolarHBondContact O-CB 3.27Å; M116-N119 PolarHBondContact O-N 2.95Å; N119-R121 VanDerWaalsContact C-N 3.27Å; N119-R121 PolarHBondContact O-N 2.89Å; N119-C187 PolarHBondContact ND2-O 3.18Å; N119-R190 PolarHBondContact OD1-NE 3.35Å; N119-Q191 PolarHBondContact ND2-OE1 3.45Å; N119-Y194 HydrophobicContact CB-CE2 3.88Å
120G88.9Confident94.3Very high5 Ų561.6 Ų61.65%0.05230%0.302CS..THydrogen-bonded Turntrans73.315.517600000113.9N118 E123 Y124N118-G120 PolarHBondContact O-N 2.89Å; N118-G120 VanDerWaalsContact O-N 3.13Å; G120-E123 WeakPolarHBondContact CA-OE2 3.43Å; G120-Y124 WeakPolarHBondContact O-CB 3.34Å; G120-Y124 PolarHBondContact O-N 2.78Å
121R93Very high94.4Very high159 Ų15960.8 Ų60.860%0.629%0.293SS*.Hα-helixtrans-64.1-44.4-175-176.9-179.6179.7-172.30.4112.3N118 N119 T125N118-R121 PolarHBondContact O-N 3.07Å; N119-R121 VanDerWaalsContact C-N 3.27Å; N119-R121 PolarHBondContact O-N 2.89Å; R121-T125 PolarHBondContact O-N 3.41Å; R121-T125 PolarHBondContact O-OG1 3.16Å
122E94.1Very high94.5Very high164 Ų16462.4 Ų62.477%0.76630%0.299SS*.Hα-helixtrans-70.1-44.2179.7-65.2-176.9176.300110.3Y124 T125 A126E122-Y124 VanDerWaalsContact C-N 3.33Å; E122-Y124 PolarHBondContact O-N 3.45Å; E122-T125 WeakPolarHBondContact O-CA 3.5Å; E122-T125 WeakPolarHBondContact O-CB 3.43Å; E122-T125 PolarHBondContact O-N 3.15Å; E122-T125 VanDerWaalsContact O-N 3.07Å; E122-A126 PolarHBondContact O-N 3.42Å
123E94.4Very high94.5Very high36 Ų3663.6 Ų63.617%0.16831%0.309CS..Hα-helixtrans-63.4-39.1178.3-57.195.6136.900111.1F36 G120 T125 A126 F127 E183 R190F36-E123 HydrophobicContact CZ-CB 3.85Å; G120-E123 WeakPolarHBondContact CA-OE2 3.43Å; E123-T125 VanDerWaalsContact C-N 3.34Å; E123-A126 PolarHBondContact O-N 3.16Å; E123-F127 VanDerWaalsContact O-CB 3.31Å; E123-F127 WeakPolarHBondContact O-CB 3.41Å; E123-F127 PolarHBondContact O-N 3.36Å; E123-E183 HydrophobicContact CB-CB 4.26Å; E123-E183 HydrophobicContact CG-CB 3.78Å; E123-E183 HydrophobicContact CG-CG 4.16Å; E123-R190 IonicContact OE1-CZ 3.98Å; E123-R190 IonicContact OE1-NH2 3.87Å; E123-R190 PolarHBondContact OE1-NH2 3.42Å
124Y94.7Very high94.5Very high25 Ų2563.5 Ų63.510%0.09831%0.308CS..Hα-helixtrans-68.4-34173.7-173-119.6000112.5F36 Q37 K40 G120 E122 F127 K128F36-Y124 AromaticContact CD1-CD2 3.95Å; F36-Y124 HydrophobicContact CD1-CD2 3.95Å; F36-Y124 AromaticContact CE1-CD2 3.85Å; F36-Y124 HydrophobicContact CE1-CD2 3.85Å; F36-Y124 HydrophobicContact CE1-CG 4.47Å; Q37-Y124 PolarHBondContact NE2-OH 2.98Å; Q37-Y124 PolarHBondContact OE1-OH 3.16Å; K40-Y124 HydrophobicContact CB-CD2 3.96Å; K40-Y124 HydrophobicContact CB-CE2 3.87Å; K40-Y124 HydrophobicContact CD-CD1 4.37Å; K40-Y124 HydrophobicContact CD-CG 4.35Å; K40-Y124 HydrophobicContact CG-CD1 3.98Å; K40-Y124 HydrophobicContact CG-CD2 3.86Å; K40-Y124 HydrophobicContact CG-CE1 3.87Å; K40-Y124 HydrophobicContact CG-CE2 3.8Å; K40-Y124 HydrophobicContact CG-CG 3.97Å; G120-Y124 WeakPolarHBondContact O-CB 3.34Å; G120-Y124 PolarHBondContact O-N 2.78Å; E122-Y124 VanDerWaalsContact C-N 3.33Å; E122-Y124 PolarHBondContact O-N 3.45Å; Y124-F127 AromaticContact CD2-CD1 3.77Å; Y124-F127 HydrophobicContact CD2-CD1 3.77Å; Y124-F127 AromaticContact CE2-CD1 3.72Å; Y124-F127 HydrophobicContact CE2-CD1 3.72Å; Y124-F127 HydrophobicContact CE2-CE1 4.07Å; Y124-F127 WeakPolarHBondContact O-CB 3.24Å; Y124-F127 PolarHBondContact O-N 3.14Å; Y124-K128 HydrophobicContact CD1-CD 4.28Å; Y124-K128 HydrophobicContact CE1-CD 3.84Å; Y124-K128 HydrophobicContact CE1-CG 4.28Å; Y124-K128 VanDerWaalsContact CE1-NZ 3.33Å; Y124-K128 HydrophobicContact CE2-CG 4.49Å; Y124-K128 VanDerWaalsContact CZ-CE 3.41Å; Y124-K128 PolarHBondContact O-N 2.75Å; Y124-K128 WeakPolarHBondContact OH-CE 3.47Å
125T95.7Very high94.6Very high69 Ų6966.5 Ų66.542%0.42332%0.316SS..Hα-helixtrans-66.2-43.3173.7-59.60000110.7R121 E122 E123 K128 K129R121-T125 PolarHBondContact O-N 3.41Å; R121-T125 PolarHBondContact O-OG1 3.16Å; E122-T125 WeakPolarHBondContact O-CA 3.5Å; E122-T125 WeakPolarHBondContact O-CB 3.43Å; E122-T125 PolarHBondContact O-N 3.15Å; E122-T125 VanDerWaalsContact O-N 3.07Å; E123-T125 VanDerWaalsContact C-N 3.34Å; T125-K128 PolarHBondContact O-N 3.39Å; T125-K129 WeakPolarHBondContact O-CG 3.41Å; T125-K129 PolarHBondContact O-N 3.43Å
126A96.1Very high94.7Very high36 Ų3664 Ų6430%0.29831%0.305SS..Hα-helixtrans-62.1-45172.900000111.3E122 E123 K128 K129 V130 V180E122-A126 PolarHBondContact O-N 3.42Å; E123-A126 PolarHBondContact O-N 3.16Å; A126-K128 PolarHBondContact O-N 2.92Å; A126-K129 WeakPolarHBondContact O-CB 3.41Å; A126-K129 PolarHBondContact O-N 3.26Å; A126-K129 VanDerWaalsContact O-N 3.16Å; A126-V130 WeakPolarHBondContact O-CG2 3.33Å; A126-V130 PolarHBondContact O-N 2.92Å; A126-V180 HydrophobicContact CB-CG1 4.48Å; A126-V180 HydrophobicContact CB-CG2 4.05Å
127F96.8Very high94.7Very high0 Ų064 Ų640%031%0.306CS..Hα-helixtrans-56.6-47.3175.9170.5-103.9000112.2L33 F36 Q37 E123 Y124 K129 V130 R131 L177 V180L33-F127 HydrophobicContact CD2-CE2 3.82Å; L33-F127 HydrophobicContact CD2-CZ 4.14Å; L33-F127 WeakPolarHBondContact O-CZ 3.48Å; F36-F127 HydrophobicContact CB-CD2 3.82Å; F36-F127 HydrophobicContact CB-CE1 4.39Å; F36-F127 HydrophobicContact CB-CE2 3.64Å; F36-F127 HydrophobicContact CB-CG 4.27Å; F36-F127 HydrophobicContact CB-CZ 3.95Å; F36-F127 HydrophobicContact CD1-CB 3.96Å; F36-F127 AromaticContact CD1-CD1 3.87Å; F36-F127 HydrophobicContact CD1-CD1 3.87Å; F36-F127 HydrophobicContact CD1-CD2 4.06Å; F36-F127 HydrophobicContact CD1-CE1 4.39Å; F36-F127 AromaticContact CD1-CG 3.68Å; F36-F127 HydrophobicContact CD1-CG 3.68Å; F36-F127 HydrophobicContact CD2-CD2 4.23Å; F36-F127 HydrophobicContact CE1-CB 3.94Å; F36-F127 HydrophobicContact CE1-CG 4.19Å; F36-F127 HydrophobicContact CG-CB 4.33Å; F36-F127 HydrophobicContact CG-CD1 4.36Å; F36-F127 AromaticContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CE2 4.12Å; F36-F127 AromaticContact CG-CG 3.89Å; F36-F127 HydrophobicContact CG-CG 3.89Å; F36-F127 HydrophobicContact CZ-CB 4.25Å; Q37-F127 HydrophobicContact CB-CE1 4.32Å; Q37-F127 HydrophobicContact CB-CZ 4.42Å; E123-F127 VanDerWaalsContact O-CB 3.31Å; E123-F127 WeakPolarHBondContact O-CB 3.41Å; E123-F127 PolarHBondContact O-N 3.36Å; Y124-F127 AromaticContact CD2-CD1 3.77Å; Y124-F127 HydrophobicContact CD2-CD1 3.77Å; Y124-F127 AromaticContact CE2-CD1 3.72Å; Y124-F127 HydrophobicContact CE2-CD1 3.72Å; Y124-F127 HydrophobicContact CE2-CE1 4.07Å; Y124-F127 WeakPolarHBondContact O-CB 3.24Å; Y124-F127 PolarHBondContact O-N 3.14Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 2.95Å; F127-V130 PolarHBondContact O-N 3.07Å; F127-R131 WeakPolarHBondContact O-CB 3.3Å; F127-R131 PolarHBondContact O-N 3.33Å; F127-L177 HydrophobicContact CD2-CD1 4.05Å; F127-L177 HydrophobicContact CE2-CD1 4.07Å; F127-V180 HydrophobicContact CB-CG1 3.85Å
128K96.5Very high94.9Very high116 Ų11659.9 Ų59.950%0.50428%0.284SS..Hα-helixtrans-58.6-43.8176.6-84.1-179.2164.7168.90111.9Y124 T125 A126 Q132Y124-K128 HydrophobicContact CD1-CD 4.28Å; Y124-K128 HydrophobicContact CE1-CD 3.84Å; Y124-K128 HydrophobicContact CE1-CG 4.28Å; Y124-K128 VanDerWaalsContact CE1-NZ 3.33Å; Y124-K128 HydrophobicContact CE2-CG 4.49Å; Y124-K128 VanDerWaalsContact CZ-CE 3.41Å; Y124-K128 PolarHBondContact O-N 2.75Å; Y124-K128 WeakPolarHBondContact OH-CE 3.47Å; T125-K128 PolarHBondContact O-N 3.39Å; A126-K128 PolarHBondContact O-N 2.92Å; K128-Q132 WeakPolarHBondContact O-CB 3.49Å; K128-Q132 PolarHBondContact O-N 3.22Å
129K97Very high95.2Very high150 Ų15056.1 Ų56.165%0.65226%0.264SS*.Hα-helixtrans-62-51.8178.1-72.3176.8-179.7178.50111T125 A126 F127 Q132 A133T125-K129 WeakPolarHBondContact O-CG 3.41Å; T125-K129 PolarHBondContact O-N 3.43Å; A126-K129 WeakPolarHBondContact O-CB 3.41Å; A126-K129 PolarHBondContact O-N 3.26Å; A126-K129 VanDerWaalsContact O-N 3.16Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 2.95Å; K129-Q132 PolarHBondContact O-N 2.73Å; K129-A133 WeakPolarHBondContact O-CB 3.31Å; K129-A133 PolarHBondContact O-N 2.79Å
130V96.4Very high95.2Very high17 Ų1756.7 Ų56.710%0.10327%0.267CS..Hα-helixtrans-65.9-41.4-179.2175.50000111.8A126 F127 Q132 A133 L134 A176 L177 V180A126-V130 WeakPolarHBondContact O-CG2 3.33Å; A126-V130 PolarHBondContact O-N 2.92Å; F127-V130 PolarHBondContact O-N 3.07Å; V130-Q132 VanDerWaalsContact C-N 3.28Å; V130-Q132 PolarHBondContact O-N 3.38Å; V130-A133 PolarHBondContact O-N 2.93Å; V130-L134 WeakPolarHBondContact O-CB 3.34Å; V130-L134 PolarHBondContact O-N 3.4Å; V130-A176 HydrophobicContact CG1-CB 4.07Å; V130-A176 HydrophobicContact CG2-CB 4.12Å; V130-L177 HydrophobicContact CG1-CB 3.73Å; V130-L177 HydrophobicContact CG1-CD1 4.33Å; V130-V180 HydrophobicContact CG2-CG2 4.06Å
131R96.5Very high95.4Very high115 Ų11556.6 Ų56.643%0.43427%0.266SS..Hα-helixtrans-56.8-43.2174.5177.1176.1177.7-1720.4111.5L33 F127 K135L33-R131 HydrophobicContact CD2-CB 4.06Å; L33-R131 HydrophobicContact CD2-CG 3.91Å; F127-R131 WeakPolarHBondContact O-CB 3.3Å; F127-R131 PolarHBondContact O-N 3.33Å; R131-K135 WeakPolarHBondContact O-CB 3.3Å; R131-K135 PolarHBondContact O-N 3.42Å; R131-K135 VanDerWaalsContact O-N 3.1Å
132Q96.4Very high95.4Very high94 Ų9449.2 Ų49.244%0.43924%0.238SC..Hα-helixtrans-71.5-38.9177.9-17654.75600112.1K128 K129 V130 K135 N136K128-Q132 WeakPolarHBondContact O-CB 3.49Å; K128-Q132 PolarHBondContact O-N 3.22Å; K129-Q132 PolarHBondContact O-N 2.73Å; V130-Q132 VanDerWaalsContact C-N 3.28Å; V130-Q132 PolarHBondContact O-N 3.38Å; Q132-K135 PolarHBondContact O-N 2.8Å; Q132-N136 PolarHBondContact NE2-ND2 3.12Å; Q132-N136 PolarHBondContact NE2-OD1 3.26Å; Q132-N136 WeakPolarHBondContact O-CB 3.38Å; Q132-N136 VanDerWaalsContact O-CG 3.22Å; Q132-N136 PolarHBondContact O-N 3.45Å; Q132-N136 PolarHBondContact O-ND2 2.91Å
133A96.1Very high95.3Very high26 Ų2642.7 Ų42.722%0.21521%0.207CC..Hα-helixtrans-64.6-46.2176.500000111.6K129 V130 K135 N136 A137 E173K129-A133 WeakPolarHBondContact O-CB 3.31Å; K129-A133 PolarHBondContact O-N 2.79Å; V130-A133 PolarHBondContact O-N 2.93Å; A133-K135 PolarHBondContact O-N 3.37Å; A133-N136 CarbonylContact O-C 3.49Å; A133-N136 WeakPolarHBondContact O-CB 3.37Å; A133-N136 PolarHBondContact O-N 3.23Å; A133-N136 VanDerWaalsContact O-N 3.1Å; A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.16Å; A133-E173 VanDerWaalsContact CB-CD 3.48Å; A133-E173 HydrophobicContact CB-CG 4.13Å; A133-E173 WeakPolarHBondContact CB-OE2 3.32Å
134L96.4Very high95.1Very high3 Ų341.7 Ų41.72%0.01620%0.203CC..Hα-helixtrans-59.7-44.1174.6-176.462000112L25 T29 V130 N136 A137 V138 F170 E173 K174 L177L25-L134 HydrophobicContact CD1-CD2 4.32Å; L25-L134 HydrophobicContact CD2-CD2 4.44Å; T29-L134 HydrophobicContact CG2-CD2 3.87Å; V130-L134 WeakPolarHBondContact O-CB 3.34Å; V130-L134 PolarHBondContact O-N 3.4Å; L134-N136 VanDerWaalsContact C-N 3.28Å; L134-N136 PolarHBondContact O-N 3.44Å; L134-A137 PolarHBondContact O-N 2.81Å; L134-V138 WeakPolarHBondContact O-CG2 3.29Å; L134-V138 PolarHBondContact O-N 3.09Å; L134-F170 HydrophobicContact CD1-CD2 3.74Å; L134-F170 HydrophobicContact CD1-CE2 3.58Å; L134-F170 HydrophobicContact CD1-CZ 4.48Å; L134-E173 HydrophobicContact CB-CB 4.21Å; L134-E173 HydrophobicContact CD1-CB 4.04Å; L134-K174 HydrophobicContact CD1-CB 4.28Å; L134-L177 HydrophobicContact CD2-CD2 4.03Å
135K95.3Very high94.7Very high108 Ų10844.9 Ų44.947%0.4722%0.215SC..Hα-helixtrans-60.2-40.2174.9-177.5177.3-178.8177.20111.9R131 Q132 A133 L139R131-K135 WeakPolarHBondContact O-CB 3.3Å; R131-K135 PolarHBondContact O-N 3.42Å; R131-K135 VanDerWaalsContact O-N 3.1Å; Q132-K135 PolarHBondContact O-N 2.8Å; A133-K135 PolarHBondContact O-N 3.37Å; K135-L139 WeakPolarHBondContact O-CG 3.38Å; K135-L139 PolarHBondContact O-N 3.45Å
136N95.4Very high94.3Very high32 Ų3243.3 Ų43.317%0.17120%0.202CC..Hα-helixtrans-68.4-41176.6-75.5-21.2000111.8R8 Q132 A133 L134 V138 L139 D140R8-N136 VanDerWaalsContact NH1-CG 3.35Å; R8-N136 PolarHBondContact NH1-ND2 2.91Å; Q132-N136 PolarHBondContact NE2-ND2 3.12Å; Q132-N136 PolarHBondContact NE2-OD1 3.26Å; Q132-N136 WeakPolarHBondContact O-CB 3.38Å; Q132-N136 VanDerWaalsContact O-CG 3.22Å; Q132-N136 PolarHBondContact O-N 3.45Å; Q132-N136 PolarHBondContact O-ND2 2.91Å; A133-N136 CarbonylContact O-C 3.49Å; A133-N136 WeakPolarHBondContact O-CB 3.37Å; A133-N136 PolarHBondContact O-N 3.23Å; A133-N136 VanDerWaalsContact O-N 3.1Å; L134-N136 VanDerWaalsContact C-N 3.28Å; L134-N136 PolarHBondContact O-N 3.44Å; N136-V138 VanDerWaalsContact C-N 3.35Å; N136-V138 PolarHBondContact O-N 2.86Å; N136-L139 WeakPolarHBondContact O-CB 3.48Å; N136-L139 PolarHBondContact O-N 3.29Å; N136-D140 VanDerWaalsContact O-CG 3.27Å; N136-D140 PolarHBondContact O-N 3.11Å
137A95Very high93.9Very high2 Ų247.5 Ų47.52%0.01721%0.213CC..Hα-helixtrans-62.6-40.5177.700000111.9A133 L134 L139 D140 M141 I169 F170 E173A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.16Å; L134-A137 PolarHBondContact O-N 2.81Å; A137-L139 PolarHBondContact O-N 3.28Å; A137-D140 PolarHBondContact O-N 3.32Å; A137-M141 VanDerWaalsContact O-CB 3.27Å; A137-M141 WeakPolarHBondContact O-CB 3.43Å; A137-M141 PolarHBondContact O-N 3.34Å; A137-I169 HydrophobicContact CB-CG2 4.1Å; A137-F170 HydrophobicContact CB-CB 4.19Å; A137-F170 HydrophobicContact CB-CD2 4.45Å; A137-E173 HydrophobicContact CB-CG 4.21Å
138V95.5Very high93.1Very high11 Ų1149.9 Ų49.97%0.06722%0.224CC..Hα-helixtrans-58.5-48.1172.21710000111.3L25 L134 N136 D140 M141 D142 F170L25-V138 HydrophobicContact CD2-CG2 3.98Å; L134-V138 WeakPolarHBondContact O-CG2 3.29Å; L134-V138 PolarHBondContact O-N 3.09Å; N136-V138 VanDerWaalsContact C-N 3.35Å; N136-V138 PolarHBondContact O-N 2.86Å; V138-D140 VanDerWaalsContact C-N 3.3Å; V138-D140 PolarHBondContact O-N 3.43Å; V138-M141 PolarHBondContact O-N 3.03Å; V138-D142 WeakPolarHBondContact O-CB 3.16Å; V138-D142 PolarHBondContact O-N 3.37Å; V138-F170 HydrophobicContact CG2-CD2 3.78Å; V138-F170 HydrophobicContact CG2-CE2 3.54Å
139L95.1Very high92.4Very high7 Ų747.7 Ų47.74%0.03723%0.227CC..Hα-helixtrans-63-37.3179.7-69.6168.8000112.8R8 T11 K12 Y15 K135 N136 A137 H143R8-L139 HydrophobicContact CB-CB 4.42Å; R8-L139 HydrophobicContact CB-CD1 4.12Å; R8-L139 HydrophobicContact CG-CB 4.03Å; R8-L139 HydrophobicContact CG-CD1 4.32Å; T11-L139 HydrophobicContact CG2-CD2 4.05Å; T11-L139 PolarHBondContact OG1-O 3.09Å; K12-L139 HydrophobicContact CG-CD1 4.39Å; K12-L139 HydrophobicContact CG-CD2 3.8Å; Y15-L139 HydrophobicContact CD2-CD2 4.34Å; Y15-L139 HydrophobicContact CE2-CD2 3.41Å; Y15-L139 VanDerWaalsContact CE2-CD2 3.41Å; K135-L139 WeakPolarHBondContact O-CG 3.38Å; K135-L139 PolarHBondContact O-N 3.45Å; N136-L139 WeakPolarHBondContact O-CB 3.48Å; N136-L139 PolarHBondContact O-N 3.29Å; A137-L139 PolarHBondContact O-N 3.28Å; L139-H143 WeakPolarHBondContact O-CB 3.32Å; L139-H143 PolarHBondContact O-N 3.47Å; L139-H143 VanDerWaalsContact O-N 3.12Å
140D93.2Very high91.5Very high16 Ų1646.9 Ų46.99%0.08623%0.226CC..Hα-helixtrans-71.9-43.5179-69.6-33.5000110.9R7 R8 N136 A137 V138 H143 E144R7-D140 IonicContact CZ-OD1 2.87Å; R7-D140 IonicContact NE-OD1 3.51Å; R7-D140 PolarHBondContact NE-OD1 3.2Å; R7-D140 IonicContact NH2-OD1 3.38Å; R7-D140 PolarHBondContact NH2-OD1 3.34Å; R7-D140 IonicContact NH2-OD2 2.79Å; R8-D140 WeakPolarHBondContact CG-OD1 3.43Å; R8-D140 IonicContact CZ-OD2 3.73Å; R8-D140 IonicContact NE-OD1 2.66Å; R8-D140 PolarHBondContact NE-OD1 3.38Å; R8-D140 VanDerWaalsContact NE-OD1 3.15Å; R8-D140 IonicContact NE-OD2 3.55Å; R8-D140 PolarHBondContact NE-OD2 3.16Å; R8-D140 VanDerWaalsContact NE-OD2 3.12Å; R8-D140 IonicContact NH2-OD1 3.71Å; R8-D140 IonicContact NH2-OD2 2.73Å; R8-D140 PolarHBondContact NH2-OD2 3.43Å; N136-D140 VanDerWaalsContact O-CG 3.27Å; N136-D140 PolarHBondContact O-N 3.11Å; A137-D140 PolarHBondContact O-N 3.32Å; V138-D140 VanDerWaalsContact C-N 3.3Å; V138-D140 PolarHBondContact O-N 3.43Å; D140-H143 WeakPolarHBondContact O-CB 3.47Å; D140-H143 PolarHBondContact O-N 3.44Å; D140-E144 WeakPolarHBondContact O-CG 3.31Å; D140-E144 PolarHBondContact O-N 3.12Å
141M93.3Very high90.3Very high3 Ų347.7 Ų47.72%0.01523%0.232CC..Hα-helixtrans-62.1-47.7175.8-179.3-179.566.700112T23 A137 V138 H143 E144 R145 E167 F170T23-M141 HydrophobicContact CG2-CE 3.64Å; T23-M141 WeakPolarHBondContact OG1-CE 3.11Å; A137-M141 VanDerWaalsContact O-CB 3.27Å; A137-M141 WeakPolarHBondContact O-CB 3.43Å; A137-M141 PolarHBondContact O-N 3.34Å; V138-M141 PolarHBondContact O-N 3.03Å; M141-H143 VanDerWaalsContact C-N 3.27Å; M141-H143 PolarHBondContact O-N 2.96Å; M141-E144 PolarHBondContact O-N 3.02Å; M141-R145 WeakPolarHBondContact O-CB 3.48Å; M141-R145 WeakPolarHBondContact O-CG 3.42Å; M141-R145 PolarHBondContact O-N 3.45Å; M141-E167 HydrophobicContact CG-CG 3.81Å; M141-E167 HydrophobicContact SD-CB 4.5Å; M141-E167 HydrophobicContact SD-CG 3.82Å; M141-F170 HydrophobicContact CE-CD1 4.43Å; M141-F170 HydrophobicContact CE-CD2 4.3Å; M141-F170 HydrophobicContact CE-CG 4.21Å; M141-F170 HydrophobicContact SD-CB 4.09Å; M141-F170 HydrophobicContact SD-CD1 4.19Å; M141-F170 HydrophobicContact SD-CG 4.07Å
142D93.2Very high88.5Confident3 Ų347.2 Ų47.22%0.01625%0.253CS..Hα-helixtrans-64.8-34.2178.6-71.5-7.1000111.7T11 Y15 I20 T23 V138 F146T11-D142 HydrophobicContact CG2-CB 4.24Å; Y15-D142 HydrophobicContact CE1-CB 4.19Å; Y15-D142 PolarHBondContact OH-OD2 2.97Å; I20-D142 HydrophobicContact CG2-CB 4.04Å; T23-D142 VanDerWaalsContact CB-OD1 3.27Å; T23-D142 WeakPolarHBondContact CB-OD1 3.18Å; T23-D142 PolarHBondContact N-OD2 2.91Å; T23-D142 PolarHBondContact OG1-OD1 3.09Å; V138-D142 WeakPolarHBondContact O-CB 3.16Å; V138-D142 PolarHBondContact O-N 3.37Å; D142-F146 WeakPolarHBondContact O-CB 3.29Å; D142-F146 PolarHBondContact O-N 3.4Å
143H91.9Very high86.5Confident27 Ų2746.2 Ų46.213%0.12526%0.256CS..Hα-helixtrans-63-50.3173.1-172.481.9000112.3R7 Y10 T11 L139 D140 M141 R145 F146 K147R7-H143 WeakPolarHBondContact CD-CD2 3.45Å; R7-H143 HydrophobicContact CG-CB 4.27Å; Y10-H143 AromaticContact CD1-CE1 3.78Å; Y10-H143 AromaticContact CD1-ND1 3.89Å; T11-H143 WeakPolarHBondContact OG1-CB 3.39Å; T11-H143 PolarHBondContact OG1-ND1 3.15Å; L139-H143 WeakPolarHBondContact O-CB 3.32Å; L139-H143 PolarHBondContact O-N 3.47Å; L139-H143 VanDerWaalsContact O-N 3.12Å; D140-H143 WeakPolarHBondContact O-CB 3.47Å; D140-H143 PolarHBondContact O-N 3.44Å; M141-H143 VanDerWaalsContact C-N 3.27Å; M141-H143 PolarHBondContact O-N 2.96Å; H143-R145 VanDerWaalsContact C-N 3.3Å; H143-R145 PolarHBondContact O-N 3.3Å; H143-F146 PolarHBondContact O-N 2.72Å; H143-K147 WeakPolarHBondContact O-CB 3.4Å; H143-K147 PolarHBondContact O-N 3.28Å
144E89.9Confident84.5Confident15 Ų1547.1 Ų47.17%0.0726%0.264CS..Hα-helixtrans-65.4-36.4-179-65.2-59.1137.400111R7 D140 M141 K147 F148 T162 K163R7-E144 IonicContact CZ-OE1 2.69Å; R7-E144 IonicContact NH1-OE1 3.88Å; R7-E144 PolarHBondContact NH1-OE1 3.06Å; D140-E144 WeakPolarHBondContact O-CG 3.31Å; D140-E144 PolarHBondContact O-N 3.12Å; M141-E144 PolarHBondContact O-N 3.02Å; E144-K147 PolarHBondContact O-N 3.1Å; E144-F148 VanDerWaalsContact O-CB 3.31Å; E144-F148 WeakPolarHBondContact O-CB 3.3Å; E144-F148 PolarHBondContact O-N 2.81Å; E144-T162 WeakPolarHBondContact OE2-CB 3.35Å; E144-T162 PolarHBondContact OE2-OG1 3.21Å; E144-K163 HydrophobicContact CB-CB 4.48Å
145R87.4Confident82.3Confident93 Ų9355.6 Ų55.635%0.35130%0.303SS..Hα-helixtrans-60.3-49.3171.8-76.7173176.3-175.1-2.6112.1T23 M141 H143 F148 A149 E167T23-R145 PolarHBondContact OG1-NH1 2.92Å; T23-R145 VanDerWaalsContact OG1-NH1 3.09Å; M141-R145 WeakPolarHBondContact O-CB 3.48Å; M141-R145 WeakPolarHBondContact O-CG 3.42Å; M141-R145 PolarHBondContact O-N 3.45Å; H143-R145 VanDerWaalsContact C-N 3.3Å; H143-R145 PolarHBondContact O-N 3.3Å; R145-F148 PolarHBondContact O-N 3.42Å; R145-A149 WeakPolarHBondContact O-CB 3.38Å; R145-A149 PolarHBondContact O-N 3.1Å; R145-E167 IonicContact CZ-OE1 2.8Å; R145-E167 IonicContact NE-OE1 2.65Å; R145-E167 PolarHBondContact NE-OE1 2.96Å; R145-E167 VanDerWaalsContact NE-OE1 3.08Å; R145-E167 IonicContact NH2-OE1 3.08Å; R145-E167 PolarHBondContact NH2-OE1 3.1Å
146F87.9Confident80.3Confident36 Ų3654.8 Ų54.816%0.15831%0.307CS..Hα-helixtrans-62.1-46.6177.8175-100000112.1Y10 R19 I20 D142 H143 F148 A149 H150Y10-F146 HydrophobicContact CE1-CE1 4.4Å; R19-F146 WeakPolarHBondContact O-CE2 3.39Å; I20-F146 HydrophobicContact CD1-CB 3.73Å; I20-F146 HydrophobicContact CD1-CD1 3.91Å; I20-F146 HydrophobicContact CD1-CD2 4.11Å; I20-F146 HydrophobicContact CD1-CG 3.64Å; I20-F146 HydrophobicContact CG1-CB 3.73Å; I20-F146 HydrophobicContact CG1-CD1 4.12Å; I20-F146 HydrophobicContact CG1-CD2 3.4Å; I20-F146 HydrophobicContact CG1-CE2 3.96Å; I20-F146 HydrophobicContact CG1-CG 3.47Å; I20-F146 VanDerWaalsContact CG1-CG 3.47Å; D142-F146 WeakPolarHBondContact O-CB 3.29Å; D142-F146 PolarHBondContact O-N 3.4Å; H143-F146 PolarHBondContact O-N 2.72Å; F146-F148 VanDerWaalsContact C-N 3.31Å; F146-F148 PolarHBondContact O-N 3.46Å; F146-A149 PolarHBondContact O-N 3.19Å; F146-H150 AromaticContact CD2-CE1 3.36Å; F146-H150 WeakPolarHBondContact CD2-CE1 3.44Å; F146-H150 AromaticContact CD2-ND1 3.5Å; F146-H150 AromaticContact CE2-CE1 3.05Å; F146-H150 WeakPolarHBondContact CE2-CE1 3.43Å; F146-H150 AromaticContact CE2-ND1 3.42Å; F146-H150 WeakPolarHBondContact CE2-ND1 3.15Å; F146-H150 AromaticContact CE2-NE2 3.58Å; F146-H150 AromaticContact CG-ND1 4Å; F146-H150 AromaticContact CZ-CE1 3.73Å; F146-H150 AromaticContact CZ-ND1 3.79Å; F146-H150 AromaticContact CZ-NE2 3.97Å; F146-H150 PolarHBondContact O-N 2.88Å; F146-H150 VanDerWaalsContact O-N 3.14Å; F146-H150 PolarHBondContact O-ND1 3.25Å
147K86.2Confident78.6Confident123 Ų12364.5 Ų64.554%0.53534%0.343SS..Hα-helixtrans-59.5-42.8178.2-176.6-175.1174-1680111.3H143 E144 H150 S151H143-K147 WeakPolarHBondContact O-CB 3.4Å; H143-K147 PolarHBondContact O-N 3.28Å; E144-K147 PolarHBondContact O-N 3.1Å; K147-H150 PolarHBondContact O-N 3.39Å; K147-S151 WeakPolarHBondContact O-CB 3.41Å; K147-S151 PolarHBondContact O-N 3Å; K147-S151 VanDerWaalsContact O-N 3.15Å
148F81.3Confident76.9Confident50 Ų5071.2 Ų71.222%0.21937%0.374CS..Hα-helixtrans-62.9-47.6176.5178.8-112.1000111.7E144 R145 F146 H150 S151 A154 P160 K163E144-F148 VanDerWaalsContact O-CB 3.31Å; E144-F148 WeakPolarHBondContact O-CB 3.3Å; E144-F148 PolarHBondContact O-N 2.81Å; R145-F148 PolarHBondContact O-N 3.42Å; F146-F148 VanDerWaalsContact C-N 3.31Å; F146-F148 PolarHBondContact O-N 3.46Å; F148-H150 PolarHBondContact O-N 3.32Å; F148-S151 PolarHBondContact O-N 2.79Å; F148-S151 VanDerWaalsContact O-N 3.12Å; F148-S151 PolarHBondContact O-OG 3.36Å; F148-A154 HydrophobicContact CE2-CB 4.44Å; F148-A154 HydrophobicContact CZ-CB 4.38Å; F148-P160 HydrophobicContact CD2-CG 3.27Å; F148-P160 VanDerWaalsContact CE2-CD 3.47Å; F148-P160 HydrophobicContact CE2-CG 3.62Å; F148-P160 HydrophobicContact CG-CG 4.11Å; F148-K163 HydrophobicContact CD1-CD 4.48Å
149A81.7Confident75.6Confident70 Ų7073.9 Ų73.958%0.57939%0.386SS*.Hα-helixtrans-59.6-27.4179.200000113.7R145 F146R145-A149 WeakPolarHBondContact O-CB 3.38Å; R145-A149 PolarHBondContact O-N 3.1Å; F146-A149 PolarHBondContact O-N 3.19Å
150H77.3Confident74.7Confident133 Ų13375.6 Ų75.662%0.61640%0.397SS*.THydrogen-bonded Turntrans-103.86.5-179.3-6575000113.7F146 K147 F148F146-H150 AromaticContact CD2-CE1 3.36Å; F146-H150 WeakPolarHBondContact CD2-CE1 3.44Å; F146-H150 AromaticContact CD2-ND1 3.5Å; F146-H150 AromaticContact CE2-CE1 3.05Å; F146-H150 WeakPolarHBondContact CE2-CE1 3.43Å; F146-H150 AromaticContact CE2-ND1 3.42Å; F146-H150 WeakPolarHBondContact CE2-ND1 3.15Å; F146-H150 AromaticContact CE2-NE2 3.58Å; F146-H150 AromaticContact CG-ND1 4Å; F146-H150 AromaticContact CZ-CE1 3.73Å; F146-H150 AromaticContact CZ-ND1 3.79Å; F146-H150 AromaticContact CZ-NE2 3.97Å; F146-H150 PolarHBondContact O-N 2.88Å; F146-H150 VanDerWaalsContact O-N 3.14Å; F146-H150 PolarHBondContact O-ND1 3.25Å; K147-H150 PolarHBondContact O-N 3.39Å; F148-H150 PolarHBondContact O-N 3.32Å
151S71.3Confident74.2Confident35 Ų3582.8 Ų82.825%0.24543%0.43CS..  trans-89.5133.3176.470.30000111K147 F148 S153 A154K147-S151 WeakPolarHBondContact O-CB 3.41Å; K147-S151 PolarHBondContact O-N 3Å; K147-S151 VanDerWaalsContact O-N 3.15Å; F148-S151 PolarHBondContact O-N 2.79Å; F148-S151 VanDerWaalsContact O-N 3.12Å; F148-S151 PolarHBondContact O-OG 3.36Å; S151-S153 PolarHBondContact O-N 3.32Å; S151-S153 PolarHBondContact OG-OG 3.4Å; S151-A154 WeakPolarHBondContact O-CB 3.5Å; S151-A154 PolarHBondContact O-N 3.21Å
152A58.3Low73.6Confident104 Ų10486.3 Ų86.386%0.8645%0.452SS*.G310 helixtrans-59.2-18.8177.100000113.3A154A152-A154 VanDerWaalsContact C-N 3.35Å
153S53.9Low73.1Confident74 Ų7487.8 Ų87.852%0.51746%0.458SS..G310 helixtrans-83.63.6176.655.40000115S151 Q155 V156S151-S153 PolarHBondContact O-N 3.32Å; S151-S153 PolarHBondContact OG-OG 3.4Å; S153-Q155 PolarHBondContact O-N 3.02Å; S153-V156 PolarHBondContact O-N 3.33Å
154A54.9Low72.7Confident45 Ų4591.6 Ų91.637%0.37247%0.472SS..G310 helixtrans-60.8-10176.300000113.7F148 S151 A152 V156F148-A154 HydrophobicContact CE2-CB 4.44Å; F148-A154 HydrophobicContact CZ-CB 4.38Å; S151-A154 WeakPolarHBondContact O-CB 3.5Å; S151-A154 PolarHBondContact O-N 3.21Å; A152-A154 VanDerWaalsContact C-N 3.35Å; A154-V156 VanDerWaalsContact C-N 3.32Å
155Q50.8Low72.8Confident180 Ų18093 Ų9384%0.84149%0.485SS*.G310 helixtrans-77.9-5.3172.8-68.7-175.3-16.200114.6S153S153-Q155 PolarHBondContact O-N 3.02Å
156V53.7Low73Confident91 Ų9189 Ų8955%0.55247%0.472SS*.SBendtrans-86.1123173.7-174.20000109S153 A154 H158S153-V156 PolarHBondContact O-N 3.33Å; A154-V156 VanDerWaalsContact C-N 3.32Å; V156-H158 PolarHBondContact O-N 3.07Å
157Y58.3Low73.2Confident236 Ų23689.5 Ų89.593%0.92548%0.475SS*.SBendtrans-54.62.4-177.8-94-93.6000116.6
158H61Low73.6Confident144 Ų14489.7 Ų89.767%0.66748%0.477SS*.SBendtrans-114.9124.3-179.1-75.9-47.6000112.3V156V156-H158 PolarHBondContact O-N 3.07Å
159E66.6Low74.2Confident67 Ų6791.4 Ų91.431%0.31349%0.488SS..  trans-62.4132173.5-169.3171-136.700110.8K163 R164E159-K163 HydrophobicContact CG-CB 4.33Å; E159-K163 HydrophobicContact CG-CD 3.79Å; E159-K163 HydrophobicContact CG-CG 4.36Å; E159-K163 VanDerWaalsContact OE1-CD 3.32Å; E159-K163 WeakPolarHBondContact OE1-CD 3.38Å; E159-K163 WeakPolarHBondContact OE1-CE 3.5Å; E159-K163 IonicContact OE1-NZ 3.88Å; E159-K163 PolarHBondContact OE1-NZ 3.49Å; E159-R164 HydrophobicContact CB-CG 4.46Å; E159-R164 HydrophobicContact CG-CG 4.11Å; E159-R164 PolarHBondContact O-NE 3.41Å; E159-R164 PolarHBondContact O-NH2 3.39Å; E159-R164 WeakPolarHBondContact OE2-CG 3.27Å; E159-R164 IonicContact OE2-NE 3.15Å
160P76.9Confident74.9Confident43 Ų4389.1 Ų89.128%0.27947%0.465SS..  trans-61.3141.5-176.3-17.226.8000111.8F148 T162 K163 R164F148-P160 HydrophobicContact CD2-CG 3.27Å; F148-P160 VanDerWaalsContact CE2-CD 3.47Å; F148-P160 HydrophobicContact CE2-CG 3.62Å; F148-P160 HydrophobicContact CG-CG 4.11Å; P160-T162 PolarHBondContact O-N 2.83Å; P160-K163 HydrophobicContact CB-CB 4.47Å; P160-K163 WeakPolarHBondContact O-CB 3.4Å; P160-K163 PolarHBondContact O-N 3.41Å; P160-R164 PolarHBondContact O-N 3.19Å
161E81.7Confident75.7Confident167 Ų16787.2 Ų87.278%0.7846%0.458SS*.Hα-helixtrans-54.9-36.5177.2-67.7-177.4165.400112.4K163 R164 A165E161-K163 VanDerWaalsContact C-N 3.35Å; E161-K163 PolarHBondContact O-N 2.86Å; E161-R164 PolarHBondContact O-N 2.98Å; E161-A165 VanDerWaalsContact O-CB 3.3Å; E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 3.39Å
162T81.3Confident76.9Confident77 Ų7790.6 Ų90.647%0.47247%0.472SS..Hα-helixtrans-66.6-35.5179.162.90000112.7E144 P160 S166E144-T162 WeakPolarHBondContact OE2-CB 3.35Å; E144-T162 PolarHBondContact OE2-OG1 3.21Å; P160-T162 PolarHBondContact O-N 2.83Å; T162-S166 WeakPolarHBondContact O-CB 3.37Å; T162-S166 PolarHBondContact O-N 3.38Å
163K83.1Confident78.7Confident33 Ų3387.8 Ų87.814%0.14344%0.441CS..Hα-helixtrans-66.6-51174.9-175.1-177.2169-155.10109.9E144 F148 E159 P160 E161 A165 S166 E167E144-K163 HydrophobicContact CB-CB 4.48Å; F148-K163 HydrophobicContact CD1-CD 4.48Å; E159-K163 HydrophobicContact CG-CB 4.33Å; E159-K163 HydrophobicContact CG-CD 3.79Å; E159-K163 HydrophobicContact CG-CG 4.36Å; E159-K163 VanDerWaalsContact OE1-CD 3.32Å; E159-K163 WeakPolarHBondContact OE1-CD 3.38Å; E159-K163 WeakPolarHBondContact OE1-CE 3.5Å; E159-K163 IonicContact OE1-NZ 3.88Å; E159-K163 PolarHBondContact OE1-NZ 3.49Å; P160-K163 HydrophobicContact CB-CB 4.47Å; P160-K163 WeakPolarHBondContact O-CB 3.4Å; P160-K163 PolarHBondContact O-N 3.41Å; E161-K163 VanDerWaalsContact C-N 3.35Å; E161-K163 PolarHBondContact O-N 2.86Å; K163-A165 VanDerWaalsContact C-N 3.3Å; K163-A165 PolarHBondContact O-N 3.4Å; K163-S166 PolarHBondContact O-N 3.15Å; K163-S166 VanDerWaalsContact O-N 3.1Å; K163-S166 PolarHBondContact O-OG 2.88Å; K163-E167 PolarHBondContact O-N 3.47Å; K163-E167 VanDerWaalsContact O-N 3.08Å
164R84.4Confident80.7Confident108 Ų10886.1 Ų86.141%0.40842%0.424SS..Hα-helixtrans-57.8-43.3177.3-65.3-171.6-145.416311.1112E159 P160 E161 S166 E167 Q168E159-R164 HydrophobicContact CB-CG 4.46Å; E159-R164 HydrophobicContact CG-CG 4.11Å; E159-R164 PolarHBondContact O-NE 3.41Å; E159-R164 PolarHBondContact O-NH2 3.39Å; E159-R164 WeakPolarHBondContact OE2-CG 3.27Å; E159-R164 IonicContact OE2-NE 3.15Å; P160-R164 PolarHBondContact O-N 3.19Å; E161-R164 PolarHBondContact O-N 2.98Å; R164-S166 VanDerWaalsContact C-N 3.34Å; R164-S166 PolarHBondContact O-N 3.03Å; R164-E167 PolarHBondContact O-N 2.99Å; R164-Q168 WeakPolarHBondContact O-CG 3.3Å; R164-Q168 PolarHBondContact O-N 3.46Å
165A90.7Very high82.7Confident43 Ų4387.8 Ų87.836%0.35543%0.427SS..Hα-helixtrans-61.3-42.2177.200000111.9E161 K163 E167 Q168 I169E161-A165 VanDerWaalsContact O-CB 3.3Å; E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 3.39Å; K163-A165 VanDerWaalsContact C-N 3.3Å; K163-A165 PolarHBondContact O-N 3.4Å; A165-E167 PolarHBondContact O-N 3.09Å; A165-Q168 PolarHBondContact O-N 3.19Å; A165-I169 VanDerWaalsContact O-CG1 3.27Å; A165-I169 WeakPolarHBondContact O-CG1 3.27Å; A165-I169 PolarHBondContact O-N 3.25Å
166S91.4Very high84.8Confident10 Ų1080.5 Ų80.57%0.0740%0.397CS..Hα-helixtrans-64.9-37.317871.90000113.1T162 K163 R164 F170T162-S166 WeakPolarHBondContact O-CB 3.37Å; T162-S166 PolarHBondContact O-N 3.38Å; K163-S166 PolarHBondContact O-N 3.15Å; K163-S166 VanDerWaalsContact O-N 3.1Å; K163-S166 PolarHBondContact O-OG 2.88Å; R164-S166 VanDerWaalsContact C-N 3.34Å; R164-S166 PolarHBondContact O-N 3.03Å; S166-F170 PolarHBondContact O-N 3.24Å
167E92.2Very high86.8Confident47 Ų4776.3 Ų76.322%0.2237%0.372CS..Hα-helixtrans-71.5-38.9176.5-67.6-175.5162.600111.8M141 R145 K163 R164 A165 F170 M171M141-E167 HydrophobicContact CG-CG 3.81Å; M141-E167 HydrophobicContact SD-CB 4.5Å; M141-E167 HydrophobicContact SD-CG 3.82Å; R145-E167 IonicContact CZ-OE1 2.8Å; R145-E167 IonicContact NE-OE1 2.65Å; R145-E167 PolarHBondContact NE-OE1 2.96Å; R145-E167 VanDerWaalsContact NE-OE1 3.08Å; R145-E167 IonicContact NH2-OE1 3.08Å; R145-E167 PolarHBondContact NH2-OE1 3.1Å; K163-E167 PolarHBondContact O-N 3.47Å; K163-E167 VanDerWaalsContact O-N 3.08Å; R164-E167 PolarHBondContact O-N 2.99Å; A165-E167 PolarHBondContact O-N 3.09Å; E167-F170 WeakPolarHBondContact O-CB 3.46Å; E167-F170 PolarHBondContact O-N 3.1Å; E167-M171 WeakPolarHBondContact O-CG 3.46Å; E167-M171 PolarHBondContact O-N 2.76Å
168Q94.6Very high88.5Confident127 Ų12767.9 Ų67.959%0.59334%0.341SS*.Hα-helixtrans-61.8-44.6172.8-74.6176.4-1.400111.7R164 A165 F170 M171 I172R164-Q168 WeakPolarHBondContact O-CG 3.3Å; R164-Q168 PolarHBondContact O-N 3.46Å; A165-Q168 PolarHBondContact O-N 3.19Å; Q168-F170 VanDerWaalsContact C-N 3.32Å; Q168-F170 PolarHBondContact O-N 3.49Å; Q168-M171 PolarHBondContact O-N 3.42Å; Q168-I172 VanDerWaalsContact O-CG1 3.28Å; Q168-I172 WeakPolarHBondContact O-CG1 3.28Å; Q168-I172 PolarHBondContact O-N 3.28Å
169I95Very high90.2Very high85 Ų8566.1 Ų66.144%0.43634%0.335SS..Hα-helixtrans-59.5-45.3175.1-68.9164.9000110.2A137 A165 M171 I172 E173A137-I169 HydrophobicContact CB-CG2 4.1Å; A165-I169 VanDerWaalsContact O-CG1 3.27Å; A165-I169 WeakPolarHBondContact O-CG1 3.27Å; A165-I169 PolarHBondContact O-N 3.25Å; I169-M171 VanDerWaalsContact C-N 3.32Å; I169-M171 PolarHBondContact O-N 2.97Å; I169-I172 PolarHBondContact O-N 3.19Å; I169-E173 HydrophobicContact CG2-CG 4.35Å; I169-E173 WeakPolarHBondContact O-CG 3.4Å; I169-E173 PolarHBondContact O-N 3.44Å
170F95.2Very high91.5Very high22 Ų2263.7 Ų63.710%0.09633%0.325CS..Hα-helixtrans-56.4-45.2175.4170.8-99.2000112.5L25 L134 A137 V138 M141 S166 E167 Q168 E173 K174L25-F170 HydrophobicContact CD2-CE2 3.66Å; L25-F170 HydrophobicContact CD2-CZ 3.88Å; L134-F170 HydrophobicContact CD1-CD2 3.74Å; L134-F170 HydrophobicContact CD1-CE2 3.58Å; L134-F170 HydrophobicContact CD1-CZ 4.48Å; A137-F170 HydrophobicContact CB-CB 4.19Å; A137-F170 HydrophobicContact CB-CD2 4.45Å; V138-F170 HydrophobicContact CG2-CD2 3.78Å; V138-F170 HydrophobicContact CG2-CE2 3.54Å; M141-F170 HydrophobicContact CE-CD1 4.43Å; M141-F170 HydrophobicContact CE-CD2 4.3Å; M141-F170 HydrophobicContact CE-CG 4.21Å; M141-F170 HydrophobicContact SD-CB 4.09Å; M141-F170 HydrophobicContact SD-CD1 4.19Å; M141-F170 HydrophobicContact SD-CG 4.07Å; S166-F170 PolarHBondContact O-N 3.24Å; E167-F170 WeakPolarHBondContact O-CB 3.46Å; E167-F170 PolarHBondContact O-N 3.1Å; Q168-F170 VanDerWaalsContact C-N 3.32Å; Q168-F170 PolarHBondContact O-N 3.49Å; F170-E173 PolarHBondContact O-N 3.3Å; F170-K174 HydrophobicContact CE1-CD 4.48Å; F170-K174 WeakPolarHBondContact O-CB 3.49Å; F170-K174 PolarHBondContact O-N 3.26Å
171M95.5Very high92.4Very high94 Ų9462.9 Ų62.946%0.46332%0.318SS..Hα-helixtrans-65.6-37.6177.6-68.9-58.8-67.900112.7E167 Q168 I169 K174 N175E167-M171 WeakPolarHBondContact O-CG 3.46Å; E167-M171 PolarHBondContact O-N 2.76Å; Q168-M171 PolarHBondContact O-N 3.42Å; I169-M171 VanDerWaalsContact C-N 3.32Å; I169-M171 PolarHBondContact O-N 2.97Å; M171-K174 PolarHBondContact O-N 2.87Å; M171-N175 VanDerWaalsContact O-CG 3.29Å; M171-N175 PolarHBondContact O-N 3.31Å; M171-N175 PolarHBondContact O-ND2 2.95Å
172I96.6Very high93Very high105 Ų10561.9 Ų61.954%0.53831%0.311SS..Hα-helixtrans-62.1-48.6174.6-70163.9000110.5Q168 I169 K174 N175 A176Q168-I172 VanDerWaalsContact O-CG1 3.28Å; Q168-I172 WeakPolarHBondContact O-CG1 3.28Å; Q168-I172 PolarHBondContact O-N 3.28Å; I169-I172 PolarHBondContact O-N 3.19Å; I172-K174 VanDerWaalsContact C-N 3.3Å; I172-K174 PolarHBondContact O-N 3.39Å; I172-N175 PolarHBondContact O-N 3.49Å; I172-A176 PolarHBondContact O-N 3.21Å
173E96Very high93.6Very high46 Ų4662.2 Ų62.222%0.21531%0.307CS..Hα-helixtrans-66.5-33.5179.9-63.8-56.3161.300112.3A133 L134 A137 I169 F170 A176 L177A133-E173 VanDerWaalsContact CB-CD 3.48Å; A133-E173 HydrophobicContact CB-CG 4.13Å; A133-E173 WeakPolarHBondContact CB-OE2 3.32Å; L134-E173 HydrophobicContact CB-CB 4.21Å; L134-E173 HydrophobicContact CD1-CB 4.04Å; A137-E173 HydrophobicContact CB-CG 4.21Å; I169-E173 HydrophobicContact CG2-CG 4.35Å; I169-E173 WeakPolarHBondContact O-CG 3.4Å; I169-E173 PolarHBondContact O-N 3.44Å; F170-E173 PolarHBondContact O-N 3.3Å; E173-A176 PolarHBondContact O-N 3.23Å; E173-L177 PolarHBondContact O-N 3.39Å
174K95.6Very high94.2Very high38 Ų3861.3 Ų61.317%0.16530%0.303CS..Hα-helixtrans-65.1-43.7173-176.7175.3164.9175.80111.4D26 T29 L134 F170 M171 I172 A176 L177 E178D26-K174 VanDerWaalsContact OD2-CE 3.3Å; D26-K174 WeakPolarHBondContact OD2-CE 3.42Å; D26-K174 IonicContact OD2-NZ 3.34Å; D26-K174 PolarHBondContact OD2-NZ 2.98Å; T29-K174 VanDerWaalsContact OG1-CE 3.32Å; T29-K174 WeakPolarHBondContact OG1-CE 3.4Å; L134-K174 HydrophobicContact CD1-CB 4.28Å; F170-K174 HydrophobicContact CE1-CD 4.48Å; F170-K174 WeakPolarHBondContact O-CB 3.49Å; F170-K174 PolarHBondContact O-N 3.26Å; M171-K174 PolarHBondContact O-N 2.87Å; I172-K174 VanDerWaalsContact C-N 3.3Å; I172-K174 PolarHBondContact O-N 3.39Å; K174-A176 VanDerWaalsContact C-N 3.34Å; K174-L177 WeakPolarHBondContact O-CB 3.34Å; K174-L177 PolarHBondContact O-N 2.97Å; K174-E178 PolarHBondContact O-N 3.49Å; K174-E178 VanDerWaalsContact O-N 3.09Å
175N95.9Very high94.7Very high81 Ų8161.5 Ų61.543%0.43331%0.312SS..Hα-helixtrans-65.4-38174.8-70.9-14.9000111.9M171 I172 L177 E178 I179M171-N175 VanDerWaalsContact O-CG 3.29Å; M171-N175 PolarHBondContact O-N 3.31Å; M171-N175 PolarHBondContact O-ND2 2.95Å; I172-N175 PolarHBondContact O-N 3.49Å; N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.28Å; N175-E178 PolarHBondContact O-N 3.38Å; N175-I179 WeakPolarHBondContact O-CG1 3.47Å; N175-I179 PolarHBondContact O-N 2.87Å
176A96Very high94.9Very high26 Ų2661.7 Ų61.722%0.21531%0.309CS..Hα-helixtrans-60.6-37.8173.500000111.5V130 I172 E173 K174 I179 V180V130-A176 HydrophobicContact CG1-CB 4.07Å; V130-A176 HydrophobicContact CG2-CB 4.12Å; I172-A176 PolarHBondContact O-N 3.21Å; E173-A176 PolarHBondContact O-N 3.23Å; K174-A176 VanDerWaalsContact C-N 3.34Å; A176-I179 PolarHBondContact O-N 3.04Å; A176-V180 WeakPolarHBondContact O-CG2 3.43Å; A176-V180 PolarHBondContact O-N 3.47Å; A176-V180 VanDerWaalsContact O-N 3.09Å
177L96.1Very high95.2Very high3 Ų361.2 Ų61.22%0.01631%0.306CS..Hα-helixtrans-63.5-47.9174.5179.565.9000110.1T29 L33 F127 V130 L134 E173 K174 N175 I179 V180 M181T29-L177 HydrophobicContact CG2-CD2 3.81Å; L33-L177 HydrophobicContact CD2-CD1 3.87Å; L33-L177 HydrophobicContact CD2-CD2 3.78Å; L33-L177 HydrophobicContact CG-CD2 3.88Å; F127-L177 HydrophobicContact CD2-CD1 4.05Å; F127-L177 HydrophobicContact CE2-CD1 4.07Å; V130-L177 HydrophobicContact CG1-CB 3.73Å; V130-L177 HydrophobicContact CG1-CD1 4.33Å; L134-L177 HydrophobicContact CD2-CD2 4.03Å; E173-L177 PolarHBondContact O-N 3.39Å; K174-L177 WeakPolarHBondContact O-CB 3.34Å; K174-L177 PolarHBondContact O-N 2.97Å; N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.28Å; L177-I179 PolarHBondContact O-N 3.45Å; L177-V180 PolarHBondContact O-N 3.2Å; L177-V180 VanDerWaalsContact O-N 3.15Å; L177-M181 HydrophobicContact CD1-CG 4.08Å; L177-M181 HydrophobicContact CD1-SD 4.34Å; L177-M181 HydrophobicContact CG-CG 4.08Å; L177-M181 WeakPolarHBondContact O-CB 3.36Å; L177-M181 WeakPolarHBondContact O-CG 3.14Å; L177-M181 PolarHBondContact O-N 3.42Å
178E94.1Very high95.4Very high59 Ų5963.8 Ų63.828%0.27632%0.319SS..Hα-helixtrans-57.1-36.7178-67.3-166.8161.500112.6R28 K174 N175 M181 K182R28-E178 IonicContact CZ-OE1 2.74Å; R28-E178 IonicContact NH1-OE1 3.39Å; R28-E178 PolarHBondContact NH1-OE1 2.94Å; R28-E178 IonicContact NH2-OE1 2.65Å; K174-E178 PolarHBondContact O-N 3.49Å; K174-E178 VanDerWaalsContact O-N 3.09Å; N175-E178 PolarHBondContact O-N 3.38Å; E178-M181 PolarHBondContact O-N 3.38Å; E178-K182 PolarHBondContact O-N 3.28Å
179I95.1Very high95.5Very high107 Ų10762.8 Ų62.855%0.54932%0.317SS..Hα-helixtrans-64.4-51.4175.4-67.1166.2000110.6N175 A176 L177 M181 K182N175-I179 WeakPolarHBondContact O-CG1 3.47Å; N175-I179 PolarHBondContact O-N 2.87Å; A176-I179 PolarHBondContact O-N 3.04Å; L177-I179 PolarHBondContact O-N 3.45Å; I179-M181 PolarHBondContact O-N 2.95Å; I179-K182 WeakPolarHBondContact O-CB 3.41Å; I179-K182 PolarHBondContact O-N 2.9Å; I179-K182 VanDerWaalsContact O-N 3.11Å
180V95.1Very high95.6Very high16 Ų1662.7 Ų62.710%0.09731%0.311CS..Hα-helixtrans-60.3-36.2178.1174.60000111.4F36 A126 F127 V130 A176 L177 K182 E183F36-V180 HydrophobicContact CE2-CG1 4.04Å; F36-V180 HydrophobicContact CZ-CG1 4.5Å; A126-V180 HydrophobicContact CB-CG1 4.48Å; A126-V180 HydrophobicContact CB-CG2 4.05Å; F127-V180 HydrophobicContact CB-CG1 3.85Å; V130-V180 HydrophobicContact CG2-CG2 4.06Å; A176-V180 WeakPolarHBondContact O-CG2 3.43Å; A176-V180 PolarHBondContact O-N 3.47Å; A176-V180 VanDerWaalsContact O-N 3.09Å; L177-V180 PolarHBondContact O-N 3.2Å; L177-V180 VanDerWaalsContact O-N 3.15Å; V180-K182 PolarHBondContact O-N 3.49Å; V180-E183 WeakPolarHBondContact O-CB 3.48Å; V180-E183 PolarHBondContact O-N 2.88Å; V180-E183 VanDerWaalsContact O-N 3.09Å
181M94.2Very high95.6Very high26 Ų2662.2 Ų62.213%0.12831%0.31CS..Hα-helixtrans-66.3-22.4179.4-71.2-59.7-49.300113.8S32 F36 L177 E178 I179 E183 L184S32-M181 VanDerWaalsContact O-CE 3.3Å; S32-M181 WeakPolarHBondContact O-CE 3.14Å; F36-M181 HydrophobicContact CB-CE 4.23Å; F36-M181 HydrophobicContact CB-SD 3.81Å; F36-M181 HydrophobicContact CD2-CE 4.27Å; F36-M181 HydrophobicContact CD2-SD 3.69Å; F36-M181 HydrophobicContact CG-SD 4.21Å; L177-M181 HydrophobicContact CD1-CG 4.08Å; L177-M181 HydrophobicContact CD1-SD 4.34Å; L177-M181 HydrophobicContact CG-CG 4.08Å; L177-M181 WeakPolarHBondContact O-CB 3.36Å; L177-M181 WeakPolarHBondContact O-CG 3.14Å; L177-M181 PolarHBondContact O-N 3.42Å; E178-M181 PolarHBondContact O-N 3.38Å; I179-M181 PolarHBondContact O-N 2.95Å; M181-E183 PolarHBondContact O-N 3.2Å; M181-L184 HydrophobicContact CE-CB 4.32Å; M181-L184 HydrophobicContact CE-CD2 3.54Å; M181-L184 WeakPolarHBondContact O-CB 3.43Å; M181-L184 PolarHBondContact O-N 3.42Å
182K94.7Very high95.7Very high146 Ų14663.6 Ų63.664%0.63531%0.313SS*.Hα-helixtrans-63.9-27.6173.2-69.5173.8-178.1179.60111.8E178 I179 V180 L184 P186E178-K182 PolarHBondContact O-N 3.28Å; I179-K182 WeakPolarHBondContact O-CB 3.41Å; I179-K182 PolarHBondContact O-N 2.9Å; I179-K182 VanDerWaalsContact O-N 3.11Å; V180-K182 PolarHBondContact O-N 3.49Å; K182-L184 VanDerWaalsContact C-N 3.28Å; K182-L184 PolarHBondContact O-N 2.97Å; K182-P186 VanDerWaalsContact O-CD 3.24Å; K182-P186 WeakPolarHBondContact O-CD 3.38Å
183E94.2Very high95.8Very high85 Ų8561.6 Ų61.640%0.39731%0.308SS..THydrogen-bonded Turntrans-77.5-12.6178.5-56.8-52.9132.200113.8E123 V180 M181 I185 P186 C187E123-E183 HydrophobicContact CB-CB 4.26Å; E123-E183 HydrophobicContact CG-CB 3.78Å; E123-E183 HydrophobicContact CG-CG 4.16Å; V180-E183 WeakPolarHBondContact O-CB 3.48Å; V180-E183 PolarHBondContact O-N 2.88Å; V180-E183 VanDerWaalsContact O-N 3.09Å; M181-E183 PolarHBondContact O-N 3.2Å; E183-I185 VanDerWaalsContact C-N 3.34Å; E183-I185 PolarHBondContact O-N 3.49Å; E183-P186 WeakPolarHBondContact O-CD 3.41Å; E183-C187 PolarHBondContact O-N 2.97Å; E183-C187 VanDerWaalsContact O-N 3.16Å; E183-C187 PolarHBondContact O-SG 2.91Å
184L95.1Very high95.8Very high13 Ų1361 Ų617%0.06830%0.304CS..Hα-helixtrans-62.8-41.6179.2-177.258.8000111.7N35 F36 F39 M181 K182 C187 M188N35-L184 HydrophobicContact CB-CD2 4.03Å; F36-L184 HydrophobicContact CD2-CB 3.99Å; F36-L184 HydrophobicContact CD2-CD1 4.03Å; F36-L184 HydrophobicContact CD2-CD2 4.45Å; F36-L184 HydrophobicContact CD2-CG 4.38Å; F36-L184 HydrophobicContact CE2-CB 4.13Å; F36-L184 HydrophobicContact CE2-CD1 4.33Å; F36-L184 HydrophobicContact CG-CD1 4.27Å; F39-L184 HydrophobicContact CB-CD1 3.7Å; F39-L184 HydrophobicContact CD1-CD1 3.67Å; F39-L184 HydrophobicContact CD2-CD1 4.48Å; F39-L184 HydrophobicContact CE1-CD1 4.49Å; F39-L184 HydrophobicContact CG-CD1 3.67Å; M181-L184 HydrophobicContact CE-CB 4.32Å; M181-L184 HydrophobicContact CE-CD2 3.54Å; M181-L184 WeakPolarHBondContact O-CB 3.43Å; M181-L184 PolarHBondContact O-N 3.42Å; K182-L184 VanDerWaalsContact C-N 3.28Å; K182-L184 PolarHBondContact O-N 2.97Å; L184-C187 WeakPolarHBondContact O-CB 3.41Å; L184-C187 PolarHBondContact O-N 3.11Å; L184-M188 HydrophobicContact CD1-CG 4.32Å; L184-M188 HydrophobicContact CG-CG 4.37Å; L184-M188 HydrophobicContact CG-SD 4.04Å; L184-M188 VanDerWaalsContact O-CG 3.3Å; L184-M188 WeakPolarHBondContact O-CG 3.42Å; L184-M188 PolarHBondContact O-N 2.98Å
185I95.3Very high95.8Very high113 Ų11362.3 Ų62.358%0.57931%0.313SS*.Hα-helixtrans-62.2-50.6-179.3-66.8171.8000111.2E183 C187 M188 L189E183-I185 VanDerWaalsContact C-N 3.34Å; E183-I185 PolarHBondContact O-N 3.49Å; I185-C187 VanDerWaalsContact C-N 3.31Å; I185-C187 PolarHBondContact O-N 2.81Å; I185-M188 WeakPolarHBondContact O-CB 3.43Å; I185-M188 PolarHBondContact O-N 3.1Å; I185-M188 VanDerWaalsContact O-N 3.16Å; I185-L189 HydrophobicContact CG2-CD1 4.19Å; I185-L189 HydrophobicContact CG2-CG 4.46Å; I185-L189 WeakPolarHBondContact O-CG 3.33Å; I185-L189 PolarHBondContact O-N 2.95Å
186P96Very high95.9Very high47 Ų4765 Ų6531%0.30532%0.321SS..Hα-helixtrans-51.3-45.6170.6-29.533.4000113.9K182 E183 M188 L189 R190K182-P186 VanDerWaalsContact O-CD 3.24Å; K182-P186 WeakPolarHBondContact O-CD 3.38Å; E183-P186 WeakPolarHBondContact O-CD 3.41Å; P186-M188 VanDerWaalsContact C-N 3.34Å; P186-M188 PolarHBondContact O-N 3.42Å; P186-L189 PolarHBondContact O-N 2.71Å; P186-R190 PolarHBondContact O-N 3.15Å
187C96.3Very high96Very high0 Ų065.9 Ų65.90%032%0.324CS..Hα-helixtrans-60.1-43177.5-64.10000112.2F39 N119 E183 L184 I185 R190 Q191F39-C187 HydrophobicContact CD1-CB 4.37Å; F39-C187 HydrophobicContact CE1-CB 3.52Å; F39-C187 HydrophobicContact CZ-CB 3.8Å; F39-C187 WeakPolarHBondContact CZ-O 3.38Å; N119-C187 PolarHBondContact ND2-O 3.18Å; E183-C187 PolarHBondContact O-N 2.97Å; E183-C187 VanDerWaalsContact O-N 3.16Å; E183-C187 PolarHBondContact O-SG 2.91Å; L184-C187 WeakPolarHBondContact O-CB 3.41Å; L184-C187 PolarHBondContact O-N 3.11Å; I185-C187 VanDerWaalsContact C-N 3.31Å; I185-C187 PolarHBondContact O-N 2.81Å; C187-R190 PolarHBondContact O-N 2.98Å; C187-R190 PolarHBondContact SG-NH2 2.79Å; C187-Q191 PolarHBondContact O-N 3.5Å
188M96.4Very high96Very high100 Ų10067.7 Ų67.749%0.49333%0.332SS..Hα-helixtrans-65-39.4177.5-70174.470.200112.2F39 L184 I185 P186 Q191 K192F39-M188 HydrophobicContact CD2-CG 3.63Å; F39-M188 HydrophobicContact CE2-CB 4.24Å; F39-M188 HydrophobicContact CE2-CG 3.67Å; F39-M188 HydrophobicContact CG-CG 4.33Å; F39-M188 HydrophobicContact CZ-CG 4.4Å; L184-M188 HydrophobicContact CD1-CG 4.32Å; L184-M188 HydrophobicContact CG-CG 4.37Å; L184-M188 HydrophobicContact CG-SD 4.04Å; L184-M188 VanDerWaalsContact O-CG 3.3Å; L184-M188 WeakPolarHBondContact O-CG 3.42Å; L184-M188 PolarHBondContact O-N 2.98Å; I185-M188 WeakPolarHBondContact O-CB 3.43Å; I185-M188 PolarHBondContact O-N 3.1Å; I185-M188 VanDerWaalsContact O-N 3.16Å; P186-M188 VanDerWaalsContact C-N 3.34Å; P186-M188 PolarHBondContact O-N 3.42Å; M188-Q191 PolarHBondContact O-N 3.42Å; M188-K192 PolarHBondContact O-N 3.37Å
189L97.3Very high96.2Very high106 Ų10667.3 Ų67.356%0.55534%0.339SS*.Hα-helixtrans-66.5-40.1176.8-69.8175.6000111.8I185 P186 K192 S193I185-L189 HydrophobicContact CG2-CD1 4.19Å; I185-L189 HydrophobicContact CG2-CG 4.46Å; I185-L189 WeakPolarHBondContact O-CG 3.33Å; I185-L189 PolarHBondContact O-N 2.95Å; P186-L189 PolarHBondContact O-N 2.71Å; L189-K192 WeakPolarHBondContact O-CB 3.34Å; L189-K192 PolarHBondContact O-N 2.82Å; L189-S193 PolarHBondContact O-N 3.38Å; L189-S193 VanDerWaalsContact O-N 3.09Å
190R96.7Very high96.3Very high83 Ų8365.9 Ų65.931%0.31334%0.338SS..Hα-helixtrans-60.7-45.4171-71.2-172.4-64.6-109.111.1111.2N119 E123 P186 C187 K192 S193 Y194N119-R190 PolarHBondContact OD1-NE 3.35Å; E123-R190 IonicContact OE1-CZ 3.98Å; E123-R190 IonicContact OE1-NH2 3.87Å; E123-R190 PolarHBondContact OE1-NH2 3.42Å; P186-R190 PolarHBondContact O-N 3.15Å; C187-R190 PolarHBondContact O-N 2.98Å; C187-R190 PolarHBondContact SG-NH2 2.79Å; R190-K192 VanDerWaalsContact C-N 3.32Å; R190-K192 PolarHBondContact O-N 3.01Å; R190-S193 WeakPolarHBondContact O-CA 3.46Å; R190-S193 VanDerWaalsContact O-CB 3.25Å; R190-S193 WeakPolarHBondContact O-CB 3.27Å; R190-S193 PolarHBondContact O-N 3.35Å; R190-Y194 HydrophobicContact CB-CE2 3.85Å; R190-Y194 VanDerWaalsContact O-CD2 3.22Å; R190-Y194 WeakPolarHBondContact O-CD2 2.96Å; R190-Y194 PolarHBondContact O-N 3.12Å
191Q96.9Very high96.4Very high13 Ų1367 Ų676%0.06134%0.34CS..Hα-helixtrans-58.8-43.2177.1-169.455.941.800112.4F39 M116 N119 C187 M188 S193 Y194 N195F39-Q191 HydrophobicContact CE2-CB 3.88Å; F39-Q191 HydrophobicContact CE2-CG 4.22Å; F39-Q191 HydrophobicContact CZ-CB 3.98Å; M116-Q191 PolarHBondContact SD-NE2 3.47Å; N119-Q191 PolarHBondContact ND2-OE1 3.45Å; C187-Q191 PolarHBondContact O-N 3.5Å; M188-Q191 PolarHBondContact O-N 3.42Å; Q191-S193 VanDerWaalsContact C-N 3.25Å; Q191-S193 PolarHBondContact O-N 3.29Å; Q191-Y194 PolarHBondContact O-N 3.44Å; Q191-N195 PolarHBondContact NE2-OD1 3.31Å; Q191-N195 VanDerWaalsContact O-CG 3.28Å; Q191-N195 PolarHBondContact O-N 2.91Å; Q191-N195 PolarHBondContact O-OD1 3.24Å
192K97.2Very high96.4Very high123 Ų12367 Ų6754%0.53534%0.341SS..Hα-helixtrans-57.8-39.4173.3179.5-178.6178.1178.80111.8M188 L189 R190 K196M188-K192 PolarHBondContact O-N 3.37Å; L189-K192 WeakPolarHBondContact O-CB 3.34Å; L189-K192 PolarHBondContact O-N 2.82Å; R190-K192 VanDerWaalsContact C-N 3.32Å; R190-K192 PolarHBondContact O-N 3.01Å; K192-K196 WeakPolarHBondContact O-CG 3.32Å; K192-K196 PolarHBondContact O-N 3.26Å; K192-K196 VanDerWaalsContact O-N 3.14Å
193S97.3Very high96.5Very high63 Ų6364.8 Ų64.844%0.44134%0.339SS..Hα-helixtrans-64.6-46.2176-1640000111.6L189 R190 Q191 N195 K196 T197L189-S193 PolarHBondContact O-N 3.38Å; L189-S193 VanDerWaalsContact O-N 3.09Å; R190-S193 WeakPolarHBondContact O-CA 3.46Å; R190-S193 VanDerWaalsContact O-CB 3.25Å; R190-S193 WeakPolarHBondContact O-CB 3.27Å; R190-S193 PolarHBondContact O-N 3.35Å; Q191-S193 VanDerWaalsContact C-N 3.25Å; Q191-S193 PolarHBondContact O-N 3.29Å; S193-N195 VanDerWaalsContact C-N 3.33Å; S193-N195 PolarHBondContact O-N 2.83Å; S193-K196 WeakPolarHBondContact O-CB 3.5Å; S193-K196 PolarHBondContact O-N 3.03Å; S193-K196 VanDerWaalsContact O-N 3.14Å; S193-T197 PolarHBondContact O-N 2.93Å; S193-T197 PolarHBondContact O-OG1 2.54Å; S193-T197 VanDerWaalsContact O-OG1 3.1Å
194Y96.5Very high96.6Very high32 Ų3265.7 Ų65.713%0.12534%0.342CS..Hα-helixtrans-61.6-41178.5-54.6-42.7000112.2Q115 M116 N119 R190 Q191 K196 T197 F198Q115-Y194 HydrophobicContact CB-CD1 3.92Å; Q115-Y194 HydrophobicContact CB-CE1 3.43Å; Q115-Y194 VanDerWaalsContact CB-CE1 3.43Å; Q115-Y194 HydrophobicContact CB-CE2 4.37Å; Q115-Y194 HydrophobicContact CG-CE1 4.18Å; M116-Y194 HydrophobicContact CG-CD2 3.7Å; M116-Y194 HydrophobicContact CG-CG 3.92Å; N119-Y194 HydrophobicContact CB-CE2 3.88Å; R190-Y194 HydrophobicContact CB-CE2 3.85Å; R190-Y194 VanDerWaalsContact O-CD2 3.22Å; R190-Y194 WeakPolarHBondContact O-CD2 2.96Å; R190-Y194 PolarHBondContact O-N 3.12Å; Q191-Y194 PolarHBondContact O-N 3.44Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 3.42Å; Y194-T197 PolarHBondContact O-N 2.53Å; Y194-F198 PolarHBondContact O-N 2.9Å
195N96.6Very high96.6Very high66 Ų6666.6 Ų66.635%0.35335%0.345SS..Hα-helixtrans-61.2-40.5175.3-66.36.3000111.8Q191 S193 A199Q191-N195 PolarHBondContact NE2-OD1 3.31Å; Q191-N195 VanDerWaalsContact O-CG 3.28Å; Q191-N195 PolarHBondContact O-N 2.91Å; Q191-N195 PolarHBondContact O-OD1 3.24Å; S193-N195 VanDerWaalsContact C-N 3.33Å; S193-N195 PolarHBondContact O-N 2.83Å; N195-A199 PolarHBondContact O-N 2.74Å
196K97.8Very high96.7Very high138 Ų13866.4 Ų66.460%0.634%0.341SS*.Hα-helixtrans-66-42.1175.2-76.9-176170-164.60112.2K192 S193 Y194 A199 S200K192-K196 WeakPolarHBondContact O-CG 3.32Å; K192-K196 PolarHBondContact O-N 3.26Å; K192-K196 VanDerWaalsContact O-N 3.14Å; S193-K196 WeakPolarHBondContact O-CB 3.5Å; S193-K196 PolarHBondContact O-N 3.03Å; S193-K196 VanDerWaalsContact O-N 3.14Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 3.42Å; K196-A199 PolarHBondContact O-N 3.2Å; K196-S200 WeakPolarHBondContact O-CB 3.41Å; K196-S200 PolarHBondContact O-N 3.39Å
197T97.1Very high96.8Very high45 Ų4566.4 Ų66.428%0.27635%0.345SS..Hα-helixtrans-61.4-45.3177.1-59.70000110.8V112 S193 Y194 A199 S200 Y201V112-T197 HydrophobicContact CG2-CG2 3.92Å; S193-T197 PolarHBondContact O-N 2.93Å; S193-T197 PolarHBondContact O-OG1 2.54Å; S193-T197 VanDerWaalsContact O-OG1 3.1Å; Y194-T197 PolarHBondContact O-N 2.53Å; T197-A199 PolarHBondContact O-N 2.88Å; T197-S200 WeakPolarHBondContact O-CB 3.34Å; T197-S200 PolarHBondContact O-N 3.37Å; T197-Y201 HydrophobicContact CG2-CD2 3.9Å; T197-Y201 HydrophobicContact CG2-CE2 3.4Å; T197-Y201 VanDerWaalsContact O-CD2 3.25Å; T197-Y201 WeakPolarHBondContact O-CD2 3.33Å; T197-Y201 PolarHBondContact O-N 3.45Å
198F97.2Very high96.8Very high41 Ų4168.4 Ų68.418%0.1836%0.357CS..Hα-helixtrans-57-50.6173.6177.6-106.4000112I50 F53 I108 V112 Y194 S200 Y201 M202I50-F198 HydrophobicContact CD1-CD1 4.45Å; I50-F198 HydrophobicContact CD1-CD2 4.44Å; I50-F198 HydrophobicContact CD1-CG 4.29Å; I50-F198 HydrophobicContact CG1-CE1 4.5Å; I50-F198 HydrophobicContact CG1-CE2 4.39Å; I50-F198 HydrophobicContact CG1-CZ 4.36Å; I50-F198 HydrophobicContact CG2-CD2 3.82Å; I50-F198 HydrophobicContact CG2-CE2 3.6Å; I50-F198 HydrophobicContact CG2-CZ 4.28Å; F53-F198 HydrophobicContact CD1-CZ 4.17Å; F53-F198 HydrophobicContact CE1-CZ 4.34Å; I108-F198 HydrophobicContact CD1-CD2 4.11Å; I108-F198 HydrophobicContact CD1-CE2 3.93Å; I108-F198 HydrophobicContact CG1-CD2 4.25Å; I108-F198 HydrophobicContact CG2-CD2 3.93Å; I108-F198 HydrophobicContact CG2-CE2 4.13Å; V112-F198 HydrophobicContact CG1-CB 4.05Å; V112-F198 HydrophobicContact CG2-CB 4.14Å; Y194-F198 PolarHBondContact O-N 2.9Å; F198-S200 VanDerWaalsContact C-N 3.28Å; F198-S200 PolarHBondContact O-N 2.87Å; F198-Y201 PolarHBondContact O-N 3.03Å; F198-Y201 VanDerWaalsContact O-N 3.14Å; F198-M202 HydrophobicContact CD1-CG 4.47Å; F198-M202 HydrophobicContact CE1-CG 4.01Å; F198-M202 HydrophobicContact CE2-CG 4.04Å; F198-M202 HydrophobicContact CE2-SD 4.22Å; F198-M202 HydrophobicContact CZ-CG 3.77Å; F198-M202 HydrophobicContact CZ-SD 4.19Å; F198-M202 PolarHBondContact O-N 3.08Å
199A97Very high96.8Very high51 Ų5164.6 Ų64.642%0.42134%0.34SS..Hα-helixtrans-58-41.3177.600000112N195 K196 T197 Y201 M202 T203N195-A199 PolarHBondContact O-N 2.74Å; K196-A199 PolarHBondContact O-N 3.2Å; T197-A199 PolarHBondContact O-N 2.88Å; A199-Y201 PolarHBondContact O-N 3.04Å; A199-M202 PolarHBondContact O-N 3.31Å; A199-T203 PolarHBondContact O-N 3.45Å; A199-T203 PolarHBondContact O-OG1 3.34Å
200S97.7Very high96.7Very high76 Ų7664.1 Ų64.153%0.53134%0.337SS..Hα-helixtrans-62.6-40.2176.9-171.10000112.7K196 T197 F198 T203 K204K196-S200 WeakPolarHBondContact O-CB 3.41Å; K196-S200 PolarHBondContact O-N 3.39Å; T197-S200 WeakPolarHBondContact O-CB 3.34Å; T197-S200 PolarHBondContact O-N 3.37Å; F198-S200 VanDerWaalsContact C-N 3.28Å; F198-S200 PolarHBondContact O-N 2.87Å; S200-T203 PolarHBondContact O-N 3.25Å; S200-K204 WeakPolarHBondContact O-CB 3.3Å; S200-K204 PolarHBondContact O-N 3.18Å
201Y96.5Very high96.7Very high39 Ų3964.6 Ų64.615%0.15335%0.346CS..Hα-helixtrans-64.7-43.2175.4-75.5-52.3000111.7I104 E107 I108 N111 V112 T197 F198 A199 K204 Y205I104-Y201 HydrophobicContact CD1-CD1 4.42Å; E107-Y201 HydrophobicContact CB-CD1 4.12Å; E107-Y201 HydrophobicContact CB-CE1 3.73Å; E107-Y201 HydrophobicContact CB-CE2 4.42Å; E107-Y201 HydrophobicContact CG-CE1 4.27Å; E107-Y201 VanDerWaalsContact OE2-CD1 3.29Å; E107-Y201 WeakPolarHBondContact OE2-CD1 3.46Å; E107-Y201 WeakPolarHBondContact OE2-CE1 3.46Å; I108-Y201 HydrophobicContact CG1-CD2 3.88Å; I108-Y201 HydrophobicContact CG1-CG 4.06Å; N111-Y201 HydrophobicContact CB-CE2 4Å; N111-Y201 PolarHBondContact ND2-OH 3.36Å; V112-Y201 HydrophobicContact CG2-CD2 4.05Å; V112-Y201 HydrophobicContact CG2-CE2 4.12Å; T197-Y201 HydrophobicContact CG2-CD2 3.9Å; T197-Y201 HydrophobicContact CG2-CE2 3.4Å; T197-Y201 VanDerWaalsContact O-CD2 3.25Å; T197-Y201 WeakPolarHBondContact O-CD2 3.33Å; T197-Y201 PolarHBondContact O-N 3.45Å; F198-Y201 PolarHBondContact O-N 3.03Å; F198-Y201 VanDerWaalsContact O-N 3.14Å; A199-Y201 PolarHBondContact O-N 3.04Å; Y201-K204 PolarHBondContact O-N 3.18Å; Y201-Y205 WeakPolarHBondContact O-CB 3.05Å; Y201-Y205 PolarHBondContact O-N 3.49Å
202M95.4Very high96.6Very high28 Ų2865.3 Ų65.314%0.13835%0.35CS..Hα-helixtrans-65-40.3176.6-65.8-51.5-5800112.3F53 I108 F198 A199 Y205 H206F53-M202 HydrophobicContact CE1-CE 3.59Å; F53-M202 HydrophobicContact CE1-SD 3.88Å; F53-M202 HydrophobicContact CZ-CE 3.76Å; I108-M202 HydrophobicContact CD1-SD 3.92Å; F198-M202 HydrophobicContact CD1-CG 4.47Å; F198-M202 HydrophobicContact CE1-CG 4.01Å; F198-M202 HydrophobicContact CE2-CG 4.04Å; F198-M202 HydrophobicContact CE2-SD 4.22Å; F198-M202 HydrophobicContact CZ-CG 3.77Å; F198-M202 HydrophobicContact CZ-SD 4.19Å; F198-M202 PolarHBondContact O-N 3.08Å; A199-M202 PolarHBondContact O-N 3.31Å; M202-Y205 HydrophobicContact CE-CD1 4.24Å; M202-Y205 WeakPolarHBondContact O-CB 3.42Å; M202-Y205 PolarHBondContact O-N 3.33Å; M202-H206 PolarHBondContact O-CD2 3.1Å; M202-H206 PolarHBondContact O-N 2.69Å
203T97Very high96.5Very high98 Ų9863.2 Ų63.260%0.60134%0.344SS*.Hα-helixtrans-61.5-45.4174.1-590000111.4A199 S200 H206 A207A199-T203 PolarHBondContact O-N 3.45Å; A199-T203 PolarHBondContact O-OG1 3.34Å; S200-T203 PolarHBondContact O-N 3.25Å; T203-H206 PolarHBondContact O-N 3.18Å; T203-A207 WeakPolarHBondContact O-CB 3.24Å; T203-A207 PolarHBondContact O-N 2.93Å
204K96.1Very high96.3Very high104 Ų10466 Ų6645%0.45235%0.346SS..Hα-helixtrans-60.7-46.5176.9-178.7-175.9170.7-164.20111.1I104 E107 S200 Y201 A207 T208I104-K204 HydrophobicContact CD1-CD 4.09Å; I104-K204 HydrophobicContact CD1-CG 4.4Å; E107-K204 IonicContact OE1-NZ 3.4Å; E107-K204 IonicContact OE2-NZ 2.72Å; S200-K204 WeakPolarHBondContact O-CB 3.3Å; S200-K204 PolarHBondContact O-N 3.18Å; Y201-K204 PolarHBondContact O-N 3.18Å; K204-A207 PolarHBondContact O-N 2.65Å; K204-T208 PolarHBondContact O-N 3.38Å; K204-T208 PolarHBondContact O-OG1 3.14Å; K204-T208 VanDerWaalsContact O-OG1 3.06Å
205Y95.5Very high96Very high32 Ų3269.5 Ų69.513%0.12537%0.367CS..Hα-helixtrans-53.5-56.9175.8172.5-108.4000111.5I100 I104 Y201 M202 A207 T208 V209I100-Y205 HydrophobicContact CG2-CD2 3.88Å; I100-Y205 HydrophobicContact CG2-CE2 4.32Å; I104-Y205 HydrophobicContact CB-CD2 4.48Å; I104-Y205 HydrophobicContact CG1-CD2 4.25Å; Y201-Y205 WeakPolarHBondContact O-CB 3.05Å; Y201-Y205 PolarHBondContact O-N 3.49Å; M202-Y205 HydrophobicContact CE-CD1 4.24Å; M202-Y205 WeakPolarHBondContact O-CB 3.42Å; M202-Y205 PolarHBondContact O-N 3.33Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; Y205-A207 PolarHBondContact O-N 3.02Å; Y205-T208 PolarHBondContact O-N 3.17Å; Y205-V209 HydrophobicContact CD2-CG2 4.1Å; Y205-V209 HydrophobicContact CE1-CG2 4.21Å; Y205-V209 HydrophobicContact CE2-CG2 3.65Å; Y205-V209 WeakPolarHBondContact O-CG2 3.35Å; Y205-V209 PolarHBondContact O-N 3.37Å
206H96.4Very high95.7Very high110 Ų11068.3 Ų68.351%0.50936%0.359SS..Hα-helixtrans-65.8-35.6-176.2-70.5-59000113M202 T203 V209 L210M202-H206 PolarHBondContact O-CD2 3.1Å; M202-H206 PolarHBondContact O-N 2.69Å; T203-H206 PolarHBondContact O-N 3.18Å; H206-V209 PolarHBondContact O-N 2.92Å; H206-L210 WeakPolarHBondContact O-CB 3.34Å; H206-L210 PolarHBondContact O-N 3.4Å
207A97.4Very high95.2Very high46 Ų4669 Ų6938%0.3836%0.358SS..Hα-helixtrans-62.8-48.2174.200000111.4T203 K204 Y205 V209 L210 D211T203-A207 WeakPolarHBondContact O-CB 3.24Å; T203-A207 PolarHBondContact O-N 2.93Å; K204-A207 PolarHBondContact O-N 2.65Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; Y205-A207 PolarHBondContact O-N 3.02Å; A207-V209 VanDerWaalsContact C-N 3.35Å; A207-V209 PolarHBondContact O-N 3.15Å; A207-L210 WeakPolarHBondContact O-CB 3.47Å; A207-L210 PolarHBondContact O-N 3.25Å; A207-D211 PolarHBondContact O-N 3.27Å
208T96.4Very high94.7Very high42 Ų4273 Ų7326%0.25838%0.376SS..Hα-helixtrans-65-38178.5-56.60000112.3I100 K204 Y205 L210 D211 I212I100-T208 HydrophobicContact CD1-CG2 4.05Å; I100-T208 HydrophobicContact CG1-CG2 3.97Å; I100-T208 HydrophobicContact CG2-CG2 4.2Å; K204-T208 PolarHBondContact O-N 3.38Å; K204-T208 PolarHBondContact O-OG1 3.14Å; K204-T208 VanDerWaalsContact O-OG1 3.06Å; Y205-T208 PolarHBondContact O-N 3.17Å; T208-L210 VanDerWaalsContact C-N 3.32Å; T208-D211 PolarHBondContact O-N 2.84Å; T208-I212 HydrophobicContact CG2-CD1 4.03Å; T208-I212 WeakPolarHBondContact O-CD1 3.48Å; T208-I212 VanDerWaalsContact O-CG1 3.26Å; T208-I212 WeakPolarHBondContact O-CG1 3.31Å; T208-I212 PolarHBondContact O-N 3.42Å
209V95.8Very high93.6Very high20 Ų2076.1 Ų76.112%0.12140%0.398CS..Hα-helixtrans-62.6-41.5174.1169.60000111.2I97 Y205 H206 A207 I212 L213I97-V209 HydrophobicContact CD1-CG1 4.17Å; I97-V209 HydrophobicContact CG1-CG1 4.3Å; I97-V209 HydrophobicContact CG1-CG2 4.42Å; I97-V209 HydrophobicContact CG2-CG2 4.05Å; Y205-V209 HydrophobicContact CD2-CG2 4.1Å; Y205-V209 HydrophobicContact CE1-CG2 4.21Å; Y205-V209 HydrophobicContact CE2-CG2 3.65Å; Y205-V209 WeakPolarHBondContact O-CG2 3.35Å; Y205-V209 PolarHBondContact O-N 3.37Å; H206-V209 PolarHBondContact O-N 2.92Å; A207-V209 VanDerWaalsContact C-N 3.35Å; A207-V209 PolarHBondContact O-N 3.15Å; V209-I212 PolarHBondContact O-N 3.3Å; V209-L213 HydrophobicContact CG1-CD1 3.89Å; V209-L213 HydrophobicContact CG1-CG 4.49Å; V209-L213 WeakPolarHBondContact O-CG 3.05Å; V209-L213 PolarHBondContact O-N 3.17Å
210L96.4Very high92.2Very high96 Ų9675.8 Ų75.850%0.50339%0.391SS..Hα-helixtrans-60.2-48176.4-166.298.8000110.8H206 A207 T208 I212 L213 Y214H206-L210 WeakPolarHBondContact O-CB 3.34Å; H206-L210 PolarHBondContact O-N 3.4Å; A207-L210 WeakPolarHBondContact O-CB 3.47Å; A207-L210 PolarHBondContact O-N 3.25Å; T208-L210 VanDerWaalsContact C-N 3.32Å; L210-I212 PolarHBondContact O-N 2.96Å; L210-L213 PolarHBondContact O-N 3.09Å; L210-Y214 HydrophobicContact CD1-CE2 4.28Å; L210-Y214 HydrophobicContact CD2-CD2 4.03Å; L210-Y214 HydrophobicContact CD2-CE2 3.87Å; L210-Y214 HydrophobicContact CG-CD2 3.83Å; L210-Y214 HydrophobicContact CG-CE2 3.86Å; L210-Y214 WeakPolarHBondContact O-CD2 3.37Å; L210-Y214 PolarHBondContact O-N 2.88Å
211D95.9Very high90.4Very high93 Ų9376.4 Ų76.450%0.49739%0.391SS..Hα-helixtrans-58.8-46.8178.6-65.9-22.7000111.2A207 T208 L213 Y214 D215A207-D211 PolarHBondContact O-N 3.27Å; T208-D211 PolarHBondContact O-N 2.84Å; D211-L213 VanDerWaalsContact C-N 3.31Å; D211-L213 PolarHBondContact O-N 3.3Å; D211-Y214 PolarHBondContact O-N 3.5Å; D211-D215 PolarHBondContact O-N 2.8Å
212I95.2Very high88.3Confident29 Ų2979 Ų7915%0.14942%0.415CS..Hα-helixtrans-58.3-42.9177.3-69.4164.8000111.6C93 A96 I97 I100 T208 V209 L210 F216C93-I212 HydrophobicContact CB-CG2 4.32Å; C93-I212 VanDerWaalsContact SG-CG2 3.58Å; A96-I212 HydrophobicContact CB-CD1 4.07Å; A96-I212 HydrophobicContact CB-CG2 4.2Å; I97-I212 HydrophobicContact CD1-CG2 4.42Å; I97-I212 HydrophobicContact CG1-CB 4.49Å; I97-I212 HydrophobicContact CG1-CD1 4.36Å; I97-I212 HydrophobicContact CG1-CG2 3.97Å; I100-I212 HydrophobicContact CG1-CD1 4.19Å; T208-I212 HydrophobicContact CG2-CD1 4.03Å; T208-I212 WeakPolarHBondContact O-CD1 3.48Å; T208-I212 VanDerWaalsContact O-CG1 3.26Å; T208-I212 WeakPolarHBondContact O-CG1 3.31Å; T208-I212 PolarHBondContact O-N 3.42Å; V209-I212 PolarHBondContact O-N 3.3Å; L210-I212 PolarHBondContact O-N 2.96Å; I212-F216 PolarHBondContact O-N 3.46Å
213L94.4Very high85.9Confident79 Ų7990 Ų9041%0.41447%0.466SS..Hα-helixtrans-70.7-35.9179.3-71.3169.2000112.2I97 V209 L210 D211 R217I97-L213 HydrophobicContact CD1-CD2 3.97Å; I97-L213 HydrophobicContact CD1-CG 4.12Å; V209-L213 HydrophobicContact CG1-CD1 3.89Å; V209-L213 HydrophobicContact CG1-CG 4.49Å; V209-L213 WeakPolarHBondContact O-CG 3.05Å; V209-L213 PolarHBondContact O-N 3.17Å; L210-L213 PolarHBondContact O-N 3.09Å; D211-L213 VanDerWaalsContact C-N 3.31Å; D211-L213 PolarHBondContact O-N 3.3Å; L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 PolarHBondContact O-N 3.12Å
214Y93Very high85.3Confident120 Ų12089.6 Ų89.647%0.47146%0.459SS..Hα-helixtrans-65.7-44.5174.9-98.4-78.7000111.8L210 D211 F216 R217 L218L210-Y214 HydrophobicContact CD1-CE2 4.28Å; L210-Y214 HydrophobicContact CD2-CD2 4.03Å; L210-Y214 HydrophobicContact CD2-CE2 3.87Å; L210-Y214 HydrophobicContact CG-CD2 3.83Å; L210-Y214 HydrophobicContact CG-CE2 3.86Å; L210-Y214 WeakPolarHBondContact O-CD2 3.37Å; L210-Y214 PolarHBondContact O-N 2.88Å; D211-Y214 PolarHBondContact O-N 3.5Å; Y214-F216 VanDerWaalsContact C-N 3.31Å; Y214-F216 PolarHBondContact O-N 3.04Å; Y214-R217 WeakPolarHBondContact O-CB 3.32Å; Y214-R217 PolarHBondContact O-N 3.17Å; Y214-R217 VanDerWaalsContact O-N 3.13Å; Y214-L218 WeakPolarHBondContact O-CG 3.47Å; Y214-L218 PolarHBondContact O-N 2.84Å
215D90.6Very high84.8Confident106 Ų10688.8 Ų88.857%0.56746%0.46SS*.Hα-helixtrans-59.1-45177-74-14.9000110.8D211 R217 L218 V219D211-D215 PolarHBondContact O-N 2.8Å; D215-R217 VanDerWaalsContact C-N 3.35Å; D215-R217 PolarHBondContact O-N 3.14Å; D215-L218 PolarHBondContact O-N 3.08Å; D215-V219 WeakPolarHBondContact O-CG2 3.42Å; D215-V219 PolarHBondContact O-N 2.65Å; D215-V219 VanDerWaalsContact O-N 3.16Å
216F90.6Very high84.2Confident42 Ų4291.9 Ų91.918%0.18448%0.478CS..Hα-helixtrans-59.1-44.8174.1169.7-105.7000112.4Y90 C93 I212 Y214 L218 V219 T220Y90-F216 VanDerWaalsContact CA-CE2 3.45Å; Y90-F216 HydrophobicContact CD2-CD1 4.29Å; Y90-F216 AromaticContact CD2-CE1 3.83Å; Y90-F216 HydrophobicContact CD2-CE1 3.83Å; Y90-F216 HydrophobicContact CD2-CE2 4.2Å; Y90-F216 AromaticContact CD2-CZ 3.79Å; Y90-F216 HydrophobicContact CD2-CZ 3.79Å; Y90-F216 HydrophobicContact CG-CE1 4.46Å; Y90-F216 HydrophobicContact CG-CE2 4.28Å; Y90-F216 AromaticContact CG-CZ 3.98Å; Y90-F216 HydrophobicContact CG-CZ 3.98Å; C93-F216 HydrophobicContact CB-CB 4.12Å; C93-F216 HydrophobicContact CB-CD2 4.44Å; C93-F216 HydrophobicContact CB-CG 4.31Å; I212-F216 PolarHBondContact O-N 3.46Å; Y214-F216 VanDerWaalsContact C-N 3.31Å; Y214-F216 PolarHBondContact O-N 3.04Å; F216-L218 VanDerWaalsContact C-N 3.34Å; F216-L218 PolarHBondContact O-N 2.87Å; F216-V219 PolarHBondContact O-N 3.32Å; F216-T220 HydrophobicContact CD2-CG2 4.1Å; F216-T220 HydrophobicContact CE2-CG2 3.56Å; F216-T220 HydrophobicContact CZ-CG2 3.89Å; F216-T220 WeakPolarHBondContact O-CG2 3.48Å; F216-T220 PolarHBondContact O-N 3.05Å; F216-T220 PolarHBondContact O-OG1 3.05Å
217R88.4Confident83.5Confident153 Ų15390.9 Ų90.958%0.57748%0.477SS*.Hα-helixtrans-62.5-40.7179.1-177.2-178.3171.9-167.2-2.9111.7L213 Y214 D215 T220 V221L213-R217 WeakPolarHBondContact O-CB 3.49Å; L213-R217 PolarHBondContact O-N 3.12Å; Y214-R217 WeakPolarHBondContact O-CB 3.32Å; Y214-R217 PolarHBondContact O-N 3.17Å; Y214-R217 VanDerWaalsContact O-N 3.13Å; D215-R217 VanDerWaalsContact C-N 3.35Å; D215-R217 PolarHBondContact O-N 3.14Å; R217-T220 PolarHBondContact O-N 3.26Å; R217-T220 PolarHBondContact O-OG1 2.76Å; R217-V221 HydrophobicContact CG-CG2 4.23Å; R217-V221 VanDerWaalsContact O-CG2 3.31Å; R217-V221 WeakPolarHBondContact O-CG2 3.36Å; R217-V221 PolarHBondContact O-N 2.88Å
218L84.6Confident82.6Confident128 Ų12893.7 Ų93.767%0.6748%0.483SS*.Hα-helixtrans-68.8-33.1-179.5-71.4172.2000112.8Y214 D215 F216 T220Y214-L218 WeakPolarHBondContact O-CG 3.47Å; Y214-L218 PolarHBondContact O-N 2.84Å; D215-L218 PolarHBondContact O-N 3.08Å; F216-L218 VanDerWaalsContact C-N 3.34Å; F216-L218 PolarHBondContact O-N 2.87Å; L218-T220 VanDerWaalsContact C-N 3.28Å; L218-T220 PolarHBondContact O-N 2.99Å
219V74.9Confident81.7Confident106 Ų10697.1 Ų97.164%0.64250%0.498SS*.Hα-helixtrans-72.7-22.8177.61750000112.3D215 F216D215-V219 WeakPolarHBondContact O-CG2 3.42Å; D215-V219 PolarHBondContact O-N 2.65Å; D215-V219 VanDerWaalsContact O-N 3.16Å; F216-V219 PolarHBondContact O-N 3.32Å
220T67.3Low80.7Confident45 Ų45102.6 Ų102.628%0.27653%0.525SS..Hα-helixtrans-107.1-10.7-171.451.90000114.7C86 F216 R217 L218 S222C86-T220 HydrophobicContact CB-CG2 4.13Å; C86-T220 VanDerWaalsContact SG-CG2 3.57Å; F216-T220 HydrophobicContact CD2-CG2 4.1Å; F216-T220 HydrophobicContact CE2-CG2 3.56Å; F216-T220 HydrophobicContact CZ-CG2 3.89Å; F216-T220 WeakPolarHBondContact O-CG2 3.48Å; F216-T220 PolarHBondContact O-N 3.05Å; F216-T220 PolarHBondContact O-OG1 3.05Å; R217-T220 PolarHBondContact O-N 3.26Å; R217-T220 PolarHBondContact O-OG1 2.76Å; L218-T220 VanDerWaalsContact C-N 3.28Å; L218-T220 PolarHBondContact O-N 2.99Å; T220-S222 PolarHBondContact O-N 2.99Å
221V60.2Low79.4Confident88 Ų88103.2 Ų103.253%0.53353%0.526SS..  trans-94.183.4171.4-176.40000108.5R217 E223R217-V221 HydrophobicContact CG-CG2 4.23Å; R217-V221 VanDerWaalsContact O-CG2 3.31Å; R217-V221 WeakPolarHBondContact O-CG2 3.36Å; R217-V221 PolarHBondContact O-N 2.88Å; V221-E223 HydrophobicContact CG1-CG 4.45Å
222S52.8Low78.1Confident93 Ų93104 Ų10465%0.6553%0.529SS*.  trans-85.5110.415425.10000107.6T220T220-S222 PolarHBondContact O-N 2.99Å
223E44.8Very low76.5Confident259 Ų259110.8 Ų110.8100%1.2156%0.563SS**  trans-64.80168.1-73.9-175.3162.600111.8V221V221-E223 HydrophobicContact CG1-CG 4.45Å

Retrieved 223 of 223 residues in 445.9 ms (Link to these results)

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