A0A077ZID2_TRITR Loading...

BHLH transcription factor LjTT8

AlphaFold DB , UniProt , Accession A0A077ZID2, 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
1M56Low82.5Confident176 Ų17695.5 Ų95.587%0.86746%0.459SS*.  01340-102.1-174.1163.200109.6L6M1-L6 HydrophobicContact CB-CG 4.34Å; M1-L6 HydrophobicContact SD-CD2 3.96Å; M1-L6 HydrophobicContact SD-CG 4.47Å
2P75.4Confident83.3Confident87 Ų8794.9 Ų94.957%0.56545%0.453SS*.  trans-60.4141.8174.6-18.229.4000111.3Q4 C5P2-Q4 PolarHBondContact O-N 3.01Å; P2-Q4 VanDerWaalsContact O-N 3.08Å; P2-C5 WeakPolarHBondContact O-CB 3.4Å; P2-C5 PolarHBondContact O-N 3.28Å
3K79.9Confident84Confident172 Ų17294.1 Ų94.175%0.74845%0.451SS*.Hα-helixtrans-51.4-35.6-178.3-74.7-178.3178176.70113.3L6 R7K3-L6 PolarHBondContact O-N 2.72Å; K3-R7 WeakPolarHBondContact O-CG 3.26Å; K3-R7 PolarHBondContact O-N 3.32Å; K3-R7 VanDerWaalsContact O-N 3.14Å
4Q80.8Confident84.5Confident117 Ų11787.6 Ų87.655%0.54742%0.42SS..Hα-helixtrans-64.7-37.5177.5-72.4174.8-8.100113.1P2 L6 R7 R8P2-Q4 PolarHBondContact O-N 3.01Å; P2-Q4 VanDerWaalsContact O-N 3.08Å; Q4-L6 VanDerWaalsContact C-N 3.34Å; Q4-L6 PolarHBondContact O-N 3.11Å; Q4-R7 PolarHBondContact O-N 3.26Å; Q4-R8 WeakPolarHBondContact O-CG 3.35Å; Q4-R8 PolarHBondContact O-N 3.14Å
5C82.2Confident85.1Confident54 Ų5484.7 Ų84.737%0.36540%0.404SS..Hα-helixtrans-63.9-41.3178.2-630000111.6P2 R8 L9P2-C5 WeakPolarHBondContact O-CB 3.4Å; P2-C5 PolarHBondContact O-N 3.28Å; C5-R8 PolarHBondContact O-N 3.14Å; C5-L9 WeakPolarHBondContact O-CB 3.49Å; C5-L9 PolarHBondContact O-N 3.17Å
6L86Confident85.4Confident94 Ų9488.8 Ų88.849%0.49243%0.426SS..Hα-helixtrans-65.8-43176.7-70171.3000111.7M1 K3 Q4 L9 Y10M1-L6 HydrophobicContact CB-CG 4.34Å; M1-L6 HydrophobicContact SD-CD2 3.96Å; M1-L6 HydrophobicContact SD-CG 4.47Å; K3-L6 PolarHBondContact O-N 2.72Å; Q4-L6 VanDerWaalsContact C-N 3.34Å; Q4-L6 PolarHBondContact O-N 3.11Å; L6-L9 PolarHBondContact O-N 2.85Å; L6-Y10 WeakPolarHBondContact O-CB 3.15Å; L6-Y10 PolarHBondContact O-N 2.94Å
7R87Confident85.8Confident116 Ų11689.2 Ų89.244%0.43843%0.431SS..Hα-helixtrans-59-48.2175.1-71.7-179.2-175.7-175.81111.9K3 Q4 L9 Y10 T11K3-R7 WeakPolarHBondContact O-CG 3.26Å; K3-R7 PolarHBondContact O-N 3.32Å; K3-R7 VanDerWaalsContact O-N 3.14Å; Q4-R7 PolarHBondContact O-N 3.26Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.41Å; R7-Y10 WeakPolarHBondContact O-CB 3.42Å; R7-Y10 PolarHBondContact O-N 2.87Å; R7-T11 PolarHBondContact O-N 2.97Å; R7-T11 PolarHBondContact O-OG1 3.47Å; R7-T11 VanDerWaalsContact O-OG1 3.09Å
8R89.6Confident85.9Confident41 Ų4187.9 Ų87.916%0.15545%0.445CS..Hα-helixtrans-63.7-37178.4-70.9175-173.3161.43.6112.7Q4 C5 K12 N136 L139 D140Q4-R8 WeakPolarHBondContact O-CG 3.35Å; Q4-R8 PolarHBondContact O-N 3.14Å; C5-R8 PolarHBondContact O-N 3.14Å; R8-K12 WeakPolarHBondContact O-CG 3.09Å; R8-K12 PolarHBondContact O-N 3.23Å; R8-K12 VanDerWaalsContact O-N 3.1Å; R8-N136 VanDerWaalsContact NH1-CG 3.28Å; R8-N136 PolarHBondContact NH1-ND2 3.4Å; R8-L139 HydrophobicContact CB-CB 4.44Å; R8-L139 HydrophobicContact CB-CD1 4.11Å; R8-L139 HydrophobicContact CG-CB 4.01Å; R8-L139 HydrophobicContact CG-CD1 4.27Å; R8-D140 VanDerWaalsContact CG-OD1 3.27Å; R8-D140 WeakPolarHBondContact CG-OD1 3.46Å; R8-D140 IonicContact CZ-OD1 3.33Å; R8-D140 IonicContact CZ-OD2 3.87Å; R8-D140 IonicContact NE-OD1 2.87Å; R8-D140 PolarHBondContact NE-OD1 3.22Å; R8-D140 IonicContact NE-OD2 3.53Å; R8-D140 PolarHBondContact NE-OD2 2.92Å; R8-D140 IonicContact NH2-OD1 2.73Å; R8-D140 IonicContact NH2-OD2 3.56Å; R8-D140 PolarHBondContact NH2-OD2 3.4Å
9L90.2Very high85.9Confident85 Ų8591.9 Ų91.945%0.44545%0.454SS..Hα-helixtrans-65.4-44.7173.6-176.464.7000111.1C5 L6 R7 T11 K12 I13C5-L9 WeakPolarHBondContact O-CB 3.49Å; C5-L9 PolarHBondContact O-N 3.17Å; L6-L9 PolarHBondContact O-N 2.85Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.41Å; L9-T11 VanDerWaalsContact C-N 3.34Å; L9-T11 PolarHBondContact O-N 3.38Å; L9-K12 WeakPolarHBondContact O-CB 3.31Å; L9-K12 PolarHBondContact O-N 2.96Å; L9-I13 HydrophobicContact CG-CD1 4.22Å; L9-I13 WeakPolarHBondContact O-CG1 3.43Å; L9-I13 PolarHBondContact O-N 3.48Å
10Y90.4Very high86Confident109 Ų10988 Ų8843%0.42744%0.435SS..Hα-helixtrans-58.3-44.7175.2179.8-93.6000111.8L6 R7 K12 I13 N14 H143 F146L6-Y10 WeakPolarHBondContact O-CB 3.15Å; L6-Y10 PolarHBondContact O-N 2.94Å; R7-Y10 WeakPolarHBondContact O-CB 3.42Å; R7-Y10 PolarHBondContact O-N 2.87Å; Y10-K12 VanDerWaalsContact C-N 3.35Å; Y10-K12 PolarHBondContact O-N 3.21Å; Y10-I13 PolarHBondContact O-N 3.37Å; Y10-N14 WeakPolarHBondContact CD1-ND2 3.5Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.47Å; Y10-N14 WeakPolarHBondContact CE2-ND2 3.43Å; Y10-N14 PolarHBondContact O-N 3.25Å; Y10-N14 PolarHBondContact O-ND2 2.69Å; Y10-H143 AromaticContact CD1-CE1 3.97Å; Y10-F146 HydrophobicContact CE1-CE1 4.13Å
11T89.8Confident85.9Confident0 Ų092.3 Ų92.30%045%0.454CS..Hα-helixtrans-59.1-45.7175.2-53.70000111.5R7 L9 I13 N14 Y15 I20 L139 D142 H143R7-T11 PolarHBondContact O-N 2.97Å; R7-T11 PolarHBondContact O-OG1 3.47Å; R7-T11 VanDerWaalsContact O-OG1 3.09Å; L9-T11 VanDerWaalsContact C-N 3.34Å; L9-T11 PolarHBondContact O-N 3.38Å; T11-I13 PolarHBondContact O-N 2.89Å; T11-N14 PolarHBondContact O-N 2.94Å; T11-N14 VanDerWaalsContact O-N 3.16Å; T11-Y15 HydrophobicContact CG2-CD1 4.5Å; T11-Y15 HydrophobicContact CG2-CE1 3.9Å; T11-Y15 HydrophobicContact CG2-CE2 4.22Å; T11-Y15 PolarHBondContact O-N 2.94Å; T11-I20 HydrophobicContact CG2-CD1 3.98Å; T11-I20 HydrophobicContact CG2-CG2 4.48Å; T11-L139 HydrophobicContact CG2-CD2 4.08Å; T11-D142 HydrophobicContact CG2-CB 4.2Å; T11-H143 WeakPolarHBondContact OG1-CB 3.47Å; T11-H143 PolarHBondContact OG1-ND1 3.27Å
12K91.9Very high87.5Confident88 Ų8891.8 Ų91.838%0.38344%0.442SS..Hα-helixtrans-60.6-41.9177.2-71.3172.9-175.4176.40112.9R8 L9 Y10 N14 Y15 I16 L139R8-K12 WeakPolarHBondContact O-CG 3.09Å; R8-K12 PolarHBondContact O-N 3.23Å; R8-K12 VanDerWaalsContact O-N 3.1Å; L9-K12 WeakPolarHBondContact O-CB 3.31Å; L9-K12 PolarHBondContact O-N 2.96Å; Y10-K12 VanDerWaalsContact C-N 3.35Å; Y10-K12 PolarHBondContact O-N 3.21Å; K12-N14 VanDerWaalsContact C-N 3.31Å; K12-Y15 WeakPolarHBondContact O-CB 3.33Å; K12-Y15 PolarHBondContact O-N 3.48Å; K12-I16 WeakPolarHBondContact O-CG1 3.35Å; K12-I16 PolarHBondContact O-N 3.45Å; K12-L139 HydrophobicContact CG-CD1 4.48Å; K12-L139 HydrophobicContact CG-CD2 3.82Å
13I92.5Very high88.1Confident84 Ų8489 Ų8943%0.43142%0.423SS..Hα-helixtrans-61.8-44176.1-68.6167.3000109.7L9 Y10 T11 Y15 I16 L17L9-I13 HydrophobicContact CG-CD1 4.22Å; L9-I13 WeakPolarHBondContact O-CG1 3.43Å; L9-I13 PolarHBondContact O-N 3.48Å; Y10-I13 PolarHBondContact O-N 3.37Å; T11-I13 PolarHBondContact O-N 2.89Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.5Å; I13-I16 WeakPolarHBondContact O-CB 3.11Å; I13-I16 PolarHBondContact O-N 2.96Å; I13-I16 VanDerWaalsContact O-N 3.11Å; I13-L17 HydrophobicContact CG2-CD1 3.88Å; I13-L17 HydrophobicContact CG2-CG 4.31Å; I13-L17 WeakPolarHBondContact O-CG 3.41Å; I13-L17 PolarHBondContact O-N 2.97Å
14N91.3Very high88.5Confident3 Ų388 Ų882%0.01642%0.422CS..Hα-helixtrans-71-24.4179.5-74.8-79.8000113.8Y10 T11 K12 G18 R19 I20Y10-N14 WeakPolarHBondContact CD1-ND2 3.5Å; Y10-N14 WeakPolarHBondContact CE1-ND2 3.47Å; Y10-N14 WeakPolarHBondContact CE2-ND2 3.43Å; Y10-N14 PolarHBondContact O-N 3.25Å; Y10-N14 PolarHBondContact O-ND2 2.69Å; T11-N14 PolarHBondContact O-N 2.94Å; T11-N14 VanDerWaalsContact O-N 3.16Å; K12-N14 VanDerWaalsContact C-N 3.31Å; N14-G18 PolarHBondContact O-N 2.82Å; N14-R19 HydrophobicContact CB-CB 4.07Å; N14-R19 PolarHBondContact O-N 2.94Å; N14-R19 VanDerWaalsContact OD1-CD 3.26Å; N14-R19 WeakPolarHBondContact OD1-CD 3.5Å; N14-I20 HydrophobicContact CB-CB 4.23Å; N14-I20 HydrophobicContact CB-CD1 3.56Å; N14-I20 HydrophobicContact CB-CG1 3.63Å; N14-I20 PolarHBondContact O-N 3.44Å
15Y92.9Very high89Confident45 Ų4584 Ų8418%0.17640%0.404CS..Hα-helixtrans-60.7-48.2165.1-65.7-30.9000111.2T11 K12 I13 L17 G18 I20 R22 L139 D142T11-Y15 HydrophobicContact CG2-CD1 4.5Å; T11-Y15 HydrophobicContact CG2-CE1 3.9Å; T11-Y15 HydrophobicContact CG2-CE2 4.22Å; T11-Y15 PolarHBondContact O-N 2.94Å; K12-Y15 WeakPolarHBondContact O-CB 3.33Å; K12-Y15 PolarHBondContact O-N 3.48Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.5Å; Y15-L17 VanDerWaalsContact C-N 3.27Å; Y15-L17 PolarHBondContact O-N 3.32Å; Y15-G18 PolarHBondContact O-N 3.28Å; Y15-I20 HydrophobicContact CD1-CB 3.84Å; Y15-I20 HydrophobicContact CD1-CG2 3.77Å; Y15-I20 WeakPolarHBondContact CD1-O 3.36Å; Y15-I20 HydrophobicContact CE1-CB 4.11Å; Y15-I20 HydrophobicContact CE1-CG2 3.5Å; Y15-R22 HydrophobicContact CD1-CB 4.1Å; Y15-R22 HydrophobicContact CE1-CB 3.78Å; Y15-R22 HydrophobicContact CE1-CG 4.17Å; Y15-R22 HydrophobicContact CE2-CB 4.5Å; Y15-R22 HydrophobicContact CE2-CG 4.17Å; Y15-L139 HydrophobicContact CD2-CD2 4.42Å; Y15-L139 HydrophobicContact CE2-CD2 3.45Å; Y15-L139 VanDerWaalsContact CE2-CD2 3.45Å; Y15-D142 HydrophobicContact CE1-CB 4.2Å; Y15-D142 PolarHBondContact OH-OD2 3.36Å
16I91.3Very high89.5Confident149 Ų14984.2 Ų84.276%0.76440%0.401SS*.Hα-helixtrans-62.9-38.1-179.1-63.4166.6000110.7K12 I13 G18K12-I16 WeakPolarHBondContact O-CG1 3.35Å; K12-I16 PolarHBondContact O-N 3.45Å; I13-I16 WeakPolarHBondContact O-CB 3.11Å; I13-I16 PolarHBondContact O-N 2.96Å; I13-I16 VanDerWaalsContact O-N 3.11Å; I16-G18 PolarHBondContact O-N 2.83Å
17L90.9Very high89.8Confident96 Ų9685.6 Ų85.650%0.50341%0.409SS..THydrogen-bonded Turntrans-76.5-0.5176.7-61.9176.3000113.7I13 Y15 R19I13-L17 HydrophobicContact CG2-CD1 3.88Å; I13-L17 HydrophobicContact CG2-CG 4.31Å; I13-L17 WeakPolarHBondContact O-CG 3.41Å; I13-L17 PolarHBondContact O-N 2.97Å; Y15-L17 VanDerWaalsContact C-N 3.27Å; Y15-L17 PolarHBondContact O-N 3.32Å; L17-R19 HydrophobicContact CB-CG 4.03Å; L17-R19 PolarHBondContact O-N 3.46Å
18G87.9Confident90.1Very high67 Ų6788.1 Ų88.169%0.69142%0.418SS*.THydrogen-bonded Turntrans6716.9-177.300000114.6N14 Y15 I16N14-G18 PolarHBondContact O-N 2.82Å; Y15-G18 PolarHBondContact O-N 3.28Å; I16-G18 PolarHBondContact O-N 2.83Å
19R87Confident90.3Very high163 Ų16386.4 Ų86.462%0.61541%0.413SS*.  trans-89.8-23.8-176.4-67.4179.1178.5-174.2-0.5113.5N14 L17 F146N14-R19 HydrophobicContact CB-CB 4.07Å; N14-R19 PolarHBondContact O-N 2.94Å; N14-R19 VanDerWaalsContact OD1-CD 3.26Å; N14-R19 WeakPolarHBondContact OD1-CD 3.5Å; L17-R19 HydrophobicContact CB-CG 4.03Å; L17-R19 PolarHBondContact O-N 3.46Å; R19-F146 HydrophobicContact CB-CE2 4.35Å; R19-F146 WeakPolarHBondContact O-CD2 3.36Å; R19-F146 VanDerWaalsContact O-CE2 3.29Å; R19-F146 WeakPolarHBondContact O-CE2 3.11Å
20I87.4Confident90.5Very high13 Ų1386.3 Ų86.37%0.06741%0.408CS..SBendtrans-119.7129.2173.7-64.4178.3000107.7T11 N14 Y15 D142 F146T11-I20 HydrophobicContact CG2-CD1 3.98Å; T11-I20 HydrophobicContact CG2-CG2 4.48Å; N14-I20 HydrophobicContact CB-CB 4.23Å; N14-I20 HydrophobicContact CB-CD1 3.56Å; N14-I20 HydrophobicContact CB-CG1 3.63Å; N14-I20 PolarHBondContact O-N 3.44Å; Y15-I20 HydrophobicContact CD1-CB 3.84Å; Y15-I20 HydrophobicContact CD1-CG2 3.77Å; Y15-I20 WeakPolarHBondContact CD1-O 3.36Å; Y15-I20 HydrophobicContact CE1-CB 4.11Å; Y15-I20 HydrophobicContact CE1-CG2 3.5Å; I20-D142 HydrophobicContact CG2-CB 4.05Å; I20-F146 HydrophobicContact CB-CD2 4.47Å; I20-F146 HydrophobicContact CD1-CB 3.65Å; I20-F146 HydrophobicContact CD1-CD1 3.83Å; I20-F146 HydrophobicContact CD1-CD2 3.99Å; I20-F146 HydrophobicContact CD1-CE1 4.46Å; I20-F146 HydrophobicContact CD1-CG 3.55Å; I20-F146 HydrophobicContact CG1-CB 3.68Å; I20-F146 HydrophobicContact CG1-CD1 4.09Å; I20-F146 HydrophobicContact CG1-CD2 3.3Å; I20-F146 HydrophobicContact CG1-CE2 3.83Å; I20-F146 HydrophobicContact CG1-CG 3.42Å; I20-F146 VanDerWaalsContact CG1-CG 3.42Å; I20-F146 HydrophobicContact CG1-CZ 4.46Å; I20-F146 HydrophobicContact CG2-CB 4.49Å
21E84.5Confident90.7Very high180 Ų18084.7 Ų84.784%0.84141%0.407SS*.PPolyproline II helixtrans-77.5131.9167.9-169.7174.4-167.600109.7
22R87.8Confident90.8Very high164 Ų16486 Ų8662%0.61942%0.416SS*.PPolyproline II helixtrans-81.7127.4-178.3-178.9175.7178.2-171-3.9109.7Y15 E24 D142Y15-R22 HydrophobicContact CD1-CB 4.1Å; Y15-R22 HydrophobicContact CE1-CB 3.78Å; Y15-R22 HydrophobicContact CE1-CG 4.17Å; Y15-R22 HydrophobicContact CE2-CB 4.5Å; Y15-R22 HydrophobicContact CE2-CG 4.17Å; R22-E24 PolarHBondContact O-N 3Å; R22-E24 VanDerWaalsContact O-N 3.17Å; R22-D142 WeakPolarHBondContact CA-OD2 3.3Å
23T88.2Confident90.9Very high28 Ų2883 Ų8317%0.17240%0.404CS..PPolyproline II helixtrans-61.2123.6169.9-68.20000109.9M141 D142 R145T23-M141 HydrophobicContact CG2-CE 3.5Å; T23-M141 VanDerWaalsContact CG2-CE 3.5Å; T23-M141 WeakPolarHBondContact OG1-CE 3.48Å; T23-D142 VanDerWaalsContact CB-OD1 3.27Å; T23-D142 WeakPolarHBondContact CB-OD1 3.18Å; T23-D142 PolarHBondContact N-OD1 3.17Å; T23-D142 PolarHBondContact N-OD2 2.82Å; T23-D142 PolarHBondContact OG1-OD1 3.42Å; T23-R145 PolarHBondContact OG1-NH1 3.19Å
24E88.7Confident91.1Very high152 Ų15286.7 Ų86.771%0.7141%0.414SS*.PPolyproline II helixtrans-80.5131.3171.5-68.7-14717900111.4R22 K30R22-E24 PolarHBondContact O-N 3Å; R22-E24 VanDerWaalsContact O-N 3.17Å; E24-K30 IonicContact OE2-NZ 2.65Å; E24-K30 PolarHBondContact OE2-NZ 3.47Å
25L91.2Very high91.2Very high32 Ų3290.4 Ų90.417%0.16843%0.434CS..PPolyproline II helixtrans-67.1141.1165-61.8178.1000109.1T29 K30 L33 L134 V138 F170L25-T29 HydrophobicContact CB-CG2 4.2Å; L25-T29 HydrophobicContact CD1-CG2 4.04Å; L25-T29 HydrophobicContact CD2-CG2 4.24Å; L25-T29 HydrophobicContact CG-CG2 4.39Å; L25-K30 HydrophobicContact CB-CG 3.85Å; L25-K30 WeakPolarHBondContact O-CD 3.35Å; L25-K30 WeakPolarHBondContact O-CE 3.14Å; L25-K30 PolarHBondContact O-NZ 3.3Å; L25-L33 HydrophobicContact CD1-CD1 3.74Å; L25-L134 HydrophobicContact CD1-CD2 4.24Å; L25-L134 HydrophobicContact CD2-CD2 4.3Å; L25-L134 HydrophobicContact CD2-CG 4.4Å; L25-V138 HydrophobicContact CD2-CG2 4.01Å; L25-F170 HydrophobicContact CD2-CE2 3.65Å; L25-F170 HydrophobicContact CD2-CZ 3.87Å
26D92.8Very high91.3Very high59 Ų5988.4 Ų88.432%0.31643%0.426SS..PPolyproline II helixtrans-61157.8172.663.889.2000111.2R28 T29 K30 K174D26-R28 PolarHBondContact O-N 3.19Å; D26-R28 WeakPolarHBondContact OD1-CB 3.44Å; D26-R28 PolarHBondContact OD1-N 3.04Å; D26-T29 VanDerWaalsContact CG-OG1 3.23Å; D26-T29 PolarHBondContact O-N 3.44Å; D26-T29 VanDerWaalsContact O-N 3.16Å; D26-T29 PolarHBondContact OD1-N 2.97Å; D26-T29 PolarHBondContact OD1-OG1 2.87Å; D26-T29 VanDerWaalsContact OD1-OG1 3.09Å; D26-T29 PolarHBondContact OD2-OG1 3.23Å; D26-K30 PolarHBondContact O-N 2.91Å; D26-K174 VanDerWaalsContact OD2-CE 3.32Å; D26-K174 WeakPolarHBondContact OD2-CE 3.35Å; D26-K174 IonicContact OD2-NZ 2.69Å; D26-K174 PolarHBondContact OD2-NZ 3.44Å
27L92.5Very high91.5Very high124 Ų12482.9 Ų82.965%0.64940%0.397SS*.Hα-helixtrans-58.4-37.1-174.7-174.563.2000112.5K30 N31L27-K30 PolarHBondContact O-N 3.26Å; L27-N31 WeakPolarHBondContact O-CB 3.36Å; L27-N31 PolarHBondContact O-N 3.26Å; L27-N31 PolarHBondContact O-ND2 2.98Å
28R93.3Very high91.7Very high168 Ų16879.5 Ų79.563%0.63438%0.383SS*.Hα-helixtrans-63.8-47.8179-177.3-177.8-179.6-157.9-3.1110.5D26 N31 S32 E178D26-R28 PolarHBondContact O-N 3.19Å; D26-R28 WeakPolarHBondContact OD1-CB 3.44Å; D26-R28 PolarHBondContact OD1-N 3.04Å; R28-N31 PolarHBondContact O-N 3.38Å; R28-S32 WeakPolarHBondContact O-CB 3.44Å; R28-S32 PolarHBondContact O-N 3.48Å; R28-S32 PolarHBondContact O-OG 3.4Å; R28-E178 IonicContact CZ-OE1 2.82Å; R28-E178 IonicContact NH1-OE1 2.73Å
29T93.2Very high92.1Very high6 Ų677.7 Ų77.74%0.03736%0.356CS..Hα-helixtrans-61.5-44.3176.4-580000111.8L25 D26 N31 S32 L33 L134 K174 L177L25-T29 HydrophobicContact CB-CG2 4.2Å; L25-T29 HydrophobicContact CD1-CG2 4.04Å; L25-T29 HydrophobicContact CD2-CG2 4.24Å; L25-T29 HydrophobicContact CG-CG2 4.39Å; D26-T29 VanDerWaalsContact CG-OG1 3.23Å; D26-T29 PolarHBondContact O-N 3.44Å; D26-T29 VanDerWaalsContact O-N 3.16Å; D26-T29 PolarHBondContact OD1-N 2.97Å; D26-T29 PolarHBondContact OD1-OG1 2.87Å; D26-T29 VanDerWaalsContact OD1-OG1 3.09Å; D26-T29 PolarHBondContact OD2-OG1 3.23Å; T29-N31 PolarHBondContact O-N 2.92Å; T29-S32 PolarHBondContact O-N 3.44Å; T29-L33 WeakPolarHBondContact O-CG 3.45Å; T29-L33 PolarHBondContact O-N 2.93Å; T29-L134 HydrophobicContact CG2-CD2 3.91Å; T29-K174 WeakPolarHBondContact OG1-CE 3.43Å; T29-L177 HydrophobicContact CG2-CD2 3.77Å
30K94.4Very high92.4Very high82 Ų8270.6 Ų70.636%0.35733%0.329SS..Hα-helixtrans-58.8-47.4175.9-73174.7174160.70111.2E24 L25 D26 L27 S32 L33 Y34E24-K30 IonicContact OE2-NZ 2.65Å; E24-K30 PolarHBondContact OE2-NZ 3.47Å; L25-K30 HydrophobicContact CB-CG 3.85Å; L25-K30 WeakPolarHBondContact O-CD 3.35Å; L25-K30 WeakPolarHBondContact O-CE 3.14Å; L25-K30 PolarHBondContact O-NZ 3.3Å; D26-K30 PolarHBondContact O-N 2.91Å; L27-K30 PolarHBondContact O-N 3.26Å; K30-S32 PolarHBondContact O-N 3.33Å; K30-L33 PolarHBondContact O-N 2.72Å; K30-Y34 PolarHBondContact O-N 3.21Å
31N94.3Very high92.8Very high76 Ų7673.6 Ų73.641%0.40635%0.346SS..Hα-helixtrans-63.9-40.8178.7-72.5-10.8000112.2L27 R28 T29 Y34 N35L27-N31 WeakPolarHBondContact O-CB 3.36Å; L27-N31 PolarHBondContact O-N 3.26Å; L27-N31 PolarHBondContact O-ND2 2.98Å; R28-N31 PolarHBondContact O-N 3.38Å; T29-N31 PolarHBondContact O-N 2.92Å; N31-Y34 PolarHBondContact O-N 3.42Å; N31-N35 VanDerWaalsContact O-CB 3.32Å; N31-N35 WeakPolarHBondContact O-CB 3.49Å; N31-N35 PolarHBondContact O-N 3.46Å; N31-N35 PolarHBondContact O-ND2 2.91Å
32S93.2Very high93.3Very high26 Ų2668.9 Ų68.918%0.18233%0.332CS..Hα-helixtrans-58.2-49.4174.5-77.20000112.2R28 T29 K30 Y34 N35 F36 M181R28-S32 WeakPolarHBondContact O-CB 3.44Å; R28-S32 PolarHBondContact O-N 3.48Å; R28-S32 PolarHBondContact O-OG 3.4Å; T29-S32 PolarHBondContact O-N 3.44Å; K30-S32 PolarHBondContact O-N 3.33Å; S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.45Å; S32-N35 PolarHBondContact O-N 2.85Å; S32-F36 PolarHBondContact O-N 3.24Å; S32-F36 VanDerWaalsContact O-N 3.16Å; S32-M181 VanDerWaalsContact O-CE 3.29Å; S32-M181 WeakPolarHBondContact O-CE 3.44Å
33L94.5Very high93.6Very high27 Ų2761.5 Ų61.514%0.14131%0.305CS..Hα-helixtrans-59.7-42.7176.9-70.6173.3000112.2L25 T29 K30 Q37 F127 R131 L177L25-L33 HydrophobicContact CD1-CD1 3.74Å; T29-L33 WeakPolarHBondContact O-CG 3.45Å; T29-L33 PolarHBondContact O-N 2.93Å; K30-L33 PolarHBondContact O-N 2.72Å; L33-Q37 WeakPolarHBondContact O-CB 3.16Å; L33-Q37 PolarHBondContact O-N 2.9Å; L33-F127 HydrophobicContact CD2-CE2 3.75Å; L33-F127 HydrophobicContact CD2-CZ 4.13Å; L33-F127 WeakPolarHBondContact O-CZ 3.34Å; L33-R131 HydrophobicContact CD2-CB 4.06Å; L33-R131 HydrophobicContact CD2-CG 3.93Å; L33-L177 HydrophobicContact CD2-CD1 3.79Å; L33-L177 HydrophobicContact CD2-CD2 3.77Å; L33-L177 HydrophobicContact CD2-CG 4.46Å; L33-L177 HydrophobicContact CG-CD2 3.88Å
34Y95.7Very high93.9Very high160 Ų16064.8 Ų64.863%0.62732%0.318SS*.Hα-helixtrans-64.5-51.7177.9176.3-99.1000111.5K30 N31 S32 F36 Q37 A38K30-Y34 PolarHBondContact O-N 3.21Å; N31-Y34 PolarHBondContact O-N 3.42Å; S32-Y34 VanDerWaalsContact C-N 3.31Å; S32-Y34 PolarHBondContact O-N 3.45Å; Y34-F36 PolarHBondContact O-N 3.3Å; Y34-Q37 PolarHBondContact O-N 2.71Å; Y34-A38 HydrophobicContact CE1-CB 4.24Å; Y34-A38 VanDerWaalsContact O-CB 3.29Å; Y34-A38 WeakPolarHBondContact O-CB 3.48Å; Y34-A38 PolarHBondContact O-N 2.97Å
35N94.3Very high94.3Very high81 Ų8166.5 Ų66.543%0.43332%0.318SS..Hα-helixtrans-62.1-41.3-173.8-71.9-13.8000112.7N31 S32 F39 L184N31-N35 VanDerWaalsContact O-CB 3.32Å; N31-N35 WeakPolarHBondContact O-CB 3.49Å; N31-N35 PolarHBondContact O-N 3.46Å; N31-N35 PolarHBondContact O-ND2 2.91Å; S32-N35 PolarHBondContact O-N 2.85Å; N35-F39 VanDerWaalsContact O-CB 3.32Å; N35-F39 WeakPolarHBondContact O-CB 3.44Å; N35-F39 PolarHBondContact O-N 3Å; N35-L184 HydrophobicContact CB-CD2 4.07Å
36F94.9Very high94.5Very high3 Ų367.2 Ų67.21%0.01332%0.322CS..Hα-helixtrans-67.2-43.5178.7-154.3-66000111.2S32 Y34 F39 K40 E123 Y124 F127 V180 M181 L184S32-F36 PolarHBondContact O-N 3.24Å; S32-F36 VanDerWaalsContact O-N 3.16Å; Y34-F36 PolarHBondContact O-N 3.3Å; F36-F39 PolarHBondContact O-N 2.94Å; F36-K40 PolarHBondContact O-N 3.13Å; F36-K40 VanDerWaalsContact O-N 3.12Å; F36-E123 HydrophobicContact CZ-CB 3.91Å; F36-Y124 HydrophobicContact CD1-CD2 4Å; F36-Y124 AromaticContact CE1-CD2 3.9Å; F36-Y124 HydrophobicContact CE1-CD2 3.9Å; F36-F127 HydrophobicContact CB-CD2 3.84Å; F36-F127 HydrophobicContact CB-CE1 4.45Å; F36-F127 HydrophobicContact CB-CE2 3.65Å; F36-F127 HydrophobicContact CB-CG 4.31Å; F36-F127 HydrophobicContact CB-CZ 3.98Å; F36-F127 HydrophobicContact CD1-CB 3.95Å; F36-F127 AromaticContact CD1-CD1 3.9Å; F36-F127 HydrophobicContact CD1-CD1 3.9Å; F36-F127 HydrophobicContact CD1-CD2 4.02Å; F36-F127 HydrophobicContact CD1-CE1 4.42Å; F36-F127 AromaticContact CD1-CG 3.67Å; F36-F127 HydrophobicContact CD1-CG 3.67Å; F36-F127 HydrophobicContact CD2-CD2 4.25Å; F36-F127 HydrophobicContact CE1-CB 3.91Å; F36-F127 HydrophobicContact CE1-CG 4.16Å; F36-F127 HydrophobicContact CG-CB 4.36Å; F36-F127 HydrophobicContact CG-CD1 4.42Å; F36-F127 AromaticContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CE2 4.11Å; F36-F127 AromaticContact CG-CG 3.92Å; F36-F127 HydrophobicContact CG-CG 3.92Å; F36-F127 HydrophobicContact CZ-CB 4.25Å; F36-V180 HydrophobicContact CE2-CG1 4Å; F36-V180 HydrophobicContact CZ-CG1 4.39Å; F36-M181 HydrophobicContact CB-CE 4.18Å; F36-M181 HydrophobicContact CB-SD 3.81Å; F36-M181 HydrophobicContact CD2-CE 4.16Å; F36-M181 HydrophobicContact CD2-SD 3.66Å; F36-M181 HydrophobicContact CG-SD 4.19Å; F36-L184 HydrophobicContact CB-CD2 4.46Å; F36-L184 HydrophobicContact CD2-CB 3.92Å; F36-L184 HydrophobicContact CD2-CD1 4.01Å; F36-L184 HydrophobicContact CD2-CD2 4.37Å; F36-L184 HydrophobicContact CD2-CG 4.32Å; F36-L184 HydrophobicContact CE2-CB 4.05Å; F36-L184 HydrophobicContact CE2-CD1 4.3Å; F36-L184 HydrophobicContact CG-CD1 4.23Å
37Q95.1Very high94.6Very high34 Ų3466.1 Ų66.116%0.15932%0.315CS..Hα-helixtrans-63.8-48.5177.2-175.962.653.400111L33 Y34 F39 K40 D41 Y124 F127 R131L33-Q37 WeakPolarHBondContact O-CB 3.16Å; L33-Q37 PolarHBondContact O-N 2.9Å; Y34-Q37 PolarHBondContact O-N 2.71Å; Q37-F39 VanDerWaalsContact C-N 3.32Å; Q37-F39 PolarHBondContact O-N 3.37Å; Q37-K40 PolarHBondContact O-N 2.98Å; Q37-K40 VanDerWaalsContact O-N 3.08Å; Q37-D41 PolarHBondContact NE2-OD1 3.45Å; Q37-D41 PolarHBondContact NE2-OD2 3.12Å; Q37-D41 VanDerWaalsContact O-CG 3.24Å; Q37-D41 PolarHBondContact O-N 3.05Å; Q37-Y124 PolarHBondContact NE2-OH 3.03Å; Q37-Y124 VanDerWaalsContact NE2-OH 3.07Å; Q37-Y124 PolarHBondContact OE1-OH 2.93Å; Q37-F127 HydrophobicContact CB-CE1 4.25Å; Q37-F127 HydrophobicContact CB-CZ 4.32Å; Q37-R131 VanDerWaalsContact OE1-NH1 3.08Å
38A95.6Very high94.7Very high24 Ų2461.8 Ų61.820%0.19830%0.3CS..Hα-helixtrans-59.4-41.8178.200000111.8Y34 K40 D41 C42Y34-A38 HydrophobicContact CE1-CB 4.24Å; Y34-A38 VanDerWaalsContact O-CB 3.29Å; Y34-A38 WeakPolarHBondContact O-CB 3.48Å; Y34-A38 PolarHBondContact O-N 2.97Å; A38-K40 VanDerWaalsContact C-N 3.32Å; A38-K40 PolarHBondContact O-N 2.86Å; A38-D41 PolarHBondContact O-N 3.19Å; A38-C42 WeakPolarHBondContact O-CB 3.42Å; A38-C42 PolarHBondContact O-N 3.39Å; A38-C42 PolarHBondContact O-SG 2.91Å
39F95.6Very high94.7Very high29 Ų2955.5 Ų55.513%0.12728%0.284CS..Hα-helixtrans-58.8-44.7174.4173.3-102.3000111.7N35 F36 Q37 T43 L184 C187 M188 Q191N35-F39 VanDerWaalsContact O-CB 3.32Å; N35-F39 WeakPolarHBondContact O-CB 3.44Å; N35-F39 PolarHBondContact O-N 3Å; F36-F39 PolarHBondContact O-N 2.94Å; Q37-F39 VanDerWaalsContact C-N 3.32Å; Q37-F39 PolarHBondContact O-N 3.37Å; F39-T43 HydrophobicContact CD2-CG2 4.05Å; F39-T43 HydrophobicContact CE1-CG2 4.09Å; F39-T43 HydrophobicContact CE2-CG2 3.56Å; F39-T43 HydrophobicContact CZ-CG2 3.59Å; F39-T43 WeakPolarHBondContact O-CB 3.38Å; F39-T43 VanDerWaalsContact O-CG2 3.29Å; F39-T43 WeakPolarHBondContact O-CG2 3.43Å; F39-T43 PolarHBondContact O-N 3.11Å; F39-T43 PolarHBondContact O-OG1 3.48Å; F39-L184 HydrophobicContact CB-CD1 3.75Å; F39-L184 HydrophobicContact CD1-CD1 3.65Å; F39-L184 HydrophobicContact CE1-CD1 4.43Å; F39-L184 HydrophobicContact CG-CD1 3.7Å; F39-C187 HydrophobicContact CD1-CB 4.45Å; F39-C187 HydrophobicContact CE1-CB 3.56Å; F39-C187 HydrophobicContact CZ-CB 3.83Å; F39-C187 WeakPolarHBondContact CZ-O 3.39Å; F39-M188 HydrophobicContact CD2-CG 3.62Å; F39-M188 HydrophobicContact CE2-CB 4.2Å; F39-M188 HydrophobicContact CE2-CG 3.61Å; F39-M188 HydrophobicContact CG-CG 4.3Å; F39-M188 HydrophobicContact CZ-CG 4.29Å; F39-Q191 HydrophobicContact CE2-CB 3.95Å; F39-Q191 HydrophobicContact CE2-CG 4.29Å; F39-Q191 HydrophobicContact CZ-CB 4.02Å
40K94.2Very high94.8Very high14 Ų1455.6 Ų55.66%0.06129%0.285CS..Hα-helixtrans-65.3-45178.5-172.655.5169.9141.10112.1F36 Q37 A38 C42 T43 E44 Y124F36-K40 PolarHBondContact O-N 3.13Å; F36-K40 VanDerWaalsContact O-N 3.12Å; Q37-K40 PolarHBondContact O-N 2.98Å; Q37-K40 VanDerWaalsContact O-N 3.08Å; A38-K40 VanDerWaalsContact C-N 3.32Å; A38-K40 PolarHBondContact O-N 2.86Å; K40-C42 PolarHBondContact O-N 3.01Å; K40-T43 WeakPolarHBondContact CA-OG1 3.48Å; K40-T43 PolarHBondContact O-N 3.47Å; K40-T43 PolarHBondContact O-OG1 3.14Å; K40-E44 HydrophobicContact CD-CG 4.17Å; K40-E44 WeakPolarHBondContact CE-OE1 3.34Å; K40-E44 IonicContact NZ-OE1 3.71Å; K40-E44 PolarHBondContact NZ-OE1 3.05Å; K40-E44 WeakPolarHBondContact O-CG 3.45Å; K40-E44 PolarHBondContact O-N 3.44Å; K40-Y124 HydrophobicContact CB-CD2 3.86Å; K40-Y124 HydrophobicContact CB-CE2 3.74Å; K40-Y124 HydrophobicContact CB-CG 4.38Å; K40-Y124 HydrophobicContact CD-CD1 4.14Å; K40-Y124 HydrophobicContact CD-CE1 4.43Å; K40-Y124 HydrophobicContact CD-CG 4.18Å; K40-Y124 HydrophobicContact CG-CD1 3.76Å; K40-Y124 HydrophobicContact CG-CD2 3.79Å; K40-Y124 HydrophobicContact CG-CE1 3.62Å; K40-Y124 HydrophobicContact CG-CE2 3.73Å; K40-Y124 HydrophobicContact CG-CG 3.83Å
41D94.6Very high94.7Very high76 Ų7654.3 Ų54.341%0.40628%0.281SS..Hα-helixtrans-62.6-44.7179.9-62.1-21.9000110.9Q37 A38 T43 W45Q37-D41 PolarHBondContact NE2-OD1 3.45Å; Q37-D41 PolarHBondContact NE2-OD2 3.12Å; Q37-D41 VanDerWaalsContact O-CG 3.24Å; Q37-D41 PolarHBondContact O-N 3.05Å; A38-D41 PolarHBondContact O-N 3.19Å; D41-T43 PolarHBondContact O-N 3.01Å; D41-W45 VanDerWaalsContact O-CB 3.29Å; D41-W45 WeakPolarHBondContact O-CB 3.47Å; D41-W45 PolarHBondContact O-N 3.43Å
42C95.1Very high94.4Very high82 Ų8258.1 Ų58.155%0.55430%0.297SS*.Hα-helixtrans-66.1-37.1177.2-690000113A38 K40 L46A38-C42 WeakPolarHBondContact O-CB 3.42Å; A38-C42 PolarHBondContact O-N 3.39Å; A38-C42 PolarHBondContact O-SG 2.91Å; K40-C42 PolarHBondContact O-N 3.01Å; C42-L46 VanDerWaalsContact O-CB 3.27Å; C42-L46 WeakPolarHBondContact O-CB 3.44Å; C42-L46 PolarHBondContact O-N 3.38Å
43T95Very high94.1Very high8 Ų862.8 Ų62.85%0.04931%0.314CS..Hα-helixtrans-71.5-38.2178.548.30000112.4F39 K40 D41 H47 Q191F39-T43 HydrophobicContact CD2-CG2 4.05Å; F39-T43 HydrophobicContact CE1-CG2 4.09Å; F39-T43 HydrophobicContact CE2-CG2 3.56Å; F39-T43 HydrophobicContact CZ-CG2 3.59Å; F39-T43 WeakPolarHBondContact O-CB 3.38Å; F39-T43 VanDerWaalsContact O-CG2 3.29Å; F39-T43 WeakPolarHBondContact O-CG2 3.43Å; F39-T43 PolarHBondContact O-N 3.11Å; F39-T43 PolarHBondContact O-OG1 3.48Å; K40-T43 WeakPolarHBondContact CA-OG1 3.48Å; K40-T43 PolarHBondContact O-N 3.47Å; K40-T43 PolarHBondContact O-OG1 3.14Å; D41-T43 PolarHBondContact O-N 3.01Å; T43-H47 WeakPolarHBondContact O-CB 3.47Å; T43-H47 PolarHBondContact O-N 3.17Å; T43-Q191 HydrophobicContact CG2-CB 4.41Å; T43-Q191 HydrophobicContact CG2-CG 3.72Å
44E94.4Very high93.4Very high97 Ų9762 Ų6245%0.45331%0.311SS..Hα-helixtrans-67.9-42.3173.5-71.7-177.3165.600111.9K40 H47 G48K40-E44 HydrophobicContact CD-CG 4.17Å; K40-E44 WeakPolarHBondContact CE-OE1 3.34Å; K40-E44 IonicContact NZ-OE1 3.71Å; K40-E44 PolarHBondContact NZ-OE1 3.05Å; K40-E44 WeakPolarHBondContact O-CG 3.45Å; K40-E44 PolarHBondContact O-N 3.44Å; E44-H47 WeakPolarHBondContact O-CB 3.35Å; E44-H47 PolarHBondContact O-N 3.28Å; E44-G48 PolarHBondContact O-N 2.92Å
45W95.7Very high92.3Very high189 Ų18957.4 Ų57.472%0.71630%0.301SS*.Hα-helixtrans-60.9-47.6174.4178.480.8000111.7D41 H47 G48 A49D41-W45 VanDerWaalsContact O-CB 3.29Å; D41-W45 WeakPolarHBondContact O-CB 3.47Å; D41-W45 PolarHBondContact O-N 3.43Å; W45-H47 VanDerWaalsContact C-N 3.33Å; W45-H47 PolarHBondContact O-N 3.16Å; W45-G48 PolarHBondContact O-N 2.96Å; W45-A49 PolarHBondContact O-N 3.35Å
46L96Very high90.9Very high47 Ų4755.4 Ų55.425%0.24630%0.296CS..Hα-helixtrans-64.3-38.5178.6-177.962.6000111.9C42 G48 A49 I50 M116C42-L46 VanDerWaalsContact O-CB 3.27Å; C42-L46 WeakPolarHBondContact O-CB 3.44Å; C42-L46 PolarHBondContact O-N 3.38Å; L46-G48 VanDerWaalsContact C-N 3.33Å; L46-A49 PolarHBondContact O-N 3.47Å; L46-I50 HydrophobicContact CD1-CD1 4.19Å; L46-I50 HydrophobicContact CD1-CG1 4.27Å; L46-I50 HydrophobicContact CG-CD1 3.98Å; L46-I50 HydrophobicContact CG-CG1 4.47Å; L46-I50 WeakPolarHBondContact O-CG1 3.41Å; L46-I50 PolarHBondContact O-N 3.03Å; L46-M116 HydrophobicContact CB-CE 4.2Å; L46-M116 HydrophobicContact CD2-CE 4.11Å; L46-M116 HydrophobicContact CG-CE 4Å
47H95.4Very high89.9Confident35 Ų3562.3 Ų62.316%0.16233%0.328CS..Hα-helixtrans-56.7-49.4172.4173.7-70.2000110.7T43 E44 W45 A49 I50 D51 L113 M116T43-H47 WeakPolarHBondContact O-CB 3.47Å; T43-H47 PolarHBondContact O-N 3.17Å; E44-H47 WeakPolarHBondContact O-CB 3.35Å; E44-H47 PolarHBondContact O-N 3.28Å; W45-H47 VanDerWaalsContact C-N 3.33Å; W45-H47 PolarHBondContact O-N 3.16Å; H47-A49 VanDerWaalsContact C-N 3.35Å; H47-A49 PolarHBondContact O-N 3.28Å; H47-I50 PolarHBondContact O-N 3.19Å; H47-D51 WeakPolarHBondContact O-CB 3.45Å; H47-D51 PolarHBondContact O-N 3.47Å; H47-L113 PolarHBondContact CD2-O 2.79Å; H47-L113 PolarHBondContact NE2-O 3.33Å; H47-L113 WeakPolarHBondContact O-CD2 3.39Å; H47-M116 HydrophobicContact CB-CE 4.03Å
48G94.1Very high88.9Confident33 Ų3366.2 Ų66.234%0.3435%0.35SS..Hα-helixtrans-58.1-45.6177.300000112.5E44 W45 L46 I50 D51 E52E44-G48 PolarHBondContact O-N 2.92Å; W45-G48 PolarHBondContact O-N 2.96Å; L46-G48 VanDerWaalsContact C-N 3.33Å; G48-I50 PolarHBondContact O-N 3.37Å; G48-D51 PolarHBondContact O-N 3.46Å; G48-E52 WeakPolarHBondContact O-CB 3.33Å; G48-E52 PolarHBondContact O-N 3Å
49A94.2Very high88.2Confident36 Ų3670.9 Ų70.930%0.29837%0.368SS..Hα-helixtrans-63.5-39.8179.100000113W45 L46 H47 F53W45-A49 PolarHBondContact O-N 3.35Å; L46-A49 PolarHBondContact O-N 3.47Å; H47-A49 VanDerWaalsContact C-N 3.35Å; H47-A49 PolarHBondContact O-N 3.28Å; A49-F53 VanDerWaalsContact O-CB 3.27Å; A49-F53 WeakPolarHBondContact O-CB 3.36Å; A49-F53 PolarHBondContact O-N 3.29Å
50I94.3Very high87.8Confident9 Ų970.9 Ų70.95%0.04637%0.368CS..Hα-helixtrans-68.9-40.1176.8-68.5170.5000111L46 H47 G48 F53 S54 I108 L113 M116 F198L46-I50 HydrophobicContact CD1-CD1 4.19Å; L46-I50 HydrophobicContact CD1-CG1 4.27Å; L46-I50 HydrophobicContact CG-CD1 3.98Å; L46-I50 HydrophobicContact CG-CG1 4.47Å; L46-I50 WeakPolarHBondContact O-CG1 3.41Å; L46-I50 PolarHBondContact O-N 3.03Å; H47-I50 PolarHBondContact O-N 3.19Å; G48-I50 PolarHBondContact O-N 3.37Å; I50-F53 PolarHBondContact O-N 3.12Å; I50-S54 VanDerWaalsContact O-CB 3.31Å; I50-S54 WeakPolarHBondContact O-CB 3.33Å; I50-S54 PolarHBondContact O-N 2.87Å; I50-S54 PolarHBondContact O-OG 3.45Å; I50-I108 HydrophobicContact CG2-CG2 3.89Å; I50-L113 HydrophobicContact CB-CD2 3.8Å; I50-L113 HydrophobicContact CG2-CD1 4.33Å; I50-L113 HydrophobicContact CG2-CD2 3.62Å; I50-L113 HydrophobicContact CG2-CG 4.03Å; I50-M116 HydrophobicContact CD1-CE 4.23Å; I50-M116 HydrophobicContact CD1-SD 4.02Å; I50-F198 HydrophobicContact CD1-CD1 4.45Å; I50-F198 HydrophobicContact CD1-CD2 4.39Å; I50-F198 HydrophobicContact CD1-CG 4.26Å; I50-F198 HydrophobicContact CG1-CE1 4.5Å; I50-F198 HydrophobicContact CG1-CE2 4.33Å; I50-F198 HydrophobicContact CG1-CZ 4.32Å; I50-F198 HydrophobicContact CG2-CD2 3.81Å; I50-F198 HydrophobicContact CG2-CE2 3.6Å; I50-F198 HydrophobicContact CG2-CZ 4.31Å
51D92Very high87.4Confident54 Ų5472.9 Ų72.929%0.28939%0.388SS..Hα-helixtrans-65.2-45.9179.2-168.232.2000111.3H47 G48 F53 S54 C55 R109 L113H47-D51 WeakPolarHBondContact O-CB 3.45Å; H47-D51 PolarHBondContact O-N 3.47Å; G48-D51 PolarHBondContact O-N 3.46Å; D51-F53 PolarHBondContact O-N 3.48Å; D51-S54 CarbonylContact O-C 3.5Å; D51-S54 PolarHBondContact O-N 3.29Å; D51-S54 VanDerWaalsContact O-N 3.15Å; D51-C55 WeakPolarHBondContact O-CB 3.49Å; D51-C55 PolarHBondContact O-N 2.96Å; D51-C55 VanDerWaalsContact O-N 3.12Å; D51-R109 IonicContact OD1-CZ 2.71Å; D51-R109 IonicContact OD1-NH1 2.86Å; D51-R109 PolarHBondContact OD1-NH1 2.89Å; D51-R109 IonicContact OD1-NH2 3.72Å; D51-L113 HydrophobicContact CB-CD1 3.82Å; D51-L113 HydrophobicContact CB-CD2 4.22Å
52E89.2Confident87.2Confident156 Ų15675.3 Ų75.373%0.72940%0.395SS*.Hα-helixtrans-59.6-47.1174.6-175.2175.6-170.900111.4G48 S54 C55G48-E52 WeakPolarHBondContact O-CB 3.33Å; G48-E52 PolarHBondContact O-N 3Å; E52-S54 PolarHBondContact O-N 3.35Å; E52-C55 PolarHBondContact O-N 3.03Å; E52-C55 VanDerWaalsContact O-N 3.12Å
53F86.3Confident87.1Confident124 Ų12473.3 Ų73.354%0.54438%0.378SS..Hα-helixtrans-59.2-35.8175.8178.8-94.5000112.6A49 I50 D51 C55 F198 M202A49-F53 VanDerWaalsContact O-CB 3.27Å; A49-F53 WeakPolarHBondContact O-CB 3.36Å; A49-F53 PolarHBondContact O-N 3.29Å; I50-F53 PolarHBondContact O-N 3.12Å; D51-F53 PolarHBondContact O-N 3.48Å; F53-C55 VanDerWaalsContact C-N 3.3Å; F53-C55 PolarHBondContact O-N 2.64Å; F53-F198 HydrophobicContact CD1-CZ 4.23Å; F53-F198 HydrophobicContact CE1-CZ 4.42Å; F53-M202 HydrophobicContact CE1-CE 3.55Å; F53-M202 HydrophobicContact CE1-SD 3.85Å; F53-M202 HydrophobicContact CZ-CE 3.78Å
54S80.8Confident87Confident12 Ų1274.9 Ų74.98%0.08439%0.387CS..THydrogen-bonded Turntrans-87.34.5-178.8-53.30000113.3I50 D51 E52 R109I50-S54 VanDerWaalsContact O-CB 3.31Å; I50-S54 WeakPolarHBondContact O-CB 3.33Å; I50-S54 PolarHBondContact O-N 2.87Å; I50-S54 PolarHBondContact O-OG 3.45Å; D51-S54 CarbonylContact O-C 3.5Å; D51-S54 PolarHBondContact O-N 3.29Å; D51-S54 VanDerWaalsContact O-N 3.15Å; E52-S54 PolarHBondContact O-N 3.35Å; S54-R109 PolarHBondContact O-NH2 3.25Å
55C70.7Confident86.9Confident62 Ų6276.7 Ų76.742%0.41940%0.396SS..THydrogen-bonded Turntrans-111.626.4-177.7-146.60000113D51 E52 F53 E57 R109D51-C55 WeakPolarHBondContact O-CB 3.49Å; D51-C55 PolarHBondContact O-N 2.96Å; D51-C55 VanDerWaalsContact O-N 3.12Å; E52-C55 PolarHBondContact O-N 3.03Å; E52-C55 VanDerWaalsContact O-N 3.12Å; F53-C55 VanDerWaalsContact C-N 3.3Å; F53-C55 PolarHBondContact O-N 2.64Å; C55-E57 PolarHBondContact O-N 3.12Å; C55-R109 PolarHBondContact SG-NH2 3.35Å
56A65.9Low86.9Confident39 Ų3971.5 Ų71.532%0.32238%0.382SS..  trans-73.760.1178.400000112.5D58 E59 E60A56-D58 PolarHBondContact O-N 3.23Å; A56-E59 HydrophobicContact CB-CB 4.21Å; A56-E59 HydrophobicContact CB-CG 4.25Å; A56-E59 PolarHBondContact O-N 3.38Å; A56-E59 VanDerWaalsContact O-N 3.11Å; A56-E60 PolarHBondContact O-N 3.34Å
57E73.5Confident86.9Confident148 Ų14869.3 Ų69.369%0.69237%0.37SS*.Hα-helixtrans-52.7-34.2171.3-68.4-173163.200110.9C55 A61C55-E57 PolarHBondContact O-N 3.12Å; E57-A61 WeakPolarHBondContact O-CB 3.28Å; E57-A61 PolarHBondContact O-N 3.42Å
58D75.2Confident87Confident116 Ų11672 Ų7262%0.6238%0.383SS*.Hα-helixtrans-62.9-41.9177.5-81.5-0.7000113.6A56 K62A56-D58 PolarHBondContact O-N 3.23Å; D58-K62 WeakPolarHBondContact O-CB 3.35Å; D58-K62 WeakPolarHBondContact O-CD 3.09Å; D58-K62 WeakPolarHBondContact O-CG 2.92Å; D58-K62 PolarHBondContact O-N 2.99Å
59E81Confident87.1Confident123 Ų12372.9 Ų72.958%0.57539%0.387SS*.Hα-helixtrans-72.9-41.7-178.5-71.3-168.7169.500111.2A56 A61 K62 M63A56-E59 HydrophobicContact CB-CB 4.21Å; A56-E59 HydrophobicContact CB-CG 4.25Å; A56-E59 PolarHBondContact O-N 3.38Å; A56-E59 VanDerWaalsContact O-N 3.11Å; E59-A61 VanDerWaalsContact C-N 3.34Å; E59-K62 PolarHBondContact O-N 3.04Å; E59-M63 HydrophobicContact CB-CE 4.36Å; E59-M63 WeakPolarHBondContact O-CB 3.25Å; E59-M63 PolarHBondContact O-N 3.45Å
60E85.6Confident87.2Confident28 Ų2871.8 Ų71.813%0.13138%0.376CS..Hα-helixtrans-64.2-39.8175.4-65.9-172.3171.600111.9A56 T64 V98 S101 K102A56-E60 PolarHBondContact O-N 3.34Å; E60-T64 WeakPolarHBondContact O-CB 3.45Å; E60-T64 PolarHBondContact O-N 3.1Å; E60-T64 PolarHBondContact O-OG1 3.27Å; E60-V98 HydrophobicContact CB-CG1 4.26Å; E60-S101 VanDerWaalsContact OE1-CB 3.28Å; E60-S101 WeakPolarHBondContact OE1-CB 3.47Å; E60-S101 PolarHBondContact OE1-OG 3.41Å; E60-K102 PolarHBondContact OE1-N 3.16Å; E60-K102 WeakPolarHBondContact OE2-CE 3.47Å; E60-K102 WeakPolarHBondContact OE2-CG 3.44Å
61A86.9Confident87.2Confident56 Ų5674 Ų7446%0.46339%0.388SS..Hα-helixtrans-63.3-48.7174.600000111E57 E59 M63 T64 E65E57-A61 WeakPolarHBondContact O-CB 3.28Å; E57-A61 PolarHBondContact O-N 3.42Å; E59-A61 VanDerWaalsContact C-N 3.34Å; A61-M63 PolarHBondContact O-N 2.99Å; A61-T64 WeakPolarHBondContact O-CB 3.44Å; A61-T64 PolarHBondContact O-N 3.06Å; A61-T64 VanDerWaalsContact O-N 3.13Å; A61-E65 WeakPolarHBondContact O-CB 3.31Å; A61-E65 PolarHBondContact O-N 3.46Å
62K90.4Very high87.4Confident128 Ų12877.2 Ų77.256%0.55740%0.401SS*.Hα-helixtrans-59.9-42.9177.5-74.2165.9-171168.60112.5D58 E59 T64 E65 L66D58-K62 WeakPolarHBondContact O-CB 3.35Å; D58-K62 WeakPolarHBondContact O-CD 3.09Å; D58-K62 WeakPolarHBondContact O-CG 2.92Å; D58-K62 PolarHBondContact O-N 2.99Å; E59-K62 PolarHBondContact O-N 3.04Å; K62-T64 VanDerWaalsContact C-N 3.33Å; K62-E65 PolarHBondContact O-N 3.37Å; K62-L66 WeakPolarHBondContact O-CB 3.45Å; K62-L66 PolarHBondContact O-N 2.87Å
63M91.6Very high87.5Confident40 Ų4074.1 Ų74.120%0.19739%0.388CS..Hα-helixtrans-66.1-36.2176.2-80.8-171.7-89.500112.2E59 A61 A67 I97 V98E59-M63 HydrophobicContact CB-CE 4.36Å; E59-M63 WeakPolarHBondContact O-CB 3.25Å; E59-M63 PolarHBondContact O-N 3.45Å; A61-M63 PolarHBondContact O-N 2.99Å; M63-A67 WeakPolarHBondContact O-CB 3.49Å; M63-A67 PolarHBondContact O-N 2.94Å; M63-I97 HydrophobicContact SD-CG2 3.89Å; M63-V98 HydrophobicContact CB-CG2 3.44Å; M63-V98 VanDerWaalsContact CB-CG2 3.44Å; M63-V98 HydrophobicContact CG-CG2 4.47Å; M63-V98 HydrophobicContact SD-CG2 4.32Å
64T92.9Very high87.8Confident41 Ų4168.6 Ų68.625%0.25237%0.365SS..Hα-helixtrans-67.1-46175.9-56.10000111E60 A61 K62 L66 A67 E68E60-T64 WeakPolarHBondContact O-CB 3.45Å; E60-T64 PolarHBondContact O-N 3.1Å; E60-T64 PolarHBondContact O-OG1 3.27Å; A61-T64 WeakPolarHBondContact O-CB 3.44Å; A61-T64 PolarHBondContact O-N 3.06Å; A61-T64 VanDerWaalsContact O-N 3.13Å; K62-T64 VanDerWaalsContact C-N 3.33Å; T64-L66 VanDerWaalsContact C-N 3.35Å; T64-L66 PolarHBondContact O-N 3.4Å; T64-A67 WeakPolarHBondContact O-CB 3.36Å; T64-A67 PolarHBondContact O-N 3.3Å; T64-E68 WeakPolarHBondContact O-CG 3.27Å; T64-E68 PolarHBondContact O-N 3.46Å
65E94.4Very high88.4Confident135 Ų13572.2 Ų72.263%0.63140%0.396SS*.Hα-helixtrans-61.3-43176.6-173.1179.9-176.100111.2A61 K62 A67 E68 A69A61-E65 WeakPolarHBondContact O-CB 3.31Å; A61-E65 PolarHBondContact O-N 3.46Å; K62-E65 PolarHBondContact O-N 3.37Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 2.98Å; E65-E68 PolarHBondContact O-N 2.98Å; E65-A69 WeakPolarHBondContact O-CB 3.45Å; E65-A69 PolarHBondContact O-N 3.39Å
66L95.4Very high89.5Confident80 Ų8077.6 Ų77.642%0.41941%0.412SS..Hα-helixtrans-61.7-41.4175.1-176.264.2000111.9K62 T64 E68 A69 T70 L94K62-L66 WeakPolarHBondContact O-CB 3.45Å; K62-L66 PolarHBondContact O-N 2.87Å; T64-L66 VanDerWaalsContact C-N 3.35Å; T64-L66 PolarHBondContact O-N 3.4Å; L66-E68 VanDerWaalsContact C-N 3.34Å; L66-E68 PolarHBondContact O-N 3.05Å; L66-A69 PolarHBondContact O-N 3.5Å; L66-T70 WeakPolarHBondContact O-CB 3.48Å; L66-T70 PolarHBondContact O-N 3.48Å; L66-T70 PolarHBondContact O-OG1 3.34Å; L66-L94 HydrophobicContact CB-CD1 4.12Å; L66-L94 HydrophobicContact CD2-CD1 3.79Å; L66-L94 HydrophobicContact CD2-CD2 4.33Å; L66-L94 HydrophobicContact CG-CD1 3.7Å
67A95.9Very high90.7Very high0 Ų076.7 Ų76.70%041%0.405CS..Hα-helixtrans-63.6-40.4176.200000111.8M63 T64 E65 T70 L71 A91 L94 R95M63-A67 WeakPolarHBondContact O-CB 3.49Å; M63-A67 PolarHBondContact O-N 2.94Å; T64-A67 WeakPolarHBondContact O-CB 3.36Å; T64-A67 PolarHBondContact O-N 3.3Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 2.98Å; A67-T70 PolarHBondContact O-N 2.97Å; A67-L71 WeakPolarHBondContact O-CG 3.32Å; A67-L71 PolarHBondContact O-N 2.95Å; A67-A91 HydrophobicContact CB-CB 4.35Å; A67-A91 WeakPolarHBondContact O-CB 3.46Å; A67-L94 HydrophobicContact CB-CB 3.8Å; A67-L94 HydrophobicContact CB-CD1 4.09Å; A67-R95 HydrophobicContact CB-CG 3.93Å
68E96.6Very high91.4Very high93 Ų9374.8 Ų74.844%0.43540%0.403SS..Hα-helixtrans-67.6-44.5177.2-72.7171.5175.600112.1T64 E65 L66 T70 L71 Q72T64-E68 WeakPolarHBondContact O-CG 3.27Å; T64-E68 PolarHBondContact O-N 3.46Å; E65-E68 PolarHBondContact O-N 2.98Å; L66-E68 VanDerWaalsContact C-N 3.34Å; L66-E68 PolarHBondContact O-N 3.05Å; E68-T70 VanDerWaalsContact C-N 3.28Å; E68-T70 PolarHBondContact O-N 3.46Å; E68-L71 PolarHBondContact O-N 2.76Å; E68-Q72 WeakPolarHBondContact O-CG 3.38Å; E68-Q72 PolarHBondContact O-N 2.96Å
69A96.6Very high92.2Very high51 Ų5174.8 Ų74.842%0.42141%0.409SS..Hα-helixtrans-59.8-40.6174.300000111.6E65 L66 L71 Q72 M73E65-A69 WeakPolarHBondContact O-CB 3.45Å; E65-A69 PolarHBondContact O-N 3.39Å; L66-A69 PolarHBondContact O-N 3.5Å; A69-L71 PolarHBondContact O-N 3.34Å; A69-Q72 WeakPolarHBondContact O-CB 3.29Å; A69-Q72 PolarHBondContact O-N 3.15Å; A69-M73 PolarHBondContact O-N 2.69Å
70T95.5Very high92.5Very high12 Ų1271.6 Ų71.67%0.07441%0.409CS..Hα-helixtrans-63.6-40.1176.4-56.20000111.5L66 A67 E68 M73 A74 A87 Y90 A91L66-T70 WeakPolarHBondContact O-CB 3.48Å; L66-T70 PolarHBondContact O-N 3.48Å; L66-T70 PolarHBondContact O-OG1 3.34Å; A67-T70 PolarHBondContact O-N 2.97Å; E68-T70 VanDerWaalsContact C-N 3.28Å; E68-T70 PolarHBondContact O-N 3.46Å; T70-M73 HydrophobicContact CG2-CE 4.43Å; T70-M73 WeakPolarHBondContact O-CB 3.27Å; T70-M73 PolarHBondContact O-N 3.38Å; T70-A74 PolarHBondContact O-N 3.04Å; T70-A87 HydrophobicContact CG2-CB 3.89Å; T70-A87 WeakPolarHBondContact CG2-O 3.41Å; T70-Y90 HydrophobicContact CG2-CD1 3.76Å; T70-Y90 HydrophobicContact CG2-CG 4.48Å; T70-A91 HydrophobicContact CG2-CB 4.2Å
71L94.9Very high92.7Very high56 Ų5671.7 Ų71.729%0.29341%0.413SS..Hα-helixtrans-67.2-36.7174.3-73.3168.3000112.7A67 E68 A69 M73 A74 A75 A91 R95A67-L71 WeakPolarHBondContact O-CG 3.32Å; A67-L71 PolarHBondContact O-N 2.95Å; E68-L71 PolarHBondContact O-N 2.76Å; A69-L71 PolarHBondContact O-N 3.34Å; L71-M73 VanDerWaalsContact C-N 3.28Å; L71-M73 PolarHBondContact O-N 3.35Å; L71-A74 WeakPolarHBondContact O-CB 3.46Å; L71-A74 PolarHBondContact O-N 3.12Å; L71-A75 WeakPolarHBondContact O-CB 3.36Å; L71-A75 PolarHBondContact O-N 2.95Å; L71-A91 HydrophobicContact CD1-CB 4.09Å; L71-A91 HydrophobicContact CD2-CB 3.75Å; L71-A91 HydrophobicContact CG-CB 3.49Å; L71-A91 VanDerWaalsContact CG-CB 3.49Å; L71-R95 VanDerWaalsContact CD1-NH1 3.34Å; L71-R95 VanDerWaalsContact CD1-NH2 3.25Å
72Q95.3Very high92.8Very high122 Ų12276.9 Ų76.957%0.5743%0.428SS*.Hα-helixtrans-64.5-35.7173.9-69.7-177.613.800111.9E68 A69 K76E68-Q72 WeakPolarHBondContact O-CG 3.38Å; E68-Q72 PolarHBondContact O-N 2.96Å; A69-Q72 WeakPolarHBondContact O-CB 3.29Å; A69-Q72 PolarHBondContact O-N 3.15Å; Q72-K76 WeakPolarHBondContact O-CG 3.48Å; Q72-K76 PolarHBondContact O-N 2.85Å
73M92.6Very high92.8Very high91 Ų9175.3 Ų75.345%0.44843%0.425SS..Hα-helixtrans-64.4-47.2171.5-177.5-178.271.700110.8A69 T70 L71 A75 K76 A77 L83 A87A69-M73 PolarHBondContact O-N 2.69Å; T70-M73 HydrophobicContact CG2-CE 4.43Å; T70-M73 WeakPolarHBondContact O-CB 3.27Å; T70-M73 PolarHBondContact O-N 3.38Å; L71-M73 VanDerWaalsContact C-N 3.28Å; L71-M73 PolarHBondContact O-N 3.35Å; M73-A75 VanDerWaalsContact C-N 3.31Å; M73-A75 PolarHBondContact O-N 3.45Å; M73-K76 PolarHBondContact O-N 2.83Å; M73-K76 VanDerWaalsContact O-N 3.11Å; M73-A77 PolarHBondContact O-N 3.19Å; M73-A77 VanDerWaalsContact O-N 3.14Å; M73-L83 HydrophobicContact CE-CD1 4.09Å; M73-A87 HydrophobicContact CE-CB 3.61Å
74A92.5Very high92.8Very high7 Ų776.1 Ų76.16%0.05843%0.429CS..Hα-helixtrans-56.9-43.917700000111.9T70 L71 K76 A77 M84 A87T70-A74 PolarHBondContact O-N 3.04Å; L71-A74 WeakPolarHBondContact O-CB 3.46Å; L71-A74 PolarHBondContact O-N 3.12Å; A74-K76 PolarHBondContact O-N 3.14Å; A74-A77 WeakPolarHBondContact O-CB 3.36Å; A74-A77 PolarHBondContact O-N 2.92Å; A74-A77 VanDerWaalsContact O-N 3.14Å; A74-M84 HydrophobicContact CB-CG 4.43Å; A74-A87 HydrophobicContact CB-CB 3.73Å
75A92.4Very high92.7Very high89 Ų8979.7 Ų79.774%0.73644%0.443SS*.Hα-helixtrans-66.5-21.2179.900000114.1L71 M73L71-A75 WeakPolarHBondContact O-CB 3.36Å; L71-A75 PolarHBondContact O-N 2.95Å; M73-A75 VanDerWaalsContact C-N 3.31Å; M73-A75 PolarHBondContact O-N 3.45Å
76K93.6Very high92.5Very high175 Ų17575.4 Ų75.476%0.76143%0.427SS*.Hα-helixtrans-94.4-11.2176.3-68.7173.8-176.31760112.8Q72 M73 A74Q72-K76 WeakPolarHBondContact O-CG 3.48Å; Q72-K76 PolarHBondContact O-N 2.85Å; M73-K76 PolarHBondContact O-N 2.83Å; M73-K76 VanDerWaalsContact O-N 3.11Å; A74-K76 PolarHBondContact O-N 3.14Å
77A92Very high92.4Very high20 Ų2071.8 Ų71.817%0.16541%0.408CS..SBendtrans-73.3162.7176.700000111M73 A74 P79 L83 M84M73-A77 PolarHBondContact O-N 3.19Å; M73-A77 VanDerWaalsContact O-N 3.14Å; A74-A77 WeakPolarHBondContact O-CB 3.36Å; A74-A77 PolarHBondContact O-N 2.92Å; A74-A77 VanDerWaalsContact O-N 3.14Å; A77-P79 WeakPolarHBondContact O-CD 3.39Å; A77-L83 HydrophobicContact CB-CD2 4.39Å; A77-M84 HydrophobicContact CB-CB 4.11Å
78V88.9Confident92.2Very high108 Ų10873.7 Ų73.766%0.65542%0.424SS*.PPolyproline II helixtrans-61.2127.9174.4178.60000108.5G80 S81V78-G80 PolarHBondContact O-N 3.02Å; V78-S81 VanDerWaalsContact O-CB 3.26Å; V78-S81 WeakPolarHBondContact O-CB 3.42Å; V78-S81 PolarHBondContact O-N 3.28Å; V78-S81 PolarHBondContact O-OG 3.18Å
79P90.5Very high92.1Very high116 Ų11671.1 Ų71.175%0.75342%0.417SS*.THydrogen-bonded Turntrans-54.6128.5177.7-27.335.2000111.6A77 S81A77-P79 WeakPolarHBondContact O-CD 3.39Å; P79-S81 VanDerWaalsContact C-N 3.33Å
80G87.5Confident91.9Very high55 Ų5572.6 Ų72.657%0.56741%0.412SS*.THydrogen-bonded Turntrans79.49.1-178.100000115.1V78 M84V78-G80 PolarHBondContact O-N 3.02Å; G80-M84 VanDerWaalsContact N-CE 3.35Å
81S90.5Very high91.9Very high31 Ų3172.1 Ų72.122%0.21741%0.409CS..  trans-75148.9171.261.30000111.9V78 P79 L83 M84 E85V78-S81 VanDerWaalsContact O-CB 3.26Å; V78-S81 WeakPolarHBondContact O-CB 3.42Å; V78-S81 PolarHBondContact O-N 3.28Å; V78-S81 PolarHBondContact O-OG 3.18Å; P79-S81 VanDerWaalsContact C-N 3.33Å; S81-L83 PolarHBondContact O-N 3.02Å; S81-L83 VanDerWaalsContact O-N 3.17Å; S81-M84 VanDerWaalsContact O-CB 3.31Å; S81-M84 WeakPolarHBondContact O-CB 3.03Å; S81-M84 PolarHBondContact O-N 3.32Å; S81-M84 PolarHBondContact OG-N 3.04Å; S81-E85 PolarHBondContact O-N 2.73Å
82E89.8Confident91.9Very high165 Ų16572.1 Ų72.177%0.77142%0.417SS*.Hα-helixtrans-54.7-34.1173.8-66.9177.7179.800112.1E85 C86E82-E85 PolarHBondContact O-N 2.93Å; E82-C86 WeakPolarHBondContact O-CB 3.36Å; E82-C86 PolarHBondContact O-N 3.49Å
83L89.5Confident91.9Very high95 Ų9566.7 Ų66.750%0.49739%0.393SS..Hα-helixtrans-63.4-42174.9179.563000111.9M73 A77 S81 E85 A87M73-L83 HydrophobicContact CE-CD1 4.09Å; A77-L83 HydrophobicContact CB-CD2 4.39Å; S81-L83 PolarHBondContact O-N 3.02Å; S81-L83 VanDerWaalsContact O-N 3.17Å; L83-E85 VanDerWaalsContact C-N 3.35Å; L83-A87 WeakPolarHBondContact O-CB 3.35Å; L83-A87 PolarHBondContact O-N 2.91Å
84M91.6Very high92Very high57 Ų5763 Ų6328%0.28137%0.374SS..Hα-helixtrans-61.1-46.6177.8-175.1-168.176.900110.6A74 A77 G80 S81 A88A74-M84 HydrophobicContact CB-CG 4.43Å; A77-M84 HydrophobicContact CB-CB 4.11Å; G80-M84 VanDerWaalsContact N-CE 3.35Å; S81-M84 VanDerWaalsContact O-CB 3.31Å; S81-M84 WeakPolarHBondContact O-CB 3.03Å; S81-M84 PolarHBondContact O-N 3.32Å; S81-M84 PolarHBondContact OG-N 3.04Å; M84-A88 VanDerWaalsContact O-CB 3.3Å; M84-A88 WeakPolarHBondContact O-CB 3.34Å; M84-A88 PolarHBondContact O-N 3.17Å
85E89.9Confident92.1Very high116 Ų11668.2 Ų68.254%0.54239%0.393SS..Hα-helixtrans-67.9-43.9-179.4-64.6-176.8175.700112.1S81 E82 L83 A88 S89S81-E85 PolarHBondContact O-N 2.73Å; E82-E85 PolarHBondContact O-N 2.93Å; L83-E85 VanDerWaalsContact C-N 3.35Å; E85-A88 PolarHBondContact O-N 3.01Å; E85-S89 WeakPolarHBondContact O-CB 3.27Å; E85-S89 PolarHBondContact O-N 3.29Å; E85-S89 PolarHBondContact O-OG 3.12Å
86C91.7Very high92.2Very high45 Ų4565.9 Ų65.930%0.30437%0.373SS..Hα-helixtrans-63.5-46.5176.9179.40000111.3E82 S89 Y90 T220E82-C86 WeakPolarHBondContact O-CB 3.36Å; E82-C86 PolarHBondContact O-N 3.49Å; C86-S89 PolarHBondContact O-N 3.3Å; C86-Y90 WeakPolarHBondContact O-CB 3.26Å; C86-Y90 PolarHBondContact O-N 2.99Å; C86-T220 HydrophobicContact CB-CG2 4.14Å
87A93.1Very high92.3Very high3 Ų358.1 Ų58.13%0.02534%0.34CS..Hα-helixtrans-63.9-42.9177.800000111.9T70 M73 A74 L83 S89 Y90 A91T70-A87 HydrophobicContact CG2-CB 3.89Å; T70-A87 WeakPolarHBondContact CG2-O 3.41Å; M73-A87 HydrophobicContact CE-CB 3.61Å; A74-A87 HydrophobicContact CB-CB 3.73Å; L83-A87 WeakPolarHBondContact O-CB 3.35Å; L83-A87 PolarHBondContact O-N 2.91Å; A87-S89 VanDerWaalsContact C-N 3.33Å; A87-S89 PolarHBondContact O-N 3.45Å; A87-Y90 PolarHBondContact O-N 3.41Å; A87-A91 WeakPolarHBondContact O-CB 3.41Å; A87-A91 PolarHBondContact O-N 3.01Å
88A92.3Very high92.3Very high41 Ų4157.6 Ų57.634%0.33934%0.335SS..Hα-helixtrans-61.2-43.1175.100000111.8M84 E85 A91 A92M84-A88 VanDerWaalsContact O-CB 3.3Å; M84-A88 WeakPolarHBondContact O-CB 3.34Å; M84-A88 PolarHBondContact O-N 3.17Å; E85-A88 PolarHBondContact O-N 3.01Å; A88-A91 PolarHBondContact O-N 2.94Å; A88-A92 PolarHBondContact O-N 3.32Å
89S92.5Very high92.6Very high39 Ų3960.2 Ų60.227%0.27334%0.337SS..Hα-helixtrans-64.9-40.4176.7-59.10000112.2E85 C86 A87 A92 C93E85-S89 WeakPolarHBondContact O-CB 3.27Å; E85-S89 PolarHBondContact O-N 3.29Å; E85-S89 PolarHBondContact O-OG 3.12Å; C86-S89 PolarHBondContact O-N 3.3Å; A87-S89 VanDerWaalsContact C-N 3.33Å; A87-S89 PolarHBondContact O-N 3.45Å; S89-A92 PolarHBondContact O-N 3.44Å; S89-C93 WeakPolarHBondContact O-CB 3.33Å; S89-C93 PolarHBondContact O-N 3.11Å
90Y94.4Very high92.7Very high82 Ų8256.1 Ų56.132%0.32231%0.309SS..Hα-helixtrans-65.5-43177.6-175.8-128.6000111.7T70 C86 A87 A92 C93 L94 F216T70-Y90 HydrophobicContact CG2-CD1 3.76Å; T70-Y90 HydrophobicContact CG2-CG 4.48Å; C86-Y90 WeakPolarHBondContact O-CB 3.26Å; C86-Y90 PolarHBondContact O-N 2.99Å; A87-Y90 PolarHBondContact O-N 3.41Å; Y90-A92 VanDerWaalsContact C-N 3.33Å; Y90-A92 PolarHBondContact O-N 2.93Å; Y90-C93 WeakPolarHBondContact O-CB 3.45Å; Y90-C93 PolarHBondContact O-N 3.37Å; Y90-L94 HydrophobicContact CD1-CD1 4.19Å; Y90-L94 HydrophobicContact CE1-CD1 3.79Å; Y90-L94 HydrophobicContact CE1-CG 4.45Å; Y90-L94 HydrophobicContact CE2-CD1 4.37Å; Y90-L94 HydrophobicContact CE2-CD2 4.25Å; Y90-L94 HydrophobicContact CE2-CG 4.17Å; Y90-L94 WeakPolarHBondContact O-CG 3.41Å; Y90-L94 PolarHBondContact O-N 3.4Å; Y90-F216 VanDerWaalsContact CA-CE2 3.41Å; Y90-F216 HydrophobicContact CD2-CD1 4.46Å; Y90-F216 AromaticContact CD2-CE1 3.93Å; Y90-F216 HydrophobicContact CD2-CE1 3.93Å; Y90-F216 HydrophobicContact CD2-CE2 4.08Å; Y90-F216 AromaticContact CD2-CZ 3.73Å; Y90-F216 HydrophobicContact CD2-CZ 3.73Å; Y90-F216 HydrophobicContact CG-CE2 4.25Å; Y90-F216 HydrophobicContact CG-CZ 4.06Å
91A94.7Very high93Very high1 Ų154.3 Ų54.31%0.00829%0.287CS..Hα-helixtrans-63.1-38.9174.800000112.6A67 T70 L71 A87 A88 L94 R95A67-A91 HydrophobicContact CB-CB 4.35Å; A67-A91 WeakPolarHBondContact O-CB 3.46Å; T70-A91 HydrophobicContact CG2-CB 4.2Å; L71-A91 HydrophobicContact CD1-CB 4.09Å; L71-A91 HydrophobicContact CD2-CB 3.75Å; L71-A91 HydrophobicContact CG-CB 3.49Å; L71-A91 VanDerWaalsContact CG-CB 3.49Å; A87-A91 WeakPolarHBondContact O-CB 3.41Å; A87-A91 PolarHBondContact O-N 3.01Å; A88-A91 PolarHBondContact O-N 2.94Å; A91-L94 PolarHBondContact O-N 3.46Å; A91-R95 WeakPolarHBondContact O-CG 3.47Å; A91-R95 PolarHBondContact O-N 3.4Å
92A93.9Very high93Very high57 Ų5758.3 Ų58.347%0.47130%0.301SS..Hα-helixtrans-63.7-42.4174.600000111.6A88 S89 Y90 R95 A96A88-A92 PolarHBondContact O-N 3.32Å; S89-A92 PolarHBondContact O-N 3.44Å; Y90-A92 VanDerWaalsContact C-N 3.33Å; Y90-A92 PolarHBondContact O-N 2.93Å; A92-R95 PolarHBondContact O-N 3.39Å; A92-A96 WeakPolarHBondContact O-CB 3.26Å; A92-A96 PolarHBondContact O-N 3.26Å
93C95.2Very high93.1Very high8 Ų853.3 Ų53.35%0.05428%0.284CS..Hα-helixtrans-56.5-52.3173.9172.90000111.6S89 Y90 R95 A96 I97 I212 F216S89-C93 WeakPolarHBondContact O-CB 3.33Å; S89-C93 PolarHBondContact O-N 3.11Å; Y90-C93 WeakPolarHBondContact O-CB 3.45Å; Y90-C93 PolarHBondContact O-N 3.37Å; C93-R95 VanDerWaalsContact C-N 3.34Å; C93-R95 PolarHBondContact O-N 3.04Å; C93-A96 WeakPolarHBondContact O-CB 3.47Å; C93-A96 PolarHBondContact O-N 2.9Å; C93-A96 VanDerWaalsContact O-N 3.16Å; C93-I97 WeakPolarHBondContact O-CG1 3.38Å; C93-I97 PolarHBondContact O-N 3.26Å; C93-I212 HydrophobicContact CB-CG2 4.37Å; C93-F216 HydrophobicContact CB-CB 4.1Å; C93-F216 HydrophobicContact CB-CD2 4.36Å; C93-F216 HydrophobicContact CB-CG 4.28Å
94L95.4Very high93.3Very high12 Ų1249 Ų496%0.06326%0.262CS..Hα-helixtrans-58.4-44.6178.2-69.5173.4000112.1L66 A67 Y90 A91 A96 I97 V98L66-L94 HydrophobicContact CB-CD1 4.12Å; L66-L94 HydrophobicContact CD2-CD1 3.79Å; L66-L94 HydrophobicContact CD2-CD2 4.33Å; L66-L94 HydrophobicContact CG-CD1 3.7Å; A67-L94 HydrophobicContact CB-CB 3.8Å; A67-L94 HydrophobicContact CB-CD1 4.09Å; Y90-L94 HydrophobicContact CD1-CD1 4.19Å; Y90-L94 HydrophobicContact CE1-CD1 3.79Å; Y90-L94 HydrophobicContact CE1-CG 4.45Å; Y90-L94 HydrophobicContact CE2-CD1 4.37Å; Y90-L94 HydrophobicContact CE2-CD2 4.25Å; Y90-L94 HydrophobicContact CE2-CG 4.17Å; Y90-L94 WeakPolarHBondContact O-CG 3.41Å; Y90-L94 PolarHBondContact O-N 3.4Å; A91-L94 PolarHBondContact O-N 3.46Å; L94-A96 VanDerWaalsContact C-N 3.33Å; L94-A96 PolarHBondContact O-N 2.98Å; L94-I97 PolarHBondContact O-N 2.89Å; L94-V98 WeakPolarHBondContact O-CG2 3.44Å; L94-V98 PolarHBondContact O-N 3.35Å
95R94.3Very high93.4Very high118 Ų11847.3 Ų47.345%0.44526%0.255SS..Hα-helixtrans-63.6-37176.9-75.3175.5172.2178.1-2.9112.8A67 L71 A91 A92 C93 V98 K99A67-R95 HydrophobicContact CB-CG 3.93Å; L71-R95 VanDerWaalsContact CD1-NH1 3.34Å; L71-R95 VanDerWaalsContact CD1-NH2 3.25Å; A91-R95 WeakPolarHBondContact O-CG 3.47Å; A91-R95 PolarHBondContact O-N 3.4Å; A92-R95 PolarHBondContact O-N 3.39Å; C93-R95 VanDerWaalsContact C-N 3.34Å; C93-R95 PolarHBondContact O-N 3.04Å; R95-V98 PolarHBondContact O-N 2.97Å; R95-K99 WeakPolarHBondContact O-CB 3.38Å; R95-K99 PolarHBondContact O-N 3.49Å
96A94.8Very high93.4Very high39 Ų3944.4 Ų44.432%0.32225%0.251SS..Hα-helixtrans-64.6-42.7176.100000111.4A92 C93 L94 K99 L100 I212A92-A96 WeakPolarHBondContact O-CB 3.26Å; A92-A96 PolarHBondContact O-N 3.26Å; C93-A96 WeakPolarHBondContact O-CB 3.47Å; C93-A96 PolarHBondContact O-N 2.9Å; C93-A96 VanDerWaalsContact O-N 3.16Å; L94-A96 VanDerWaalsContact C-N 3.33Å; L94-A96 PolarHBondContact O-N 2.98Å; A96-K99 PolarHBondContact O-N 2.83Å; A96-L100 WeakPolarHBondContact O-CB 2.91Å; A96-L100 PolarHBondContact O-N 3.28Å; A96-I212 HydrophobicContact CB-CD1 4.09Å; A96-I212 HydrophobicContact CB-CG2 4.13Å
97I94.9Very high93.6Very high12 Ų1244.8 Ų44.86%0.06225%0.248CC..Hα-helixtrans-62.3-46175.6-66.1169.6000111M63 C93 L94 K99 L100 S101 V209 I212 L213M63-I97 HydrophobicContact SD-CG2 3.89Å; C93-I97 WeakPolarHBondContact O-CG1 3.38Å; C93-I97 PolarHBondContact O-N 3.26Å; L94-I97 PolarHBondContact O-N 2.89Å; I97-K99 PolarHBondContact O-N 3.47Å; I97-L100 PolarHBondContact O-N 3.42Å; I97-S101 PolarHBondContact O-N 2.85Å; I97-V209 HydrophobicContact CD1-CG1 4.21Å; I97-V209 HydrophobicContact CG1-CG1 4.36Å; I97-V209 HydrophobicContact CG1-CG2 4.48Å; I97-V209 HydrophobicContact CG2-CG2 4.18Å; I97-I212 HydrophobicContact CD1-CG2 4.4Å; I97-I212 HydrophobicContact CG1-CB 4.49Å; I97-I212 HydrophobicContact CG1-CD1 4.33Å; I97-I212 HydrophobicContact CG1-CG2 3.98Å; I97-L213 HydrophobicContact CD1-CD2 4Å; I97-L213 HydrophobicContact CD1-CG 4.15Å
98V93.7Very high93.7Very high9 Ų944.7 Ų44.76%0.05525%0.247CC..Hα-helixtrans-60.8-44.3176.71720000111.4E60 M63 L94 R95 L100 S101 K102E60-V98 HydrophobicContact CB-CG1 4.26Å; M63-V98 HydrophobicContact CB-CG2 3.44Å; M63-V98 VanDerWaalsContact CB-CG2 3.44Å; M63-V98 HydrophobicContact CG-CG2 4.47Å; M63-V98 HydrophobicContact SD-CG2 4.32Å; L94-V98 WeakPolarHBondContact O-CG2 3.44Å; L94-V98 PolarHBondContact O-N 3.35Å; R95-V98 PolarHBondContact O-N 2.97Å; V98-L100 VanDerWaalsContact C-N 3.31Å; V98-L100 PolarHBondContact O-N 3.5Å; V98-S101 WeakPolarHBondContact O-CB 3.44Å; V98-S101 PolarHBondContact O-N 3.16Å; V98-K102 HydrophobicContact CG1-CD 4.36Å; V98-K102 WeakPolarHBondContact O-CG 3.44Å; V98-K102 PolarHBondContact O-N 3.4Å
99K93.8Very high93.7Very high164 Ų16447.2 Ų47.271%0.71325%0.248SC*.Hα-helixtrans-61-41.5177.7-175.8-179.6177.8-176.40111.6R95 A96 I97 S103R95-K99 WeakPolarHBondContact O-CB 3.38Å; R95-K99 PolarHBondContact O-N 3.49Å; A96-K99 PolarHBondContact O-N 2.83Å; I97-K99 PolarHBondContact O-N 3.47Å; K99-S103 PolarHBondContact O-N 3.29Å; K99-S103 VanDerWaalsContact O-N 3.16Å
100L93.9Very high93.7Very high29 Ų2951.6 Ų51.615%0.15227%0.265CS..Hα-helixtrans-65-45.3176.4178.367.9000111.5A96 I97 V98 K102 S103 I104 Y205 T208 V209 I212A96-L100 WeakPolarHBondContact O-CB 2.91Å; A96-L100 PolarHBondContact O-N 3.28Å; I97-L100 PolarHBondContact O-N 3.42Å; V98-L100 VanDerWaalsContact C-N 3.31Å; V98-L100 PolarHBondContact O-N 3.5Å; L100-K102 PolarHBondContact O-N 3.15Å; L100-S103 WeakPolarHBondContact O-CB 3.29Å; L100-S103 PolarHBondContact O-N 3.11Å; L100-I104 HydrophobicContact CD1-CG1 4.09Å; L100-I104 HydrophobicContact CG-CG1 4.39Å; L100-I104 WeakPolarHBondContact O-CG1 3.47Å; L100-I104 PolarHBondContact O-N 2.9Å; L100-Y205 HydrophobicContact CD2-CD2 3.93Å; L100-Y205 HydrophobicContact CD2-CE2 4.24Å; L100-Y205 HydrophobicContact CG-CD2 3.92Å; L100-Y205 HydrophobicContact CG-CE2 4.28Å; L100-T208 HydrophobicContact CD1-CG2 4.24Å; L100-T208 HydrophobicContact CD2-CG2 3.72Å; L100-V209 HydrophobicContact CD2-CG2 3.79Å; L100-I212 HydrophobicContact CD2-CD1 4.29Å
101S92.6Very high93.7Very high17 Ų1750.6 Ų50.612%0.11927%0.265CS..Hα-helixtrans-53.4-52.8176.1-179.10000111.1E60 I97 V98 S103 I104 S105E60-S101 VanDerWaalsContact OE1-CB 3.28Å; E60-S101 WeakPolarHBondContact OE1-CB 3.47Å; E60-S101 PolarHBondContact OE1-OG 3.41Å; I97-S101 PolarHBondContact O-N 2.85Å; V98-S101 WeakPolarHBondContact O-CB 3.44Å; V98-S101 PolarHBondContact O-N 3.16Å; S101-S103 VanDerWaalsContact C-N 3.3Å; S101-S103 PolarHBondContact O-N 2.98Å; S101-I104 PolarHBondContact O-N 3.22Å; S101-S105 WeakPolarHBondContact O-CB 3.29Å; S101-S105 PolarHBondContact O-N 2.94Å; S101-S105 PolarHBondContact O-OG 2.98Å; S101-S105 VanDerWaalsContact O-OG 3.12Å
102K91.4Very high93.8Very high115 Ų11550.6 Ų50.650%0.526%0.264SS..Hα-helixtrans-56.7-42.9177.7-72.1-179.5178.5-178.60112.8E60 V98 L100 A106E60-K102 PolarHBondContact OE1-N 3.16Å; E60-K102 WeakPolarHBondContact OE2-CE 3.47Å; E60-K102 WeakPolarHBondContact OE2-CG 3.44Å; V98-K102 HydrophobicContact CG1-CD 4.36Å; V98-K102 WeakPolarHBondContact O-CG 3.44Å; V98-K102 PolarHBondContact O-N 3.4Å; L100-K102 PolarHBondContact O-N 3.15Å; K102-A106 WeakPolarHBondContact O-CB 3.47Å; K102-A106 PolarHBondContact O-N 2.93Å
103S92.7Very high93.8Very high60 Ų6048.2 Ų48.242%0.4224%0.244SC..Hα-helixtrans-64.4-47.1178.9-168.80000111.7K99 L100 S101 A106 E107K99-S103 PolarHBondContact O-N 3.29Å; K99-S103 VanDerWaalsContact O-N 3.16Å; L100-S103 WeakPolarHBondContact O-CB 3.29Å; L100-S103 PolarHBondContact O-N 3.11Å; S101-S103 VanDerWaalsContact C-N 3.3Å; S101-S103 PolarHBondContact O-N 2.98Å; S103-A106 PolarHBondContact O-N 2.82Å; S103-E107 WeakPolarHBondContact O-CG 3.32Å; S103-E107 PolarHBondContact O-N 3.38Å
104I93.4Very high93.7Very high5 Ų550 Ų503%0.02626%0.256CS..Hα-helixtrans-68.3-41.6-179.1-67.4-68000110.9L100 S101 A106 E107 I108 Y201 K204 Y205L100-I104 HydrophobicContact CD1-CG1 4.09Å; L100-I104 HydrophobicContact CG-CG1 4.39Å; L100-I104 WeakPolarHBondContact O-CG1 3.47Å; L100-I104 PolarHBondContact O-N 2.9Å; S101-I104 PolarHBondContact O-N 3.22Å; I104-A106 VanDerWaalsContact C-N 3.29Å; I104-A106 PolarHBondContact O-N 2.94Å; I104-E107 PolarHBondContact O-N 3.24Å; I104-E107 VanDerWaalsContact O-N 3.14Å; I104-I108 HydrophobicContact CG2-CD1 3.67Å; I104-I108 HydrophobicContact CG2-CG1 4.25Å; I104-I108 WeakPolarHBondContact O-CG1 3.42Å; I104-I108 PolarHBondContact O-N 2.89Å; I104-Y201 HydrophobicContact CD1-CD1 4.44Å; I104-K204 HydrophobicContact CD1-CD 4.48Å; I104-Y205 HydrophobicContact CB-CD2 4.42Å; I104-Y205 HydrophobicContact CG1-CD2 4.17Å
105S92.1Very high93.7Very high21 Ų2153.3 Ų53.315%0.14727%0.272CS..Hα-helixtrans-59.3-40.2174.7-66.90000111.7S101 I108 R109S101-S105 WeakPolarHBondContact O-CB 3.29Å; S101-S105 PolarHBondContact O-N 2.94Å; S101-S105 PolarHBondContact O-OG 2.98Å; S101-S105 VanDerWaalsContact O-OG 3.12Å; S105-I108 PolarHBondContact O-N 2.73Å; S105-R109 WeakPolarHBondContact O-CB 3.45Å; S105-R109 VanDerWaalsContact O-CG 3.32Å; S105-R109 WeakPolarHBondContact O-CG 3.47Å; S105-R109 PolarHBondContact O-N 3.07Å
106A91.8Very high93.7Very high55 Ų5547.9 Ų47.946%0.45525%0.251SS..Hα-helixtrans-64-44.1173.500000112.2K102 S103 I104 I108 R109 Q110K102-A106 WeakPolarHBondContact O-CB 3.47Å; K102-A106 PolarHBondContact O-N 2.93Å; S103-A106 PolarHBondContact O-N 2.82Å; I104-A106 VanDerWaalsContact C-N 3.29Å; I104-A106 PolarHBondContact O-N 2.94Å; A106-I108 PolarHBondContact O-N 3.33Å; A106-R109 PolarHBondContact O-N 3.2Å; A106-Q110 WeakPolarHBondContact O-CB 3.5Å; A106-Q110 PolarHBondContact O-N 3.49Å
107E94.1Very high93.5Very high53 Ų5350 Ų5025%0.24826%0.256CS..Hα-helixtrans-62-41.6176-72.6-179.9174.700112.1S103 I104 Q110 N111 Y201S103-E107 WeakPolarHBondContact O-CG 3.32Å; S103-E107 PolarHBondContact O-N 3.38Å; I104-E107 PolarHBondContact O-N 3.24Å; I104-E107 VanDerWaalsContact O-N 3.14Å; E107-Q110 PolarHBondContact O-N 2.9Å; E107-N111 VanDerWaalsContact O-CB 3.27Å; E107-N111 WeakPolarHBondContact O-CB 3.22Å; E107-N111 PolarHBondContact O-N 3.44Å; E107-N111 PolarHBondContact O-ND2 3.2Å; E107-Y201 HydrophobicContact CB-CD1 4.24Å; E107-Y201 HydrophobicContact CB-CE1 3.83Å; E107-Y201 HydrophobicContact CB-CE2 4.44Å; E107-Y201 HydrophobicContact CG-CE1 4.37Å; E107-Y201 WeakPolarHBondContact OE2-CD1 3.48Å; E107-Y201 WeakPolarHBondContact OE2-CE1 3.37Å
108I95.4Very high93.3Very high1 Ų153.6 Ų53.61%0.00528%0.276CS..Hα-helixtrans-64.9-46.7176.7-70.4167.6000110.6I50 I104 S105 A106 Q110 V112 L113 F198 Y201 M202I50-I108 HydrophobicContact CG2-CG2 3.89Å; I104-I108 HydrophobicContact CG2-CD1 3.67Å; I104-I108 HydrophobicContact CG2-CG1 4.25Å; I104-I108 WeakPolarHBondContact O-CG1 3.42Å; I104-I108 PolarHBondContact O-N 2.89Å; S105-I108 PolarHBondContact O-N 2.73Å; A106-I108 PolarHBondContact O-N 3.33Å; I108-Q110 VanDerWaalsContact C-N 3.32Å; I108-Q110 PolarHBondContact O-N 3.23Å; I108-V112 HydrophobicContact CG2-CB 4.28Å; I108-V112 WeakPolarHBondContact O-CA 3.37Å; I108-V112 VanDerWaalsContact O-CB 3.26Å; I108-V112 WeakPolarHBondContact O-CB 3.49Å; I108-V112 PolarHBondContact O-N 2.87Å; I108-L113 HydrophobicContact CG2-CG 4.47Å; I108-L113 PolarHBondContact O-N 2.93Å; I108-F198 HydrophobicContact CD1-CD2 4.1Å; I108-F198 HydrophobicContact CD1-CE2 3.95Å; I108-F198 HydrophobicContact CG1-CD2 4.28Å; I108-F198 HydrophobicContact CG2-CD2 3.93Å; I108-F198 HydrophobicContact CG2-CE2 4.15Å; I108-Y201 HydrophobicContact CG1-CD2 3.91Å; I108-Y201 HydrophobicContact CG1-CG 4.08Å; I108-M202 HydrophobicContact CD1-SD 3.87Å
109R93.6Very high93.3Very high94 Ų9453.4 Ų53.436%0.35528%0.275SS..Iπ-helixtrans-57.8-46176.9-75.4176.7-172.4-79-4.9111.5D51 S54 C55 S105 A106 L113 S114D51-R109 IonicContact OD1-CZ 2.71Å; D51-R109 IonicContact OD1-NH1 2.86Å; D51-R109 PolarHBondContact OD1-NH1 2.89Å; D51-R109 IonicContact OD1-NH2 3.72Å; S54-R109 PolarHBondContact O-NH2 3.25Å; C55-R109 PolarHBondContact SG-NH2 3.35Å; S105-R109 WeakPolarHBondContact O-CB 3.45Å; S105-R109 VanDerWaalsContact O-CG 3.32Å; S105-R109 WeakPolarHBondContact O-CG 3.47Å; S105-R109 PolarHBondContact O-N 3.07Å; A106-R109 PolarHBondContact O-N 3.2Å; R109-L113 HydrophobicContact CG-CD1 3.98Å; R109-S114 PolarHBondContact O-N 3.21Å; R109-S114 VanDerWaalsContact O-N 3.11Å
110Q92.4Very high93.2Very high132 Ų13245.8 Ų45.862%0.61724%0.243SC*.Iπ-helixtrans-72-47.8-177.9-173.7177.4200112.7A106 E107 I108 S114A106-Q110 WeakPolarHBondContact O-CB 3.5Å; A106-Q110 PolarHBondContact O-N 3.49Å; E107-Q110 PolarHBondContact O-N 2.9Å; I108-Q110 VanDerWaalsContact C-N 3.32Å; I108-Q110 PolarHBondContact O-N 3.23Å; Q110-S114 PolarHBondContact O-OG 2.6Å
111N94.1Very high93.1Very high61 Ų6151.3 Ų51.333%0.32626%0.262SS..Iπ-helixtrans-99.9-15.8-166-60-43.7000113.9E107 Q115 Y201E107-N111 VanDerWaalsContact O-CB 3.27Å; E107-N111 WeakPolarHBondContact O-CB 3.22Å; E107-N111 PolarHBondContact O-N 3.44Å; E107-N111 PolarHBondContact O-ND2 3.2Å; N111-Q115 WeakPolarHBondContact O-CG 3.43Å; N111-Y201 HydrophobicContact CB-CE2 4.04Å; N111-Y201 PolarHBondContact ND2-OH 3.27Å
112V96Very high93.2Very high0 Ų058.2 Ų58.20%029%0.292CS..Iπ-helixtrans-113.5-64179.4-176.60000110.4I108 S114 Q115 M116 T197 F198 Y201I108-V112 HydrophobicContact CG2-CB 4.28Å; I108-V112 WeakPolarHBondContact O-CA 3.37Å; I108-V112 VanDerWaalsContact O-CB 3.26Å; I108-V112 WeakPolarHBondContact O-CB 3.49Å; I108-V112 PolarHBondContact O-N 2.87Å; V112-S114 PolarHBondContact O-N 3.02Å; V112-Q115 PolarHBondContact O-N 3.39Å; V112-M116 HydrophobicContact CG1-CG 4.38Å; V112-M116 HydrophobicContact CG1-SD 3.7Å; V112-M116 WeakPolarHBondContact O-CB 3.33Å; V112-M116 WeakPolarHBondContact O-CG 3.49Å; V112-M116 PolarHBondContact O-N 2.98Å; V112-T197 HydrophobicContact CG2-CG2 3.89Å; V112-F198 HydrophobicContact CG1-CB 4.05Å; V112-F198 HydrophobicContact CG2-CB 4.2Å; V112-Y201 HydrophobicContact CG2-CD2 4.1Å; V112-Y201 HydrophobicContact CG2-CE2 4.17Å
113L95.2Very high93.3Very high7 Ų754.4 Ų54.44%0.03728%0.276CS..Iπ-helixtrans-64.2-47.9-170.6-70.2173.4000112.2H47 I50 D51 I108 R109 Q115 M116 L117H47-L113 PolarHBondContact CD2-O 2.79Å; H47-L113 PolarHBondContact NE2-O 3.33Å; H47-L113 WeakPolarHBondContact O-CD2 3.39Å; I50-L113 HydrophobicContact CB-CD2 3.8Å; I50-L113 HydrophobicContact CG2-CD1 4.33Å; I50-L113 HydrophobicContact CG2-CD2 3.62Å; I50-L113 HydrophobicContact CG2-CG 4.03Å; D51-L113 HydrophobicContact CB-CD1 3.82Å; D51-L113 HydrophobicContact CB-CD2 4.22Å; I108-L113 HydrophobicContact CG2-CG 4.47Å; I108-L113 PolarHBondContact O-N 2.93Å; R109-L113 HydrophobicContact CG-CD1 3.98Å; L113-Q115 PolarHBondContact O-N 3.32Å; L113-M116 PolarHBondContact O-N 3.11Å; L113-L117 PolarHBondContact O-N 3.37Å
114S93.1Very high93.5Very high45 Ų4552.7 Ų52.732%0.31526%0.261SS..Hα-helixtrans-58.1-35.5178.184.60000112.7R109 Q110 V112 N118R109-S114 PolarHBondContact O-N 3.21Å; R109-S114 VanDerWaalsContact O-N 3.11Å; Q110-S114 PolarHBondContact O-OG 2.6Å; V112-S114 PolarHBondContact O-N 3.02Å; S114-N118 PolarHBondContact O-ND2 3.22Å
115Q94Very high93.6Very high83 Ų8355.8 Ų55.839%0.38828%0.28SS..Hα-helixtrans-77.8-41.9-179-60.7-62.3-39.500111.1N111 V112 L113 L117 N118 N119 Y194N111-Q115 WeakPolarHBondContact O-CG 3.43Å; V112-Q115 PolarHBondContact O-N 3.39Å; L113-Q115 PolarHBondContact O-N 3.32Å; Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 3.37Å; Q115-N118 PolarHBondContact O-N 2.8Å; Q115-N119 PolarHBondContact O-N 3.47Å; Q115-Y194 HydrophobicContact CB-CD1 3.88Å; Q115-Y194 HydrophobicContact CB-CE1 3.4Å; Q115-Y194 HydrophobicContact CB-CE2 4.31Å; Q115-Y194 HydrophobicContact CG-CE1 4.13Å
116M95.1Very high93.8Very high4 Ų456.5 Ų56.52%0.0229%0.287CS..Hα-helixtrans-60.7-40.5174.6-77.1-177.953.500112.2L46 H47 I50 V112 L113 N118 N119 Q191 Y194L46-M116 HydrophobicContact CB-CE 4.2Å; L46-M116 HydrophobicContact CD2-CE 4.11Å; L46-M116 HydrophobicContact CG-CE 4Å; H47-M116 HydrophobicContact CB-CE 4.03Å; I50-M116 HydrophobicContact CD1-CE 4.23Å; I50-M116 HydrophobicContact CD1-SD 4.02Å; V112-M116 HydrophobicContact CG1-CG 4.38Å; V112-M116 HydrophobicContact CG1-SD 3.7Å; V112-M116 WeakPolarHBondContact O-CB 3.33Å; V112-M116 WeakPolarHBondContact O-CG 3.49Å; V112-M116 PolarHBondContact O-N 2.98Å; L113-M116 PolarHBondContact O-N 3.11Å; M116-N118 VanDerWaalsContact C-N 3.25Å; M116-N118 PolarHBondContact O-N 3.25Å; M116-N119 WeakPolarHBondContact O-CB 3.11Å; M116-N119 PolarHBondContact O-N 3.24Å; M116-Q191 PolarHBondContact SD-NE2 3.17Å; M116-Q191 VanDerWaalsContact SD-NE2 3.41Å; M116-Y194 HydrophobicContact CG-CD2 3.72Å; M116-Y194 HydrophobicContact CG-CG 3.92Å
117L91.1Very high94Very high82 Ų8253.9 Ų53.943%0.42927%0.266SS..Hα-helixtrans-60.8-36.4178.5-173.865.2000112.4L113 Q115L113-L117 PolarHBondContact O-N 3.37Å; Q115-L117 VanDerWaalsContact C-N 3.32Å; Q115-L117 PolarHBondContact O-N 3.37Å
118N90.4Very high94.1Very high88 Ų8856.9 Ų56.947%0.47128%0.278SS..Hα-helixtrans-88.5-14.3-179.7-68.7-46.3000113.3S114 Q115 M116 G120 R121S114-N118 PolarHBondContact O-ND2 3.22Å; Q115-N118 PolarHBondContact O-N 2.8Å; M116-N118 VanDerWaalsContact C-N 3.25Å; M116-N118 PolarHBondContact O-N 3.25Å; N118-G120 PolarHBondContact O-N 3.38Å; N118-G120 VanDerWaalsContact O-N 3.15Å; N118-R121 PolarHBondContact O-N 2.91Å
119N94.1Very high94.2Very high5 Ų563.6 Ų63.63%0.02731%0.307CS..THydrogen-bonded Turntrans-61.4118.4-177.9-172.227.2000111.2Q115 M116 R121 C187 R190 Q191 Y194Q115-N119 PolarHBondContact O-N 3.47Å; M116-N119 WeakPolarHBondContact O-CB 3.11Å; M116-N119 PolarHBondContact O-N 3.24Å; N119-R121 PolarHBondContact O-N 3.12Å; N119-C187 PolarHBondContact ND2-O 2.92Å; N119-R190 PolarHBondContact OD1-NE 3.08Å; N119-Q191 PolarHBondContact ND2-OE1 3.36Å; N119-Y194 HydrophobicContact CB-CE2 3.92Å
120G89.8Confident94.3Very high5 Ų560 Ų605%0.05230%0.295CS..THydrogen-bonded Turntrans72.514.1175.700000114N118 E123 Y124N118-G120 PolarHBondContact O-N 3.38Å; N118-G120 VanDerWaalsContact O-N 3.15Å; G120-E123 WeakPolarHBondContact CA-OE2 3.2Å; G120-Y124 WeakPolarHBondContact O-CB 3.43Å; G120-Y124 PolarHBondContact O-N 3.31Å
121R93.2Very high94.5Very high144 Ų14459.1 Ų59.154%0.54329%0.287SS..Hα-helixtrans-63-45.2-175.2177.9-177.3-106.3-163-2.8112N118 N119 T125N118-R121 PolarHBondContact O-N 2.91Å; N119-R121 PolarHBondContact O-N 3.12Å; R121-T125 PolarHBondContact O-N 3.33Å; R121-T125 PolarHBondContact O-OG1 2.86Å
122E94.2Very high94.6Very high162 Ų16260.7 Ų60.776%0.75729%0.292SS*.Hα-helixtrans-69.8-44.3180-65.4-176.4176.300110.4Y124 T125 A126E122-Y124 VanDerWaalsContact C-N 3.32Å; E122-Y124 PolarHBondContact O-N 2.95Å; E122-T125 WeakPolarHBondContact O-CA 3.1Å; E122-T125 WeakPolarHBondContact O-CB 3.43Å; E122-T125 PolarHBondContact O-N 3.1Å; E122-T125 VanDerWaalsContact O-N 3.09Å; E122-A126 PolarHBondContact O-N 2.98Å
123E94.7Very high94.6Very high36 Ų3662.8 Ų62.817%0.16831%0.306CS..Hα-helixtrans-63.6-38.8178.7-57.196.2135.800111.1F36 G120 A126 F127 E183 R190F36-E123 HydrophobicContact CZ-CB 3.91Å; G120-E123 WeakPolarHBondContact CA-OE2 3.2Å; E123-A126 PolarHBondContact O-N 3.34Å; E123-F127 VanDerWaalsContact O-CB 3.32Å; E123-F127 WeakPolarHBondContact O-CB 3.36Å; E123-F127 PolarHBondContact O-N 3.36Å; E123-E183 HydrophobicContact CB-CB 4.25Å; E123-E183 HydrophobicContact CG-CB 3.79Å; E123-E183 HydrophobicContact CG-CG 4.14Å; E123-R190 IonicContact OE1-CZ 3.43Å; E123-R190 IonicContact OE1-NH2 3.66Å; E123-R190 PolarHBondContact OE1-NH2 2.93Å
124Y95.1Very high94.6Very high24 Ų2462.5 Ų62.59%0.09431%0.305CS..Hα-helixtrans-68.9-34.8173.8-172.9-123.5000112.4F36 Q37 K40 G120 E122 F127 K128F36-Y124 HydrophobicContact CD1-CD2 4Å; F36-Y124 AromaticContact CE1-CD2 3.9Å; F36-Y124 HydrophobicContact CE1-CD2 3.9Å; Q37-Y124 PolarHBondContact NE2-OH 3.03Å; Q37-Y124 VanDerWaalsContact NE2-OH 3.07Å; Q37-Y124 PolarHBondContact OE1-OH 2.93Å; K40-Y124 HydrophobicContact CB-CD2 3.86Å; K40-Y124 HydrophobicContact CB-CE2 3.74Å; K40-Y124 HydrophobicContact CB-CG 4.38Å; K40-Y124 HydrophobicContact CD-CD1 4.14Å; K40-Y124 HydrophobicContact CD-CE1 4.43Å; K40-Y124 HydrophobicContact CD-CG 4.18Å; K40-Y124 HydrophobicContact CG-CD1 3.76Å; K40-Y124 HydrophobicContact CG-CD2 3.79Å; K40-Y124 HydrophobicContact CG-CE1 3.62Å; K40-Y124 HydrophobicContact CG-CE2 3.73Å; K40-Y124 HydrophobicContact CG-CG 3.83Å; G120-Y124 WeakPolarHBondContact O-CB 3.43Å; G120-Y124 PolarHBondContact O-N 3.31Å; E122-Y124 VanDerWaalsContact C-N 3.32Å; E122-Y124 PolarHBondContact O-N 2.95Å; Y124-F127 AromaticContact CD2-CD1 3.77Å; Y124-F127 HydrophobicContact CD2-CD1 3.77Å; Y124-F127 AromaticContact CE2-CD1 3.71Å; Y124-F127 HydrophobicContact CE2-CD1 3.71Å; Y124-F127 HydrophobicContact CE2-CE1 4.07Å; Y124-F127 WeakPolarHBondContact O-CB 3.32Å; Y124-F127 PolarHBondContact O-N 3.21Å; Y124-K128 HydrophobicContact CE1-CD 4.23Å; Y124-K128 HydrophobicContact CE1-CG 4.45Å; Y124-K128 HydrophobicContact CE2-CG 4.48Å; Y124-K128 PolarHBondContact O-N 3.28Å; Y124-K128 WeakPolarHBondContact OH-CE 3.44Å
125T95.7Very high94.7Very high69 Ų6965.3 Ų65.342%0.42331%0.312SS..Hα-helixtrans-65.2-43.8173.3-59.90000110.8R121 E122 K128 K129R121-T125 PolarHBondContact O-N 3.33Å; R121-T125 PolarHBondContact O-OG1 2.86Å; E122-T125 WeakPolarHBondContact O-CA 3.1Å; E122-T125 WeakPolarHBondContact O-CB 3.43Å; E122-T125 PolarHBondContact O-N 3.1Å; E122-T125 VanDerWaalsContact O-N 3.09Å; T125-K128 PolarHBondContact O-N 3.42Å; T125-K129 WeakPolarHBondContact O-CG 2.98Å; T125-K129 PolarHBondContact O-N 3.01Å
126A96.2Very high94.7Very high37 Ų3762.9 Ų62.931%0.30630%0.301SS..Hα-helixtrans-61.7-44.5173.200000111.3E122 E123 K128 K129 V130 V180E122-A126 PolarHBondContact O-N 2.98Å; E123-A126 PolarHBondContact O-N 3.34Å; A126-K128 PolarHBondContact O-N 2.97Å; A126-K129 WeakPolarHBondContact O-CB 3.35Å; A126-K129 PolarHBondContact O-N 3.43Å; A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 3.04Å; A126-V180 HydrophobicContact CB-CG1 4.49Å; A126-V180 HydrophobicContact CB-CG2 4.04Å
127F96.7Very high94.7Very high0 Ų062.8 Ų62.80%030%0.301CS..Hα-helixtrans-56.9-47.5175.8170.1-103.1000112.3L33 F36 Q37 E123 Y124 K129 V130 R131 L177 V180L33-F127 HydrophobicContact CD2-CE2 3.75Å; L33-F127 HydrophobicContact CD2-CZ 4.13Å; L33-F127 WeakPolarHBondContact O-CZ 3.34Å; F36-F127 HydrophobicContact CB-CD2 3.84Å; F36-F127 HydrophobicContact CB-CE1 4.45Å; F36-F127 HydrophobicContact CB-CE2 3.65Å; F36-F127 HydrophobicContact CB-CG 4.31Å; F36-F127 HydrophobicContact CB-CZ 3.98Å; F36-F127 HydrophobicContact CD1-CB 3.95Å; F36-F127 AromaticContact CD1-CD1 3.9Å; F36-F127 HydrophobicContact CD1-CD1 3.9Å; F36-F127 HydrophobicContact CD1-CD2 4.02Å; F36-F127 HydrophobicContact CD1-CE1 4.42Å; F36-F127 AromaticContact CD1-CG 3.67Å; F36-F127 HydrophobicContact CD1-CG 3.67Å; F36-F127 HydrophobicContact CD2-CD2 4.25Å; F36-F127 HydrophobicContact CE1-CB 3.91Å; F36-F127 HydrophobicContact CE1-CG 4.16Å; F36-F127 HydrophobicContact CG-CB 4.36Å; F36-F127 HydrophobicContact CG-CD1 4.42Å; F36-F127 AromaticContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CD2 3.76Å; F36-F127 HydrophobicContact CG-CE2 4.11Å; F36-F127 AromaticContact CG-CG 3.92Å; F36-F127 HydrophobicContact CG-CG 3.92Å; F36-F127 HydrophobicContact CZ-CB 4.25Å; Q37-F127 HydrophobicContact CB-CE1 4.25Å; Q37-F127 HydrophobicContact CB-CZ 4.32Å; E123-F127 VanDerWaalsContact O-CB 3.32Å; E123-F127 WeakPolarHBondContact O-CB 3.36Å; 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 3.71Å; Y124-F127 HydrophobicContact CE2-CD1 3.71Å; Y124-F127 HydrophobicContact CE2-CE1 4.07Å; Y124-F127 WeakPolarHBondContact O-CB 3.32Å; Y124-F127 PolarHBondContact O-N 3.21Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 2.94Å; F127-V130 PolarHBondContact O-N 3.13Å; F127-R131 WeakPolarHBondContact O-CB 3.44Å; F127-R131 PolarHBondContact O-N 3.33Å; F127-L177 HydrophobicContact CD2-CD1 4.1Å; F127-L177 HydrophobicContact CE2-CD1 4.14Å; F127-V180 HydrophobicContact CB-CG1 3.86Å
128K96.6Very high94.8Very high115 Ų11559.4 Ų59.450%0.528%0.284SS..Hα-helixtrans-59.3-43.4177.1-76.9-169-174.4177.30112Y124 T125 A126 Q132Y124-K128 HydrophobicContact CE1-CD 4.23Å; Y124-K128 HydrophobicContact CE1-CG 4.45Å; Y124-K128 HydrophobicContact CE2-CG 4.48Å; Y124-K128 PolarHBondContact O-N 3.28Å; Y124-K128 WeakPolarHBondContact OH-CE 3.44Å; T125-K128 PolarHBondContact O-N 3.42Å; A126-K128 PolarHBondContact O-N 2.97Å; K128-Q132 WeakPolarHBondContact O-CB 3.46Å; K128-Q132 PolarHBondContact O-N 3.15Å
129K97Very high95Very high142 Ų14255.5 Ų55.562%0.61726%0.263SS*.Hα-helixtrans-61.1-53.6178.1-72.1177-179.7178.20110.5T125 A126 F127 R131 Q132 S133T125-K129 WeakPolarHBondContact O-CG 2.98Å; T125-K129 PolarHBondContact O-N 3.01Å; A126-K129 WeakPolarHBondContact O-CB 3.35Å; A126-K129 PolarHBondContact O-N 3.43Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 2.94Å; K129-R131 PolarHBondContact O-N 3.2Å; K129-Q132 PolarHBondContact O-N 3.26Å; K129-S133 PolarHBondContact O-N 3.47Å; K129-S133 PolarHBondContact O-OG 3.24Å
130V96.1Very high94.8Very high19 Ų1957 Ų5712%0.11527%0.271CS..Hα-helixtrans-63.8-41.9-179.3174.90000111.8A126 F127 Q132 S133 L134 A176 L177 V180A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 3.04Å; F127-V130 PolarHBondContact O-N 3.13Å; V130-Q132 VanDerWaalsContact C-N 3.27Å; V130-Q132 PolarHBondContact O-N 3.02Å; V130-S133 PolarHBondContact O-N 3.45Å; V130-L134 VanDerWaalsContact O-CB 3.32Å; V130-L134 WeakPolarHBondContact O-CB 3.39Å; V130-L134 PolarHBondContact O-N 3Å; V130-A176 HydrophobicContact CG1-CB 4.11Å; V130-A176 HydrophobicContact CG2-CB 4.09Å; V130-L177 HydrophobicContact CG1-CB 3.7Å; V130-L177 HydrophobicContact CG1-CD1 4.29Å; V130-V180 HydrophobicContact CG2-CG2 4.08Å
131R96.3Very high94.9Very high114 Ų11456.9 Ų56.943%0.4327%0.269SS..Hα-helixtrans-57.1-42.4175178.6176.9179.7-170.30.8111.6L33 Q37 F127 K129 K135L33-R131 HydrophobicContact CD2-CB 4.06Å; L33-R131 HydrophobicContact CD2-CG 3.93Å; Q37-R131 VanDerWaalsContact OE1-NH1 3.08Å; F127-R131 WeakPolarHBondContact O-CB 3.44Å; F127-R131 PolarHBondContact O-N 3.33Å; K129-R131 PolarHBondContact O-N 3.2Å; R131-K135 WeakPolarHBondContact O-CB 3.29Å; R131-K135 PolarHBondContact O-N 2.96Å; R131-K135 VanDerWaalsContact O-N 3.11Å
132Q96.2Very high94.8Very high93 Ų9350.2 Ų50.244%0.43524%0.244SC..Hα-helixtrans-71.5-40.6178.1-176.354.354.600112K128 K129 V130 K135 N136K128-Q132 WeakPolarHBondContact O-CB 3.46Å; K128-Q132 PolarHBondContact O-N 3.15Å; K129-Q132 PolarHBondContact O-N 3.26Å; V130-Q132 VanDerWaalsContact C-N 3.27Å; V130-Q132 PolarHBondContact O-N 3.02Å; Q132-K135 PolarHBondContact O-N 2.91Å; Q132-N136 PolarHBondContact NE2-ND2 2.89Å; Q132-N136 PolarHBondContact NE2-OD1 3.49Å; Q132-N136 WeakPolarHBondContact O-CB 3.43Å; Q132-N136 VanDerWaalsContact O-CG 3.24Å; Q132-N136 PolarHBondContact O-N 2.73Å; Q132-N136 PolarHBondContact O-ND2 3.32Å
133S95.7Very high94.6Very high44 Ų4443.6 Ų43.631%0.30821%0.213SC..Hα-helixtrans-63.6-45175.6-64.40000112K129 V130 K135 N136 A137 E173K129-S133 PolarHBondContact O-N 3.47Å; K129-S133 PolarHBondContact O-OG 3.24Å; V130-S133 PolarHBondContact O-N 3.45Å; S133-K135 PolarHBondContact O-N 3.35Å; S133-N136 CarbonylContact O-C 3.58Å; S133-N136 WeakPolarHBondContact O-CB 3.29Å; S133-N136 PolarHBondContact O-N 3.3Å; S133-N136 VanDerWaalsContact O-N 3.11Å; S133-A137 WeakPolarHBondContact O-CB 3.44Å; S133-A137 PolarHBondContact O-N 3.22Å; S133-E173 WeakPolarHBondContact CB-OE2 3.43Å
134L95.8Very high94.2Very high1 Ų143 Ų431%0.00521%0.21CC..Hα-helixtrans-60.9-43.3175.6-176.362.2000111.8L25 T29 V130 N136 A137 V138 F170 E173 K174 L177L25-L134 HydrophobicContact CD1-CD2 4.24Å; L25-L134 HydrophobicContact CD2-CD2 4.3Å; L25-L134 HydrophobicContact CD2-CG 4.4Å; T29-L134 HydrophobicContact CG2-CD2 3.91Å; V130-L134 VanDerWaalsContact O-CB 3.32Å; V130-L134 WeakPolarHBondContact O-CB 3.39Å; V130-L134 PolarHBondContact O-N 3Å; L134-N136 VanDerWaalsContact C-N 3.29Å; L134-N136 PolarHBondContact O-N 3.34Å; L134-A137 PolarHBondContact O-N 3.5Å; L134-V138 WeakPolarHBondContact O-CG2 3.37Å; L134-V138 PolarHBondContact O-N 2.84Å; L134-F170 HydrophobicContact CD1-CD2 3.76Å; L134-F170 HydrophobicContact CD1-CE2 3.61Å; L134-F170 HydrophobicContact CD1-CZ 4.47Å; L134-E173 HydrophobicContact CB-CB 4.23Å; L134-E173 HydrophobicContact CD1-CB 4.02Å; L134-K174 HydrophobicContact CD1-CB 4.33Å; L134-L177 HydrophobicContact CD2-CD2 4.05Å
135K94.7Very high93.8Very high105 Ų10546.5 Ų46.546%0.45722%0.223SC..Hα-helixtrans-60.3-40.1174.4-177.7177.9-179.2177.50111.9R131 Q132 S133 L139R131-K135 WeakPolarHBondContact O-CB 3.29Å; R131-K135 PolarHBondContact O-N 2.96Å; R131-K135 VanDerWaalsContact O-N 3.11Å; Q132-K135 PolarHBondContact O-N 2.91Å; S133-K135 PolarHBondContact O-N 3.35Å; K135-L139 WeakPolarHBondContact O-CG 3.13Å; K135-L139 PolarHBondContact O-N 2.83Å
136N94.7Very high93.3Very high31 Ų3144.5 Ų44.517%0.16621%0.209CC..Hα-helixtrans-68.3-41.8176.6-75.2-22.6000111.7R8 Q132 S133 L134 V138 L139 D140R8-N136 VanDerWaalsContact NH1-CG 3.28Å; R8-N136 PolarHBondContact NH1-ND2 3.4Å; Q132-N136 PolarHBondContact NE2-ND2 2.89Å; Q132-N136 PolarHBondContact NE2-OD1 3.49Å; Q132-N136 WeakPolarHBondContact O-CB 3.43Å; Q132-N136 VanDerWaalsContact O-CG 3.24Å; Q132-N136 PolarHBondContact O-N 2.73Å; Q132-N136 PolarHBondContact O-ND2 3.32Å; S133-N136 CarbonylContact O-C 3.58Å; S133-N136 WeakPolarHBondContact O-CB 3.29Å; S133-N136 PolarHBondContact O-N 3.3Å; S133-N136 VanDerWaalsContact O-N 3.11Å; L134-N136 VanDerWaalsContact C-N 3.29Å; L134-N136 PolarHBondContact O-N 3.34Å; N136-V138 VanDerWaalsContact C-N 3.34Å; N136-V138 PolarHBondContact O-N 3.42Å; N136-L139 WeakPolarHBondContact O-CB 3.43Å; N136-L139 PolarHBondContact O-N 3.32Å; N136-L139 VanDerWaalsContact O-N 3.15Å; N136-D140 VanDerWaalsContact O-CG 3.25Å; N136-D140 PolarHBondContact O-N 3.41Å
137A93.7Very high92.7Very high3 Ų348 Ų483%0.02522%0.217CC..Hα-helixtrans-62-40.3177.700000112S133 L134 L139 D140 M141 I169 F170 E173S133-A137 WeakPolarHBondContact O-CB 3.44Å; S133-A137 PolarHBondContact O-N 3.22Å; L134-A137 PolarHBondContact O-N 3.5Å; A137-L139 PolarHBondContact O-N 3.4Å; A137-D140 PolarHBondContact O-N 3.05Å; A137-M141 VanDerWaalsContact O-CB 3.27Å; A137-M141 WeakPolarHBondContact O-CB 3.37Å; A137-M141 PolarHBondContact O-N 3Å; A137-I169 HydrophobicContact CB-CG2 4.07Å; A137-F170 HydrophobicContact CB-CB 4.2Å; A137-F170 HydrophobicContact CB-CD2 4.44Å; A137-E173 HydrophobicContact CB-CG 4.23Å
138V94.1Very high91.6Very high10 Ų1051.4 Ų51.46%0.06123%0.232CC..Hα-helixtrans-58.7-47.1172.1169.90000111.3L25 L134 N136 D140 M141 D142 F170L25-V138 HydrophobicContact CD2-CG2 4.01Å; L134-V138 WeakPolarHBondContact O-CG2 3.37Å; L134-V138 PolarHBondContact O-N 2.84Å; N136-V138 VanDerWaalsContact C-N 3.34Å; N136-V138 PolarHBondContact O-N 3.42Å; V138-D140 VanDerWaalsContact C-N 3.33Å; V138-D140 PolarHBondContact O-N 3.16Å; V138-M141 PolarHBondContact O-N 2.91Å; V138-D142 WeakPolarHBondContact O-CB 3.42Å; V138-D142 VanDerWaalsContact O-CG 3.32Å; V138-D142 PolarHBondContact O-N 2.96Å; V138-F170 HydrophobicContact CG2-CD2 3.82Å; V138-F170 HydrophobicContact CG2-CE2 3.56Å
139L93.7Very high90.7Very high6 Ų649.4 Ų49.43%0.03123%0.233CC..Hα-helixtrans-63.4-39.3179.8-69.9168.4000112.5R8 T11 K12 Y15 K135 N136 A137 H143R8-L139 HydrophobicContact CB-CB 4.44Å; R8-L139 HydrophobicContact CB-CD1 4.11Å; R8-L139 HydrophobicContact CG-CB 4.01Å; R8-L139 HydrophobicContact CG-CD1 4.27Å; T11-L139 HydrophobicContact CG2-CD2 4.08Å; K12-L139 HydrophobicContact CG-CD1 4.48Å; K12-L139 HydrophobicContact CG-CD2 3.82Å; Y15-L139 HydrophobicContact CD2-CD2 4.42Å; Y15-L139 HydrophobicContact CE2-CD2 3.45Å; Y15-L139 VanDerWaalsContact CE2-CD2 3.45Å; K135-L139 WeakPolarHBondContact O-CG 3.13Å; K135-L139 PolarHBondContact O-N 2.83Å; N136-L139 WeakPolarHBondContact O-CB 3.43Å; N136-L139 PolarHBondContact O-N 3.32Å; N136-L139 VanDerWaalsContact O-N 3.15Å; A137-L139 PolarHBondContact O-N 3.4Å; L139-H143 VanDerWaalsContact O-CB 3.29Å; L139-H143 WeakPolarHBondContact O-CB 3.32Å; L139-H143 PolarHBondContact O-N 3Å
140D91.3Very high89.5Confident36 Ų3648.9 Ų48.919%0.19323%0.232CC..Hα-helixtrans-70.7-42.3-180-65.6-20.4000110.5R8 N136 A137 V138 H143 E144R8-D140 VanDerWaalsContact CG-OD1 3.27Å; R8-D140 WeakPolarHBondContact CG-OD1 3.46Å; R8-D140 IonicContact CZ-OD1 3.33Å; R8-D140 IonicContact CZ-OD2 3.87Å; R8-D140 IonicContact NE-OD1 2.87Å; R8-D140 PolarHBondContact NE-OD1 3.22Å; R8-D140 IonicContact NE-OD2 3.53Å; R8-D140 PolarHBondContact NE-OD2 2.92Å; R8-D140 IonicContact NH2-OD1 2.73Å; R8-D140 IonicContact NH2-OD2 3.56Å; R8-D140 PolarHBondContact NH2-OD2 3.4Å; N136-D140 VanDerWaalsContact O-CG 3.25Å; N136-D140 PolarHBondContact O-N 3.41Å; A137-D140 PolarHBondContact O-N 3.05Å; V138-D140 VanDerWaalsContact C-N 3.33Å; V138-D140 PolarHBondContact O-N 3.16Å; D140-H143 WeakPolarHBondContact O-CB 3.42Å; D140-H143 PolarHBondContact O-N 3.16Å; D140-E144 WeakPolarHBondContact O-CG 3.38Å; D140-E144 PolarHBondContact O-N 3.19Å
141M91.6Very high88Confident4 Ų451 Ų512%0.0225%0.248CC..Hα-helixtrans-63.5-46.4176-175.6-1757000112T23 A137 V138 H143 E144 R145 E167 F170T23-M141 HydrophobicContact CG2-CE 3.5Å; T23-M141 VanDerWaalsContact CG2-CE 3.5Å; T23-M141 WeakPolarHBondContact OG1-CE 3.48Å; A137-M141 VanDerWaalsContact O-CB 3.27Å; A137-M141 WeakPolarHBondContact O-CB 3.37Å; A137-M141 PolarHBondContact O-N 3Å; V138-M141 PolarHBondContact O-N 2.91Å; M141-H143 VanDerWaalsContact C-N 3.29Å; M141-H143 PolarHBondContact O-N 3.45Å; M141-E144 PolarHBondContact O-N 3.29Å; M141-R145 WeakPolarHBondContact O-CB 3.4Å; M141-R145 WeakPolarHBondContact O-CG 3.45Å; M141-R145 PolarHBondContact O-N 3.46Å; M141-E167 HydrophobicContact CG-CG 3.82Å; M141-E167 HydrophobicContact SD-CG 3.81Å; M141-F170 HydrophobicContact SD-CB 4.22Å; M141-F170 HydrophobicContact SD-CD1 4.39Å; M141-F170 HydrophobicContact SD-CG 4.21Å
142D91.1Very high86.1Confident3 Ų348.3 Ų48.32%0.01625%0.25CS..Hα-helixtrans-65.9-34.2177.7-71.7-9.3000111.8T11 Y15 I20 R22 T23 V138 F146T11-D142 HydrophobicContact CG2-CB 4.2Å; Y15-D142 HydrophobicContact CE1-CB 4.2Å; Y15-D142 PolarHBondContact OH-OD2 3.36Å; I20-D142 HydrophobicContact CG2-CB 4.05Å; R22-D142 WeakPolarHBondContact CA-OD2 3.3Å; T23-D142 VanDerWaalsContact CB-OD1 3.27Å; T23-D142 WeakPolarHBondContact CB-OD1 3.18Å; T23-D142 PolarHBondContact N-OD1 3.17Å; T23-D142 PolarHBondContact N-OD2 2.82Å; T23-D142 PolarHBondContact OG1-OD1 3.42Å; V138-D142 WeakPolarHBondContact O-CB 3.42Å; V138-D142 VanDerWaalsContact O-CG 3.32Å; V138-D142 PolarHBondContact O-N 2.96Å; D142-F146 WeakPolarHBondContact O-CB 3.49Å; D142-F146 PolarHBondContact O-N 3.26Å
143H89.7Confident84.1Confident24 Ų2449.7 Ų49.711%0.11127%0.27CS..Hα-helixtrans-61.6-49.7173-17371.1000112Y10 T11 L139 D140 M141 R145 F146 K147Y10-H143 AromaticContact CD1-CE1 3.97Å; T11-H143 WeakPolarHBondContact OG1-CB 3.47Å; T11-H143 PolarHBondContact OG1-ND1 3.27Å; L139-H143 VanDerWaalsContact O-CB 3.29Å; L139-H143 WeakPolarHBondContact O-CB 3.32Å; L139-H143 PolarHBondContact O-N 3Å; D140-H143 WeakPolarHBondContact O-CB 3.42Å; D140-H143 PolarHBondContact O-N 3.16Å; M141-H143 VanDerWaalsContact C-N 3.29Å; M141-H143 PolarHBondContact O-N 3.45Å; H143-R145 VanDerWaalsContact C-N 3.33Å; H143-R145 PolarHBondContact O-N 3.1Å; H143-F146 PolarHBondContact O-N 2.83Å; H143-K147 WeakPolarHBondContact O-CB 3.41Å; H143-K147 PolarHBondContact O-N 2.89Å
144E87.3Confident81.7Confident22 Ų2251.6 Ų51.610%0.10329%0.289CS..Hα-helixtrans-66-37.4-179.6-67.7-62.7135.800111.1D140 M141 K147 F148 T162D140-E144 WeakPolarHBondContact O-CG 3.38Å; D140-E144 PolarHBondContact O-N 3.19Å; M141-E144 PolarHBondContact O-N 3.29Å; E144-K147 PolarHBondContact O-N 2.89Å; E144-F148 WeakPolarHBondContact O-CB 3.39Å; E144-F148 PolarHBondContact O-N 3.41Å; E144-T162 WeakPolarHBondContact OE2-CB 3.45Å; E144-T162 PolarHBondContact OE2-OG1 3.11Å
145R84.8Confident79.4Confident98 Ų9859.2 Ų59.237%0.3732%0.324SS..Hα-helixtrans-61.1-46.6172.7-74.9175.2177-176.8-2.6112.4T23 M141 H143 F148 S149 E167T23-R145 PolarHBondContact OG1-NH1 3.19Å; M141-R145 WeakPolarHBondContact O-CB 3.4Å; M141-R145 WeakPolarHBondContact O-CG 3.45Å; M141-R145 PolarHBondContact O-N 3.46Å; H143-R145 VanDerWaalsContact C-N 3.33Å; H143-R145 PolarHBondContact O-N 3.1Å; R145-F148 PolarHBondContact O-N 2.8Å; R145-S149 PolarHBondContact O-N 2.99Å; R145-E167 IonicContact CZ-OE1 3.89Å; R145-E167 IonicContact NE-OE1 2.83Å; R145-E167 PolarHBondContact NE-OE1 3.16Å; R145-E167 IonicContact NH2-OE1 3.42Å; R145-E167 PolarHBondContact NH2-OE1 3.16Å
146F85.5Confident77.3Confident27 Ų2758.4 Ų58.412%0.11834%0.337CS..Hα-helixtrans-64.7-44.1177.2176-103.1000112.5Y10 R19 I20 D142 H143 F148 S149 H150Y10-F146 HydrophobicContact CE1-CE1 4.13Å; R19-F146 HydrophobicContact CB-CE2 4.35Å; R19-F146 WeakPolarHBondContact O-CD2 3.36Å; R19-F146 VanDerWaalsContact O-CE2 3.29Å; R19-F146 WeakPolarHBondContact O-CE2 3.11Å; I20-F146 HydrophobicContact CB-CD2 4.47Å; I20-F146 HydrophobicContact CD1-CB 3.65Å; I20-F146 HydrophobicContact CD1-CD1 3.83Å; I20-F146 HydrophobicContact CD1-CD2 3.99Å; I20-F146 HydrophobicContact CD1-CE1 4.46Å; I20-F146 HydrophobicContact CD1-CG 3.55Å; I20-F146 HydrophobicContact CG1-CB 3.68Å; I20-F146 HydrophobicContact CG1-CD1 4.09Å; I20-F146 HydrophobicContact CG1-CD2 3.3Å; I20-F146 HydrophobicContact CG1-CE2 3.83Å; I20-F146 HydrophobicContact CG1-CG 3.42Å; I20-F146 VanDerWaalsContact CG1-CG 3.42Å; I20-F146 HydrophobicContact CG1-CZ 4.46Å; I20-F146 HydrophobicContact CG2-CB 4.49Å; D142-F146 WeakPolarHBondContact O-CB 3.49Å; D142-F146 PolarHBondContact O-N 3.26Å; H143-F146 PolarHBondContact O-N 2.83Å; F146-F148 VanDerWaalsContact C-N 3.26Å; F146-F148 PolarHBondContact O-N 3.12Å; F146-S149 PolarHBondContact O-N 3.32Å; F146-S149 PolarHBondContact O-OG 2.98Å; F146-H150 AromaticContact CD2-CE1 3.36Å; F146-H150 WeakPolarHBondContact CD2-CE1 3.5Å; F146-H150 AromaticContact CD2-ND1 3.55Å; F146-H150 AromaticContact CE2-CE1 2.96Å; F146-H150 WeakPolarHBondContact CE2-CE1 2.96Å; F146-H150 AromaticContact CE2-ND1 3.47Å; F146-H150 WeakPolarHBondContact CE2-ND1 3.48Å; F146-H150 AromaticContact CE2-NE2 3.5Å; F146-H150 WeakPolarHBondContact CE2-NE2 3.36Å; F146-H150 AromaticContact CZ-CE1 3.55Å; F146-H150 AromaticContact CZ-ND1 3.81Å; F146-H150 AromaticContact CZ-NE2 3.73Å; F146-H150 PolarHBondContact O-N 3.49Å; F146-H150 PolarHBondContact O-ND1 3.28Å
147K83.4Confident75.4Confident111 Ų11167.5 Ų67.548%0.48337%0.371SS..Hα-helixtrans-58.3-44.3176.4-173.8-174.3173.9-162.50110.1H143 E144 H150 S151H143-K147 WeakPolarHBondContact O-CB 3.41Å; H143-K147 PolarHBondContact O-N 2.89Å; E144-K147 PolarHBondContact O-N 2.89Å; K147-H150 PolarHBondContact O-N 3.02Å; K147-S151 WeakPolarHBondContact O-CB 3.32Å; K147-S151 PolarHBondContact O-N 3.3Å; K147-S151 PolarHBondContact O-OG 3.18Å
148F75.3Confident73.5Confident72 Ų7275.1 Ų75.132%0.31641%0.405SS..Hα-helixtrans-63-46177.9-177.3-102.3000112.4E144 R145 F146 H150 S151 A152 P160E144-F148 WeakPolarHBondContact O-CB 3.39Å; E144-F148 PolarHBondContact O-N 3.41Å; R145-F148 PolarHBondContact O-N 2.8Å; F146-F148 VanDerWaalsContact C-N 3.26Å; F146-F148 PolarHBondContact O-N 3.12Å; F148-H150 PolarHBondContact O-N 3.36Å; F148-S151 PolarHBondContact O-N 3Å; F148-S151 VanDerWaalsContact O-N 3.15Å; F148-A152 PolarHBondContact O-N 3.04Å; F148-P160 HydrophobicContact CD2-CG 3.84Å; F148-P160 HydrophobicContact CE2-CG 4.29Å
149S76.1Confident71.9Confident73 Ų7378 Ų7851%0.5142%0.418SS..Hα-helixtrans-61.3-27.8179.264.30000113.4R145 F146R145-S149 PolarHBondContact O-N 2.99Å; F146-S149 PolarHBondContact O-N 3.32Å; F146-S149 PolarHBondContact O-OG 2.98Å
150H72.8Confident70.6Confident130 Ų13080 Ų8060%0.60243%0.431SS*.Hα-helixtrans-95.3-9.1179.2-6868.4000114.4F146 K147 F148F146-H150 AromaticContact CD2-CE1 3.36Å; F146-H150 WeakPolarHBondContact CD2-CE1 3.5Å; F146-H150 AromaticContact CD2-ND1 3.55Å; F146-H150 AromaticContact CE2-CE1 2.96Å; F146-H150 WeakPolarHBondContact CE2-CE1 2.96Å; F146-H150 AromaticContact CE2-ND1 3.47Å; F146-H150 WeakPolarHBondContact CE2-ND1 3.48Å; F146-H150 AromaticContact CE2-NE2 3.5Å; F146-H150 WeakPolarHBondContact CE2-NE2 3.36Å; F146-H150 AromaticContact CZ-CE1 3.55Å; F146-H150 AromaticContact CZ-ND1 3.81Å; F146-H150 AromaticContact CZ-NE2 3.73Å; F146-H150 PolarHBondContact O-N 3.49Å; F146-H150 PolarHBondContact O-ND1 3.28Å; K147-H150 PolarHBondContact O-N 3.02Å; F148-H150 PolarHBondContact O-N 3.36Å
151S65.2Low69.7Low64 Ų6486.6 Ų86.645%0.44846%0.461SS..Hα-helixtrans-108.34.4177.7470000113.6K147 F148 S153K147-S151 WeakPolarHBondContact O-CB 3.32Å; K147-S151 PolarHBondContact O-N 3.3Å; K147-S151 PolarHBondContact O-OG 3.18Å; F148-S151 PolarHBondContact O-N 3Å; F148-S151 VanDerWaalsContact O-N 3.15Å; S151-S153 PolarHBondContact O-N 3.4Å
152A55Low68.9Low58 Ų5889.9 Ų89.948%0.47948%0.482SS..THydrogen-bonded Turntrans-64.65.2-178.100000115.7F148 A154F148-A152 PolarHBondContact O-N 3.04Å; A152-A154 VanDerWaalsContact C-N 3.29Å; A152-A154 PolarHBondContact O-N 3.18Å
153S54Low68.1Low122 Ų12291.4 Ų91.485%0.85349%0.488SS*.THydrogen-bonded Turntrans-77.8-1.4175.858.80000114.9S151S151-S153 PolarHBondContact O-N 3.4Å
154A46Very low67.5Low84 Ų8496.7 Ų96.769%0.69451%0.507SS*.SBendtrans-140.9-14.6-175.700000119.3A152A152-A154 VanDerWaalsContact C-N 3.29Å; A152-A154 PolarHBondContact O-N 3.18Å
155Q48.4Very low67.6Low161 Ų16197.7 Ų97.775%0.75252%0.519SS*.  trans-146.963.3-172.5-68.7-174.2-18.100113.9Y157Q155-Y157 VanDerWaalsContact C-N 3.27Å; Q155-Y157 PolarHBondContact O-N 3.19Å
156A50.4Low67.7Low88 Ų8893.5 Ų93.573%0.72750%0.504SS*.THydrogen-bonded Turntrans-72.3-3.4-172.900000116.5
157Y54.2Low67.9Low222 Ų22294.7 Ų94.787%0.87151%0.51SS*.THydrogen-bonded Turntrans-106.8-10.6-171.7-81.9-84.6000116.2Q155Q155-Y157 VanDerWaalsContact C-N 3.27Å; Q155-Y157 PolarHBondContact O-N 3.19Å
158H54.4Low68.4Low163 Ų16395.4 Ų95.476%0.75552%0.516SS*.  trans-125.3121.4175.2-81.2-59000111.1P160H158-P160 WeakPolarHBondContact O-CD 3.47Å
159E60.4Low69.2Low70 Ų7095.9 Ų95.933%0.32752%0.521SS..  trans-65.2118.5166.6-164.3174-14000108E161 K163 R164E159-E161 PolarHBondContact O-N 3.19Å; E159-K163 HydrophobicContact CG-CD 3.89Å; E159-K163 WeakPolarHBondContact OE1-CE 3.48Å; E159-K163 IonicContact OE1-NZ 3.3Å; E159-K163 PolarHBondContact OE1-NZ 3.04Å; E159-R164 HydrophobicContact CG-CG 4.4Å; E159-R164 IonicContact OE2-CZ 3.66Å; E159-R164 IonicContact OE2-NE 2.9Å; E159-R164 PolarHBondContact OE2-NE 3.43Å; E159-R164 IonicContact OE2-NH2 3.51Å
160P66.1Low70.1Confident47 Ų4793.5 Ų93.531%0.30550%0.501SS..  trans-62.3136.6-17321.4-30.2000110F148 H158 T162 K163F148-P160 HydrophobicContact CD2-CG 3.84Å; F148-P160 HydrophobicContact CE2-CG 4.29Å; H158-P160 WeakPolarHBondContact O-CD 3.47Å; P160-T162 PolarHBondContact O-N 3.43Å; P160-K163 HydrophobicContact CG-CB 4.2Å; P160-K163 WeakPolarHBondContact O-CB 3.29Å; P160-K163 PolarHBondContact O-N 3.38Å
161E73.2Confident71.1Confident175 Ų17591.9 Ų91.982%0.81850%0.495SS*.Hα-helixtrans-50-31.6-180-67.6-179.7160.600112.4E159 K163 R164 A165E159-E161 PolarHBondContact O-N 3.19Å; E161-K163 PolarHBondContact O-N 2.81Å; E161-R164 PolarHBondContact O-N 3.42Å; E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 2.84Å
162T72.7Confident72.6Confident74 Ų7494 Ų9445%0.45450%0.5SS..Hα-helixtrans-65.3-36.8178.262.60000113.4E144 P160 A165 S166E144-T162 WeakPolarHBondContact OE2-CB 3.45Å; E144-T162 PolarHBondContact OE2-OG1 3.11Å; P160-T162 PolarHBondContact O-N 3.43Å; T162-A165 PolarHBondContact O-N 2.91Å; T162-S166 PolarHBondContact O-N 3.38Å
163K74.3Confident74.5Confident35 Ų3593.3 Ų93.315%0.15249%0.487CS..Hα-helixtrans-66-49.7176.3-175.5-171.4169.9-153.60110E159 P160 E161 A165 S166 E167E159-K163 HydrophobicContact CG-CD 3.89Å; E159-K163 WeakPolarHBondContact OE1-CE 3.48Å; E159-K163 IonicContact OE1-NZ 3.3Å; E159-K163 PolarHBondContact OE1-NZ 3.04Å; P160-K163 HydrophobicContact CG-CB 4.2Å; P160-K163 WeakPolarHBondContact O-CB 3.29Å; P160-K163 PolarHBondContact O-N 3.38Å; E161-K163 PolarHBondContact O-N 2.81Å; K163-A165 VanDerWaalsContact C-N 3.29Å; K163-A165 PolarHBondContact O-N 3.37Å; K163-S166 PolarHBondContact O-N 2.87Å; K163-S166 VanDerWaalsContact O-N 3.11Å; K163-S166 PolarHBondContact O-OG 3.46Å; K163-E167 WeakPolarHBondContact CE-OE1 3.16Å; K163-E167 PolarHBondContact O-N 3.09Å
164R79.1Confident76.4Confident135 Ų13589.5 Ų89.551%0.50946%0.455SS..Hα-helixtrans-58.6-42.1177-71.1-175.7-178.6170.71.1111.9E159 E161 S166 E167 Q168E159-R164 HydrophobicContact CG-CG 4.4Å; E159-R164 IonicContact OE2-CZ 3.66Å; E159-R164 IonicContact OE2-NE 2.9Å; E159-R164 PolarHBondContact OE2-NE 3.43Å; E159-R164 IonicContact OE2-NH2 3.51Å; E161-R164 PolarHBondContact O-N 3.42Å; R164-S166 PolarHBondContact O-N 2.78Å; R164-E167 PolarHBondContact O-N 3.43Å; R164-Q168 WeakPolarHBondContact O-CB 3.27Å; R164-Q168 VanDerWaalsContact O-CG 3.3Å; R164-Q168 WeakPolarHBondContact O-CG 3.11Å; R164-Q168 PolarHBondContact O-N 3.17Å
165A87.9Confident78.7Confident42 Ų4289.3 Ų89.335%0.34744%0.442SS..Hα-helixtrans-61.1-43.817600000111.9E161 T162 K163 E167 Q168 I169E161-A165 WeakPolarHBondContact O-CB 3.43Å; E161-A165 PolarHBondContact O-N 2.84Å; T162-A165 PolarHBondContact O-N 2.91Å; K163-A165 VanDerWaalsContact C-N 3.29Å; K163-A165 PolarHBondContact O-N 3.37Å; A165-E167 PolarHBondContact O-N 2.94Å; A165-Q168 PolarHBondContact O-N 3.39Å; A165-I169 VanDerWaalsContact O-CG1 3.26Å; A165-I169 WeakPolarHBondContact O-CG1 3.36Å; A165-I169 PolarHBondContact O-N 2.89Å
166S88.3Confident81Confident10 Ų1082.9 Ų82.97%0.0742%0.417CS..Hα-helixtrans-64.8-38.5178.771.20000113.2T162 K163 R164 I169 F170T162-S166 PolarHBondContact O-N 3.38Å; K163-S166 PolarHBondContact O-N 2.87Å; K163-S166 VanDerWaalsContact O-N 3.11Å; K163-S166 PolarHBondContact O-OG 3.46Å; R164-S166 PolarHBondContact O-N 2.78Å; S166-I169 PolarHBondContact O-N 3.35Å; S166-F170 PolarHBondContact O-N 3.14Å
167E89.5Confident83.1Confident52 Ų5278.9 Ų78.924%0.24338%0.383CS..Hα-helixtrans-70.6-38.6176.7-69.5-177.6161.700111.7M141 R145 K163 R164 A165 F170 M171M141-E167 HydrophobicContact CG-CG 3.82Å; M141-E167 HydrophobicContact SD-CG 3.81Å; R145-E167 IonicContact CZ-OE1 3.89Å; R145-E167 IonicContact NE-OE1 2.83Å; R145-E167 PolarHBondContact NE-OE1 3.16Å; R145-E167 IonicContact NH2-OE1 3.42Å; R145-E167 PolarHBondContact NH2-OE1 3.16Å; K163-E167 WeakPolarHBondContact CE-OE1 3.16Å; K163-E167 PolarHBondContact O-N 3.09Å; R164-E167 PolarHBondContact O-N 3.43Å; A165-E167 PolarHBondContact O-N 2.94Å; E167-F170 WeakPolarHBondContact O-CB 3.33Å; E167-F170 PolarHBondContact O-N 3.09Å; E167-M171 WeakPolarHBondContact O-CG 3.38Å; E167-M171 PolarHBondContact O-N 2.85Å
168Q92.5Very high85Confident127 Ų12771.4 Ų71.459%0.59336%0.356SS*.Hα-helixtrans-62.5-44.1172.8-75.5176.5-0.400111.8R164 A165 F170 M171 I172R164-Q168 WeakPolarHBondContact O-CB 3.27Å; R164-Q168 VanDerWaalsContact O-CG 3.3Å; R164-Q168 WeakPolarHBondContact O-CG 3.11Å; R164-Q168 PolarHBondContact O-N 3.17Å; A165-Q168 PolarHBondContact O-N 3.39Å; Q168-F170 VanDerWaalsContact C-N 3.32Å; Q168-F170 PolarHBondContact O-N 3.26Å; Q168-M171 PolarHBondContact O-N 2.54Å; Q168-I172 VanDerWaalsContact O-CG1 3.29Å; Q168-I172 WeakPolarHBondContact O-CG1 3.42Å; Q168-I172 PolarHBondContact O-N 2.96Å
169I93.4Very high86.9Confident82 Ų8268.8 Ų68.842%0.42135%0.347SS..Hα-helixtrans-59.5-45.6175.2-69.2164.3000110.1A137 A165 S166 M171 I172 E173A137-I169 HydrophobicContact CB-CG2 4.07Å; A165-I169 VanDerWaalsContact O-CG1 3.26Å; A165-I169 WeakPolarHBondContact O-CG1 3.36Å; A165-I169 PolarHBondContact O-N 2.89Å; S166-I169 PolarHBondContact O-N 3.35Å; I169-M171 VanDerWaalsContact C-N 3.32Å; I169-M171 PolarHBondContact O-N 3.16Å; I169-I172 PolarHBondContact O-N 3.17Å; I169-E173 HydrophobicContact CG2-CG 4.33Å; I169-E173 WeakPolarHBondContact O-CG 3.22Å; I169-E173 PolarHBondContact O-N 3.23Å
170F94.1Very high88.6Confident23 Ų2366.3 Ų66.310%0.10134%0.336CS..Hα-helixtrans-56.2-45.3175.4172-98.2000112.4L25 L134 A137 V138 M141 S166 E167 Q168 E173 K174L25-F170 HydrophobicContact CD2-CE2 3.65Å; L25-F170 HydrophobicContact CD2-CZ 3.87Å; L134-F170 HydrophobicContact CD1-CD2 3.76Å; L134-F170 HydrophobicContact CD1-CE2 3.61Å; L134-F170 HydrophobicContact CD1-CZ 4.47Å; A137-F170 HydrophobicContact CB-CB 4.2Å; A137-F170 HydrophobicContact CB-CD2 4.44Å; V138-F170 HydrophobicContact CG2-CD2 3.82Å; V138-F170 HydrophobicContact CG2-CE2 3.56Å; M141-F170 HydrophobicContact SD-CB 4.22Å; M141-F170 HydrophobicContact SD-CD1 4.39Å; M141-F170 HydrophobicContact SD-CG 4.21Å; S166-F170 PolarHBondContact O-N 3.14Å; E167-F170 WeakPolarHBondContact O-CB 3.33Å; E167-F170 PolarHBondContact O-N 3.09Å; Q168-F170 VanDerWaalsContact C-N 3.32Å; Q168-F170 PolarHBondContact O-N 3.26Å; F170-E173 PolarHBondContact O-N 2.94Å; F170-K174 HydrophobicContact CE1-CD 4.48Å; F170-K174 WeakPolarHBondContact O-CB 3.34Å; F170-K174 PolarHBondContact O-N 2.52Å
171M94.4Very high89.9Confident96 Ų9665.2 Ų65.247%0.47333%0.327SS..Hα-helixtrans-65.5-37.9177.7-68.9-59.1-6800112.7E167 Q168 I169 K174 N175E167-M171 WeakPolarHBondContact O-CG 3.38Å; E167-M171 PolarHBondContact O-N 2.85Å; Q168-M171 PolarHBondContact O-N 2.54Å; I169-M171 VanDerWaalsContact C-N 3.32Å; I169-M171 PolarHBondContact O-N 3.16Å; M171-K174 PolarHBondContact O-N 3.12Å; M171-N175 VanDerWaalsContact O-CG 3.28Å; M171-N175 PolarHBondContact O-N 3.46Å; M171-N175 PolarHBondContact O-ND2 3.35Å
172I95.6Very high90.9Very high108 Ų10863.8 Ų63.855%0.55432%0.318SS*.Hα-helixtrans-62.1-48174.8-69.9164.1000110.6Q168 I169 K174 N175 A176Q168-I172 VanDerWaalsContact O-CG1 3.29Å; Q168-I172 WeakPolarHBondContact O-CG1 3.42Å; Q168-I172 PolarHBondContact O-N 2.96Å; I169-I172 PolarHBondContact O-N 3.17Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.27Å; I172-N175 PolarHBondContact O-N 3.02Å; I172-A176 WeakPolarHBondContact O-CB 3.29Å; I172-A176 PolarHBondContact O-N 3.44Å
173E95Very high92Very high44 Ų4464.2 Ų64.221%0.20632%0.315CS..Hα-helixtrans-66.5-33.7179.7-64.5-58.5163.500112.3S133 L134 A137 I169 F170 A176 L177S133-E173 WeakPolarHBondContact CB-OE2 3.43Å; L134-E173 HydrophobicContact CB-CB 4.23Å; L134-E173 HydrophobicContact CD1-CB 4.02Å; A137-E173 HydrophobicContact CB-CG 4.23Å; I169-E173 HydrophobicContact CG2-CG 4.33Å; I169-E173 WeakPolarHBondContact O-CG 3.22Å; I169-E173 PolarHBondContact O-N 3.23Å; F170-E173 PolarHBondContact O-N 2.94Å; E173-A176 PolarHBondContact O-N 3.02Å; E173-L177 PolarHBondContact O-N 3.3Å
174K94.5Very high92.9Very high41 Ų4163.1 Ų63.118%0.17831%0.311CS..Hα-helixtrans-65.6-44173.1-176.2175166.9175.60111.5D26 T29 L134 F170 M171 I172 A176 L177 E178D26-K174 VanDerWaalsContact OD2-CE 3.32Å; D26-K174 WeakPolarHBondContact OD2-CE 3.35Å; D26-K174 IonicContact OD2-NZ 2.69Å; D26-K174 PolarHBondContact OD2-NZ 3.44Å; T29-K174 WeakPolarHBondContact OG1-CE 3.43Å; L134-K174 HydrophobicContact CD1-CB 4.33Å; F170-K174 HydrophobicContact CE1-CD 4.48Å; F170-K174 WeakPolarHBondContact O-CB 3.34Å; F170-K174 PolarHBondContact O-N 2.52Å; M171-K174 PolarHBondContact O-N 3.12Å; I172-K174 VanDerWaalsContact C-N 3.31Å; I172-K174 PolarHBondContact O-N 3.27Å; K174-A176 VanDerWaalsContact C-N 3.33Å; K174-A176 PolarHBondContact O-N 3.34Å; K174-L177 WeakPolarHBondContact O-CB 3.42Å; K174-L177 PolarHBondContact O-N 3.22Å; K174-L177 VanDerWaalsContact O-N 3.17Å; K174-E178 PolarHBondContact O-N 2.94Å
175N95Very high93.7Very high80 Ų8062.1 Ų62.143%0.42831%0.314SS..Hα-helixtrans-64.8-38.1174.9-70.6-14.6000111.7M171 I172 L177 E178 I179M171-N175 VanDerWaalsContact O-CG 3.28Å; M171-N175 PolarHBondContact O-N 3.46Å; M171-N175 PolarHBondContact O-ND2 3.35Å; I172-N175 PolarHBondContact O-N 3.02Å; N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.09Å; N175-E178 PolarHBondContact O-N 3.49Å; N175-I179 WeakPolarHBondContact O-CG1 3.4Å; N175-I179 PolarHBondContact O-N 3.42Å
176A95.5Very high94.1Very high27 Ų2762.2 Ų62.222%0.22331%0.312CS..Hα-helixtrans-60.7-38173.600000111.4V130 I172 E173 K174 I179 V180V130-A176 HydrophobicContact CG1-CB 4.11Å; V130-A176 HydrophobicContact CG2-CB 4.09Å; I172-A176 WeakPolarHBondContact O-CB 3.29Å; I172-A176 PolarHBondContact O-N 3.44Å; E173-A176 PolarHBondContact O-N 3.02Å; K174-A176 VanDerWaalsContact C-N 3.33Å; K174-A176 PolarHBondContact O-N 3.34Å; A176-I179 PolarHBondContact O-N 2.94Å; A176-V180 WeakPolarHBondContact O-CG2 3.32Å; A176-V180 PolarHBondContact O-N 2.91Å; A176-V180 VanDerWaalsContact O-N 3.11Å
177L95.6Very high94.5Very high3 Ų361.8 Ų61.82%0.01631%0.308CS..Hα-helixtrans-63.5-47.2174.5179.666000110.3T29 L33 F127 V130 L134 E173 K174 N175 I179 V180 M181T29-L177 HydrophobicContact CG2-CD2 3.77Å; L33-L177 HydrophobicContact CD2-CD1 3.79Å; L33-L177 HydrophobicContact CD2-CD2 3.77Å; L33-L177 HydrophobicContact CD2-CG 4.46Å; L33-L177 HydrophobicContact CG-CD2 3.88Å; F127-L177 HydrophobicContact CD2-CD1 4.1Å; F127-L177 HydrophobicContact CE2-CD1 4.14Å; V130-L177 HydrophobicContact CG1-CB 3.7Å; V130-L177 HydrophobicContact CG1-CD1 4.29Å; L134-L177 HydrophobicContact CD2-CD2 4.05Å; E173-L177 PolarHBondContact O-N 3.3Å; K174-L177 WeakPolarHBondContact O-CB 3.42Å; K174-L177 PolarHBondContact O-N 3.22Å; K174-L177 VanDerWaalsContact O-N 3.17Å; N175-L177 VanDerWaalsContact C-N 3.26Å; N175-L177 PolarHBondContact O-N 3.09Å; L177-I179 PolarHBondContact O-N 3.32Å; L177-V180 PolarHBondContact O-N 3.43Å; L177-V180 VanDerWaalsContact O-N 3.16Å; L177-M181 HydrophobicContact CD1-CG 4.06Å; L177-M181 HydrophobicContact CD1-SD 4.3Å; L177-M181 HydrophobicContact CG-CG 4.05Å; L177-M181 WeakPolarHBondContact O-CB 3.5Å; L177-M181 WeakPolarHBondContact O-CG 3.4Å; L177-M181 PolarHBondContact O-N 3.35Å
178E93.8Very high94.8Very high65 Ų6563.9 Ų63.930%0.30432%0.32SS..Hα-helixtrans-57.5-36.9178.1-68.2-169.5166.200112.6R28 K174 N175 M181 K182R28-E178 IonicContact CZ-OE1 2.82Å; R28-E178 IonicContact NH1-OE1 2.73Å; K174-E178 PolarHBondContact O-N 2.94Å; N175-E178 PolarHBondContact O-N 3.49Å; E178-M181 PolarHBondContact O-N 3.15Å; E178-K182 WeakPolarHBondContact O-CG 3.38Å; E178-K182 PolarHBondContact O-N 3.43Å
179I94.9Very high95Very high109 Ų10963 Ų6356%0.55932%0.319SS*.Hα-helixtrans-64-51.5175.2-67166.1000110.6N175 A176 L177 M181 K182N175-I179 WeakPolarHBondContact O-CG1 3.4Å; N175-I179 PolarHBondContact O-N 3.42Å; A176-I179 PolarHBondContact O-N 2.94Å; L177-I179 PolarHBondContact O-N 3.32Å; I179-M181 PolarHBondContact O-N 3.46Å; I179-K182 WeakPolarHBondContact O-CB 3.27Å; I179-K182 PolarHBondContact O-N 3.26Å; I179-K182 VanDerWaalsContact O-N 3.12Å
180V95Very high95.2Very high17 Ų1763 Ų6310%0.10331%0.313CS..Hα-helixtrans-61-36.7178.4175.30000111.4F36 A126 F127 V130 A176 L177 K182 E183F36-V180 HydrophobicContact CE2-CG1 4Å; F36-V180 HydrophobicContact CZ-CG1 4.39Å; A126-V180 HydrophobicContact CB-CG1 4.49Å; A126-V180 HydrophobicContact CB-CG2 4.04Å; F127-V180 HydrophobicContact CB-CG1 3.86Å; V130-V180 HydrophobicContact CG2-CG2 4.08Å; A176-V180 WeakPolarHBondContact O-CG2 3.32Å; A176-V180 PolarHBondContact O-N 2.91Å; A176-V180 VanDerWaalsContact O-N 3.11Å; L177-V180 PolarHBondContact O-N 3.43Å; L177-V180 VanDerWaalsContact O-N 3.16Å; V180-K182 PolarHBondContact O-N 3.39Å; V180-E183 WeakPolarHBondContact O-CB 3.46Å; V180-E183 PolarHBondContact O-N 3.4Å; V180-E183 VanDerWaalsContact O-N 3.07Å
181M94Very high95.3Very high25 Ų2562.5 Ų62.512%0.12331%0.311CS..Hα-helixtrans-65.6-23179.2-71.6-58.2-48.600113.7S32 F36 L177 E178 I179 E183 L184S32-M181 VanDerWaalsContact O-CE 3.29Å; S32-M181 WeakPolarHBondContact O-CE 3.44Å; F36-M181 HydrophobicContact CB-CE 4.18Å; F36-M181 HydrophobicContact CB-SD 3.81Å; F36-M181 HydrophobicContact CD2-CE 4.16Å; F36-M181 HydrophobicContact CD2-SD 3.66Å; F36-M181 HydrophobicContact CG-SD 4.19Å; L177-M181 HydrophobicContact CD1-CG 4.06Å; L177-M181 HydrophobicContact CD1-SD 4.3Å; L177-M181 HydrophobicContact CG-CG 4.05Å; L177-M181 WeakPolarHBondContact O-CB 3.5Å; L177-M181 WeakPolarHBondContact O-CG 3.4Å; L177-M181 PolarHBondContact O-N 3.35Å; E178-M181 PolarHBondContact O-N 3.15Å; I179-M181 PolarHBondContact O-N 3.46Å; M181-E183 PolarHBondContact O-N 2.99Å; M181-L184 HydrophobicContact CE-CB 4.29Å; M181-L184 HydrophobicContact CE-CD2 3.53Å; M181-L184 WeakPolarHBondContact O-CB 3.02Å; M181-L184 PolarHBondContact O-N 3.43Å
182K94.5Very high95.4Very high145 Ų14563.8 Ų63.863%0.6331%0.314SS*.Hα-helixtrans-64.2-26.9173.4-70.2172.6-177.7179.20112E178 I179 V180 L184 P186E178-K182 WeakPolarHBondContact O-CG 3.38Å; E178-K182 PolarHBondContact O-N 3.43Å; I179-K182 WeakPolarHBondContact O-CB 3.27Å; I179-K182 PolarHBondContact O-N 3.26Å; I179-K182 VanDerWaalsContact O-N 3.12Å; V180-K182 PolarHBondContact O-N 3.39Å; K182-L184 VanDerWaalsContact C-N 3.3Å; K182-L184 PolarHBondContact O-N 2.79Å; K182-P186 VanDerWaalsContact O-CD 3.22Å; K182-P186 WeakPolarHBondContact O-CD 3.34Å
183E94.3Very high95.5Very high82 Ų8261.7 Ų61.738%0.38331%0.309SS..THydrogen-bonded Turntrans-78.4-12.7178.5-57.2-52.6132.100113.9E123 V180 M181 I185 P186 C187E123-E183 HydrophobicContact CB-CB 4.25Å; E123-E183 HydrophobicContact CG-CB 3.79Å; E123-E183 HydrophobicContact CG-CG 4.14Å; V180-E183 WeakPolarHBondContact O-CB 3.46Å; V180-E183 PolarHBondContact O-N 3.4Å; V180-E183 VanDerWaalsContact O-N 3.07Å; M181-E183 PolarHBondContact O-N 2.99Å; E183-I185 PolarHBondContact O-N 3.16Å; E183-P186 WeakPolarHBondContact O-CD 3.48Å; E183-C187 PolarHBondContact O-N 2.85Å; E183-C187 VanDerWaalsContact O-N 3.12Å; E183-C187 PolarHBondContact O-SG 3.31Å
184L95Very high95.6Very high12 Ų1261.3 Ų61.36%0.06331%0.306CS..Hα-helixtrans-62.8-42.8179.7-177.358.5000111.7N35 F36 F39 M181 K182 C187 M188N35-L184 HydrophobicContact CB-CD2 4.07Å; F36-L184 HydrophobicContact CB-CD2 4.46Å; F36-L184 HydrophobicContact CD2-CB 3.92Å; F36-L184 HydrophobicContact CD2-CD1 4.01Å; F36-L184 HydrophobicContact CD2-CD2 4.37Å; F36-L184 HydrophobicContact CD2-CG 4.32Å; F36-L184 HydrophobicContact CE2-CB 4.05Å; F36-L184 HydrophobicContact CE2-CD1 4.3Å; F36-L184 HydrophobicContact CG-CD1 4.23Å; F39-L184 HydrophobicContact CB-CD1 3.75Å; F39-L184 HydrophobicContact CD1-CD1 3.65Å; F39-L184 HydrophobicContact CE1-CD1 4.43Å; F39-L184 HydrophobicContact CG-CD1 3.7Å; M181-L184 HydrophobicContact CE-CB 4.29Å; M181-L184 HydrophobicContact CE-CD2 3.53Å; M181-L184 WeakPolarHBondContact O-CB 3.02Å; M181-L184 PolarHBondContact O-N 3.43Å; K182-L184 VanDerWaalsContact C-N 3.3Å; K182-L184 PolarHBondContact O-N 2.79Å; L184-C187 WeakPolarHBondContact O-CB 3.46Å; L184-C187 PolarHBondContact O-N 3.22Å; L184-M188 HydrophobicContact CD1-CG 4.29Å; L184-M188 HydrophobicContact CD1-SD 4.47Å; L184-M188 HydrophobicContact CG-CG 4.37Å; L184-M188 HydrophobicContact CG-SD 4.03Å; L184-M188 VanDerWaalsContact O-CG 3.29Å; L184-M188 WeakPolarHBondContact O-CG 3.46Å; L184-M188 PolarHBondContact O-N 3.32Å
185I95.2Very high95.7Very high114 Ų11462.4 Ų62.459%0.58531%0.314SS*.Hα-helixtrans-61.9-50.5-179.6-66.7171.9000111.1E183 C187 M188 L189E183-I185 PolarHBondContact O-N 3.16Å; I185-C187 VanDerWaalsContact C-N 3.32Å; I185-C187 PolarHBondContact O-N 3.26Å; I185-M188 PolarHBondContact O-N 3.3Å; I185-M188 VanDerWaalsContact O-N 3.17Å; I185-L189 HydrophobicContact CG2-CD1 4.17Å; I185-L189 HydrophobicContact CG2-CG 4.47Å; I185-L189 WeakPolarHBondContact O-CG 3.32Å; I185-L189 PolarHBondContact O-N 2.8Å
186P96Very high95.8Very high45 Ų4565.1 Ų65.129%0.29232%0.322SS..Hα-helixtrans-51.2-46.1170.5-29.533.4000113.9K182 E183 M188 L189 R190K182-P186 VanDerWaalsContact O-CD 3.22Å; K182-P186 WeakPolarHBondContact O-CD 3.34Å; E183-P186 WeakPolarHBondContact O-CD 3.48Å; P186-M188 VanDerWaalsContact C-N 3.34Å; P186-M188 PolarHBondContact O-N 2.71Å; P186-L189 PolarHBondContact O-N 3.11Å; P186-R190 PolarHBondContact O-N 3.2Å
187C96.4Very high95.9Very high0 Ų066 Ų660%032%0.324CS..Hα-helixtrans-60.2-42.8177.6-650000112.3F39 N119 E183 L184 I185 R190 Q191F39-C187 HydrophobicContact CD1-CB 4.45Å; F39-C187 HydrophobicContact CE1-CB 3.56Å; F39-C187 HydrophobicContact CZ-CB 3.83Å; F39-C187 WeakPolarHBondContact CZ-O 3.39Å; N119-C187 PolarHBondContact ND2-O 2.92Å; E183-C187 PolarHBondContact O-N 2.85Å; E183-C187 VanDerWaalsContact O-N 3.12Å; E183-C187 PolarHBondContact O-SG 3.31Å; L184-C187 WeakPolarHBondContact O-CB 3.46Å; L184-C187 PolarHBondContact O-N 3.22Å; I185-C187 VanDerWaalsContact C-N 3.32Å; I185-C187 PolarHBondContact O-N 3.26Å; C187-R190 PolarHBondContact O-N 2.88Å; C187-R190 PolarHBondContact SG-NH2 3.07Å; C187-Q191 PolarHBondContact O-N 3.08Å
188M96.5Very high95.9Very high97 Ų9767.9 Ų67.948%0.47833%0.332SS..Hα-helixtrans-64.9-39.5177.6-70.2175.372.700112.2F39 L184 I185 P186 Q191 K192F39-M188 HydrophobicContact CD2-CG 3.62Å; F39-M188 HydrophobicContact CE2-CB 4.2Å; F39-M188 HydrophobicContact CE2-CG 3.61Å; F39-M188 HydrophobicContact CG-CG 4.3Å; F39-M188 HydrophobicContact CZ-CG 4.29Å; L184-M188 HydrophobicContact CD1-CG 4.29Å; L184-M188 HydrophobicContact CD1-SD 4.47Å; L184-M188 HydrophobicContact CG-CG 4.37Å; L184-M188 HydrophobicContact CG-SD 4.03Å; L184-M188 VanDerWaalsContact O-CG 3.29Å; L184-M188 WeakPolarHBondContact O-CG 3.46Å; L184-M188 PolarHBondContact O-N 3.32Å; I185-M188 PolarHBondContact O-N 3.3Å; I185-M188 VanDerWaalsContact O-N 3.17Å; P186-M188 VanDerWaalsContact C-N 3.34Å; P186-M188 PolarHBondContact O-N 2.71Å; M188-Q191 WeakPolarHBondContact O-CB 3.33Å; M188-Q191 PolarHBondContact O-N 2.65Å; M188-K192 PolarHBondContact O-N 2.86Å
189L97.2Very high96.1Very high109 Ų10967 Ų6757%0.57134%0.337SS*.Hα-helixtrans-66.3-40.5176.6-70.1174.9000111.9I185 P186 K192 S193I185-L189 HydrophobicContact CG2-CD1 4.17Å; I185-L189 HydrophobicContact CG2-CG 4.47Å; I185-L189 WeakPolarHBondContact O-CG 3.32Å; I185-L189 PolarHBondContact O-N 2.8Å; P186-L189 PolarHBondContact O-N 3.11Å; L189-K192 WeakPolarHBondContact O-CB 3.49Å; L189-K192 PolarHBondContact O-N 3.19Å; L189-S193 PolarHBondContact O-N 3.3Å; L189-S193 VanDerWaalsContact O-N 3.1Å
190R96.6Very high96.2Very high82 Ų8265.6 Ų65.631%0.30934%0.336SS..Hα-helixtrans-60.9-45.4171.5-71.1-172.3-64-109.111111.3N119 E123 P186 C187 K192 S193 Y194N119-R190 PolarHBondContact OD1-NE 3.08Å; E123-R190 IonicContact OE1-CZ 3.43Å; E123-R190 IonicContact OE1-NH2 3.66Å; E123-R190 PolarHBondContact OE1-NH2 2.93Å; P186-R190 PolarHBondContact O-N 3.2Å; C187-R190 PolarHBondContact O-N 2.88Å; C187-R190 PolarHBondContact SG-NH2 3.07Å; R190-K192 VanDerWaalsContact C-N 3.32Å; R190-K192 PolarHBondContact O-N 2.89Å; R190-S193 WeakPolarHBondContact O-CA 3.42Å; R190-S193 WeakPolarHBondContact O-CB 3.38Å; R190-S193 PolarHBondContact O-N 2.98Å; R190-Y194 HydrophobicContact CB-CE2 3.88Å; R190-Y194 WeakPolarHBondContact O-CD2 3.48Å; R190-Y194 PolarHBondContact O-N 2.87Å
191Q96.7Very high96.2Very high12 Ų1266.9 Ų66.96%0.05634%0.339CS..Hα-helixtrans-58.2-43.7176.6-171.959.743.800112.4F39 T43 M116 N119 C187 M188 S193 Y194 N195F39-Q191 HydrophobicContact CE2-CB 3.95Å; F39-Q191 HydrophobicContact CE2-CG 4.29Å; F39-Q191 HydrophobicContact CZ-CB 4.02Å; T43-Q191 HydrophobicContact CG2-CB 4.41Å; T43-Q191 HydrophobicContact CG2-CG 3.72Å; M116-Q191 PolarHBondContact SD-NE2 3.17Å; M116-Q191 VanDerWaalsContact SD-NE2 3.41Å; N119-Q191 PolarHBondContact ND2-OE1 3.36Å; C187-Q191 PolarHBondContact O-N 3.08Å; M188-Q191 WeakPolarHBondContact O-CB 3.33Å; M188-Q191 PolarHBondContact O-N 2.65Å; Q191-S193 PolarHBondContact O-N 3.35Å; Q191-Y194 PolarHBondContact O-N 2.72Å; Q191-N195 PolarHBondContact NE2-OD1 3.07Å; Q191-N195 VanDerWaalsContact O-CG 3.3Å; Q191-N195 PolarHBondContact O-N 3.17Å; Q191-N195 PolarHBondContact O-OD1 3.45Å
192K97Very high96.3Very high123 Ų12366.9 Ų66.954%0.53534%0.34SS..Hα-helixtrans-57.8-38.8174.2178.5-179.6177.6178.30111.8M188 L189 R190 K196M188-K192 PolarHBondContact O-N 2.86Å; L189-K192 WeakPolarHBondContact O-CB 3.49Å; L189-K192 PolarHBondContact O-N 3.19Å; R190-K192 VanDerWaalsContact C-N 3.32Å; R190-K192 PolarHBondContact O-N 2.89Å; K192-K196 WeakPolarHBondContact O-CG 3.38Å; K192-K196 PolarHBondContact O-N 3.15Å; K192-K196 VanDerWaalsContact O-N 3.15Å
193S97.2Very high96.4Very high64 Ų6464.7 Ų64.745%0.44834%0.338SS..Hα-helixtrans-63.7-47.9175.9-1620000111.4L189 R190 Q191 N195 K196 T197L189-S193 PolarHBondContact O-N 3.3Å; L189-S193 VanDerWaalsContact O-N 3.1Å; R190-S193 WeakPolarHBondContact O-CA 3.42Å; R190-S193 WeakPolarHBondContact O-CB 3.38Å; R190-S193 PolarHBondContact O-N 2.98Å; Q191-S193 PolarHBondContact O-N 3.35Å; S193-N195 VanDerWaalsContact C-N 3.33Å; S193-N195 PolarHBondContact O-N 3.49Å; S193-K196 WeakPolarHBondContact O-CB 3.39Å; S193-K196 PolarHBondContact O-N 2.6Å; S193-K196 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-N 2.94Å; S193-T197 PolarHBondContact O-OG1 3.33Å; S193-T197 VanDerWaalsContact O-OG1 3.13Å
194Y96.3Very high96.5Very high36 Ų3665.9 Ų65.914%0.14134%0.342CS..Hα-helixtrans-61.3-40.8178.4-54.3-44.4000112.4Q115 M116 N119 R190 Q191 K196 T197 F198Q115-Y194 HydrophobicContact CB-CD1 3.88Å; Q115-Y194 HydrophobicContact CB-CE1 3.4Å; Q115-Y194 HydrophobicContact CB-CE2 4.31Å; Q115-Y194 HydrophobicContact CG-CE1 4.13Å; M116-Y194 HydrophobicContact CG-CD2 3.72Å; M116-Y194 HydrophobicContact CG-CG 3.92Å; N119-Y194 HydrophobicContact CB-CE2 3.92Å; R190-Y194 HydrophobicContact CB-CE2 3.88Å; R190-Y194 WeakPolarHBondContact O-CD2 3.48Å; R190-Y194 PolarHBondContact O-N 2.87Å; Q191-Y194 PolarHBondContact O-N 2.72Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 3.38Å; Y194-T197 PolarHBondContact O-N 3.07Å; Y194-F198 PolarHBondContact O-N 3.19Å
195N96.3Very high96.5Very high64 Ų6467 Ų6734%0.34235%0.346SS..Hα-helixtrans-61-40175.3-66.97.4000111.9Q191 S193 A199Q191-N195 PolarHBondContact NE2-OD1 3.07Å; Q191-N195 VanDerWaalsContact O-CG 3.3Å; Q191-N195 PolarHBondContact O-N 3.17Å; Q191-N195 PolarHBondContact O-OD1 3.45Å; S193-N195 VanDerWaalsContact C-N 3.33Å; S193-N195 PolarHBondContact O-N 3.49Å; N195-A199 PolarHBondContact O-N 3.33Å
196K97.6Very high96.6Very high137 Ų13766.3 Ų66.360%0.59634%0.34SS*.Hα-helixtrans-66.2-42.6175.3-75.8-178.1170.4-164.80112K192 S193 Y194 F198 A199 S200K192-K196 WeakPolarHBondContact O-CG 3.38Å; K192-K196 PolarHBondContact O-N 3.15Å; K192-K196 VanDerWaalsContact O-N 3.15Å; S193-K196 WeakPolarHBondContact O-CB 3.39Å; S193-K196 PolarHBondContact O-N 2.6Å; S193-K196 VanDerWaalsContact O-N 3.11Å; Y194-K196 VanDerWaalsContact C-N 3.31Å; Y194-K196 PolarHBondContact O-N 3.38Å; K196-F198 VanDerWaalsContact C-N 3.35Å; K196-A199 PolarHBondContact O-N 3.5Å; K196-S200 WeakPolarHBondContact O-CB 3.44Å; K196-S200 PolarHBondContact O-N 2.94Å
197T96.8Very high96.6Very high45 Ų4566.3 Ų66.328%0.27634%0.344SS..Hα-helixtrans-61-45.3177.2-58.60000110.9V112 S193 Y194 S200 Y201V112-T197 HydrophobicContact CG2-CG2 3.89Å; S193-T197 PolarHBondContact O-N 2.94Å; S193-T197 PolarHBondContact O-OG1 3.33Å; S193-T197 VanDerWaalsContact O-OG1 3.13Å; Y194-T197 PolarHBondContact O-N 3.07Å; T197-S200 WeakPolarHBondContact O-CB 3.35Å; T197-S200 PolarHBondContact O-N 3.3Å; T197-Y201 HydrophobicContact CG2-CD2 3.89Å; T197-Y201 HydrophobicContact CG2-CE2 3.41Å; T197-Y201 VanDerWaalsContact CG2-CE2 3.41Å; T197-Y201 VanDerWaalsContact O-CD2 3.26Å; T197-Y201 WeakPolarHBondContact O-CD2 3.45Å; T197-Y201 PolarHBondContact O-N 3.03Å
198F96.9Very high96.7Very high42 Ų4268.6 Ų68.618%0.18436%0.358CS..Hα-helixtrans-57.1-51.1173.6177.3-105.6000112.1I50 F53 I108 V112 Y194 K196 S200 Y201 M202I50-F198 HydrophobicContact CD1-CD1 4.45Å; I50-F198 HydrophobicContact CD1-CD2 4.39Å; I50-F198 HydrophobicContact CD1-CG 4.26Å; I50-F198 HydrophobicContact CG1-CE1 4.5Å; I50-F198 HydrophobicContact CG1-CE2 4.33Å; I50-F198 HydrophobicContact CG1-CZ 4.32Å; I50-F198 HydrophobicContact CG2-CD2 3.81Å; I50-F198 HydrophobicContact CG2-CE2 3.6Å; I50-F198 HydrophobicContact CG2-CZ 4.31Å; F53-F198 HydrophobicContact CD1-CZ 4.23Å; F53-F198 HydrophobicContact CE1-CZ 4.42Å; I108-F198 HydrophobicContact CD1-CD2 4.1Å; I108-F198 HydrophobicContact CD1-CE2 3.95Å; I108-F198 HydrophobicContact CG1-CD2 4.28Å; I108-F198 HydrophobicContact CG2-CD2 3.93Å; I108-F198 HydrophobicContact CG2-CE2 4.15Å; V112-F198 HydrophobicContact CG1-CB 4.05Å; V112-F198 HydrophobicContact CG2-CB 4.2Å; Y194-F198 PolarHBondContact O-N 3.19Å; K196-F198 VanDerWaalsContact C-N 3.35Å; F198-S200 VanDerWaalsContact C-N 3.26Å; F198-S200 PolarHBondContact O-N 3.46Å; F198-Y201 PolarHBondContact O-N 2.88Å; F198-Y201 VanDerWaalsContact O-N 3.12Å; F198-M202 HydrophobicContact CD1-CG 4.47Å; F198-M202 HydrophobicContact CD2-CG 4.45Å; F198-M202 HydrophobicContact CE1-CG 4Å; F198-M202 HydrophobicContact CE2-CG 3.97Å; F198-M202 HydrophobicContact CE2-SD 4.22Å; F198-M202 HydrophobicContact CZ-CG 3.72Å; F198-M202 HydrophobicContact CZ-SD 4.23Å; F198-M202 PolarHBondContact O-N 3.46Å
199A96.7Very high96.6Very high48 Ų4864.9 Ų64.940%0.39734%0.34SS..Hα-helixtrans-59.1-37.817800000112.5N195 K196 M202 T203N195-A199 PolarHBondContact O-N 3.33Å; K196-A199 PolarHBondContact O-N 3.5Å; A199-M202 PolarHBondContact O-N 3.02Å; A199-T203 WeakPolarHBondContact O-CB 3.47Å; A199-T203 PolarHBondContact O-N 2.71Å; A199-T203 PolarHBondContact O-OG1 3.45Å
200S97.5Very high96.6Very high78 Ų7865.2 Ų65.255%0.54534%0.342SS..Hα-helixtrans-64.3-42.4175.6-1710000112.1K196 T197 F198 T203 K204K196-S200 WeakPolarHBondContact O-CB 3.44Å; K196-S200 PolarHBondContact O-N 2.94Å; T197-S200 WeakPolarHBondContact O-CB 3.35Å; T197-S200 PolarHBondContact O-N 3.3Å; F198-S200 VanDerWaalsContact C-N 3.26Å; F198-S200 PolarHBondContact O-N 3.46Å; S200-T203 PolarHBondContact O-N 2.9Å; S200-K204 WeakPolarHBondContact O-CB 3.27Å; S200-K204 PolarHBondContact O-N 3.31Å
201Y96.1Very high96.6Very high44 Ų4466 Ų6617%0.17335%0.353CS..Hα-helixtrans-63.7-45.3176.7-76.5-53.1000111.8I104 E107 I108 N111 V112 T197 F198 T203 K204 Y205I104-Y201 HydrophobicContact CD1-CD1 4.44Å; E107-Y201 HydrophobicContact CB-CD1 4.24Å; E107-Y201 HydrophobicContact CB-CE1 3.83Å; E107-Y201 HydrophobicContact CB-CE2 4.44Å; E107-Y201 HydrophobicContact CG-CE1 4.37Å; E107-Y201 WeakPolarHBondContact OE2-CD1 3.48Å; E107-Y201 WeakPolarHBondContact OE2-CE1 3.37Å; I108-Y201 HydrophobicContact CG1-CD2 3.91Å; I108-Y201 HydrophobicContact CG1-CG 4.08Å; N111-Y201 HydrophobicContact CB-CE2 4.04Å; N111-Y201 PolarHBondContact ND2-OH 3.27Å; V112-Y201 HydrophobicContact CG2-CD2 4.1Å; V112-Y201 HydrophobicContact CG2-CE2 4.17Å; T197-Y201 HydrophobicContact CG2-CD2 3.89Å; T197-Y201 HydrophobicContact CG2-CE2 3.41Å; T197-Y201 VanDerWaalsContact CG2-CE2 3.41Å; T197-Y201 VanDerWaalsContact O-CD2 3.26Å; T197-Y201 WeakPolarHBondContact O-CD2 3.45Å; T197-Y201 PolarHBondContact O-N 3.03Å; F198-Y201 PolarHBondContact O-N 2.88Å; F198-Y201 VanDerWaalsContact O-N 3.12Å; Y201-T203 VanDerWaalsContact C-N 3.34Å; Y201-T203 PolarHBondContact O-N 2.95Å; Y201-K204 PolarHBondContact O-N 3.37Å; Y201-Y205 WeakPolarHBondContact O-CB 3.41Å; Y201-Y205 PolarHBondContact O-N 3.2Å
202M95.3Very high96.5Very high26 Ų2667 Ų6713%0.12836%0.358CS..Hα-helixtrans-63.9-39.1176.9-66.5-50.7-56.700112.4F53 I108 F198 A199 Y205 H206F53-M202 HydrophobicContact CE1-CE 3.55Å; F53-M202 HydrophobicContact CE1-SD 3.85Å; F53-M202 HydrophobicContact CZ-CE 3.78Å; I108-M202 HydrophobicContact CD1-SD 3.87Å; F198-M202 HydrophobicContact CD1-CG 4.47Å; F198-M202 HydrophobicContact CD2-CG 4.45Å; F198-M202 HydrophobicContact CE1-CG 4Å; F198-M202 HydrophobicContact CE2-CG 3.97Å; F198-M202 HydrophobicContact CE2-SD 4.22Å; F198-M202 HydrophobicContact CZ-CG 3.72Å; F198-M202 HydrophobicContact CZ-SD 4.23Å; F198-M202 PolarHBondContact O-N 3.46Å; A199-M202 PolarHBondContact O-N 3.02Å; M202-Y205 HydrophobicContact CE-CD1 4.2Å; M202-Y205 PolarHBondContact O-N 2.95Å; M202-H206 PolarHBondContact O-CD2 3.42Å; M202-H206 PolarHBondContact O-N 3.24Å
203T96.8Very high96.4Very high98 Ų9864.6 Ų64.660%0.60135%0.351SS*.Hα-helixtrans-62.4-46.1175.9-57.90000111A199 S200 Y201 H206 A207A199-T203 WeakPolarHBondContact O-CB 3.47Å; A199-T203 PolarHBondContact O-N 2.71Å; A199-T203 PolarHBondContact O-OG1 3.45Å; S200-T203 PolarHBondContact O-N 2.9Å; Y201-T203 VanDerWaalsContact C-N 3.34Å; Y201-T203 PolarHBondContact O-N 2.95Å; T203-H206 PolarHBondContact O-N 2.97Å; T203-A207 WeakPolarHBondContact O-CB 3.49Å; T203-A207 PolarHBondContact O-N 3.38Å
204K96Very high96.2Very high108 Ų10867.8 Ų67.847%0.4735%0.354SS..Hα-helixtrans-61.9-45.2176.7-176.8-175.8174.5-167.60111.3I104 S200 Y201 A207 T208I104-K204 HydrophobicContact CD1-CD 4.48Å; S200-K204 WeakPolarHBondContact O-CB 3.27Å; S200-K204 PolarHBondContact O-N 3.31Å; Y201-K204 PolarHBondContact O-N 3.37Å; K204-A207 PolarHBondContact O-N 3.41Å; K204-T208 PolarHBondContact O-N 3.41Å; K204-T208 PolarHBondContact O-OG1 3.35Å; K204-T208 VanDerWaalsContact O-OG1 3.1Å
205Y95.5Very high96Very high36 Ų3670.9 Ų70.914%0.14137%0.373CS..Hα-helixtrans-54.4-56.1176.2171.1-102.5000111.3L100 I104 Y201 M202 A207 T208 V209L100-Y205 HydrophobicContact CD2-CD2 3.93Å; L100-Y205 HydrophobicContact CD2-CE2 4.24Å; L100-Y205 HydrophobicContact CG-CD2 3.92Å; L100-Y205 HydrophobicContact CG-CE2 4.28Å; I104-Y205 HydrophobicContact CB-CD2 4.42Å; I104-Y205 HydrophobicContact CG1-CD2 4.17Å; Y201-Y205 WeakPolarHBondContact O-CB 3.41Å; Y201-Y205 PolarHBondContact O-N 3.2Å; M202-Y205 HydrophobicContact CE-CD1 4.2Å; M202-Y205 PolarHBondContact O-N 2.95Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; Y205-A207 PolarHBondContact O-N 2.99Å; Y205-T208 PolarHBondContact O-N 2.86Å; Y205-V209 HydrophobicContact CD1-CG2 4.42Å; Y205-V209 HydrophobicContact CD2-CG2 4.13Å; Y205-V209 HydrophobicContact CE1-CG2 4.03Å; Y205-V209 HydrophobicContact CE2-CG2 3.71Å; Y205-V209 HydrophobicContact CG-CG2 4.46Å; Y205-V209 WeakPolarHBondContact O-CG2 3.48Å; Y205-V209 PolarHBondContact O-N 3.03Å
206H96.5Very high95.7Very high98 Ų9869.9 Ų69.945%0.45437%0.366SS..Hα-helixtrans-65.1-36.6-177.2-69.6-58.1000112.9M202 T203 V209 L210M202-H206 PolarHBondContact O-CD2 3.42Å; M202-H206 PolarHBondContact O-N 3.24Å; T203-H206 PolarHBondContact O-N 2.97Å; H206-V209 PolarHBondContact O-N 2.79Å; H206-L210 WeakPolarHBondContact O-CG 3.49Å; H206-L210 PolarHBondContact O-N 2.9Å
207A97.6Very high95.4Very high46 Ų4670.2 Ų70.238%0.3836%0.363SS..Hα-helixtrans-61.3-49174.300000111.5T203 K204 Y205 V209 L210 D211T203-A207 WeakPolarHBondContact O-CB 3.49Å; T203-A207 PolarHBondContact O-N 3.38Å; K204-A207 PolarHBondContact O-N 3.41Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; Y205-A207 PolarHBondContact O-N 2.99Å; A207-V209 PolarHBondContact O-N 3.39Å; A207-L210 WeakPolarHBondContact O-CB 3.41Å; A207-L210 PolarHBondContact O-N 3.23Å; A207-D211 PolarHBondContact O-N 3.36Å
208T96.7Very high94.9Very high47 Ų4773.3 Ų73.329%0.28838%0.377SS..Hα-helixtrans-69.3-33179.8-53.40000112.5L100 K204 Y205 L210 D211 I212L100-T208 HydrophobicContact CD1-CG2 4.24Å; L100-T208 HydrophobicContact CD2-CG2 3.72Å; K204-T208 PolarHBondContact O-N 3.41Å; K204-T208 PolarHBondContact O-OG1 3.35Å; K204-T208 VanDerWaalsContact O-OG1 3.1Å; Y205-T208 PolarHBondContact O-N 2.86Å; T208-L210 VanDerWaalsContact C-N 3.32Å; T208-D211 PolarHBondContact O-N 3.4Å; T208-I212 HydrophobicContact CG2-CD1 4.2Å; T208-I212 WeakPolarHBondContact O-CD1 3.46Å; T208-I212 VanDerWaalsContact O-CG1 3.25Å; T208-I212 WeakPolarHBondContact O-CG1 3.38Å; T208-I212 PolarHBondContact O-N 3.11Å
209V96Very high94.1Very high19 Ų1976.5 Ų76.512%0.11540%0.4CS..Hα-helixtrans-61.6-42.3171.61690000111.1I97 L100 Y205 H206 A207 I212 L213I97-V209 HydrophobicContact CD1-CG1 4.21Å; I97-V209 HydrophobicContact CG1-CG1 4.36Å; I97-V209 HydrophobicContact CG1-CG2 4.48Å; I97-V209 HydrophobicContact CG2-CG2 4.18Å; L100-V209 HydrophobicContact CD2-CG2 3.79Å; Y205-V209 HydrophobicContact CD1-CG2 4.42Å; Y205-V209 HydrophobicContact CD2-CG2 4.13Å; Y205-V209 HydrophobicContact CE1-CG2 4.03Å; Y205-V209 HydrophobicContact CE2-CG2 3.71Å; Y205-V209 HydrophobicContact CG-CG2 4.46Å; Y205-V209 WeakPolarHBondContact O-CG2 3.48Å; Y205-V209 PolarHBondContact O-N 3.03Å; H206-V209 PolarHBondContact O-N 2.79Å; A207-V209 PolarHBondContact O-N 3.39Å; V209-I212 PolarHBondContact O-N 2.73Å; V209-L213 HydrophobicContact CG1-CD1 3.88Å; V209-L213 HydrophobicContact CG1-CG 4.45Å; V209-L213 WeakPolarHBondContact O-CG 3.3Å; V209-L213 PolarHBondContact O-N 3.04Å
210L96.5Very high93.2Very high117 Ų11775.8 Ų75.861%0.61339%0.391SS*.Hα-helixtrans-62-44.2175.9-76.4165.9000111.6H206 A207 T208 I212 L213 Y214H206-L210 WeakPolarHBondContact O-CG 3.49Å; H206-L210 PolarHBondContact O-N 2.9Å; A207-L210 WeakPolarHBondContact O-CB 3.41Å; A207-L210 PolarHBondContact O-N 3.23Å; T208-L210 VanDerWaalsContact C-N 3.32Å; L210-I212 PolarHBondContact O-N 3.44Å; L210-L213 PolarHBondContact O-N 3.11Å; L210-Y214 WeakPolarHBondContact O-CB 3.45Å; L210-Y214 PolarHBondContact O-N 2.94Å
211D96.1Very high91.8Very high99 Ų9976.2 Ų76.253%0.52939%0.39SS..Hα-helixtrans-59.2-46.5176.7-64.5-26.1000111A207 T208 L213 Y214 D215A207-D211 PolarHBondContact O-N 3.36Å; T208-D211 PolarHBondContact O-N 3.4Å; D211-L213 VanDerWaalsContact C-N 3.35Å; D211-L213 PolarHBondContact O-N 2.9Å; D211-Y214 PolarHBondContact O-N 3.39Å; D211-D215 PolarHBondContact O-N 3.49Å
212I95.5Very high90Very high31 Ų3179.2 Ų79.216%0.15942%0.417CS..Hα-helixtrans-59.2-44.5177.6-68.7163.8000111.5C93 A96 I97 L100 T208 V209 L210 Y214 F216C93-I212 HydrophobicContact CB-CG2 4.37Å; A96-I212 HydrophobicContact CB-CD1 4.09Å; A96-I212 HydrophobicContact CB-CG2 4.13Å; I97-I212 HydrophobicContact CD1-CG2 4.4Å; I97-I212 HydrophobicContact CG1-CB 4.49Å; I97-I212 HydrophobicContact CG1-CD1 4.33Å; I97-I212 HydrophobicContact CG1-CG2 3.98Å; L100-I212 HydrophobicContact CD2-CD1 4.29Å; T208-I212 HydrophobicContact CG2-CD1 4.2Å; T208-I212 WeakPolarHBondContact O-CD1 3.46Å; T208-I212 VanDerWaalsContact O-CG1 3.25Å; T208-I212 WeakPolarHBondContact O-CG1 3.38Å; T208-I212 PolarHBondContact O-N 3.11Å; V209-I212 PolarHBondContact O-N 2.73Å; L210-I212 PolarHBondContact O-N 3.44Å; I212-Y214 VanDerWaalsContact C-N 3.34Å; I212-F216 PolarHBondContact O-N 3.2Å; I212-F216 VanDerWaalsContact O-N 3.12Å
213L94.5Very high87.8Confident74 Ų7490.5 Ų90.539%0.38747%0.47SS..Hα-helixtrans-68.9-34.7179-71.7169.1000112I97 V209 L210 D211 R217I97-L213 HydrophobicContact CD1-CD2 4Å; I97-L213 HydrophobicContact CD1-CG 4.15Å; V209-L213 HydrophobicContact CG1-CD1 3.88Å; V209-L213 HydrophobicContact CG1-CG 4.45Å; V209-L213 WeakPolarHBondContact O-CG 3.3Å; V209-L213 PolarHBondContact O-N 3.04Å; L210-L213 PolarHBondContact O-N 3.11Å; D211-L213 VanDerWaalsContact C-N 3.35Å; D211-L213 PolarHBondContact O-N 2.9Å; L213-R217 PolarHBondContact O-N 3.5Å
214Y93.2Very high87.4Confident131 Ų13190.2 Ų90.251%0.51446%0.463SS..Hα-helixtrans-69.2-43.2177.7-168-101.3000111.5L210 D211 I212 F216 R217 L218L210-Y214 WeakPolarHBondContact O-CB 3.45Å; L210-Y214 PolarHBondContact O-N 2.94Å; D211-Y214 PolarHBondContact O-N 3.39Å; I212-Y214 VanDerWaalsContact C-N 3.34Å; Y214-F216 VanDerWaalsContact C-N 3.32Å; Y214-F216 PolarHBondContact O-N 3.39Å; Y214-R217 WeakPolarHBondContact O-CB 3.29Å; Y214-R217 PolarHBondContact O-N 3.49Å; Y214-R217 VanDerWaalsContact O-N 3.14Å; Y214-L218 HydrophobicContact CD1-CD1 3.79Å; Y214-L218 HydrophobicContact CD1-CG 4.12Å; Y214-L218 HydrophobicContact CE1-CD1 3.52Å; Y214-L218 HydrophobicContact CE1-CD2 4.17Å; Y214-L218 HydrophobicContact CE1-CG 3.86Å; Y214-L218 WeakPolarHBondContact O-CG 3.26Å; Y214-L218 PolarHBondContact O-N 3.49Å
215D91Very high86.9Confident100 Ų10089.2 Ų89.254%0.53546%0.463SS..Hα-helixtrans-59.3-43.9173.9-73.5-14.9000111.1D211 R217 L218 V219D211-D215 PolarHBondContact O-N 3.49Å; D215-R217 PolarHBondContact O-N 2.99Å; D215-L218 PolarHBondContact O-N 3.02Å; D215-V219 WeakPolarHBondContact O-CG2 3.37Å; D215-V219 PolarHBondContact O-N 2.93Å
216F91.2Very high86.4Confident44 Ų4492.2 Ų92.219%0.19348%0.481CS..Hα-helixtrans-58.7-46173.5168.6-105000112.1Y90 C93 I212 Y214 L218 V219 T220Y90-F216 VanDerWaalsContact CA-CE2 3.41Å; Y90-F216 HydrophobicContact CD2-CD1 4.46Å; Y90-F216 AromaticContact CD2-CE1 3.93Å; Y90-F216 HydrophobicContact CD2-CE1 3.93Å; Y90-F216 HydrophobicContact CD2-CE2 4.08Å; Y90-F216 AromaticContact CD2-CZ 3.73Å; Y90-F216 HydrophobicContact CD2-CZ 3.73Å; Y90-F216 HydrophobicContact CG-CE2 4.25Å; Y90-F216 HydrophobicContact CG-CZ 4.06Å; C93-F216 HydrophobicContact CB-CB 4.1Å; C93-F216 HydrophobicContact CB-CD2 4.36Å; C93-F216 HydrophobicContact CB-CG 4.28Å; I212-F216 PolarHBondContact O-N 3.2Å; I212-F216 VanDerWaalsContact O-N 3.12Å; Y214-F216 VanDerWaalsContact C-N 3.32Å; Y214-F216 PolarHBondContact O-N 3.39Å; F216-L218 PolarHBondContact O-N 3.49Å; F216-V219 PolarHBondContact O-N 2.9Å; F216-T220 HydrophobicContact CD2-CG2 3.94Å; F216-T220 HydrophobicContact CE2-CG2 3.5Å; F216-T220 HydrophobicContact CZ-CG2 4.05Å; F216-T220 PolarHBondContact O-N 3.4Å; F216-T220 PolarHBondContact O-OG1 2.97Å
217R90.3Very high85.8Confident144 Ų14491.8 Ų91.854%0.54348%0.482SS..Hα-helixtrans-60.2-45.3179-179.9-175169.9-159.7-5.7111.6L213 Y214 D215 V219 T220 V221L213-R217 PolarHBondContact O-N 3.5Å; Y214-R217 WeakPolarHBondContact O-CB 3.29Å; Y214-R217 PolarHBondContact O-N 3.49Å; Y214-R217 VanDerWaalsContact O-N 3.14Å; D215-R217 PolarHBondContact O-N 2.99Å; R217-V219 PolarHBondContact O-N 2.96Å; R217-T220 PolarHBondContact O-N 2.91Å; R217-V221 HydrophobicContact CG-CB 4.23Å; R217-V221 HydrophobicContact CG-CG2 3.95Å; R217-V221 WeakPolarHBondContact O-CB 3.4Å; R217-V221 PolarHBondContact O-N 3.19Å
218L86.3Confident85.1Confident110 Ų11094.7 Ų94.758%0.57649%0.489SS*.Hα-helixtrans-61.8-32.6-179.6-74.4177.1000113.1Y214 D215 F216Y214-L218 HydrophobicContact CD1-CD1 3.79Å; Y214-L218 HydrophobicContact CD1-CG 4.12Å; Y214-L218 HydrophobicContact CE1-CD1 3.52Å; Y214-L218 HydrophobicContact CE1-CD2 4.17Å; Y214-L218 HydrophobicContact CE1-CG 3.86Å; Y214-L218 WeakPolarHBondContact O-CG 3.26Å; Y214-L218 PolarHBondContact O-N 3.49Å; D215-L218 PolarHBondContact O-N 3.02Å; F216-L218 PolarHBondContact O-N 3.49Å
219V80.1Confident84.3Confident108 Ų10897.9 Ų97.966%0.65550%0.502SS*.Hα-helixtrans-80.8-24.6-179.4176.70000112.3D215 F216 R217D215-V219 WeakPolarHBondContact O-CG2 3.37Å; D215-V219 PolarHBondContact O-N 2.93Å; F216-V219 PolarHBondContact O-N 2.9Å; R217-V219 PolarHBondContact O-N 2.96Å
220T77.9Confident83.5Confident34 Ų34103.5 Ų103.521%0.20953%0.53CS..Hα-helixtrans-118.9-16.6-166.657.50000115.5C86 F216 R217C86-T220 HydrophobicContact CB-CG2 4.14Å; F216-T220 HydrophobicContact CD2-CG2 3.94Å; F216-T220 HydrophobicContact CE2-CG2 3.5Å; F216-T220 HydrophobicContact CZ-CG2 4.05Å; F216-T220 PolarHBondContact O-N 3.4Å; F216-T220 PolarHBondContact O-OG1 2.97Å; R217-T220 PolarHBondContact O-N 2.91Å
221V68Low82.5Confident86 Ų86102.5 Ų102.552%0.52152%0.523SS..  trans-108.694.9178.1-174.20000108.5R217R217-V221 HydrophobicContact CG-CB 4.23Å; R217-V221 HydrophobicContact CG-CG2 3.95Å; R217-V221 WeakPolarHBondContact O-CB 3.4Å; R217-V221 PolarHBondContact O-N 3.19Å
222S59Low81.4Confident108 Ų108102.8 Ų102.876%0.75552%0.523SS*.  trans-64.9128.1164.8-32.30000108.9
223E49.3Very low80.1Confident263 Ų263109.3 Ų109.3100%1.22956%0.556SS**  trans-66.20165.6-74.2-173.2162.900111.8

Retrieved 223 of 223 residues in 168.5 ms (Link to these results)

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