A0A096N762_PAPAN Loading...

Tetraspanin

AlphaFold DB (A0A2K5MFX6), UniProt , Accession A0A096N762, Species PAPAN (Papio anubis, Olive baboon), Gene TSPAN6, Length 245 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
1M50.9Low59.9Low230 Ų230106.9 Ų106.9100%1.13355%0.548SS*.  01100-72173.3-17500110
2A52.2Low61.9Low19 Ų19104.7 Ų104.716%0.15755%0.545CS..  trans-74.2143.9174.100000111E243A2-E243 HydrophobicContact CB-CG 4.03Å; A2-E243 WeakPolarHBondContact CB-OE1 3.5Å; A2-E243 WeakPolarHBondContact CB-OE2 3.16Å
3S59Low63.7Low55 Ų55102.2 Ų102.239%0.38554%0.537SS..  trans-62.1143.3178.9134.10000111.3S5 R6S3-S5 PolarHBondContact O-N 3.46Å; S3-S5 PolarHBondContact OG-N 3.32Å; S3-R6 WeakPolarHBondContact O-CB 3.29Å; S3-R6 PolarHBondContact O-N 3.41Å
4P56.8Low65.3Low101 Ų10196.4 Ų96.466%0.65651%0.506SS*.Hα-helixtrans-52.3-29.8178.7-24.731.8000114.4R7 L8P4-R7 PolarHBondContact O-N 3.25Å; P4-L8 PolarHBondContact O-N 2.96Å
5S56.2Low66.8Low82 Ų8295.5 Ų95.557%0.57351%0.507SS*.Hα-helixtrans-64.3-37.9176.4173.70000112.4S3 R7 L8 Q9S3-S5 PolarHBondContact O-N 3.46Å; S3-S5 PolarHBondContact OG-N 3.32Å; S5-R7 PolarHBondContact O-N 3.49Å; S5-L8 PolarHBondContact O-N 3.09Å; S5-Q9 PolarHBondContact O-N 3.5Å
6R59Low68.2Low156 Ų15694.3 Ų94.359%0.58951%0.507SS*.Hα-helixtrans-66.8-33.5176-88.4-174-89.7-156.9-4.1112.6S3 T10S3-R6 WeakPolarHBondContact O-CB 3.29Å; S3-R6 PolarHBondContact O-N 3.41Å; R6-T10 WeakPolarHBondContact O-CG2 3.32Å; R6-T10 PolarHBondContact O-N 3.33Å; R6-T10 PolarHBondContact O-OG1 2.7Å
7R57.6Low69.6Low74 Ų7492 Ų9228%0.27949%0.492SS..Hα-helixtrans-73.7-32177.8-64-167-153.9-139.23.1113.8P4 S5 Q9 T10 E243P4-R7 PolarHBondContact O-N 3.25Å; S5-R7 PolarHBondContact O-N 3.49Å; R7-Q9 VanDerWaalsContact C-N 3.34Å; R7-T10 PolarHBondContact O-OG1 2.83Å; R7-E243 VanDerWaalsContact CZ-O 3.23Å; R7-E243 PolarHBondContact NH1-O 3.46Å; R7-E243 VanDerWaalsContact NH1-O 3.17Å; R7-E243 PolarHBondContact NH2-O 3.34Å
8L58.3Low70.8Confident131 Ų13190 Ų9069%0.68648%0.478SS*.Hα-helixtrans-70.2-34174.7-10583000111.7P4 S5 P12P4-L8 PolarHBondContact O-N 2.96Å; S5-L8 PolarHBondContact O-N 3.09Å; L8-P12 WeakPolarHBondContact O-CD 3.46Å
9Q61.8Low72Confident133 Ų13388.4 Ų88.462%0.62147%0.474SS*.Hα-helixtrans-77-26.4-177.6-163175.4000113.5S5 R7 P12S5-Q9 PolarHBondContact O-N 3.5Å; R7-Q9 VanDerWaalsContact C-N 3.34Å; Q9-P12 WeakPolarHBondContact O-CD 3.4Å; Q9-P12 WeakPolarHBondContact O-CG 3.43Å
10T71Confident73.1Confident55 Ų5587.3 Ų87.334%0.33747%0.471SS..Hα-helixtrans-80.7-26.6179.547.50000113.9R6 R7 V13 I14R6-T10 WeakPolarHBondContact O-CG2 3.32Å; R6-T10 PolarHBondContact O-N 3.33Å; R6-T10 PolarHBondContact O-OG1 2.7Å; R7-T10 PolarHBondContact O-OG1 2.83Å; T10-V13 PolarHBondContact O-N 2.77Å; T10-I14 VanDerWaalsContact O-CG1 3.31Å; T10-I14 WeakPolarHBondContact O-CG1 3.43Å; T10-I14 PolarHBondContact O-N 3.25Å
11K76.4Confident74.2Confident140 Ų14083.1 Ų83.161%0.60945%0.448SS*.Hα-helixtrans-56.1-52.7176-72.6-176.7179.5-175.30114.1V13 I14 T15K11-V13 VanDerWaalsContact C-N 3.28Å; K11-V13 PolarHBondContact O-N 3.48Å; K11-I14 PolarHBondContact O-N 2.75Å; K11-T15 PolarHBondContact O-N 2.96Å; K11-T15 PolarHBondContact O-OG1 2.94Å; K11-T15 VanDerWaalsContact O-OG1 3.07Å
12P84.1Confident76.3Confident80 Ų8074.8 Ų74.852%0.51941%0.408SS..Hα-helixtrans-63.7-34.2179.123.6-33.5000112.4L8 Q9 T15 C16L8-P12 WeakPolarHBondContact O-CD 3.46Å; Q9-P12 WeakPolarHBondContact O-CD 3.4Å; Q9-P12 WeakPolarHBondContact O-CG 3.43Å; P12-T15 PolarHBondContact O-N 3.4Å; P12-C16 WeakPolarHBondContact O-CB 3.45Å; P12-C16 PolarHBondContact O-N 2.84Å
13V84.5Confident78.3Confident72 Ų7278.9 Ų78.944%0.43643%0.427SS..Hα-helixtrans-65.9-46176.9176.40000111.3T10 K11 T15 C16 F17T10-V13 PolarHBondContact O-N 2.77Å; K11-V13 VanDerWaalsContact C-N 3.28Å; K11-V13 PolarHBondContact O-N 3.48Å; V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 PolarHBondContact O-N 3Å; V13-C16 WeakPolarHBondContact O-CB 3.33Å; V13-C16 PolarHBondContact O-N 2.87Å; V13-F17 HydrophobicContact CG1-CD2 3.71Å; V13-F17 HydrophobicContact CG1-CE2 3.48Å; V13-F17 VanDerWaalsContact CG1-CE2 3.48Å; V13-F17 WeakPolarHBondContact O-CD2 3.19Å; V13-F17 PolarHBondContact O-N 3.45Å
14I85.9Confident80Confident21 Ų2176.6 Ų76.611%0.10841%0.409CS..Hα-helixtrans-62.2-42.4176-69166.7000110.7T10 K11 F17 K18 L233 A236 N240T10-I14 VanDerWaalsContact O-CG1 3.31Å; T10-I14 WeakPolarHBondContact O-CG1 3.43Å; T10-I14 PolarHBondContact O-N 3.25Å; K11-I14 PolarHBondContact O-N 2.75Å; I14-F17 PolarHBondContact O-N 3.39Å; I14-K18 HydrophobicContact CG2-CD 4.26Å; I14-K18 WeakPolarHBondContact O-CB 3.37Å; I14-K18 WeakPolarHBondContact O-CG 3.5Å; I14-K18 PolarHBondContact O-N 3.46Å; I14-L233 HydrophobicContact CG2-CD1 4.02Å; I14-A236 HydrophobicContact CD1-CB 4.49Å; I14-A236 HydrophobicContact CG1-CB 3.94Å; I14-N240 HydrophobicContact CD1-CB 4.49Å
15T87.8Confident81.8Confident84 Ų8471.9 Ų71.952%0.51538%0.379SS..Hα-helixtrans-62.2-43.5176-58.10000111.3K11 P12 V13 K18 S19K11-T15 PolarHBondContact O-N 2.96Å; K11-T15 PolarHBondContact O-OG1 2.94Å; K11-T15 VanDerWaalsContact O-OG1 3.07Å; P12-T15 PolarHBondContact O-N 3.4Å; V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 PolarHBondContact O-N 3Å; T15-K18 PolarHBondContact O-N 3.23Å; T15-S19 WeakPolarHBondContact O-CB 3.17Å; T15-S19 PolarHBondContact O-N 3.36Å; T15-S19 PolarHBondContact O-OG 2.86Å; T15-S19 VanDerWaalsContact O-OG 3.05Å
16C90.4Very high83.7Confident76 Ų7674.1 Ų74.151%0.51438%0.378SS..Hα-helixtrans-58.5-52.6175.9-175.70000111.6P12 V13 K18 S19 V20P12-C16 WeakPolarHBondContact O-CB 3.45Å; P12-C16 PolarHBondContact O-N 2.84Å; V13-C16 WeakPolarHBondContact O-CB 3.33Å; V13-C16 PolarHBondContact O-N 2.87Å; C16-K18 VanDerWaalsContact C-N 3.32Å; C16-K18 PolarHBondContact O-N 3.47Å; C16-S19 PolarHBondContact O-N 3.31Å; C16-V20 WeakPolarHBondContact O-CG2 3.44Å; C16-V20 PolarHBondContact O-N 3.09Å
17F90.6Very high85.4Confident55 Ų5570.4 Ų70.424%0.24137%0.369CS..Hα-helixtrans-59.8-40.3178-78.9-61.7000112.8V13 I14 L21 L229 C232 L233V13-F17 HydrophobicContact CG1-CD2 3.71Å; V13-F17 HydrophobicContact CG1-CE2 3.48Å; V13-F17 VanDerWaalsContact CG1-CE2 3.48Å; V13-F17 WeakPolarHBondContact O-CD2 3.19Å; V13-F17 PolarHBondContact O-N 3.45Å; I14-F17 PolarHBondContact O-N 3.39Å; F17-L21 VanDerWaalsContact O-CB 3.23Å; F17-L21 WeakPolarHBondContact O-CB 3.45Å; F17-L21 PolarHBondContact O-N 3.48Å; F17-L229 HydrophobicContact CD1-CD2 3.74Å; F17-L229 HydrophobicContact CE1-CD2 4.04Å; F17-C232 HydrophobicContact CE1-CB 4.19Å; F17-C232 HydrophobicContact CZ-CB 4.32Å; F17-L233 HydrophobicContact CB-CB 4.33Å; F17-L233 HydrophobicContact CB-CD1 4.08Å
18K92.4Very high87Confident56 Ų5669 Ų6924%0.24337%0.365CS..Hα-helixtrans-60.9-48.2174-80.6-178.6169.9-178.30112I14 T15 C16 L21 L22 T82 L233I14-K18 HydrophobicContact CG2-CD 4.26Å; I14-K18 WeakPolarHBondContact O-CB 3.37Å; I14-K18 WeakPolarHBondContact O-CG 3.5Å; I14-K18 PolarHBondContact O-N 3.46Å; T15-K18 PolarHBondContact O-N 3.23Å; C16-K18 VanDerWaalsContact C-N 3.32Å; C16-K18 PolarHBondContact O-N 3.47Å; K18-L21 PolarHBondContact O-N 3.04Å; K18-L22 WeakPolarHBondContact O-CB 3.41Å; K18-L22 WeakPolarHBondContact O-CG 3.3Å; K18-L22 PolarHBondContact O-N 3.21Å; K18-T82 HydrophobicContact CB-CG2 4.11Å; K18-T82 HydrophobicContact CG-CG2 4.02Å; K18-L233 HydrophobicContact CG-CD1 3.74Å; K18-L233 HydrophobicContact CG-CD2 3.75Å; K18-L233 HydrophobicContact CG-CG 4.4Å
19S93.3Very high88.9Confident59 Ų5966.9 Ų66.941%0.41335%0.348SS..Hα-helixtrans-61.4-46.5-179-63.70000111.4T15 C16 L22 I23T15-S19 WeakPolarHBondContact O-CB 3.17Å; T15-S19 PolarHBondContact O-N 3.36Å; T15-S19 PolarHBondContact O-OG 2.86Å; T15-S19 VanDerWaalsContact O-OG 3.05Å; C16-S19 PolarHBondContact O-N 3.31Å; S19-L22 PolarHBondContact O-N 3.46Å; S19-I23 VanDerWaalsContact O-CG1 3.29Å; S19-I23 WeakPolarHBondContact O-CG1 3.39Å; S19-I23 PolarHBondContact O-N 3.39Å
20V94.6Very high90.5Very high66 Ų6663.6 Ų63.640%0.433%0.334SS..Hα-helixtrans-64.5-43.9178.7179.50000111.1C16 L22 I23 Y24 L229C16-V20 WeakPolarHBondContact O-CG2 3.44Å; C16-V20 PolarHBondContact O-N 3.09Å; V20-L22 PolarHBondContact O-N 2.91Å; V20-I23 PolarHBondContact O-N 3.38Å; V20-Y24 WeakPolarHBondContact O-CB 3.37Å; V20-Y24 PolarHBondContact O-N 2.77Å; V20-L229 HydrophobicContact CG1-CD1 3.71Å; V20-L229 HydrophobicContact CG1-CD2 4.21Å
21L94.5Very high91.7Very high0 Ų063.7 Ų63.70%034%0.335CS..Hα-helixtrans-66.5-36178.3-172.961.2000112.2F17 K18 Y24 T25 T82 L90 Y93 L229 A230 L233F17-L21 VanDerWaalsContact O-CB 3.23Å; F17-L21 WeakPolarHBondContact O-CB 3.45Å; F17-L21 PolarHBondContact O-N 3.48Å; K18-L21 PolarHBondContact O-N 3.04Å; L21-Y24 HydrophobicContact CD1-CD1 4.09Å; L21-Y24 WeakPolarHBondContact O-CB 2.89Å; L21-Y24 PolarHBondContact O-N 3.25Å; L21-T25 VanDerWaalsContact O-CG2 3.3Å; L21-T25 WeakPolarHBondContact O-CG2 3.33Å; L21-T25 PolarHBondContact O-N 3.29Å; L21-T25 PolarHBondContact O-OG1 3.39Å; L21-T82 HydrophobicContact CB-CG2 4.38Å; L21-T82 HydrophobicContact CD2-CG2 4.29Å; L21-T82 WeakPolarHBondContact CD2-OG1 3.34Å; L21-T82 HydrophobicContact CG-CG2 4.5Å; L21-L90 HydrophobicContact CD2-CD2 3.74Å; L21-Y93 HydrophobicContact CD1-CE1 4.35Å; L21-L229 HydrophobicContact CD1-CB 4Å; L21-A230 HydrophobicContact CD2-CB 4.31Å; L21-L233 HydrophobicContact CD2-CD2 3.8Å
22L95.1Very high92.7Very high56 Ų5657 Ų5729%0.29331%0.306SS..Hα-helixtrans-63.6-47.4173.7-79.4175.2000111.6K18 S19 V20 Y24 T25 F26 C79 T82K18-L22 WeakPolarHBondContact O-CB 3.41Å; K18-L22 WeakPolarHBondContact O-CG 3.3Å; K18-L22 PolarHBondContact O-N 3.21Å; S19-L22 PolarHBondContact O-N 3.46Å; V20-L22 PolarHBondContact O-N 2.91Å; L22-Y24 VanDerWaalsContact C-N 3.3Å; L22-Y24 PolarHBondContact O-N 2.87Å; L22-T25 WeakPolarHBondContact CA-OG1 3.42Å; L22-T25 PolarHBondContact O-N 2.92Å; L22-T25 PolarHBondContact O-OG1 3.01Å; L22-F26 WeakPolarHBondContact O-CB 3.41Å; L22-F26 PolarHBondContact O-N 3.43Å; L22-C79 HydrophobicContact CD2-CB 4.46Å; L22-T82 HydrophobicContact CD1-CG2 4.44Å; L22-T82 HydrophobicContact CD2-CG2 3.95Å; L22-T82 HydrophobicContact CG-CG2 3.71Å
23I95.8Very high93.4Very high105 Ų10555.8 Ų55.854%0.53830%0.297SS..Hα-helixtrans-57.9-46.3176-68164.5000110.1S19 V20 T25 F26 I27S19-I23 VanDerWaalsContact O-CG1 3.29Å; S19-I23 WeakPolarHBondContact O-CG1 3.39Å; S19-I23 PolarHBondContact O-N 3.39Å; V20-I23 PolarHBondContact O-N 3.38Å; I23-T25 PolarHBondContact O-N 3.48Å; I23-F26 PolarHBondContact O-N 2.92Å; I23-I27 HydrophobicContact CG2-CD1 3.9Å; I23-I27 WeakPolarHBondContact O-CG1 3.43Å; I23-I27 PolarHBondContact O-N 2.87Å
24Y94.8Very high94Very high7 Ų757 Ų573%0.02730%0.3CS..Hα-helixtrans-55-51.1175.2173.1-90.1000112.3V20 L21 L22 F26 I27 F28 L97 F222 G226V20-Y24 WeakPolarHBondContact O-CB 3.37Å; V20-Y24 PolarHBondContact O-N 2.77Å; L21-Y24 HydrophobicContact CD1-CD1 4.09Å; L21-Y24 WeakPolarHBondContact O-CB 2.89Å; L21-Y24 PolarHBondContact O-N 3.25Å; L22-Y24 VanDerWaalsContact C-N 3.3Å; L22-Y24 PolarHBondContact O-N 2.87Å; Y24-F26 VanDerWaalsContact C-N 3.3Å; Y24-F26 PolarHBondContact O-N 3.31Å; Y24-I27 PolarHBondContact O-N 3.48Å; Y24-F28 HydrophobicContact CD1-CD2 4.16Å; Y24-F28 HydrophobicContact CD2-CD2 4.37Å; Y24-F28 HydrophobicContact CD2-CE2 4.24Å; Y24-F28 AromaticContact CE1-CD2 3.71Å; Y24-F28 HydrophobicContact CE1-CD2 3.71Å; Y24-F28 AromaticContact CE1-CE2 3.77Å; Y24-F28 HydrophobicContact CE1-CE2 3.77Å; Y24-F28 AromaticContact CE2-CD2 3.96Å; Y24-F28 HydrophobicContact CE2-CD2 3.96Å; Y24-F28 AromaticContact CE2-CE2 3.45Å; Y24-F28 HydrophobicContact CE2-CE2 3.45Å; Y24-F28 VanDerWaalsContact CE2-CE2 3.45Å; Y24-F28 HydrophobicContact CG-CD2 4.47Å; Y24-F28 AromaticContact CZ-CD2 3.61Å; Y24-F28 AromaticContact CZ-CE2 3.17Å; Y24-F28 PolarHBondContact O-N 3.27Å; Y24-F28 VanDerWaalsContact O-N 3.16Å; Y24-F28 WeakPolarHBondContact OH-CE2 3.42Å; Y24-L97 HydrophobicContact CE1-CD1 4.44Å; Y24-F222 HydrophobicContact CD2-CD1 4.4Å; Y24-F222 HydrophobicContact CD2-CD2 4.34Å; Y24-F222 AromaticContact CD2-CE1 3.79Å; Y24-F222 HydrophobicContact CD2-CE1 3.79Å; Y24-F222 AromaticContact CD2-CE2 3.7Å; Y24-F222 HydrophobicContact CD2-CE2 3.7Å; Y24-F222 AromaticContact CD2-CZ 3.38Å; Y24-F222 HydrophobicContact CD2-CZ 3.38Å; Y24-F222 AromaticContact CE2-CD1 3.76Å; Y24-F222 HydrophobicContact CE2-CD1 3.76Å; Y24-F222 HydrophobicContact CE2-CD2 4.13Å; Y24-F222 AromaticContact CE2-CE1 3.54Å; Y24-F222 HydrophobicContact CE2-CE1 3.54Å; Y24-F222 AromaticContact CE2-CE2 3.91Å; Y24-F222 HydrophobicContact CE2-CE2 3.91Å; Y24-F222 HydrophobicContact CE2-CG 4.05Å; Y24-F222 AromaticContact CE2-CZ 3.6Å; Y24-F222 HydrophobicContact CE2-CZ 3.6Å; Y24-F222 VanDerWaalsContact CE2-O 3.22Å; Y24-F222 WeakPolarHBondContact CE2-O 3.36Å; Y24-F222 HydrophobicContact CG-CZ 4.4Å; Y24-F222 PolarHBondContact OH-O 3.34Å; Y24-G226 VanDerWaalsContact CZ-CA 3.41Å
25T94.9Very high94.5Very high2 Ų259 Ų591%0.01231%0.31CS..Hα-helixtrans-65.3-33.5179.857.30000112.7L21 L22 I23 W29 Y93L21-T25 VanDerWaalsContact O-CG2 3.3Å; L21-T25 WeakPolarHBondContact O-CG2 3.33Å; L21-T25 PolarHBondContact O-N 3.29Å; L21-T25 PolarHBondContact O-OG1 3.39Å; L22-T25 WeakPolarHBondContact CA-OG1 3.42Å; L22-T25 PolarHBondContact O-N 2.92Å; L22-T25 PolarHBondContact O-OG1 3.01Å; I23-T25 PolarHBondContact O-N 3.48Å; T25-W29 WeakPolarHBondContact O-CB 3.31Å; T25-W29 PolarHBondContact O-N 3.32Å; T25-Y93 HydrophobicContact CG2-CE1 4.29Å
26F94.8Very high94.9Very high128 Ų12856.9 Ų56.956%0.56130%0.296SS*.Hα-helixtrans-70.3-41.9178.6-173.5-103.6000111.6L22 I23 Y24 F28 W29 I30L22-F26 WeakPolarHBondContact O-CB 3.41Å; L22-F26 PolarHBondContact O-N 3.43Å; I23-F26 PolarHBondContact O-N 2.92Å; Y24-F26 VanDerWaalsContact C-N 3.3Å; Y24-F26 PolarHBondContact O-N 3.31Å; F26-F28 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 2.7Å; F26-W29 PolarHBondContact O-N 3.05Å; F26-I30 HydrophobicContact CD1-CG1 4.25Å; F26-I30 HydrophobicContact CE1-CD1 4.28Å; F26-I30 HydrophobicContact CE1-CG1 3.89Å; F26-I30 HydrophobicContact CE2-CD1 4.46Å; F26-I30 HydrophobicContact CE2-CG1 4.48Å; F26-I30 HydrophobicContact CZ-CD1 3.97Å; F26-I30 HydrophobicContact CZ-CG1 4.02Å; F26-I30 WeakPolarHBondContact O-CG1 3.41Å; F26-I30 PolarHBondContact O-N 3.29Å
27I94.5Very high95.1Very high78 Ų7855.9 Ų55.940%0.429%0.293SS..Hα-helixtrans-58-49.2173.6-68.2166.4000110I23 Y24 W29 I30 T31 F222I23-I27 HydrophobicContact CG2-CD1 3.9Å; I23-I27 WeakPolarHBondContact O-CG1 3.43Å; I23-I27 PolarHBondContact O-N 2.87Å; Y24-I27 PolarHBondContact O-N 3.48Å; I27-W29 VanDerWaalsContact C-N 3.32Å; I27-W29 PolarHBondContact O-N 3.43Å; I27-I30 PolarHBondContact O-N 3.04Å; I27-T31 WeakPolarHBondContact O-CG2 3.4Å; I27-T31 PolarHBondContact O-N 3.49Å; I27-T31 PolarHBondContact O-OG1 2.8Å; I27-F222 HydrophobicContact CG2-CZ 4.49Å
28F92.6Very high95.3Very high44 Ų4457 Ų5719%0.19330%0.304CS..Hα-helixtrans-59.3-42.5176.1-95.7-73.9000112.7Y24 F26 I30 T31 G32 I71 F222Y24-F28 HydrophobicContact CD1-CD2 4.16Å; Y24-F28 HydrophobicContact CD2-CD2 4.37Å; Y24-F28 HydrophobicContact CD2-CE2 4.24Å; Y24-F28 AromaticContact CE1-CD2 3.71Å; Y24-F28 HydrophobicContact CE1-CD2 3.71Å; Y24-F28 AromaticContact CE1-CE2 3.77Å; Y24-F28 HydrophobicContact CE1-CE2 3.77Å; Y24-F28 AromaticContact CE2-CD2 3.96Å; Y24-F28 HydrophobicContact CE2-CD2 3.96Å; Y24-F28 AromaticContact CE2-CE2 3.45Å; Y24-F28 HydrophobicContact CE2-CE2 3.45Å; Y24-F28 VanDerWaalsContact CE2-CE2 3.45Å; Y24-F28 HydrophobicContact CG-CD2 4.47Å; Y24-F28 AromaticContact CZ-CD2 3.61Å; Y24-F28 AromaticContact CZ-CE2 3.17Å; Y24-F28 PolarHBondContact O-N 3.27Å; Y24-F28 VanDerWaalsContact O-N 3.16Å; Y24-F28 WeakPolarHBondContact OH-CE2 3.42Å; F26-F28 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 2.7Å; F28-I30 VanDerWaalsContact C-N 3.34Å; F28-I30 PolarHBondContact O-N 2.92Å; F28-T31 WeakPolarHBondContact CA-OG1 3.39Å; F28-T31 PolarHBondContact O-N 3.46Å; F28-T31 PolarHBondContact O-OG1 3.5Å; F28-G32 PolarHBondContact O-N 3.15Å; F28-I71 HydrophobicContact CB-CG2 4.41Å; F28-I71 HydrophobicContact CD1-CG2 4.12Å; F28-I71 WeakPolarHBondContact O-CG2 3.35Å; F28-F222 HydrophobicContact CD2-CD1 4.27Å; F28-F222 AromaticContact CD2-CE1 3.62Å; F28-F222 HydrophobicContact CD2-CE1 3.62Å; F28-F222 HydrophobicContact CD2-CZ 4.48Å; F28-F222 AromaticContact CE2-CD1 3.28Å; F28-F222 HydrophobicContact CE2-CD1 3.28Å; F28-F222 AromaticContact CE2-CE1 3.06Å; F28-F222 HydrophobicContact CE2-CE1 3.06Å; F28-F222 HydrophobicContact CE2-CZ 4.16Å; F28-F222 AromaticContact CZ-CD1 3.56Å; F28-F222 HydrophobicContact CZ-CD1 3.56Å; F28-F222 AromaticContact CZ-CE1 3.75Å; F28-F222 HydrophobicContact CZ-CE1 3.75Å
29W96.4Very high95.2Very high87 Ų8754.3 Ų54.333%0.3329%0.293SS..Hα-helixtrans-60.9-45178.8-173.886.7000111.7T25 F26 I27 G32 V33T25-W29 WeakPolarHBondContact O-CB 3.31Å; T25-W29 PolarHBondContact O-N 3.32Å; F26-W29 PolarHBondContact O-N 3.05Å; I27-W29 VanDerWaalsContact C-N 3.32Å; I27-W29 PolarHBondContact O-N 3.43Å; W29-G32 PolarHBondContact O-N 2.65Å; W29-V33 HydrophobicContact CD2-CG2 4.17Å; W29-V33 HydrophobicContact CE3-CG2 4.06Å; W29-V33 HydrophobicContact CH2-CG2 3.79Å; W29-V33 HydrophobicContact CZ2-CG2 3.89Å; W29-V33 HydrophobicContact CZ3-CG2 3.87Å; W29-V33 WeakPolarHBondContact O-CG2 3.16Å; W29-V33 PolarHBondContact O-N 2.93Å
30I97.1Very high95.1Very high65 Ų6555.4 Ų55.433%0.33329%0.293SS..Hα-helixtrans-62.6-44177-66-69.4000111.3F26 I27 F28 G32 V33 I34F26-I30 HydrophobicContact CD1-CG1 4.25Å; F26-I30 HydrophobicContact CE1-CD1 4.28Å; F26-I30 HydrophobicContact CE1-CG1 3.89Å; F26-I30 HydrophobicContact CE2-CD1 4.46Å; F26-I30 HydrophobicContact CE2-CG1 4.48Å; F26-I30 HydrophobicContact CZ-CD1 3.97Å; F26-I30 HydrophobicContact CZ-CG1 4.02Å; F26-I30 WeakPolarHBondContact O-CG1 3.41Å; F26-I30 PolarHBondContact O-N 3.29Å; I27-I30 PolarHBondContact O-N 3.04Å; F28-I30 VanDerWaalsContact C-N 3.34Å; F28-I30 PolarHBondContact O-N 2.92Å; I30-G32 VanDerWaalsContact C-N 3.28Å; I30-G32 PolarHBondContact O-N 2.97Å; I30-V33 PolarHBondContact O-N 3.24Å; I30-I34 HydrophobicContact CG2-CD1 3.94Å; I30-I34 WeakPolarHBondContact O-CG1 3.34Å; I30-I34 PolarHBondContact O-N 3Å
31T95.6Very high94.9Very high56 Ų5661.7 Ų61.734%0.34431%0.31SS..Hα-helixtrans-62.8-37.7176.859.10000111.6I27 F28 I34 L35I27-T31 WeakPolarHBondContact O-CG2 3.4Å; I27-T31 PolarHBondContact O-N 3.49Å; I27-T31 PolarHBondContact O-OG1 2.8Å; F28-T31 WeakPolarHBondContact CA-OG1 3.39Å; F28-T31 PolarHBondContact O-N 3.46Å; F28-T31 PolarHBondContact O-OG1 3.5Å; T31-I34 PolarHBondContact O-N 3.19Å; T31-L35 WeakPolarHBondContact O-CB 3.34Å; T31-L35 WeakPolarHBondContact O-CG 3.03Å; T31-L35 PolarHBondContact O-N 3.29Å
32G97.3Very high94.4Very high0 Ų062.6 Ų62.60%032%0.32CS..Hα-helixtrans-60.4-43.5172.800000113.3F28 W29 I30 L35 L36F28-G32 PolarHBondContact O-N 3.15Å; W29-G32 PolarHBondContact O-N 2.65Å; I30-G32 VanDerWaalsContact C-N 3.28Å; I30-G32 PolarHBondContact O-N 2.97Å; G32-L35 PolarHBondContact O-N 2.9Å; G32-L36 WeakPolarHBondContact O-CB 3.36Å; G32-L36 PolarHBondContact O-N 3.46Å
33V97.8Very high93.9Very high55 Ų5563 Ų6333%0.33332%0.319SS..Hα-helixtrans-62.7-43.7175.8173.40000111.5W29 I30 L36 A37 I72W29-V33 HydrophobicContact CD2-CG2 4.17Å; W29-V33 HydrophobicContact CE3-CG2 4.06Å; W29-V33 HydrophobicContact CH2-CG2 3.79Å; W29-V33 HydrophobicContact CZ2-CG2 3.89Å; W29-V33 HydrophobicContact CZ3-CG2 3.87Å; W29-V33 WeakPolarHBondContact O-CG2 3.16Å; W29-V33 PolarHBondContact O-N 2.93Å; I30-V33 PolarHBondContact O-N 3.24Å; V33-L36 PolarHBondContact O-N 2.84Å; V33-A37 WeakPolarHBondContact O-CB 3.49Å; V33-A37 PolarHBondContact O-N 3.1Å; V33-I72 HydrophobicContact CG2-CD1 3.91Å; V33-I72 HydrophobicContact CG2-CG1 4.04Å
34I97.3Very high93.2Very high97 Ų9761.1 Ų61.150%0.49731%0.312SS..Hα-helixtrans-62.3-47.4177.2-66.6167.5000110.4I30 T31 L36 A37 V38I30-I34 HydrophobicContact CG2-CD1 3.94Å; I30-I34 WeakPolarHBondContact O-CG1 3.34Å; I30-I34 PolarHBondContact O-N 3Å; T31-I34 PolarHBondContact O-N 3.19Å; I34-L36 VanDerWaalsContact C-N 3.35Å; I34-L36 PolarHBondContact O-N 2.97Å; I34-A37 PolarHBondContact O-N 2.59Å; I34-V38 HydrophobicContact CG2-CG2 4.38Å; I34-V38 VanDerWaalsContact O-CG2 3.32Å; I34-V38 WeakPolarHBondContact O-CG2 3.01Å; I34-V38 PolarHBondContact O-N 3.39Å
35L96.3Very high92.4Very high63 Ų6362.8 Ų62.833%0.3333%0.325SS..Hα-helixtrans-61.9-41.8178.6-74.1175.3000112.3T31 G32 V38 G39 I71T31-L35 WeakPolarHBondContact O-CB 3.34Å; T31-L35 WeakPolarHBondContact O-CG 3.03Å; T31-L35 PolarHBondContact O-N 3.29Å; G32-L35 PolarHBondContact O-N 2.9Å; L35-V38 PolarHBondContact O-N 3.08Å; L35-G39 PolarHBondContact O-N 2.86Å; L35-I71 HydrophobicContact CD1-CD1 3.76Å
36L96.4Very high91.2Very high39 Ų3964.9 Ų64.920%0.20434%0.335CS..Hα-helixtrans-62.7-46.1175.8-178.862.3000111.1G32 V33 I34 G39 I40 I65 I72G32-L36 WeakPolarHBondContact O-CB 3.36Å; G32-L36 PolarHBondContact O-N 3.46Å; V33-L36 PolarHBondContact O-N 2.84Å; I34-L36 VanDerWaalsContact C-N 3.35Å; I34-L36 PolarHBondContact O-N 2.97Å; L36-G39 PolarHBondContact O-N 3.4Å; L36-I40 HydrophobicContact CD1-CD1 3.97Å; L36-I40 HydrophobicContact CD1-CG1 4.26Å; L36-I40 HydrophobicContact CG-CD1 3.88Å; L36-I40 VanDerWaalsContact O-CG1 3.29Å; L36-I40 WeakPolarHBondContact O-CG1 3.43Å; L36-I40 PolarHBondContact O-N 3.14Å; L36-I65 HydrophobicContact CD1-CB 4.25Å; L36-I65 HydrophobicContact CD1-CG1 4.42Å; L36-I65 HydrophobicContact CD1-CG2 3.78Å; L36-I72 HydrophobicContact CB-CD1 4.21Å; L36-I72 HydrophobicContact CD2-CD1 3.69Å
37A95.8Very high89.8Confident56 Ų5662.9 Ų62.946%0.46333%0.328SS..Hα-helixtrans-61.6-45.9178.300000111.8V33 I34 G39 I40 W41V33-A37 WeakPolarHBondContact O-CB 3.49Å; V33-A37 PolarHBondContact O-N 3.1Å; I34-A37 PolarHBondContact O-N 2.59Å; A37-G39 VanDerWaalsContact C-N 3.35Å; A37-G39 PolarHBondContact O-N 3.37Å; A37-I40 PolarHBondContact O-N 3.34Å; A37-W41 VanDerWaalsContact O-CB 3.26Å; A37-W41 WeakPolarHBondContact O-CB 3.48Å; A37-W41 PolarHBondContact O-N 3.08Å
38V93.5Very high88.2Confident77 Ų7764.1 Ų64.147%0.46734%0.335SS..Hα-helixtrans-63.4-41175.8173.70000111.1I34 L35 W41 G42 L64I34-V38 HydrophobicContact CG2-CG2 4.38Å; I34-V38 VanDerWaalsContact O-CG2 3.32Å; I34-V38 WeakPolarHBondContact O-CG2 3.01Å; I34-V38 PolarHBondContact O-N 3.39Å; L35-V38 PolarHBondContact O-N 3.08Å; V38-W41 PolarHBondContact O-N 2.93Å; V38-G42 PolarHBondContact O-N 3.43Å; V38-L64 HydrophobicContact CB-CD2 4.45Å; V38-L64 HydrophobicContact CG1-CD2 3.8Å
39G91.8Very high86.4Confident1 Ų168.4 Ų68.41%0.0135%0.351CS..Hα-helixtrans-63.1-45.5176.900000112.8L35 L36 A37 G42 K43 I65L35-G39 PolarHBondContact O-N 2.86Å; L36-G39 PolarHBondContact O-N 3.4Å; A37-G39 VanDerWaalsContact C-N 3.35Å; A37-G39 PolarHBondContact O-N 3.37Å; G39-G42 PolarHBondContact O-N 2.76Å; G39-K43 WeakPolarHBondContact O-CB 3.36Å; G39-K43 PolarHBondContact O-N 2.93Å; G39-I65 VanDerWaalsContact C-CG1 3.5Å
40I91.2Very high84.4Confident82 Ų8265.7 Ų65.742%0.42134%0.342SS..Hα-helixtrans-64.5-46.4175.4-67.1168.6000110.3L36 A37 G42 K43 V44 I65L36-I40 HydrophobicContact CD1-CD1 3.97Å; L36-I40 HydrophobicContact CD1-CG1 4.26Å; L36-I40 HydrophobicContact CG-CD1 3.88Å; L36-I40 VanDerWaalsContact O-CG1 3.29Å; L36-I40 WeakPolarHBondContact O-CG1 3.43Å; L36-I40 PolarHBondContact O-N 3.14Å; A37-I40 PolarHBondContact O-N 3.34Å; I40-G42 VanDerWaalsContact C-N 3.29Å; I40-G42 PolarHBondContact O-N 3.27Å; I40-K43 WeakPolarHBondContact O-CB 3.23Å; I40-K43 PolarHBondContact O-N 2.76Å; I40-K43 VanDerWaalsContact O-N 3.14Å; I40-V44 HydrophobicContact CG2-CG2 4.22Å; I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.41Å; I40-I65 HydrophobicContact CG1-CD1 4.25Å; I40-I65 HydrophobicContact CG1-CG1 4.17Å
41W89.9Confident82.2Confident197 Ų19767.3 Ų67.375%0.74636%0.359SS*.Hα-helixtrans-57.7-44.8176.7-178.6-86.9000111.5A37 V38 V44 S45A37-W41 VanDerWaalsContact O-CB 3.26Å; A37-W41 WeakPolarHBondContact O-CB 3.48Å; A37-W41 PolarHBondContact O-N 3.08Å; V38-W41 PolarHBondContact O-N 2.93Å; W41-V44 PolarHBondContact O-N 3.48Å; W41-S45 PolarHBondContact NE1-OG 3.48Å; W41-S45 WeakPolarHBondContact O-CB 3.3Å; W41-S45 PolarHBondContact O-N 3.35Å; W41-S45 PolarHBondContact O-OG 3.24Å
42G84.6Confident80.1Confident20 Ų2071.5 Ų71.521%0.20638%0.378CS..Hα-helixtrans-58.6-49.6174.500000110.9V38 G39 I40 V44 S45 L46V38-G42 PolarHBondContact O-N 3.43Å; G39-G42 PolarHBondContact O-N 2.76Å; I40-G42 VanDerWaalsContact C-N 3.29Å; I40-G42 PolarHBondContact O-N 3.27Å; G42-V44 PolarHBondContact O-N 3.33Å; G42-S45 PolarHBondContact O-N 2.9Å; G42-L46 VanDerWaalsContact O-CB 3.29Å; G42-L46 WeakPolarHBondContact O-CB 3.35Å; G42-L46 VanDerWaalsContact O-CD1 3.28Å; G42-L46 WeakPolarHBondContact O-CD1 3.24Å; G42-L46 PolarHBondContact O-N 2.87Å
43K83.5Confident77.7Confident65 Ų6574.7 Ų74.728%0.28340%0.395SS..Hα-helixtrans-58.4-50.1178-175.3-171.5168.8-165.20112.2G39 I40 L46 E47 P61 F62 I65G39-K43 WeakPolarHBondContact O-CB 3.36Å; G39-K43 PolarHBondContact O-N 2.93Å; I40-K43 WeakPolarHBondContact O-CB 3.23Å; I40-K43 PolarHBondContact O-N 2.76Å; I40-K43 VanDerWaalsContact O-N 3.14Å; K43-L46 CarbonylContact O-C 3.47Å; K43-L46 WeakPolarHBondContact O-CA 3.38Å; K43-L46 WeakPolarHBondContact O-CB 3.41Å; K43-L46 PolarHBondContact O-N 2.93Å; K43-L46 VanDerWaalsContact O-N 3.11Å; K43-E47 WeakPolarHBondContact CE-OE1 3.36Å; K43-E47 WeakPolarHBondContact CE-OE2 3.28Å; K43-E47 HydrophobicContact CG-CG 4.41Å; K43-E47 IonicContact NZ-OE1 3.92Å; K43-E47 PolarHBondContact NZ-OE1 3.15Å; K43-E47 IonicContact NZ-OE2 3.29Å; K43-E47 WeakPolarHBondContact O-CB 3.32Å; K43-E47 PolarHBondContact O-N 3.17Å; K43-P61 HydrophobicContact CB-CB 4.15Å; K43-F62 HydrophobicContact CD-CE1 4.25Å; K43-F62 HydrophobicContact CD-CZ 4.48Å; K43-I65 HydrophobicContact CB-CD1 4.19Å; K43-I65 HydrophobicContact CD-CD1 4.2Å
44V82.1Confident75.4Confident64 Ų6480.2 Ų80.239%0.38842%0.423SS..Hα-helixtrans-65.3-42.8-179.1172.10000110.7I40 W41 G42 L46 E47 N48I40-V44 HydrophobicContact CG2-CG2 4.22Å; I40-V44 WeakPolarHBondContact O-CG2 3.42Å; I40-V44 PolarHBondContact O-N 3.41Å; W41-V44 PolarHBondContact O-N 3.48Å; G42-V44 PolarHBondContact O-N 3.33Å; V44-L46 PolarHBondContact O-N 3.34Å; V44-E47 PolarHBondContact O-N 3.41Å; V44-N48 WeakPolarHBondContact O-CB 3.29Å; V44-N48 PolarHBondContact O-N 2.95Å
45S77.8Confident73.3Confident42 Ų4278.5 Ų78.529%0.29441%0.412SS..Hα-helixtrans-63-28174.5-60.40000111.8W41 G42 Y49W41-S45 PolarHBondContact NE1-OG 3.48Å; W41-S45 WeakPolarHBondContact O-CB 3.3Å; W41-S45 PolarHBondContact O-N 3.35Å; W41-S45 PolarHBondContact O-OG 3.24Å; G42-S45 PolarHBondContact O-N 2.9Å; S45-Y49 WeakPolarHBondContact O-CD2 3.45Å; S45-Y49 VanDerWaalsContact O-CE2 3.3Å; S45-Y49 WeakPolarHBondContact O-CE2 3.39Å
46L69Low71.2Confident46 Ų4684.6 Ų84.624%0.24144%0.436CS..Hα-helixtrans-81.5-41.7173.1-87.9144.9000111.6G42 K43 V44 Y49 F50 T58 P61G42-L46 VanDerWaalsContact O-CB 3.29Å; G42-L46 WeakPolarHBondContact O-CB 3.35Å; G42-L46 VanDerWaalsContact O-CD1 3.28Å; G42-L46 WeakPolarHBondContact O-CD1 3.24Å; G42-L46 PolarHBondContact O-N 2.87Å; K43-L46 CarbonylContact O-C 3.47Å; K43-L46 WeakPolarHBondContact O-CA 3.38Å; K43-L46 WeakPolarHBondContact O-CB 3.41Å; K43-L46 PolarHBondContact O-N 2.93Å; K43-L46 VanDerWaalsContact O-N 3.11Å; V44-L46 PolarHBondContact O-N 3.34Å; L46-Y49 WeakPolarHBondContact O-CB 3.49Å; L46-Y49 PolarHBondContact O-N 3.23Å; L46-Y49 VanDerWaalsContact O-N 3.13Å; L46-F50 VanDerWaalsContact C-CD2 3.47Å; L46-F50 HydrophobicContact CB-CD2 4.02Å; L46-F50 HydrophobicContact CB-CE2 3.72Å; L46-F50 HydrophobicContact CD2-CD2 4.39Å; L46-F50 HydrophobicContact CD2-CE2 3.34Å; L46-F50 HydrophobicContact CD2-CZ 3.7Å; L46-F50 HydrophobicContact CG-CE2 4.14Å; L46-F50 WeakPolarHBondContact O-CD2 3.42Å; L46-F50 WeakPolarHBondContact O-CG 3.46Å; L46-F50 PolarHBondContact O-N 3.49Å; L46-T58 HydrophobicContact CD2-CG2 4.43Å; L46-P61 HydrophobicContact CD1-CG 3.43Å; L46-P61 VanDerWaalsContact CD1-CG 3.43Å
47E65.1Low69.3Low87 Ų8784.2 Ų84.241%0.40744%0.439SS..Hα-helixtrans-66.9-35.7179.4-83.2-177.4163.700113.7K43 V44 Y49 F50 S51K43-E47 WeakPolarHBondContact CE-OE1 3.36Å; K43-E47 WeakPolarHBondContact CE-OE2 3.28Å; K43-E47 HydrophobicContact CG-CG 4.41Å; K43-E47 IonicContact NZ-OE1 3.92Å; K43-E47 PolarHBondContact NZ-OE1 3.15Å; K43-E47 IonicContact NZ-OE2 3.29Å; K43-E47 WeakPolarHBondContact O-CB 3.32Å; K43-E47 PolarHBondContact O-N 3.17Å; V44-E47 PolarHBondContact O-N 3.41Å; E47-Y49 PolarHBondContact O-N 3Å; E47-F50 PolarHBondContact O-N 2.91Å; E47-S51 WeakPolarHBondContact O-CB 3.39Å; E47-S51 PolarHBondContact O-N 3.41Å; E47-S51 PolarHBondContact O-OG 3.14Å
48N60.4Low67.8Low103 Ų10384.5 Ų84.555%0.55144%0.435SS*.Hα-helixtrans-61.7-23.4172.9-73.6-17.9000112.2V44V44-N48 WeakPolarHBondContact O-CB 3.29Å; V44-N48 PolarHBondContact O-N 2.95Å
49Y54.8Low66.9Low135 Ų13587 Ų8753%0.52945%0.445SS..Hα-helixtrans-91.8-39.5174.6-70.5-112.4000110.7S45 L46 E47 L52 L53S45-Y49 WeakPolarHBondContact O-CD2 3.45Å; S45-Y49 VanDerWaalsContact O-CE2 3.3Å; S45-Y49 WeakPolarHBondContact O-CE2 3.39Å; L46-Y49 WeakPolarHBondContact O-CB 3.49Å; L46-Y49 PolarHBondContact O-N 3.23Å; L46-Y49 VanDerWaalsContact O-N 3.13Å; E47-Y49 PolarHBondContact O-N 3Å; Y49-L52 PolarHBondContact O-N 2.9Å; Y49-L53 WeakPolarHBondContact O-CD1 3.44Å
50F54.5Low66.4Low30 Ų3091.4 Ų91.413%0.13247%0.472CS..Hα-helixtrans-74-29-179.7-69.4-54.3000115.2L46 E47 L52 L53 N54 E55 A57L46-F50 VanDerWaalsContact C-CD2 3.47Å; L46-F50 HydrophobicContact CB-CD2 4.02Å; L46-F50 HydrophobicContact CB-CE2 3.72Å; L46-F50 HydrophobicContact CD2-CD2 4.39Å; L46-F50 HydrophobicContact CD2-CE2 3.34Å; L46-F50 HydrophobicContact CD2-CZ 3.7Å; L46-F50 HydrophobicContact CG-CE2 4.14Å; L46-F50 WeakPolarHBondContact O-CD2 3.42Å; L46-F50 WeakPolarHBondContact O-CG 3.46Å; L46-F50 PolarHBondContact O-N 3.49Å; E47-F50 PolarHBondContact O-N 2.91Å; F50-L52 PolarHBondContact O-N 3.45Å; F50-L52 VanDerWaalsContact O-N 3.14Å; F50-L53 PolarHBondContact O-N 2.81Å; F50-N54 PolarHBondContact O-N 3.16Å; F50-E55 WeakPolarHBondContact CD1-O 3.49Å; F50-A57 HydrophobicContact CD2-CB 3.84Å; F50-A57 HydrophobicContact CE2-CB 3.46Å; F50-A57 VanDerWaalsContact CE2-CB 3.46Å; F50-A57 HydrophobicContact CZ-CB 4.29Å
51S50.8Low66.2Low98 Ų9888 Ų8869%0.68546%0.455SS*.THydrogen-bonded Turntrans-61.4-18.7173.754.20000112.5E47E47-S51 WeakPolarHBondContact O-CB 3.39Å; E47-S51 PolarHBondContact O-N 3.41Å; E47-S51 PolarHBondContact O-OG 3.14Å
52L52.4Low66.1Low144 Ų14483.4 Ų83.475%0.75444%0.441SS*.THydrogen-bonded Turntrans-89-15.1172-60.6173.1000113.5Y49 F50Y49-L52 PolarHBondContact O-N 2.9Å; F50-L52 PolarHBondContact O-N 3.45Å; F50-L52 VanDerWaalsContact O-N 3.14Å
53L47.1Very low66.5Low68 Ų6886.6 Ų86.636%0.35646%0.456SS..THydrogen-bonded Turntrans-135.12.1-158.8-67.3164000115.9Y49 F50 E55 G137Y49-L53 WeakPolarHBondContact O-CD1 3.44Å; F50-L53 PolarHBondContact O-N 2.81Å; L53-E55 VanDerWaalsContact C-N 3.26Å; L53-E55 PolarHBondContact O-N 3.3Å; L53-E55 VanDerWaalsContact O-N 3.08Å; L53-G137 WeakPolarHBondContact CD1-O 3.41Å
54N50Low66.9Low171 Ų17186 Ų8691%0.91446%0.455SS*.  trans52.833166.8-130.714.7000115.7F50F50-N54 PolarHBondContact O-N 3.16Å
55E52.3Low67.5Low60 Ų6084.6 Ų84.628%0.2845%0.446SS..  trans-125.3157.2178.7-83.7-160135.300113.4F50 L53 D138 Y139 R140F50-E55 WeakPolarHBondContact CD1-O 3.49Å; L53-E55 VanDerWaalsContact C-N 3.26Å; L53-E55 PolarHBondContact O-N 3.3Å; L53-E55 VanDerWaalsContact O-N 3.08Å; E55-D138 WeakPolarHBondContact OE2-CB 3.17Å; E55-Y139 HydrophobicContact CB-CD1 4.22Å; E55-Y139 VanDerWaalsContact CD-CD1 3.49Å; E55-Y139 HydrophobicContact CG-CD1 4.43Å; E55-Y139 WeakPolarHBondContact OE2-CD1 3.5Å; E55-Y139 PolarHBondContact OE2-N 2.89Å; E55-R140 IonicContact OE1-NH2 3.21Å; E55-R140 PolarHBondContact OE1-NH2 3.24Å
56K53.3Low68.3Low191 Ų19184.3 Ų84.383%0.8345%0.449SS*.PPolyproline II helixtrans-76.5131-174.4-65.7-176.7-179.9-178.60111.5
57A54.8Low69.5Low31 Ų3185.5 Ų85.526%0.25646%0.458SS..PPolyproline II helixtrans-63157178.600000114.1F50 F62F50-A57 HydrophobicContact CD2-CB 3.84Å; F50-A57 HydrophobicContact CE2-CB 3.46Å; F50-A57 VanDerWaalsContact CE2-CB 3.46Å; F50-A57 HydrophobicContact CZ-CB 4.29Å; A57-F62 HydrophobicContact CB-CE2 4.3Å
58T64.8Low71Confident63 Ų6381.3 Ų81.339%0.38744%0.439SS..PPolyproline II helixtrans-63.5148.4170.683.10000110L46 V60 P61L46-T58 HydrophobicContact CD2-CG2 4.43Å; T58-V60 PolarHBondContact O-N 2.03Å; T58-P61 WeakPolarHBondContact O-CD 3.37Å; T58-P61 WeakPolarHBondContact OG1-CD 3.39Å
59N75.1Confident72.8Confident128 Ų12879.1 Ų79.168%0.68443%0.429SS*.SBendtrans-75.8-9.9-179.8-68-23.2000113.2F62 V63N59-F62 PolarHBondContact O-N 3.12Å; N59-V63 WeakPolarHBondContact O-CG2 3.18Å; N59-V63 PolarHBondContact O-N 3.4Å; N59-V63 VanDerWaalsContact O-N 3.1Å
60V81.2Confident74.8Confident95 Ų9576.4 Ų76.458%0.57643%0.426SS*.Hα-helixtrans-62.1-50.3-172.3177.60000112.8T58 F62 V63 L64T58-V60 PolarHBondContact O-N 2.03Å; V60-F62 VanDerWaalsContact C-N 3.26Å; V60-F62 PolarHBondContact O-N 3.13Å; V60-V63 WeakPolarHBondContact O-CB 3Å; V60-V63 PolarHBondContact O-N 3.01Å; V60-V63 VanDerWaalsContact O-N 3.13Å; V60-L64 HydrophobicContact CG1-CD1 3.94Å; V60-L64 VanDerWaalsContact O-CD1 3.23Å; V60-L64 WeakPolarHBondContact O-CD1 3.32Å; V60-L64 PolarHBondContact O-N 3.21Å; V60-L64 VanDerWaalsContact O-N 3.11Å
61P87Confident76.8Confident9 Ų976.4 Ų76.46%0.05843%0.428CS..Hα-helixtrans-59.6-35.6176.7-17.626.5000113K43 L46 T58 V63 L64 I65K43-P61 HydrophobicContact CB-CB 4.15Å; L46-P61 HydrophobicContact CD1-CG 3.43Å; L46-P61 VanDerWaalsContact CD1-CG 3.43Å; T58-P61 WeakPolarHBondContact O-CD 3.37Å; T58-P61 WeakPolarHBondContact OG1-CD 3.39Å; P61-V63 VanDerWaalsContact C-N 3.34Å; P61-V63 PolarHBondContact O-N 2.86Å; P61-L64 PolarHBondContact O-N 3.29Å; P61-I65 VanDerWaalsContact O-CG1 3.25Å; P61-I65 WeakPolarHBondContact O-CG1 3.3Å; P61-I65 PolarHBondContact O-N 3.05Å
62F88.4Confident79Confident101 Ų10173.2 Ų73.244%0.44340%0.403SS..Hα-helixtrans-65.4-38.1177.2-67.4-75.2000112.1K43 A57 N59 V60 I65 G66K43-F62 HydrophobicContact CD-CE1 4.25Å; K43-F62 HydrophobicContact CD-CZ 4.48Å; A57-F62 HydrophobicContact CB-CE2 4.3Å; N59-F62 PolarHBondContact O-N 3.12Å; V60-F62 VanDerWaalsContact C-N 3.26Å; V60-F62 PolarHBondContact O-N 3.13Å; F62-I65 PolarHBondContact O-N 2.9Å; F62-G66 PolarHBondContact O-N 3.36Å
63V91.3Very high81.1Confident87 Ų8771.6 Ų71.653%0.52739%0.394SS..Hα-helixtrans-62.4-44.9172.9175.80000110.5N59 V60 P61 I65 G66 T67N59-V63 WeakPolarHBondContact O-CG2 3.18Å; N59-V63 PolarHBondContact O-N 3.4Å; N59-V63 VanDerWaalsContact O-N 3.1Å; V60-V63 WeakPolarHBondContact O-CB 3Å; V60-V63 PolarHBondContact O-N 3.01Å; V60-V63 VanDerWaalsContact O-N 3.13Å; P61-V63 VanDerWaalsContact C-N 3.34Å; P61-V63 PolarHBondContact O-N 2.86Å; V63-I65 PolarHBondContact O-N 3.45Å; V63-G66 PolarHBondContact O-N 3.4Å; V63-T67 WeakPolarHBondContact O-CB 3.47Å; V63-T67 PolarHBondContact O-N 3.08Å; V63-T67 PolarHBondContact O-OG1 3.22Å
64L92.6Very high83.4Confident52 Ų5269.9 Ų69.927%0.27239%0.385SS..Hα-helixtrans-61.8-44.7177.2-87.972.3000112.2V38 V60 P61 G68V38-L64 HydrophobicContact CB-CD2 4.45Å; V38-L64 HydrophobicContact CG1-CD2 3.8Å; V60-L64 HydrophobicContact CG1-CD1 3.94Å; V60-L64 VanDerWaalsContact O-CD1 3.23Å; V60-L64 WeakPolarHBondContact O-CD1 3.32Å; V60-L64 PolarHBondContact O-N 3.21Å; V60-L64 VanDerWaalsContact O-N 3.11Å; P61-L64 PolarHBondContact O-N 3.29Å; L64-G68 PolarHBondContact O-N 3.02Å
65I94.4Very high85.6Confident36 Ų3661.8 Ų61.819%0.18534%0.342CS..Hα-helixtrans-61.3-48.3177-69.1167.6000110.5L36 G39 I40 K43 P61 F62 V63 T69L36-I65 HydrophobicContact CD1-CB 4.25Å; L36-I65 HydrophobicContact CD1-CG1 4.42Å; L36-I65 HydrophobicContact CD1-CG2 3.78Å; G39-I65 VanDerWaalsContact C-CG1 3.5Å; I40-I65 HydrophobicContact CG1-CD1 4.25Å; I40-I65 HydrophobicContact CG1-CG1 4.17Å; K43-I65 HydrophobicContact CB-CD1 4.19Å; K43-I65 HydrophobicContact CD-CD1 4.2Å; P61-I65 VanDerWaalsContact O-CG1 3.25Å; P61-I65 WeakPolarHBondContact O-CG1 3.3Å; P61-I65 PolarHBondContact O-N 3.05Å; F62-I65 PolarHBondContact O-N 2.9Å; V63-I65 PolarHBondContact O-N 3.45Å; I65-T69 WeakPolarHBondContact O-CB 3.47Å; I65-T69 PolarHBondContact O-N 3.04Å; I65-T69 PolarHBondContact O-OG1 2.89Å
66G95.1Very high87.7Confident35 Ų3561.1 Ų61.136%0.36134%0.342SS..Hα-helixtrans-60.7-52.7-179.900000111.7F62 V63 G68 T69 V70F62-G66 PolarHBondContact O-N 3.36Å; V63-G66 PolarHBondContact O-N 3.4Å; G66-G68 PolarHBondContact O-N 2.95Å; G66-T69 PolarHBondContact O-N 3.04Å; G66-V70 WeakPolarHBondContact O-CG2 3.04Å; G66-V70 PolarHBondContact O-N 3Å
67T94.5Very high89.7Confident71 Ų7154.5 Ų54.544%0.43631%0.314SS..Hα-helixtrans-61.4-45.4179-58.10000111.7V63 T69 V70 I71V63-T67 WeakPolarHBondContact O-CB 3.47Å; V63-T67 PolarHBondContact O-N 3.08Å; V63-T67 PolarHBondContact O-OG1 3.22Å; T67-T69 VanDerWaalsContact C-N 3.34Å; T67-T69 PolarHBondContact O-N 3.49Å; T67-V70 PolarHBondContact O-N 3.32Å; T67-I71 HydrophobicContact CG2-CD1 3.83Å; T67-I71 HydrophobicContact CG2-CG1 4.47Å; T67-I71 VanDerWaalsContact O-CG1 3.28Å; T67-I71 WeakPolarHBondContact O-CG1 2.98Å; T67-I71 PolarHBondContact O-N 3.48Å
68G97.2Very high91.6Very high0 Ų053 Ų530%030%0.301CS..Hα-helixtrans-59.1-43.517700000112.6L64 G66 I71 I72L64-G68 PolarHBondContact O-N 3.02Å; G66-G68 PolarHBondContact O-N 2.95Å; G68-I71 PolarHBondContact O-N 3.26Å; G68-I72 VanDerWaalsContact O-CG1 3.3Å; G68-I72 WeakPolarHBondContact O-CG1 3.47Å; G68-I72 PolarHBondContact O-N 3.27Å
69T97.2Very high93Very high56 Ų5652.4 Ų52.434%0.34430%0.299SS..Hα-helixtrans-62.3-46.2176.7-55.20000111.8I65 G66 T67 I71 I72 L73I65-T69 WeakPolarHBondContact O-CB 3.47Å; I65-T69 PolarHBondContact O-N 3.04Å; I65-T69 PolarHBondContact O-OG1 2.89Å; G66-T69 PolarHBondContact O-N 3.04Å; T67-T69 VanDerWaalsContact C-N 3.34Å; T67-T69 PolarHBondContact O-N 3.49Å; T69-I71 VanDerWaalsContact C-N 3.33Å; T69-I71 PolarHBondContact O-N 2.85Å; T69-I72 PolarHBondContact O-N 3.39Å; T69-L73 HydrophobicContact CG2-CD1 4.35Å; T69-L73 WeakPolarHBondContact O-CG 3.4Å; T69-L73 PolarHBondContact O-N 3.06Å
70V96.3Very high93.9Very high78 Ų7852.2 Ų52.247%0.47329%0.293SS..Hα-helixtrans-60.7-43.5177.9170.30000110.9G66 T67 I72 L73 L74G66-V70 WeakPolarHBondContact O-CG2 3.04Å; G66-V70 PolarHBondContact O-N 3Å; T67-V70 PolarHBondContact O-N 3.32Å; V70-I72 PolarHBondContact O-N 2.85Å; V70-L73 PolarHBondContact O-N 2.95Å; V70-L74 HydrophobicContact CG1-CD1 3.76Å; V70-L74 HydrophobicContact CG1-CG 4.35Å; V70-L74 WeakPolarHBondContact O-CG 3.02Å; V70-L74 PolarHBondContact O-N 3.38Å
71I96.6Very high94.4Very high31 Ų3147.7 Ų47.716%0.15927%0.265CS..Hα-helixtrans-62.4-42.8178.2-68.6167000111.3F28 L35 T67 G68 T69 L73 L74 G75F28-I71 HydrophobicContact CB-CG2 4.41Å; F28-I71 HydrophobicContact CD1-CG2 4.12Å; F28-I71 WeakPolarHBondContact O-CG2 3.35Å; L35-I71 HydrophobicContact CD1-CD1 3.76Å; T67-I71 HydrophobicContact CG2-CD1 3.83Å; T67-I71 HydrophobicContact CG2-CG1 4.47Å; T67-I71 VanDerWaalsContact O-CG1 3.28Å; T67-I71 WeakPolarHBondContact O-CG1 2.98Å; T67-I71 PolarHBondContact O-N 3.48Å; G68-I71 PolarHBondContact O-N 3.26Å; T69-I71 VanDerWaalsContact C-N 3.33Å; T69-I71 PolarHBondContact O-N 2.85Å; I71-L73 PolarHBondContact O-N 2.69Å; I71-L74 PolarHBondContact O-N 3.22Å; I71-G75 PolarHBondContact O-N 3.26Å
72I97.7Very high94.7Very high31 Ų3147.3 Ų47.316%0.15926%0.263CS..Hα-helixtrans-60.2-45.9176.2-70.5166.5000110.8V33 L36 G68 T69 V70 G75 T76V33-I72 HydrophobicContact CG2-CD1 3.91Å; V33-I72 HydrophobicContact CG2-CG1 4.04Å; L36-I72 HydrophobicContact CB-CD1 4.21Å; L36-I72 HydrophobicContact CD2-CD1 3.69Å; G68-I72 VanDerWaalsContact O-CG1 3.3Å; G68-I72 WeakPolarHBondContact O-CG1 3.47Å; G68-I72 PolarHBondContact O-N 3.27Å; T69-I72 PolarHBondContact O-N 3.39Å; V70-I72 PolarHBondContact O-N 2.85Å; I72-G75 PolarHBondContact O-N 3.18Å; I72-T76 WeakPolarHBondContact O-CG2 3.26Å; I72-T76 PolarHBondContact O-N 2.73Å; I72-T76 PolarHBondContact O-OG1 3.44Å
73L96.9Very high94.8Very high109 Ų10946.4 Ų46.457%0.57127%0.268SS*.Hα-helixtrans-63.3-44179.1-69175.5000111.7T69 V70 I71 T76 F77T69-L73 HydrophobicContact CG2-CD1 4.35Å; T69-L73 WeakPolarHBondContact O-CG 3.4Å; T69-L73 PolarHBondContact O-N 3.06Å; V70-L73 PolarHBondContact O-N 2.95Å; I71-L73 PolarHBondContact O-N 2.69Å; L73-T76 PolarHBondContact O-OG1 2.95Å; L73-F77 VanDerWaalsContact O-CB 3.26Å; L73-F77 WeakPolarHBondContact O-CB 3.4Å; L73-F77 PolarHBondContact O-N 2.97Å
74L95.8Very high94.7Very high32 Ų3251.7 Ų51.717%0.16828%0.278CS..Hα-helixtrans-67.4-40.2177.2-68.4170.1000112.2V70 I71 F77 G78 Y93 F96 I100V70-L74 HydrophobicContact CG1-CD1 3.76Å; V70-L74 HydrophobicContact CG1-CG 4.35Å; V70-L74 WeakPolarHBondContact O-CG 3.02Å; V70-L74 PolarHBondContact O-N 3.38Å; I71-L74 PolarHBondContact O-N 3.22Å; L74-F77 PolarHBondContact O-N 3Å; L74-G78 PolarHBondContact O-N 3.15Å; L74-Y93 WeakPolarHBondContact O-CE2 3.24Å; L74-F96 HydrophobicContact CD2-CB 4.09Å; L74-F96 HydrophobicContact CD2-CG 4.4Å; L74-I100 HydrophobicContact CD1-CD1 3.27Å
75G95.7Very high94.4Very high2 Ų250.6 Ų50.62%0.02128%0.276CS..Hα-helixtrans-63.6-46176.900000112.3I71 I72 G78 C79I71-G75 PolarHBondContact O-N 3.26Å; I72-G75 PolarHBondContact O-N 3.18Å; G75-G78 PolarHBondContact O-N 3.36Å; G75-C79 WeakPolarHBondContact O-CB 3.11Å; G75-C79 PolarHBondContact O-N 3.42Å
76T95.3Very high94.1Very high46 Ų4650.7 Ų50.728%0.28228%0.281SS..Hα-helixtrans-62.8-46.4174.652.70000111.4I72 L73 G78 C79 F80I72-T76 WeakPolarHBondContact O-CG2 3.26Å; I72-T76 PolarHBondContact O-N 2.73Å; I72-T76 PolarHBondContact O-OG1 3.44Å; L73-T76 PolarHBondContact O-OG1 2.95Å; T76-G78 PolarHBondContact O-N 3.28Å; T76-C79 WeakPolarHBondContact O-CB 3.42Å; T76-C79 PolarHBondContact O-N 3.12Å; T76-F80 WeakPolarHBondContact O-CD2 3.35Å; T76-F80 WeakPolarHBondContact O-CG 3.43Å; T76-F80 PolarHBondContact O-N 2.83Å
77F95.7Very high93.9Very high51 Ų5149.6 Ų49.622%0.22427%0.268CS..Hα-helixtrans-59.8-43.6176.8178.8-109000112.5L73 L74 F80 A81 M89 L92 Y93 F96L73-F77 VanDerWaalsContact O-CB 3.26Å; L73-F77 WeakPolarHBondContact O-CB 3.4Å; L73-F77 PolarHBondContact O-N 2.97Å; L74-F77 PolarHBondContact O-N 3Å; F77-F80 PolarHBondContact O-N 3.49Å; F77-A81 WeakPolarHBondContact O-CB 3.36Å; F77-A81 PolarHBondContact O-N 3.27Å; F77-M89 HydrophobicContact CD2-CE 4.5Å; F77-M89 HydrophobicContact CE2-CE 3.93Å; F77-L92 HydrophobicContact CZ-CB 4.3Å; F77-L92 HydrophobicContact CZ-CD2 3.9Å; F77-L92 HydrophobicContact CZ-CG 4.26Å; F77-Y93 AromaticContact CD1-CD2 3.87Å; F77-Y93 HydrophobicContact CD1-CD2 3.87Å; F77-Y93 HydrophobicContact CD1-CG 4.48Å; F77-Y93 HydrophobicContact CE1-CD2 4.3Å; F77-F96 HydrophobicContact CE1-CD2 4.23Å; F77-F96 HydrophobicContact CE1-CE2 4.36Å
78G94.6Very high93.8Very high0 Ų054.8 Ų54.80%028%0.28CS..Hα-helixtrans-62.2-41.5175.500000112.7L74 G75 T76 A81 T82L74-G78 PolarHBondContact O-N 3.15Å; G75-G78 PolarHBondContact O-N 3.36Å; T76-G78 PolarHBondContact O-N 3.28Å; G78-A81 PolarHBondContact O-N 2.94Å; G78-T82 WeakPolarHBondContact O-CB 3.49Å; G78-T82 PolarHBondContact O-N 2.94Å; G78-T82 PolarHBondContact O-OG1 2.95Å
79C94.4Very high93.6Very high50 Ų5056.9 Ų56.934%0.33829%0.29SS..Hα-helixtrans-61.9-49.1173.6-178.30000111.2L22 G75 T76 A81 T82 C83L22-C79 HydrophobicContact CD2-CB 4.46Å; G75-C79 WeakPolarHBondContact O-CB 3.11Å; G75-C79 PolarHBondContact O-N 3.42Å; T76-C79 WeakPolarHBondContact O-CB 3.42Å; T76-C79 PolarHBondContact O-N 3.12Å; C79-A81 PolarHBondContact O-N 3.43Å; C79-T82 PolarHBondContact O-N 3.42Å; C79-C83 WeakPolarHBondContact O-CB 3.5Å; C79-C83 PolarHBondContact O-N 3.23Å; C79-C83 PolarHBondContact O-SG 2.85Å; C79-C83 VanDerWaalsContact O-SG 3.38Å
80F93.3Very high93.5Very high125 Ų12554.2 Ų54.255%0.54827%0.274SS..Hα-helixtrans-59.7-43.9176.5-73.8-60000112.5T76 F77 T82 R84 M89T76-F80 WeakPolarHBondContact O-CD2 3.35Å; T76-F80 WeakPolarHBondContact O-CG 3.43Å; T76-F80 PolarHBondContact O-N 2.83Å; F77-F80 PolarHBondContact O-N 3.49Å; F80-T82 VanDerWaalsContact C-N 3.31Å; F80-T82 PolarHBondContact O-N 2.87Å; F80-R84 VanDerWaalsContact O-CB 3.26Å; F80-R84 WeakPolarHBondContact O-CB 3.35Å; F80-R84 VanDerWaalsContact O-CG 3.28Å; F80-R84 WeakPolarHBondContact O-CG 3.25Å; F80-R84 PolarHBondContact O-N 3.49Å; F80-M89 HydrophobicContact CB-CE 4.48Å
81A93Very high93.4Very high0 Ų055.7 Ų55.70%027%0.274CS..Hα-helixtrans-60-41.2177.200000111.9F77 G78 C79 A85 S86 M89 L90F77-A81 WeakPolarHBondContact O-CB 3.36Å; F77-A81 PolarHBondContact O-N 3.27Å; G78-A81 PolarHBondContact O-N 2.94Å; C79-A81 PolarHBondContact O-N 3.43Å; A81-A85 PolarHBondContact O-N 2.85Å; A81-S86 PolarHBondContact O-N 2.03Å; A81-M89 HydrophobicContact CB-CB 3.75Å; A81-M89 HydrophobicContact CB-CE 4.39Å; A81-L90 HydrophobicContact CB-CD2 4.13Å; A81-L90 HydrophobicContact CB-CG 4.32Å
82T92.7Very high93.4Very high1 Ų156.6 Ų56.61%0.00628%0.278CS..Hα-helixtrans-72.4-45.1-179.3-52.90000112K18 L21 L22 G78 C79 F80 A85 L233K18-T82 HydrophobicContact CB-CG2 4.11Å; K18-T82 HydrophobicContact CG-CG2 4.02Å; L21-T82 HydrophobicContact CB-CG2 4.38Å; L21-T82 HydrophobicContact CD2-CG2 4.29Å; L21-T82 WeakPolarHBondContact CD2-OG1 3.34Å; L21-T82 HydrophobicContact CG-CG2 4.5Å; L22-T82 HydrophobicContact CD1-CG2 4.44Å; L22-T82 HydrophobicContact CD2-CG2 3.95Å; L22-T82 HydrophobicContact CG-CG2 3.71Å; G78-T82 WeakPolarHBondContact O-CB 3.49Å; G78-T82 PolarHBondContact O-N 2.94Å; G78-T82 PolarHBondContact O-OG1 2.95Å; C79-T82 PolarHBondContact O-N 3.42Å; F80-T82 VanDerWaalsContact C-N 3.31Å; F80-T82 PolarHBondContact O-N 2.87Å; T82-A85 PolarHBondContact O-N 3.32Å; T82-A85 VanDerWaalsContact O-N 3.15Å; T82-L233 HydrophobicContact CG2-CD2 3.95Å
83C90.9Very high93.3Very high82 Ų8255.2 Ų55.255%0.55427%0.271SS*.Hα-helixtrans-64.1-44.3177.6-73.30000112.3C79 A85C79-C83 WeakPolarHBondContact O-CB 3.5Å; C79-C83 PolarHBondContact O-N 3.23Å; C79-C83 PolarHBondContact O-SG 2.85Å; C79-C83 VanDerWaalsContact O-SG 3.38Å; C83-A85 PolarHBondContact O-N 3.18Å
84R89.3Confident93.3Very high198 Ų19850.4 Ų50.475%0.74725%0.247SC*.THydrogen-bonded Turntrans-68.5-14175.9-71.3-69.6-172.61490.6112.9F80 S86 M89F80-R84 VanDerWaalsContact O-CB 3.26Å; F80-R84 WeakPolarHBondContact O-CB 3.35Å; F80-R84 VanDerWaalsContact O-CG 3.28Å; F80-R84 WeakPolarHBondContact O-CG 3.25Å; F80-R84 PolarHBondContact O-N 3.49Å; R84-S86 PolarHBondContact O-N 2.02Å; R84-S86 VanDerWaalsContact O-N 3.13Å; R84-M89 HydrophobicContact CB-SD 4.39Å
85A86Confident93.3Very high28 Ų2853.1 Ų53.123%0.23126%0.26CS..THydrogen-bonded Turntrans50.636.2-176.800000112.2A81 T82 C83 I237A81-A85 PolarHBondContact O-N 2.85Å; T82-A85 PolarHBondContact O-N 3.32Å; T82-A85 VanDerWaalsContact O-N 3.15Å; C83-A85 PolarHBondContact O-N 3.18Å; A85-I237 HydrophobicContact CB-CD1 4.09Å; A85-I237 WeakPolarHBondContact O-CG2 3.43Å
86S89Confident93.4Very high39 Ų3956.6 Ų56.627%0.27328%0.275SS..  trans-91114.9-178.41740000109.5A81 R84 W88 M89 L90A81-S86 PolarHBondContact O-N 2.03Å; R84-S86 PolarHBondContact O-N 2.02Å; R84-S86 VanDerWaalsContact O-N 3.13Å; S86-W88 PolarHBondContact O-N 3.32Å; S86-M89 PolarHBondContact O-N 2.93Å; S86-L90 WeakPolarHBondContact O-CG 3.42Å; S86-L90 PolarHBondContact O-N 3.4Å
87A89.4Confident93.4Very high11 Ų1154.9 Ų54.99%0.09126%0.264CS..Hα-helixtrans-58.9-36.2-179.700000112.5K91 S234 I237 T238A87-K91 WeakPolarHBondContact O-CG 3.4Å; A87-K91 PolarHBondContact O-N 2.96Å; A87-S234 PolarHBondContact O-OG 3.27Å; A87-I237 HydrophobicContact CB-CB 4.45Å; A87-I237 HydrophobicContact CB-CG2 4.1Å; A87-T238 VanDerWaalsContact CB-OG1 3.29Å; A87-T238 WeakPolarHBondContact CB-OG1 3.35Å
88W93Very high93.5Very high181 Ų18155.2 Ų55.269%0.68627%0.27SS*.Hα-helixtrans-68.8-45178.6-173.782.8000112S86 L90 K91 L92S86-W88 PolarHBondContact O-N 3.32Å; W88-L90 VanDerWaalsContact C-N 3.32Å; W88-L90 PolarHBondContact O-N 2.86Å; W88-K91 WeakPolarHBondContact O-CB 3.43Å; W88-K91 PolarHBondContact O-N 3.41Å; W88-L92 HydrophobicContact CH2-CD2 4.31Å; W88-L92 HydrophobicContact CZ3-CD2 4.37Å; W88-L92 PolarHBondContact O-N 3.38Å
89M93.7Very high93.6Very high44 Ų4459.9 Ų59.922%0.21729%0.294CS..Hα-helixtrans-63.5-38.2176.5-65.9178.170.300111.9F77 F80 A81 R84 S86 L92 Y93F77-M89 HydrophobicContact CD2-CE 4.5Å; F77-M89 HydrophobicContact CE2-CE 3.93Å; F80-M89 HydrophobicContact CB-CE 4.48Å; A81-M89 HydrophobicContact CB-CB 3.75Å; A81-M89 HydrophobicContact CB-CE 4.39Å; R84-M89 HydrophobicContact CB-SD 4.39Å; S86-M89 PolarHBondContact O-N 2.93Å; M89-L92 PolarHBondContact O-N 3.42Å; M89-Y93 WeakPolarHBondContact O-CB 3.44Å; M89-Y93 PolarHBondContact O-N 3.34Å
90L94.3Very high93.7Very high0 Ų059.9 Ų59.90%029%0.291CS..Hα-helixtrans-66.1-36.5175.7-74165.4000112.6L21 A81 S86 W88 Y93 A94 L233 I237L21-L90 HydrophobicContact CD2-CD2 3.74Å; A81-L90 HydrophobicContact CB-CD2 4.13Å; A81-L90 HydrophobicContact CB-CG 4.32Å; S86-L90 WeakPolarHBondContact O-CG 3.42Å; S86-L90 PolarHBondContact O-N 3.4Å; W88-L90 VanDerWaalsContact C-N 3.32Å; W88-L90 PolarHBondContact O-N 2.86Å; L90-Y93 PolarHBondContact O-N 2.84Å; L90-A94 WeakPolarHBondContact O-CB 3.45Å; L90-A94 PolarHBondContact O-N 2.93Å; L90-L233 HydrophobicContact CD1-CB 4.3Å; L90-L233 HydrophobicContact CD1-CD2 3.75Å; L90-L233 HydrophobicContact CD1-CG 3.71Å; L90-L233 HydrophobicContact CD2-CD2 4.07Å; L90-I237 HydrophobicContact CD1-CD1 3.61Å
91K94.6Very high93.9Very high109 Ų10956.3 Ų56.347%0.47428%0.275SS..Hα-helixtrans-64.1-42.6172-73.6173.4-173.3-177.50111.2A87 W88 Y93 A94 M95 S234A87-K91 WeakPolarHBondContact O-CG 3.4Å; A87-K91 PolarHBondContact O-N 2.96Å; W88-K91 WeakPolarHBondContact O-CB 3.43Å; W88-K91 PolarHBondContact O-N 3.41Å; K91-Y93 VanDerWaalsContact C-N 3.35Å; K91-A94 PolarHBondContact O-N 2.86Å; K91-M95 WeakPolarHBondContact O-CB 3.32Å; K91-M95 PolarHBondContact O-N 2.86Å; K91-S234 WeakPolarHBondContact CE-OG 3.28Å; K91-S234 WeakPolarHBondContact CG-OG 2.97Å
92L95.9Very high94.1Very high49 Ų4960.6 Ų60.626%0.25730%0.298SS..Hα-helixtrans-64.5-41.4177.7-170.666.1000111.4F77 W88 M89 M95 F96F77-L92 HydrophobicContact CZ-CB 4.3Å; F77-L92 HydrophobicContact CZ-CD2 3.9Å; F77-L92 HydrophobicContact CZ-CG 4.26Å; W88-L92 HydrophobicContact CH2-CD2 4.31Å; W88-L92 HydrophobicContact CZ3-CD2 4.37Å; W88-L92 PolarHBondContact O-N 3.38Å; M89-L92 PolarHBondContact O-N 3.42Å; L92-M95 HydrophobicContact CD1-CE 3.51Å; L92-M95 WeakPolarHBondContact O-CB 3.44Å; L92-M95 PolarHBondContact O-N 3.37Å; L92-F96 HydrophobicContact CD1-CE2 4.06Å; L92-F96 HydrophobicContact CD1-CZ 4.34Å; L92-F96 HydrophobicContact CD2-CE2 4.04Å; L92-F96 HydrophobicContact CG-CD2 4.14Å; L92-F96 HydrophobicContact CG-CE2 3.63Å; L92-F96 HydrophobicContact CG-CZ 4.36Å; L92-F96 WeakPolarHBondContact O-CD2 3.2Å; L92-F96 PolarHBondContact O-N 2.82Å
93Y96.1Very high94.3Very high3 Ų365 Ų651%0.01232%0.324CS..Hα-helixtrans-61-46.8174-178.6-117.5000112.1L21 T25 L74 F77 M89 L90 K91 M95 F96 L97 A230L21-Y93 HydrophobicContact CD1-CE1 4.35Å; T25-Y93 HydrophobicContact CG2-CE1 4.29Å; L74-Y93 WeakPolarHBondContact O-CE2 3.24Å; F77-Y93 AromaticContact CD1-CD2 3.87Å; F77-Y93 HydrophobicContact CD1-CD2 3.87Å; F77-Y93 HydrophobicContact CD1-CG 4.48Å; F77-Y93 HydrophobicContact CE1-CD2 4.3Å; M89-Y93 WeakPolarHBondContact O-CB 3.44Å; M89-Y93 PolarHBondContact O-N 3.34Å; L90-Y93 PolarHBondContact O-N 2.84Å; K91-Y93 VanDerWaalsContact C-N 3.35Å; Y93-M95 VanDerWaalsContact C-N 3.3Å; Y93-M95 PolarHBondContact O-N 2.88Å; Y93-F96 PolarHBondContact O-N 2.88Å; Y93-L97 HydrophobicContact CD1-CD1 4.15Å; Y93-L97 HydrophobicContact CE1-CD1 3.59Å; Y93-L97 HydrophobicContact CE1-CG 4.3Å; Y93-L97 HydrophobicContact CE2-CD1 4.37Å; Y93-L97 HydrophobicContact CE2-CD2 4.36Å; Y93-L97 HydrophobicContact CE2-CG 4.25Å; Y93-L97 PolarHBondContact O-N 3.21Å; Y93-A230 HydrophobicContact CD1-CB 3.97Å
94A96.4Very high94.4Very high8 Ų864.6 Ų64.67%0.06631%0.314CS..Hα-helixtrans-59.4-40.9175.200000112L90 K91 L97 T98 A230L90-A94 WeakPolarHBondContact O-CB 3.45Å; L90-A94 PolarHBondContact O-N 2.93Å; K91-A94 PolarHBondContact O-N 2.86Å; A94-L97 PolarHBondContact O-N 3.13Å; A94-T98 PolarHBondContact O-N 3.1Å; A94-T98 PolarHBondContact O-OG1 3.34Å; A94-A230 HydrophobicContact CB-CB 4.01Å
95M97Very high94.7Very high89 Ų8959.1 Ų59.144%0.43830%0.299SS..Hα-helixtrans-60.7-46.3176.6-177.3-79.9-66.300112K91 L92 Y93 L97 T98 L99K91-M95 WeakPolarHBondContact O-CB 3.32Å; K91-M95 PolarHBondContact O-N 2.86Å; L92-M95 HydrophobicContact CD1-CE 3.51Å; L92-M95 WeakPolarHBondContact O-CB 3.44Å; L92-M95 PolarHBondContact O-N 3.37Å; Y93-M95 VanDerWaalsContact C-N 3.3Å; Y93-M95 PolarHBondContact O-N 2.88Å; M95-L97 PolarHBondContact O-N 3.18Å; M95-T98 PolarHBondContact O-N 2.88Å; M95-L99 PolarHBondContact O-N 2.77Å
96F96.4Very high95.2Very high75 Ų7562 Ų6233%0.32931%0.313SS..Hα-helixtrans-61-44.2175.8-73.6-55.8000112.2L74 F77 L92 Y93 T98 L99 I100L74-F96 HydrophobicContact CD2-CB 4.09Å; L74-F96 HydrophobicContact CD2-CG 4.4Å; F77-F96 HydrophobicContact CE1-CD2 4.23Å; F77-F96 HydrophobicContact CE1-CE2 4.36Å; L92-F96 HydrophobicContact CD1-CE2 4.06Å; L92-F96 HydrophobicContact CD1-CZ 4.34Å; L92-F96 HydrophobicContact CD2-CE2 4.04Å; L92-F96 HydrophobicContact CG-CD2 4.14Å; L92-F96 HydrophobicContact CG-CE2 3.63Å; L92-F96 HydrophobicContact CG-CZ 4.36Å; L92-F96 WeakPolarHBondContact O-CD2 3.2Å; L92-F96 PolarHBondContact O-N 2.82Å; Y93-F96 PolarHBondContact O-N 2.88Å; F96-T98 VanDerWaalsContact C-N 3.32Å; F96-T98 PolarHBondContact O-N 3.14Å; F96-L99 PolarHBondContact O-N 3.37Å; F96-I100 WeakPolarHBondContact O-CG1 3.45Å; F96-I100 PolarHBondContact O-N 2.87Å
97L96.2Very high95.5Very high10 Ų1062.9 Ų62.95%0.05232%0.324CS..Hα-helixtrans-61.9-39.3175.9-69.1-177.7000111.9Y24 Y93 A94 M95 I100 F101 Q223 I227Y24-L97 HydrophobicContact CE1-CD1 4.44Å; Y93-L97 HydrophobicContact CD1-CD1 4.15Å; Y93-L97 HydrophobicContact CE1-CD1 3.59Å; Y93-L97 HydrophobicContact CE1-CG 4.3Å; Y93-L97 HydrophobicContact CE2-CD1 4.37Å; Y93-L97 HydrophobicContact CE2-CD2 4.36Å; Y93-L97 HydrophobicContact CE2-CG 4.25Å; Y93-L97 PolarHBondContact O-N 3.21Å; A94-L97 PolarHBondContact O-N 3.13Å; M95-L97 PolarHBondContact O-N 3.18Å; L97-I100 PolarHBondContact O-N 2.85Å; L97-F101 PolarHBondContact O-N 3.42Å; L97-Q223 PolarHBondContact O-NE2 3.46Å; L97-I227 HydrophobicContact CB-CD1 4.17Å; L97-I227 HydrophobicContact CB-CG1 3.52Å; L97-I227 HydrophobicContact CD1-CG1 4.27Å
98T97.6Very high95.6Very high57 Ų5765.4 Ų65.435%0.3534%0.344SS..Hα-helixtrans-64.3-42.8174.7-58.60000111.9A94 M95 F96 I100 F101 L102A94-T98 PolarHBondContact O-N 3.1Å; A94-T98 PolarHBondContact O-OG1 3.34Å; M95-T98 PolarHBondContact O-N 2.88Å; F96-T98 VanDerWaalsContact C-N 3.32Å; F96-T98 PolarHBondContact O-N 3.14Å; T98-I100 VanDerWaalsContact C-N 3.32Å; T98-I100 PolarHBondContact O-N 3.5Å; T98-F101 WeakPolarHBondContact O-CB 3.34Å; T98-F101 PolarHBondContact O-N 3.13Å; T98-L102 WeakPolarHBondContact O-CG 3.31Å; T98-L102 PolarHBondContact O-N 3.26Å
99L97.1Very high95.7Very high98 Ų9861.3 Ų61.351%0.51334%0.335SS..Hα-helixtrans-60.9-43.4178-175.567.7000111.4M95 F96 F101 L102 V103M95-L99 PolarHBondContact O-N 2.77Å; F96-L99 PolarHBondContact O-N 3.37Å; L99-F101 VanDerWaalsContact C-N 3.33Å; L99-F101 PolarHBondContact O-N 3.36Å; L99-L102 PolarHBondContact O-N 3.1Å; L99-V103 WeakPolarHBondContact O-CG2 3.2Å; L99-V103 PolarHBondContact O-N 2.64Å
100I96.1Very high95.8Very high51 Ų5162.6 Ų62.626%0.26235%0.345SS..Hα-helixtrans-62.7-42.8177.2-65.8163.3000110.5L74 F96 L97 T98 L102 V103 E104 Q223L74-I100 HydrophobicContact CD1-CD1 3.27Å; F96-I100 WeakPolarHBondContact O-CG1 3.45Å; F96-I100 PolarHBondContact O-N 2.87Å; L97-I100 PolarHBondContact O-N 2.85Å; T98-I100 VanDerWaalsContact C-N 3.32Å; T98-I100 PolarHBondContact O-N 3.5Å; I100-L102 VanDerWaalsContact C-N 3.28Å; I100-L102 PolarHBondContact O-N 3.03Å; I100-V103 PolarHBondContact O-N 2.95Å; I100-V103 VanDerWaalsContact O-N 3.1Å; I100-E104 HydrophobicContact CG2-CG 4.33Å; I100-E104 WeakPolarHBondContact O-CG 3.32Å; I100-E104 PolarHBondContact O-N 2.93Å; I100-Q223 VanDerWaalsContact CB-NE2 3.33Å; I100-Q223 VanDerWaalsContact CG2-NE2 3.29Å
101F96.8Very high95.7Very high50 Ų5064.1 Ų64.122%0.21936%0.36CS..Hα-helixtrans-59.9-40177.9177.4-97.9000111.8L97 T98 L99 E104 L105 A220 Q223 L224L97-F101 PolarHBondContact O-N 3.42Å; T98-F101 WeakPolarHBondContact O-CB 3.34Å; T98-F101 PolarHBondContact O-N 3.13Å; L99-F101 VanDerWaalsContact C-N 3.33Å; L99-F101 PolarHBondContact O-N 3.36Å; F101-E104 PolarHBondContact O-N 3.46Å; F101-L105 WeakPolarHBondContact O-CB 3.45Å; F101-L105 PolarHBondContact O-N 3Å; F101-A220 HydrophobicContact CE2-CB 4.1Å; F101-Q223 HydrophobicContact CB-CG 4.46Å; F101-L224 HydrophobicContact CD2-CD2 4.29Å; F101-L224 HydrophobicContact CD2-CG 4.42Å; F101-L224 HydrophobicContact CE1-CD2 4.38Å; F101-L224 HydrophobicContact CE2-CD1 4.25Å; F101-L224 HydrophobicContact CE2-CD2 4.06Å; F101-L224 HydrophobicContact CE2-CG 4.03Å; F101-L224 HydrophobicContact CZ-CD1 4.36Å; F101-L224 HydrophobicContact CZ-CD2 4.12Å; F101-L224 HydrophobicContact CZ-CG 4.42Å
102L97.6Very high95.5Very high90 Ų9065.4 Ų65.447%0.47137%0.366SS..Hα-helixtrans-65.7-41175.2-66175.5000111.9T98 L99 I100 L105 V106T98-L102 WeakPolarHBondContact O-CG 3.31Å; T98-L102 PolarHBondContact O-N 3.26Å; L99-L102 PolarHBondContact O-N 3.1Å; I100-L102 VanDerWaalsContact C-N 3.28Å; I100-L102 PolarHBondContact O-N 3.03Å; L102-L105 PolarHBondContact O-N 2.98Å; L102-V106 WeakPolarHBondContact O-CG2 3.14Å; L102-V106 PolarHBondContact O-N 3.39Å
103V96.1Very high95.5Very high92 Ų9267.4 Ų67.456%0.55838%0.38SS*.Hα-helixtrans-63-43.7175.4172.10000110.9L99 I100 V106 A107L99-V103 WeakPolarHBondContact O-CG2 3.2Å; L99-V103 PolarHBondContact O-N 2.64Å; I100-V103 PolarHBondContact O-N 2.95Å; I100-V103 VanDerWaalsContact O-N 3.1Å; V103-V106 PolarHBondContact O-N 3.19Å; V103-A107 WeakPolarHBondContact O-CB 3.42Å; V103-A107 PolarHBondContact O-N 3.46Å
104E94.1Very high95.4Very high74 Ų7471.6 Ų71.635%0.34640%0.399SS..Hα-helixtrans-62.6-42.4176.4-73.2-177.4-17800112I100 F101 A107 A108 Q223I100-E104 HydrophobicContact CG2-CG 4.33Å; I100-E104 WeakPolarHBondContact O-CG 3.32Å; I100-E104 PolarHBondContact O-N 2.93Å; F101-E104 PolarHBondContact O-N 3.46Å; E104-A107 PolarHBondContact O-N 2.89Å; E104-A108 WeakPolarHBondContact O-CB 3.27Å; E104-A108 PolarHBondContact O-N 3.13Å; E104-Q223 PolarHBondContact OE2-OE1 3.28Å
105L95.9Very high95.1Very high84 Ų8477 Ų7744%0.4442%0.418SS..Hα-helixtrans-61.6-46.1176.1-179.163.7000111.5F101 L102 A108 I109F101-L105 WeakPolarHBondContact O-CB 3.45Å; F101-L105 PolarHBondContact O-N 3Å; L102-L105 PolarHBondContact O-N 2.98Å; L105-A108 PolarHBondContact O-N 3.34Å; L105-I109 HydrophobicContact CD1-CD1 4.27Å; L105-I109 HydrophobicContact CG-CD1 4.07Å; L105-I109 VanDerWaalsContact O-CG1 3.27Å; L105-I109 WeakPolarHBondContact O-CG1 3.07Å; L105-I109 PolarHBondContact O-N 3.46Å
106V97Very high94.9Very high87 Ų8778 Ų7853%0.52742%0.421SS..Hα-helixtrans-62.8-44.8176.4171.60000110.6L102 V103 A108 I109 V110L102-V106 WeakPolarHBondContact O-CG2 3.14Å; L102-V106 PolarHBondContact O-N 3.39Å; V103-V106 PolarHBondContact O-N 3.19Å; V106-A108 VanDerWaalsContact C-N 3.33Å; V106-A108 PolarHBondContact O-N 2.92Å; V106-I109 PolarHBondContact O-N 3.09Å; V106-V110 HydrophobicContact CG1-CG2 4.22Å; V106-V110 WeakPolarHBondContact O-CB 3.35Å; V106-V110 VanDerWaalsContact O-CG2 3.28Å; V106-V110 WeakPolarHBondContact O-CG2 3.36Å; V106-V110 PolarHBondContact O-N 2.75Å
107A93.4Very high94.7Very high59 Ų5980.5 Ų80.549%0.48843%0.433SS..Hα-helixtrans-60.9-41177.600000112V103 E104 V110 G111V103-A107 WeakPolarHBondContact O-CB 3.42Å; V103-A107 PolarHBondContact O-N 3.46Å; E104-A107 PolarHBondContact O-N 2.89Å; A107-V110 PolarHBondContact O-N 3.25Å; A107-G111 PolarHBondContact O-N 3.11Å
108A93.1Very high94.4Very high64 Ų6484.7 Ų84.753%0.52946%0.455SS..Hα-helixtrans-63.9-44.6175.600000112E104 L105 V106 G111 F112E104-A108 WeakPolarHBondContact O-CB 3.27Å; E104-A108 PolarHBondContact O-N 3.13Å; L105-A108 PolarHBondContact O-N 3.34Å; V106-A108 VanDerWaalsContact C-N 3.33Å; V106-A108 PolarHBondContact O-N 2.92Å; A108-G111 PolarHBondContact O-N 3.18Å; A108-F112 WeakPolarHBondContact O-CB 3.41Å; A108-F112 PolarHBondContact O-N 2.85Å
109I95.1Very high94.1Very high95 Ų9584.8 Ų84.849%0.48745%0.45SS..Hα-helixtrans-62.5-48.5176.8-66.7164.6000110.4L105 V106 G111 F112 V113L105-I109 HydrophobicContact CD1-CD1 4.27Å; L105-I109 HydrophobicContact CG-CD1 4.07Å; L105-I109 VanDerWaalsContact O-CG1 3.27Å; L105-I109 WeakPolarHBondContact O-CG1 3.07Å; L105-I109 PolarHBondContact O-N 3.46Å; V106-I109 PolarHBondContact O-N 3.09Å; I109-G111 PolarHBondContact O-N 3.37Å; I109-F112 PolarHBondContact O-N 3.21Å; I109-V113 HydrophobicContact CG2-CG2 4.21Å; I109-V113 WeakPolarHBondContact O-CB 3.43Å; I109-V113 VanDerWaalsContact O-CG2 3.29Å; I109-V113 WeakPolarHBondContact O-CG2 3.26Å; I109-V113 PolarHBondContact O-N 2.91Å
110V95.3Very high93.9Very high71 Ų7184.4 Ų84.443%0.4345%0.449SS..Hα-helixtrans-60.1-46.5177.8169.30000110.5V106 A107 F112 V113 F114V106-V110 HydrophobicContact CG1-CG2 4.22Å; V106-V110 WeakPolarHBondContact O-CB 3.35Å; V106-V110 VanDerWaalsContact O-CG2 3.28Å; V106-V110 WeakPolarHBondContact O-CG2 3.36Å; V106-V110 PolarHBondContact O-N 2.75Å; A107-V110 PolarHBondContact O-N 3.25Å; V110-F112 VanDerWaalsContact C-N 3.28Å; V110-F112 PolarHBondContact O-N 3.47Å; V110-V113 PolarHBondContact O-N 2.84Å; V110-F114 HydrophobicContact CG1-CD2 3.82Å; V110-F114 HydrophobicContact CG1-CE2 4.33Å; V110-F114 WeakPolarHBondContact O-CB 3.42Å; V110-F114 WeakPolarHBondContact O-CD2 3.02Å; V110-F114 PolarHBondContact O-N 3.5Å
111G91.1Very high93.7Very high31 Ų3184.8 Ų84.832%0.3246%0.456SS..Hα-helixtrans-59.9-38.3177.500000112.8A107 A108 I109 R115A107-G111 PolarHBondContact O-N 3.11Å; A108-G111 PolarHBondContact O-N 3.18Å; I109-G111 PolarHBondContact O-N 3.37Å; G111-R115 WeakPolarHBondContact O-CA 2.9Å; G111-R115 WeakPolarHBondContact O-CB 3.26Å; G111-R115 PolarHBondContact O-N 3.01Å; G111-R115 VanDerWaalsContact O-N 3.17Å
112F91.2Very high93.4Very high136 Ų13685.4 Ų85.460%0.59646%0.459SS*.Hα-helixtrans-71.1-47.3176.3-177.5-95.9000112.7A108 I109 V110 R115A108-F112 WeakPolarHBondContact O-CB 3.41Å; A108-F112 PolarHBondContact O-N 2.85Å; I109-F112 PolarHBondContact O-N 3.21Å; V110-F112 VanDerWaalsContact C-N 3.28Å; V110-F112 PolarHBondContact O-N 3.47Å; F112-R115 WeakPolarHBondContact O-CB 3.19Å; F112-R115 WeakPolarHBondContact O-CD 3.29Å; F112-R115 VanDerWaalsContact O-CG 3.26Å; F112-R115 WeakPolarHBondContact O-CG 3.45Å; F112-R115 PolarHBondContact O-N 3.3Å
113V95.8Very high93.3Very high91 Ų9184.4 Ų84.455%0.55245%0.451SS*.Hα-helixtrans-62.5-46.3-179.3169.40000110.7I109 V110 R115I109-V113 HydrophobicContact CG2-CG2 4.21Å; I109-V113 WeakPolarHBondContact O-CB 3.43Å; I109-V113 VanDerWaalsContact O-CG2 3.29Å; I109-V113 WeakPolarHBondContact O-CG2 3.26Å; I109-V113 PolarHBondContact O-N 2.91Å; V110-V113 PolarHBondContact O-N 2.84Å; V113-R115 VanDerWaalsContact C-N 3.34Å; V113-R115 PolarHBondContact O-N 2.91Å
114F93.9Very high93.1Very high92 Ų9283.9 Ų83.940%0.40445%0.445SS..THydrogen-bonded Turntrans-92.515.1-177.2-65.2-76.9000113.7V110 H116 E117 I118V110-F114 HydrophobicContact CG1-CD2 3.82Å; V110-F114 HydrophobicContact CG1-CE2 4.33Å; V110-F114 WeakPolarHBondContact O-CB 3.42Å; V110-F114 WeakPolarHBondContact O-CD2 3.02Å; V110-F114 PolarHBondContact O-N 3.5Å; F114-H116 PolarHBondContact O-N 3.3Å; F114-H116 VanDerWaalsContact O-N 3.15Å; F114-E117 HydrophobicContact CD1-CG 4.43Å; F114-E117 WeakPolarHBondContact CD1-OE2 3.37Å; F114-E117 PolarHBondContact O-N 3.38Å; F114-I118 WeakPolarHBondContact O-CG1 3.46Å; F114-I118 PolarHBondContact O-N 2.92Å
115R90.5Very high92.9Very high122 Ų12284.5 Ų84.546%0.4645%0.451SS..Hα-helixtrans-54.6-38.3-177.371.2-172.7-177.3-156.9-0.5113.6G111 F112 V113 I118 K119G111-R115 WeakPolarHBondContact O-CA 2.9Å; G111-R115 WeakPolarHBondContact O-CB 3.26Å; G111-R115 PolarHBondContact O-N 3.01Å; G111-R115 VanDerWaalsContact O-N 3.17Å; F112-R115 WeakPolarHBondContact O-CB 3.19Å; F112-R115 WeakPolarHBondContact O-CD 3.29Å; F112-R115 VanDerWaalsContact O-CG 3.26Å; F112-R115 WeakPolarHBondContact O-CG 3.45Å; F112-R115 PolarHBondContact O-N 3.3Å; V113-R115 VanDerWaalsContact C-N 3.34Å; V113-R115 PolarHBondContact O-N 2.91Å; R115-I118 PolarHBondContact O-N 3.5Å; R115-K119 WeakPolarHBondContact O-CB 3.24Å; R115-K119 PolarHBondContact O-N 3.25Å
116H92.2Very high92.8Very high109 Ų10981 Ų8151%0.50543%0.432SS..Hα-helixtrans-71.8-37.6-179.6-69-72.5000111.4F114 K119 N120F114-H116 PolarHBondContact O-N 3.3Å; F114-H116 VanDerWaalsContact O-N 3.15Å; H116-K119 PolarHBondContact O-N 3.48Å; H116-N120 WeakPolarHBondContact O-CB 3.18Å; H116-N120 VanDerWaalsContact O-CG 3.22Å; H116-N120 PolarHBondContact O-N 2.9Å
117E93.7Very high92.6Very high127 Ų12780 Ų8059%0.59342%0.421SS*.Hα-helixtrans-67.6-40.3174.5-67.5-170.6-173.900111.6F114 K119 N120 S121F114-E117 HydrophobicContact CD1-CG 4.43Å; F114-E117 WeakPolarHBondContact CD1-OE2 3.37Å; F114-E117 PolarHBondContact O-N 3.38Å; E117-K119 PolarHBondContact O-N 3.45Å; E117-N120 PolarHBondContact O-N 2.92Å; E117-S121 WeakPolarHBondContact O-CB 3.35Å; E117-S121 PolarHBondContact O-N 2.9Å
118I89.1Confident92.6Very high99 Ų9983.2 Ų83.251%0.50842%0.424SS..Hα-helixtrans-60.4-46.9174.6-65.3166.5000110.2F114 R115 N120 S121 F122F114-I118 WeakPolarHBondContact O-CG1 3.46Å; F114-I118 PolarHBondContact O-N 2.92Å; R115-I118 PolarHBondContact O-N 3.5Å; I118-N120 PolarHBondContact O-N 3.41Å; I118-S121 PolarHBondContact O-N 2.86Å; I118-F122 WeakPolarHBondContact O-CB 3.25Å; I118-F122 PolarHBondContact O-N 3.14Å
119K90.8Very high92.4Very high58 Ų5880.7 Ų80.725%0.25240%0.403SS..Hα-helixtrans-57.7-48.7175.5176.3164.3-173.8160.30111.4R115 H116 E117 F122 K123 F198 M202 E206R115-K119 WeakPolarHBondContact O-CB 3.24Å; R115-K119 PolarHBondContact O-N 3.25Å; H116-K119 PolarHBondContact O-N 3.48Å; E117-K119 PolarHBondContact O-N 3.45Å; K119-F122 PolarHBondContact O-N 3.48Å; K119-K123 PolarHBondContact O-N 3.22Å; K119-F198 HydrophobicContact CD-CZ 4.17Å; K119-F198 HydrophobicContact CG-CE2 3.71Å; K119-F198 HydrophobicContact CG-CZ 3.57Å; K119-F198 WeakPolarHBondContact O-CE2 3.41Å; K119-M202 HydrophobicContact CB-CE 4.16Å; K119-M202 HydrophobicContact CB-SD 4.19Å; K119-M202 HydrophobicContact CD-CE 4.34Å; K119-M202 HydrophobicContact CD-CG 4.17Å; K119-M202 HydrophobicContact CD-SD 3.36Å; K119-M202 WeakPolarHBondContact CD-SD 3.48Å; K119-M202 WeakPolarHBondContact CE-SD 3.46Å; K119-M202 HydrophobicContact CG-CE 3.77Å; K119-M202 HydrophobicContact CG-CG 4.36Å; K119-M202 HydrophobicContact CG-SD 3.49Å; K119-M202 WeakPolarHBondContact CG-SD 3.34Å; K119-E206 IonicContact NZ-OE1 3.7Å; K119-E206 PolarHBondContact NZ-OE1 3.28Å
120N93.5Very high92.3Very high90 Ų9076.3 Ų76.348%0.48138%0.381SS..Hα-helixtrans-67.4-39.8179.9-70.8-9.3000112.5H116 E117 I118 K123 N124H116-N120 WeakPolarHBondContact O-CB 3.18Å; H116-N120 VanDerWaalsContact O-CG 3.22Å; H116-N120 PolarHBondContact O-N 2.9Å; E117-N120 PolarHBondContact O-N 2.92Å; I118-N120 PolarHBondContact O-N 3.41Å; N120-K123 PolarHBondContact O-N 2.92Å; N120-N124 WeakPolarHBondContact O-CB 3.21Å; N120-N124 PolarHBondContact O-N 3.02Å; N120-N124 PolarHBondContact O-ND2 3.23Å
121S91.8Very high92.2Very high59 Ų5977.9 Ų77.941%0.41338%0.382SS..Hα-helixtrans-61.2-45175.9-175.40000110.9E117 I118 N124 N125E117-S121 WeakPolarHBondContact O-CB 3.35Å; E117-S121 PolarHBondContact O-N 2.9Å; I118-S121 PolarHBondContact O-N 2.86Å; S121-N124 PolarHBondContact O-N 3.4Å; S121-N125 VanDerWaalsContact O-CB 3.3Å; S121-N125 WeakPolarHBondContact O-CB 2.9Å; S121-N125 PolarHBondContact O-N 2.86Å; S121-N125 PolarHBondContact O-ND2 3.06Å; S121-N125 VanDerWaalsContact O-ND2 3.08Å; S121-N125 PolarHBondContact OG-ND2 3.47Å
122F90.4Very high92.2Very high64 Ų6481.1 Ų81.128%0.28139%0.389SS..Hα-helixtrans-59.1-48.8174.1178.7-106.1000111.7I118 K119 N124 N125 Y126 F198 V201 M202I118-F122 WeakPolarHBondContact O-CB 3.25Å; I118-F122 PolarHBondContact O-N 3.14Å; K119-F122 PolarHBondContact O-N 3.48Å; F122-N124 PolarHBondContact O-N 3.11Å; F122-N125 PolarHBondContact O-N 3.43Å; F122-Y126 VanDerWaalsContact O-CB 3.3Å; F122-Y126 WeakPolarHBondContact O-CB 3.41Å; F122-Y126 PolarHBondContact O-N 3.01Å; F122-F198 AromaticContact CD1-CD2 3.89Å; F122-F198 HydrophobicContact CD1-CD2 3.89Å; F122-F198 HydrophobicContact CD1-CE2 4.45Å; F122-F198 HydrophobicContact CE1-CD2 4.31Å; F122-V201 HydrophobicContact CE1-CB 4.15Å; F122-V201 HydrophobicContact CE1-CG1 4.03Å; F122-V201 HydrophobicContact CE1-CG2 4.17Å; F122-V201 HydrophobicContact CZ-CG1 4.42Å; F122-V201 HydrophobicContact CZ-CG2 4.19Å; F122-M202 HydrophobicContact CD1-CE 4.06Å
123K94.6Very high92.1Very high68 Ų6875.2 Ų75.230%0.29636%0.363SS..Hα-helixtrans-54.6-52.2176.6-168.9-177.2174.7-175.10111.7K119 N120 N125 Y126 E127 V156 F198K119-K123 PolarHBondContact O-N 3.22Å; N120-K123 PolarHBondContact O-N 2.92Å; K123-N125 PolarHBondContact O-N 3.34Å; K123-Y126 PolarHBondContact O-N 3.45Å; K123-E127 WeakPolarHBondContact O-CB 3.34Å; K123-E127 PolarHBondContact O-N 3.38Å; K123-V156 HydrophobicContact CG-CG1 3.92Å; K123-F198 HydrophobicContact CB-CD2 3.65Å; K123-F198 HydrophobicContact CB-CE2 3.57Å; K123-F198 HydrophobicContact CB-CG 4.23Å; K123-F198 HydrophobicContact CB-CZ 4.08Å; K123-F198 HydrophobicContact CD-CD1 4.18Å; K123-F198 HydrophobicContact CD-CE1 4.01Å; K123-F198 HydrophobicContact CD-CE2 4.41Å; K123-F198 HydrophobicContact CD-CG 4.45Å; K123-F198 HydrophobicContact CD-CZ 4.11Å; K123-F198 HydrophobicContact CG-CD1 4.25Å; K123-F198 HydrophobicContact CG-CD2 3.96Å; K123-F198 HydrophobicContact CG-CE1 4.4Å; K123-F198 HydrophobicContact CG-CE2 4.13Å; K123-F198 HydrophobicContact CG-CG 4.01Å; K123-F198 HydrophobicContact CG-CZ 4.33Å
124N93.3Very high91.7Very high82 Ų8274.1 Ų74.144%0.43935%0.353SS..Hα-helixtrans-65.8-39.8-175.7-67.6-16.3000112.1N120 S121 F122 K128N120-N124 WeakPolarHBondContact O-CB 3.21Å; N120-N124 PolarHBondContact O-N 3.02Å; N120-N124 PolarHBondContact O-ND2 3.23Å; S121-N124 PolarHBondContact O-N 3.4Å; F122-N124 PolarHBondContact O-N 3.11Å; N124-K128 WeakPolarHBondContact O-CB 3.42Å; N124-K128 VanDerWaalsContact O-CG 3.29Å; N124-K128 WeakPolarHBondContact O-CG 3.48Å; N124-K128 PolarHBondContact O-N 3.06Å
125N90.1Very high91.1Very high87 Ų8772.4 Ų72.447%0.46535%0.353SS..Hα-helixtrans-69.2-39.5178.1-69.7-27.2000111.3S121 F122 K123 K128 A129S121-N125 VanDerWaalsContact O-CB 3.3Å; S121-N125 WeakPolarHBondContact O-CB 2.9Å; S121-N125 PolarHBondContact O-N 2.86Å; S121-N125 PolarHBondContact O-ND2 3.06Å; S121-N125 VanDerWaalsContact O-ND2 3.08Å; S121-N125 PolarHBondContact OG-ND2 3.47Å; F122-N125 PolarHBondContact O-N 3.43Å; K123-N125 PolarHBondContact O-N 3.34Å; N125-K128 PolarHBondContact O-N 3.26Å; N125-A129 WeakPolarHBondContact O-CB 3.31Å; N125-A129 PolarHBondContact O-N 3.48Å
126Y92.4Very high90.3Very high10 Ų1070.9 Ų70.94%0.03936%0.357CS..Hα-helixtrans-67.6-41.1176.1-167.3-105.4000111.6F122 K123 K128 A129 L130 V144 I147 Q148 G155 V156 C197F122-Y126 VanDerWaalsContact O-CB 3.3Å; F122-Y126 WeakPolarHBondContact O-CB 3.41Å; F122-Y126 PolarHBondContact O-N 3.01Å; K123-Y126 PolarHBondContact O-N 3.45Å; Y126-K128 PolarHBondContact O-N 3.5Å; Y126-A129 PolarHBondContact O-N 2.99Å; Y126-L130 HydrophobicContact CE1-CD1 4.39Å; Y126-L130 WeakPolarHBondContact O-CB 3.45Å; Y126-L130 PolarHBondContact O-N 2.89Å; Y126-V144 HydrophobicContact CE2-CG2 4.09Å; Y126-I147 HydrophobicContact CD2-CD1 3.97Å; Y126-I147 HydrophobicContact CE2-CB 4.17Å; Y126-I147 HydrophobicContact CE2-CD1 3.7Å; Y126-I147 HydrophobicContact CE2-CG2 3.99Å; Y126-Q148 WeakPolarHBondContact OH-CG 2.98Å; Y126-Q148 PolarHBondContact OH-NE2 3.42Å; Y126-G155 WeakPolarHBondContact CE1-O 3.23Å; Y126-V156 HydrophobicContact CD1-CB 4.28Å; Y126-V156 HydrophobicContact CD1-CG1 4.29Å; Y126-V156 HydrophobicContact CD1-CG2 3.89Å; Y126-V156 HydrophobicContact CE1-CG2 4.32Å; Y126-C197 HydrophobicContact CE1-CB 3.81Å; Y126-C197 PolarHBondContact OH-SG 2.88Å
127E94.3Very high89.1Confident65 Ų6567 Ų6730%0.30435%0.347SS..Hα-helixtrans-61.3-43.1174.2-171.8-175.4158.900112.2K123 L130 K131 V156K123-E127 WeakPolarHBondContact O-CB 3.34Å; K123-E127 PolarHBondContact O-N 3.38Å; E127-L130 PolarHBondContact O-N 3.49Å; E127-K131 WeakPolarHBondContact O-CG 3.38Å; E127-K131 PolarHBondContact O-N 3.03Å; E127-K131 VanDerWaalsContact OE1-CE 3.32Å; E127-K131 WeakPolarHBondContact OE1-CE 3.28Å; E127-K131 IonicContact OE1-NZ 2.7Å; E127-K131 PolarHBondContact OE1-NZ 2.92Å; E127-V156 HydrophobicContact CB-CG2 3.99Å; E127-V156 HydrophobicContact CG-CG2 4.26Å
128K91.7Very high88.4Confident127 Ų12761.9 Ų61.955%0.55232%0.324SS*.Hα-helixtrans-61.7-43.8173.7-74.7173.1-1771780111.9N124 N125 Y126 L130 K131 Q132N124-K128 WeakPolarHBondContact O-CB 3.42Å; N124-K128 VanDerWaalsContact O-CG 3.29Å; N124-K128 WeakPolarHBondContact O-CG 3.48Å; N124-K128 PolarHBondContact O-N 3.06Å; N125-K128 PolarHBondContact O-N 3.26Å; Y126-K128 PolarHBondContact O-N 3.5Å; K128-L130 VanDerWaalsContact C-N 3.31Å; K128-L130 PolarHBondContact O-N 2.78Å; K128-K131 PolarHBondContact O-N 3.18Å; K128-Q132 WeakPolarHBondContact O-CB 3.42Å; K128-Q132 WeakPolarHBondContact O-CG 3.48Å; K128-Q132 PolarHBondContact O-N 3.35Å
129A90.7Very high87.7Confident11 Ų1161.7 Ų61.79%0.09132%0.317CS..Hα-helixtrans-62.4-39.217700000111.7N125 Y126 Q132 Y133 R140 V144N125-A129 WeakPolarHBondContact O-CB 3.31Å; N125-A129 PolarHBondContact O-N 3.48Å; Y126-A129 PolarHBondContact O-N 2.99Å; A129-Q132 PolarHBondContact O-N 3.49Å; A129-Y133 PolarHBondContact O-N 3.46Å; A129-Y133 VanDerWaalsContact O-N 3.09Å; A129-R140 HydrophobicContact CB-CB 4.08Å; A129-R140 HydrophobicContact CB-CG 4.28Å; A129-V144 HydrophobicContact CB-CG2 3.86Å
130L92.9Very high87.2Confident3 Ų362 Ų622%0.01632%0.317CS..Hα-helixtrans-66.3-45.6176.5-165.3119.3000111.9Y126 E127 K128 Q132 Y133 V156 D161 W162 T165Y126-L130 HydrophobicContact CE1-CD1 4.39Å; Y126-L130 WeakPolarHBondContact O-CB 3.45Å; Y126-L130 PolarHBondContact O-N 2.89Å; E127-L130 PolarHBondContact O-N 3.49Å; K128-L130 VanDerWaalsContact C-N 3.31Å; K128-L130 PolarHBondContact O-N 2.78Å; L130-Q132 VanDerWaalsContact C-N 3.27Å; L130-Q132 PolarHBondContact O-N 2.94Å; L130-Y133 WeakPolarHBondContact O-CB 3.34Å; L130-Y133 PolarHBondContact O-N 3.47Å; L130-V156 HydrophobicContact CB-CG2 4.42Å; L130-V156 HydrophobicContact CD1-CG2 4.44Å; L130-V156 HydrophobicContact CD2-CG2 4.42Å; L130-D161 HydrophobicContact CD2-CB 4.1Å; L130-W162 HydrophobicContact CD1-CD2 4.39Å; L130-W162 HydrophobicContact CD1-CH2 4.37Å; L130-W162 HydrophobicContact CD1-CZ2 3.76Å; L130-W162 HydrophobicContact CG-CH2 4.41Å; L130-W162 HydrophobicContact CG-CZ2 4.26Å; L130-T165 HydrophobicContact CD2-CG2 3.55Å; L130-T165 HydrophobicContact CG-CG2 4.21Å
131K92.2Very high86.9Confident105 Ų10557.8 Ų57.846%0.45729%0.294SS..Hα-helixtrans-65.1-29.6177.5-72.7-179.1-176.1172.50113.6E127 K128E127-K131 WeakPolarHBondContact O-CG 3.38Å; E127-K131 PolarHBondContact O-N 3.03Å; E127-K131 VanDerWaalsContact OE1-CE 3.32Å; E127-K131 WeakPolarHBondContact OE1-CE 3.28Å; E127-K131 IonicContact OE1-NZ 2.7Å; E127-K131 PolarHBondContact OE1-NZ 2.92Å; K128-K131 PolarHBondContact O-N 3.18Å
132Q90.3Very high86.4Confident99 Ų9959 Ų5946%0.46329%0.294SS..THydrogen-bonded Turntrans-93.51.2179.3-67.1174.9-28.700113.1K128 A129 L130 N134K128-Q132 WeakPolarHBondContact O-CB 3.42Å; K128-Q132 WeakPolarHBondContact O-CG 3.48Å; K128-Q132 PolarHBondContact O-N 3.35Å; A129-Q132 PolarHBondContact O-N 3.49Å; L130-Q132 VanDerWaalsContact C-N 3.27Å; L130-Q132 PolarHBondContact O-N 2.94Å; Q132-N134 PolarHBondContact O-N 3.28Å
133Y90.5Very high86.1Confident12 Ų1258.1 Ų58.15%0.04730%0.298CS..  trans-61.2130179.7-174.4-85.2000110.9A129 L130 V144 D145 W162 Y167 P174A129-Y133 PolarHBondContact O-N 3.46Å; A129-Y133 VanDerWaalsContact O-N 3.09Å; L130-Y133 WeakPolarHBondContact O-CB 3.34Å; L130-Y133 PolarHBondContact O-N 3.47Å; Y133-V144 HydrophobicContact CD2-CB 4.05Å; Y133-V144 HydrophobicContact CD2-CG1 4.02Å; Y133-V144 HydrophobicContact CE2-CB 4.33Å; Y133-V144 HydrophobicContact CE2-CG1 4.25Å; Y133-D145 VanDerWaalsContact CE2-OD1 3.23Å; Y133-D145 WeakPolarHBondContact CE2-OD1 3.43Å; Y133-D145 PolarHBondContact OH-OD1 3.04Å; Y133-D145 PolarHBondContact OH-OD2 3.28Å; Y133-W162 AromaticContact CD1-CH2 3.75Å; Y133-W162 HydrophobicContact CD1-CH2 3.75Å; Y133-W162 AromaticContact CD1-CZ3 3.74Å; Y133-W162 HydrophobicContact CD1-CZ3 3.74Å; Y133-W162 AromaticContact CD2-CH2 3.93Å; Y133-W162 HydrophobicContact CD2-CH2 3.93Å; Y133-W162 HydrophobicContact CE1-CH2 4.13Å; Y133-W162 HydrophobicContact CE1-CZ3 4.32Å; Y133-W162 HydrophobicContact CE2-CH2 4.29Å; Y133-W162 AromaticContact CG-CH2 3.65Å; Y133-W162 HydrophobicContact CG-CH2 3.65Å; Y133-W162 AromaticContact CG-CZ3 3.93Å; Y133-W162 HydrophobicContact CG-CZ3 3.93Å; Y133-Y167 AromaticContact CD1-CD1 3.97Å; Y133-Y167 HydrophobicContact CD1-CD1 3.97Å; Y133-Y167 AromaticContact CD1-CD2 3.74Å; Y133-Y167 HydrophobicContact CD1-CD2 3.74Å; Y133-Y167 HydrophobicContact CD1-CE1 4.43Å; Y133-Y167 HydrophobicContact CD1-CE2 4.21Å; Y133-Y167 AromaticContact CD1-CG 3.61Å; Y133-Y167 HydrophobicContact CD1-CG 3.61Å; Y133-Y167 AromaticContact CE1-CD1 3.93Å; Y133-Y167 HydrophobicContact CE1-CD1 3.93Å; Y133-Y167 AromaticContact CE1-CD2 3.74Å; Y133-Y167 HydrophobicContact CE1-CD2 3.74Å; Y133-Y167 AromaticContact CE1-CE1 3.93Å; Y133-Y167 HydrophobicContact CE1-CE1 3.93Å; Y133-Y167 AromaticContact CE1-CE2 3.71Å; Y133-Y167 HydrophobicContact CE1-CE2 3.71Å; Y133-Y167 AromaticContact CE1-CG 3.86Å; Y133-Y167 HydrophobicContact CE1-CG 3.86Å; Y133-Y167 AromaticContact CE1-CZ 3.82Å; Y133-P174 HydrophobicContact CE1-CB 4.23Å
134N87.2Confident85.9Confident67 Ų6754.9 Ų54.936%0.35828%0.284SS..  trans-136.91.4-178.665.63.9000113.2Q132 T136 S141Q132-N134 PolarHBondContact O-N 3.28Å; N134-T136 HydrophobicContact CB-CG2 4.18Å; N134-T136 WeakPolarHBondContact ND2-CG2 3.13Å; N134-T136 PolarHBondContact ND2-OG1 2.73Å; N134-T136 PolarHBondContact O-N 3.28Å; N134-T136 VanDerWaalsContact O-N 3.14Å; N134-T136 WeakPolarHBondContact OD1-CB 3.33Å; N134-T136 PolarHBondContact OD1-N 3.44Å; N134-T136 PolarHBondContact OD1-OG1 2.96Å; N134-S141 PolarHBondContact N-OG 2.82Å; N134-S141 PolarHBondContact OD1-OG 2.77Å
135S81.1Confident85.8Confident56 Ų5652.8 Ų52.839%0.39227%0.273SS..SBendtrans60.114.8-176.7-163.50000114.3G137 Y167S135-G137 PolarHBondContact O-N 3.41Å; S135-Y167 VanDerWaalsContact CB-CE2 3.45Å
136T74.6Confident85.7Confident90 Ų9054.8 Ų54.855%0.55228%0.277SS*.SBendtrans-81.97.6178.668.60000113.2N134 D138N134-T136 HydrophobicContact CB-CG2 4.18Å; N134-T136 WeakPolarHBondContact ND2-CG2 3.13Å; N134-T136 PolarHBondContact ND2-OG1 2.73Å; N134-T136 PolarHBondContact O-N 3.28Å; N134-T136 VanDerWaalsContact O-N 3.14Å; N134-T136 WeakPolarHBondContact OD1-CB 3.33Å; N134-T136 PolarHBondContact OD1-N 3.44Å; N134-T136 PolarHBondContact OD1-OG1 2.96Å; T136-D138 VanDerWaalsContact C-N 3.34Å
137G66.8Low85.6Confident29 Ų2956.3 Ų56.330%0.29929%0.285SS..  trans7813.1-179.700000114.6L53 S135L53-G137 WeakPolarHBondContact CD1-O 3.41Å; S135-G137 PolarHBondContact O-N 3.41Å
138D77.8Confident85.6Confident18 Ų1853.2 Ų53.210%0.09627%0.271CS..  trans-60.4161.5173.986.7-33.2000111.4E55 T136 R140 S141 H142E55-D138 WeakPolarHBondContact OE2-CB 3.17Å; T136-D138 VanDerWaalsContact C-N 3.34Å; D138-R140 PolarHBondContact O-N 3.44Å; D138-R140 VanDerWaalsContact O-N 3.1Å; D138-R140 IonicContact OD2-NE 3.72Å; D138-R140 PolarHBondContact OD2-NE 3.27Å; D138-S141 PolarHBondContact O-N 3.02Å; D138-S141 WeakPolarHBondContact OD1-CA 3.39Å; D138-S141 WeakPolarHBondContact OD1-CB 3.37Å; D138-S141 PolarHBondContact OD1-N 2.84Å; D138-S141 PolarHBondContact OD1-OG 3.28Å; D138-H142 PolarHBondContact O-N 3.36Å
139Y74.3Confident85.5Confident95 Ų9549.8 Ų49.837%0.37326%0.263SS..Hα-helixtrans-60.3-30.3-17382.1-99000111.9E55 A143E55-Y139 HydrophobicContact CB-CD1 4.22Å; E55-Y139 VanDerWaalsContact CD-CD1 3.49Å; E55-Y139 HydrophobicContact CG-CD1 4.43Å; E55-Y139 WeakPolarHBondContact OE2-CD1 3.5Å; E55-Y139 PolarHBondContact OE2-N 2.89Å; Y139-A143 VanDerWaalsContact O-CB 3.28Å; Y139-A143 WeakPolarHBondContact O-CB 3.31Å; Y139-A143 PolarHBondContact O-N 3.05Å
140R81.6Confident85.5Confident65 Ų6553.1 Ų53.125%0.24528%0.282CS..Hα-helixtrans-71.1-50179.2-73.2171.1-87.8-161.7-13.4111.3E55 A129 D138 H142 A143 V144E55-R140 IonicContact OE1-NH2 3.21Å; E55-R140 PolarHBondContact OE1-NH2 3.24Å; A129-R140 HydrophobicContact CB-CB 4.08Å; A129-R140 HydrophobicContact CB-CG 4.28Å; D138-R140 PolarHBondContact O-N 3.44Å; D138-R140 VanDerWaalsContact O-N 3.1Å; D138-R140 IonicContact OD2-NE 3.72Å; D138-R140 PolarHBondContact OD2-NE 3.27Å; R140-H142 VanDerWaalsContact C-N 3.3Å; R140-H142 PolarHBondContact O-N 3.42Å; R140-A143 PolarHBondContact O-N 2.87Å; R140-V144 WeakPolarHBondContact O-CG2 3.21Å; R140-V144 PolarHBondContact O-N 3.5Å
141S85.7Confident85.5Confident1 Ų155.2 Ų55.21%0.00729%0.293CS..Hα-helixtrans-61.6-42.1178.7-59.80000110.8N134 D138 A143 V144 D145N134-S141 PolarHBondContact N-OG 2.82Å; N134-S141 PolarHBondContact OD1-OG 2.77Å; D138-S141 PolarHBondContact O-N 3.02Å; D138-S141 WeakPolarHBondContact OD1-CA 3.39Å; D138-S141 WeakPolarHBondContact OD1-CB 3.37Å; D138-S141 PolarHBondContact OD1-N 2.84Å; D138-S141 PolarHBondContact OD1-OG 3.28Å; S141-A143 PolarHBondContact O-N 3.32Å; S141-V144 PolarHBondContact O-N 3.04Å; S141-D145 PolarHBondContact O-N 3.39Å
142H82.9Confident85.6Confident86 Ų8656.1 Ų56.140%0.39830%0.299SS..Hα-helixtrans-67.2-38.4177.7-161.849.2000112.7D138 R140 D145 K146D138-H142 PolarHBondContact O-N 3.36Å; R140-H142 VanDerWaalsContact C-N 3.3Å; R140-H142 PolarHBondContact O-N 3.42Å; H142-D145 PolarHBondContact O-N 3.36Å; H142-K146 VanDerWaalsContact O-CB 3.24Å; H142-K146 WeakPolarHBondContact O-CB 3.46Å; H142-K146 PolarHBondContact O-N 2.92Å
143A83.8Confident85.8Confident44 Ų4451.4 Ų51.436%0.36428%0.277SS..Hα-helixtrans-62.3-42.7173.300000111.7Y139 R140 S141 K146 I147Y139-A143 VanDerWaalsContact O-CB 3.28Å; Y139-A143 WeakPolarHBondContact O-CB 3.31Å; Y139-A143 PolarHBondContact O-N 3.05Å; R140-A143 PolarHBondContact O-N 2.87Å; S141-A143 PolarHBondContact O-N 3.32Å; A143-K146 PolarHBondContact O-N 3.28Å; A143-I147 WeakPolarHBondContact O-CB 3.49Å; A143-I147 WeakPolarHBondContact O-CD1 3.5Å; A143-I147 WeakPolarHBondContact O-CG1 3.47Å; A143-I147 PolarHBondContact O-N 3.41Å
144V90.9Very high86Confident1 Ų150.8 Ų50.81%0.00628%0.275CS..Hα-helixtrans-59.5-50.5174.6171.10000110.4Y126 A129 Y133 R140 S141 K146 I147 Q148 W162Y126-V144 HydrophobicContact CE2-CG2 4.09Å; A129-V144 HydrophobicContact CB-CG2 3.86Å; Y133-V144 HydrophobicContact CD2-CB 4.05Å; Y133-V144 HydrophobicContact CD2-CG1 4.02Å; Y133-V144 HydrophobicContact CE2-CB 4.33Å; Y133-V144 HydrophobicContact CE2-CG1 4.25Å; R140-V144 WeakPolarHBondContact O-CG2 3.21Å; R140-V144 PolarHBondContact O-N 3.5Å; S141-V144 PolarHBondContact O-N 3.04Å; V144-K146 PolarHBondContact O-N 3.24Å; V144-I147 PolarHBondContact O-N 2.91Å; V144-Q148 HydrophobicContact CG1-CG 4.48Å; V144-Q148 WeakPolarHBondContact O-CB 3.24Å; V144-Q148 VanDerWaalsContact O-CG 3.31Å; V144-Q148 WeakPolarHBondContact O-CG 2.83Å; V144-Q148 PolarHBondContact O-N 3.39Å; V144-W162 HydrophobicContact CG1-CH2 4.2Å; V144-W162 HydrophobicContact CG1-CZ2 3.96Å
145D90.1Very high86.4Confident38 Ų3847.6 Ų47.620%0.20326%0.258CS..Hα-helixtrans-61.7-43.7-179.1-70.8-20.4000111.8Y133 S141 H142 S149 S176Y133-D145 VanDerWaalsContact CE2-OD1 3.23Å; Y133-D145 WeakPolarHBondContact CE2-OD1 3.43Å; Y133-D145 PolarHBondContact OH-OD1 3.04Å; Y133-D145 PolarHBondContact OH-OD2 3.28Å; S141-D145 PolarHBondContact O-N 3.39Å; H142-D145 PolarHBondContact O-N 3.36Å; D145-S149 VanDerWaalsContact O-CB 3.32Å; D145-S149 WeakPolarHBondContact O-CB 3.34Å; D145-S149 PolarHBondContact O-N 3.27Å; D145-S149 PolarHBondContact O-OG 3.03Å; D145-S176 VanDerWaalsContact CA-CB 3.45Å; D145-S176 WeakPolarHBondContact O-CB 3.49Å; D145-S176 PolarHBondContact OD1-OG 3.43Å; D145-S176 VanDerWaalsContact OD1-OG 3.06Å
146K87.8Confident87.1Confident129 Ų12945.1 Ų45.156%0.56124%0.24SC*.Hα-helixtrans-65.7-44.6180-171.866.3178.7179.80111.4H142 A143 V144 S149 T150H142-K146 VanDerWaalsContact O-CB 3.24Å; H142-K146 WeakPolarHBondContact O-CB 3.46Å; H142-K146 PolarHBondContact O-N 2.92Å; A143-K146 PolarHBondContact O-N 3.28Å; V144-K146 PolarHBondContact O-N 3.24Å; K146-S149 PolarHBondContact O-OG 2.98Å; K146-T150 WeakPolarHBondContact O-CB 3.47Å; K146-T150 PolarHBondContact O-N 2.88Å; K146-T150 PolarHBondContact O-OG1 2.78Å
147I91.2Very high88.1Confident41 Ų4143.5 Ų43.521%0.2123%0.23CC..Hα-helixtrans-62-49.3177.7-72.8167.3000110.1Y126 A143 V144 T150 L151 C197Y126-I147 HydrophobicContact CD2-CD1 3.97Å; Y126-I147 HydrophobicContact CE2-CB 4.17Å; Y126-I147 HydrophobicContact CE2-CD1 3.7Å; Y126-I147 HydrophobicContact CE2-CG2 3.99Å; A143-I147 WeakPolarHBondContact O-CB 3.49Å; A143-I147 WeakPolarHBondContact O-CD1 3.5Å; A143-I147 WeakPolarHBondContact O-CG1 3.47Å; A143-I147 PolarHBondContact O-N 3.41Å; V144-I147 PolarHBondContact O-N 2.91Å; I147-T150 PolarHBondContact O-N 3.45Å; I147-L151 HydrophobicContact CG2-CD1 4.13Å; I147-L151 WeakPolarHBondContact O-CB 3.47Å; I147-L151 PolarHBondContact O-N 2.86Å; I147-C197 HydrophobicContact CG2-CB 3.96Å
148Q93.8Very high89.4Confident0 Ų043.8 Ų43.80%022%0.224CC..Hα-helixtrans-63.1-45.7-177.8-74177-6.800112.6Y126 V144 H152 C153 S176 C177 C197Y126-Q148 WeakPolarHBondContact OH-CG 2.98Å; Y126-Q148 PolarHBondContact OH-NE2 3.42Å; V144-Q148 HydrophobicContact CG1-CG 4.48Å; V144-Q148 WeakPolarHBondContact O-CB 3.24Å; V144-Q148 VanDerWaalsContact O-CG 3.31Å; V144-Q148 WeakPolarHBondContact O-CG 2.83Å; V144-Q148 PolarHBondContact O-N 3.39Å; Q148-H152 VanDerWaalsContact O-CA 3.26Å; Q148-H152 WeakPolarHBondContact O-CA 3.41Å; Q148-H152 PolarHBondContact O-N 3.49Å; Q148-C153 WeakPolarHBondContact CB-O 3.25Å; Q148-C153 WeakPolarHBondContact CG-O 3.29Å; Q148-C153 PolarHBondContact O-N 2.9Å; Q148-S176 CarbonylContact C-O 3.52Å; Q148-S176 WeakPolarHBondContact CB-O 3.48Å; Q148-S176 PolarHBondContact OE1-OG 3.03Å; Q148-C177 PolarHBondContact OE1-SG 2.9Å; Q148-C197 VanDerWaalsContact CG-SG 3.55Å
149S90.4Very high90.1Very high55 Ų5545.3 Ų45.339%0.38523%0.229SC..Hα-helixtrans-69.5-37178.755.20000113.2D145 K146 S176D145-S149 VanDerWaalsContact O-CB 3.32Å; D145-S149 WeakPolarHBondContact O-CB 3.34Å; D145-S149 PolarHBondContact O-N 3.27Å; D145-S149 PolarHBondContact O-OG 3.03Å; K146-S149 PolarHBondContact O-OG 2.98Å; S149-S176 PolarHBondContact N-O 2.93Å
150T90.8Very high91.1Very high81 Ų8147.5 Ų47.550%0.49724%0.237SC..Hα-helixtrans-76.8-37.3-177.9-540000112K146 I147K146-T150 WeakPolarHBondContact O-CB 3.47Å; K146-T150 PolarHBondContact O-N 2.88Å; K146-T150 PolarHBondContact O-OG1 2.78Å; I147-T150 PolarHBondContact O-N 3.45Å
151L91.9Very high91.7Very high48 Ų4846.1 Ų46.125%0.25123%0.234SC..Hα-helixtrans-100-0.2-176.3-60.1-177.5000113.5I147 C153 K200 V201 I204I147-L151 HydrophobicContact CG2-CD1 4.13Å; I147-L151 WeakPolarHBondContact O-CB 3.47Å; I147-L151 PolarHBondContact O-N 2.86Å; L151-C153 VanDerWaalsContact C-N 3.34Å; L151-C153 PolarHBondContact O-N 3.07Å; L151-K200 HydrophobicContact CB-CG 4.43Å; L151-V201 HydrophobicContact CD1-CG2 3.37Å; L151-I204 HydrophobicContact CD2-CD1 3.99Å
152H93.3Very high92.1Very high123 Ų12346 Ų4657%0.56923%0.234SC*.THydrogen-bonded Turntrans49.252.9-176.6-60.2-69.9000112.5Q148 N193Q148-H152 VanDerWaalsContact O-CA 3.26Å; Q148-H152 WeakPolarHBondContact O-CA 3.41Å; Q148-H152 PolarHBondContact O-N 3.49Å; H152-N193 VanDerWaalsContact C-CG 3.44Å; H152-N193 WeakPolarHBondContact O-CB 3.48Å; H152-N193 VanDerWaalsContact O-CG 3.25Å
153C95.4Very high92.5Very high0 Ų045 Ų450%023%0.234CC..  trans-129.1166.8-179.459.80000110.4Q148 L151 E195 C197 K200Q148-C153 WeakPolarHBondContact CB-O 3.25Å; Q148-C153 WeakPolarHBondContact CG-O 3.29Å; Q148-C153 PolarHBondContact O-N 2.9Å; L151-C153 VanDerWaalsContact C-N 3.34Å; L151-C153 PolarHBondContact O-N 3.07Å; C153-E195 CarbonylContact C-O 3.51Å; C153-E195 WeakPolarHBondContact CA-O 3.39Å; C153-E195 WeakPolarHBondContact CB-O 3.33Å; C153-C197 VanDerWaalsContact C-SG 3.51Å; C153-C197 HydrophobicContact CB-CB 3.93Å; C153-C197 WeakPolarHBondContact CB-SG 3.38Å; C153-C197 WeakPolarHBondContact SG-CA 3.14Å; C153-C197 WeakPolarHBondContact SG-CB 3.45Å; C153-C197 CovalentContact SG-SG 2.03Å; C153-C197 PolarHBondContact SG-SG 3.04Å; C153-K200 HydrophobicContact CB-CB 4.15Å; C153-K200 HydrophobicContact CB-CG 4.44Å
154C95.1Very high92.8Very high0 Ų048.7 Ų48.70%025%0.247CC..  trans-146.2134.1177.3-170.20000111.6D158 Y159 W162 C177 N193 E195 G196C154-D158 CarbonylContact O-C 3.3Å; C154-D158 VanDerWaalsContact O-C 3.3Å; C154-Y159 WeakPolarHBondContact O-CA 3.16Å; C154-Y159 PolarHBondContact O-N 3.08Å; C154-W162 PolarHBondContact SG-NE1 3.41Å; C154-C177 VanDerWaalsContact CA-SG 3.51Å; C154-C177 HydrophobicContact CB-CB 3.78Å; C154-C177 WeakPolarHBondContact CB-SG 2.84Å; C154-C177 WeakPolarHBondContact SG-CB 3.45Å; C154-C177 CovalentContact SG-SG 2.03Å; C154-C177 PolarHBondContact SG-SG 3.2Å; C154-N193 HydrophobicContact CB-CB 4.19Å; C154-N193 WeakPolarHBondContact CB-O 3.3Å; C154-E195 PolarHBondContact N-O 3.25Å; C154-G196 WeakPolarHBondContact O-CA 3.33Å
155G95.4Very high92.9Very high0 Ų048.8 Ų48.80%025%0.248CC..SBendtrans75.3-175.8-176.600000113Y126 D158 C197Y126-G155 WeakPolarHBondContact CE1-O 3.23Å; G155-D158 WeakPolarHBondContact CA-O 3.39Å; G155-C197 WeakPolarHBondContact O-CB 3.44Å; G155-C197 PolarHBondContact O-N 3.39Å
156V95.7Very high92.9Very high4 Ų453.1 Ų53.12%0.02427%0.271CS..SBendtrans-82.4-67.6-178.3-174.40000108.9K123 Y126 E127 L130 D161 G196 C197 F198K123-V156 HydrophobicContact CG-CG1 3.92Å; Y126-V156 HydrophobicContact CD1-CB 4.28Å; Y126-V156 HydrophobicContact CD1-CG1 4.29Å; Y126-V156 HydrophobicContact CD1-CG2 3.89Å; Y126-V156 HydrophobicContact CE1-CG2 4.32Å; E127-V156 HydrophobicContact CB-CG2 3.99Å; E127-V156 HydrophobicContact CG-CG2 4.26Å; L130-V156 HydrophobicContact CB-CG2 4.42Å; L130-V156 HydrophobicContact CD1-CG2 4.44Å; L130-V156 HydrophobicContact CD2-CG2 4.42Å; V156-D161 VanDerWaalsContact CA-OD2 3.31Å; V156-D161 WeakPolarHBondContact CA-OD2 3.47Å; V156-D161 WeakPolarHBondContact CB-OD2 3.4Å; V156-D161 PolarHBondContact N-OD2 2.93Å; V156-G196 CarbonylContact O-C 3.21Å; V156-G196 VanDerWaalsContact O-CA 3.3Å; V156-G196 WeakPolarHBondContact O-CA 3.47Å; V156-C197 PolarHBondContact O-N 3Å; V156-C197 VanDerWaalsContact O-N 3.14Å; V156-F198 HydrophobicContact CG1-CB 3.95Å; V156-F198 WeakPolarHBondContact O-CA 3.22Å; V156-F198 WeakPolarHBondContact O-CB 3.42Å; V156-F198 PolarHBondContact O-N 3.27Å
157T95.4Very high93Very high55 Ų5548.3 Ų48.334%0.33725%0.25SC..SBendtrans-96.9-30.9175.642.20000113.2D161 G196T157-D161 PolarHBondContact N-OD2 2.89Å; T157-D161 PolarHBondContact OG1-OD1 3.38Å; T157-D161 PolarHBondContact OG1-OD2 2.91Å; T157-G196 VanDerWaalsContact C-CA 3.41Å; T157-G196 WeakPolarHBondContact O-CA 3.44Å; T157-G196 PolarHBondContact O-N 3.35Å
158D94.6Very high93Very high35 Ų3548.2 Ų48.219%0.18725%0.247CC..BIsolated β-bridgetrans-156.9157.4-177.1-172.2-76.6000109.8C154 G155 R160 D161C154-D158 CarbonylContact O-C 3.3Å; C154-D158 VanDerWaalsContact O-C 3.3Å; G155-D158 WeakPolarHBondContact CA-O 3.39Å; D158-R160 VanDerWaalsContact CG-NE 3.35Å; D158-R160 PolarHBondContact O-N 3.42Å; D158-R160 VanDerWaalsContact O-N 3.08Å; D158-R160 WeakPolarHBondContact OD1-CB 3.42Å; D158-R160 WeakPolarHBondContact OD1-CG 3.36Å; D158-R160 IonicContact OD1-CZ 2.77Å; D158-R160 PolarHBondContact OD1-N 2.88Å; D158-R160 IonicContact OD1-NE 2.87Å; D158-R160 PolarHBondContact OD1-NE 3.37Å; D158-R160 IonicContact OD1-NH2 3.9Å; D158-R160 IonicContact OD2-CZ 3.53Å; D158-R160 IonicContact OD2-NE 3.45Å; D158-R160 PolarHBondContact OD2-NE 3.03Å; D158-R160 IonicContact OD2-NH2 2.75Å; D158-R160 PolarHBondContact OD2-NH2 3.21Å; D158-D161 PolarHBondContact N-OD2 3.18Å; D158-D161 WeakPolarHBondContact O-CB 3.39Å; D158-D161 PolarHBondContact O-N 3.43Å
159Y92.9Very high92.8Very high50 Ų5051.8 Ų51.820%0.19627%0.272CS..G310 helixtrans-55.3-2917676.6-86.8000112.6C154 D161 W162 F173 P189 V192 N193 N194C154-Y159 WeakPolarHBondContact O-CA 3.16Å; C154-Y159 PolarHBondContact O-N 3.08Å; Y159-D161 PolarHBondContact O-N 3.25Å; Y159-W162 PolarHBondContact O-N 2.9Å; Y159-F173 AromaticContact CD2-CE1 3.88Å; Y159-F173 HydrophobicContact CD2-CE1 3.88Å; Y159-F173 HydrophobicContact CD2-CE2 4.47Å; Y159-F173 AromaticContact CD2-CZ 3.54Å; Y159-F173 HydrophobicContact CD2-CZ 3.54Å; Y159-F173 HydrophobicContact CE2-CZ 4.06Å; Y159-F173 WeakPolarHBondContact O-CE1 3.36Å; Y159-P189 HydrophobicContact CE2-CB 3.71Å; Y159-P189 HydrophobicContact CE2-CG 4.28Å; Y159-V192 HydrophobicContact CD2-CG2 4.16Å; Y159-V192 HydrophobicContact CG-CG2 4.27Å; Y159-N193 WeakPolarHBondContact CB-O 3.38Å; Y159-N194 HydrophobicContact CD1-CB 4.32Å
160R94.3Very high92.6Very high142 Ų14256.2 Ų56.254%0.53629%0.287SS..G310 helixtrans-62.1-19.1176.9-70.8171.5-72.5171.2-0.8113.9D158 W162 T163D158-R160 VanDerWaalsContact CG-NE 3.35Å; D158-R160 PolarHBondContact O-N 3.42Å; D158-R160 VanDerWaalsContact O-N 3.08Å; D158-R160 WeakPolarHBondContact OD1-CB 3.42Å; D158-R160 WeakPolarHBondContact OD1-CG 3.36Å; D158-R160 IonicContact OD1-CZ 2.77Å; D158-R160 PolarHBondContact OD1-N 2.88Å; D158-R160 IonicContact OD1-NE 2.87Å; D158-R160 PolarHBondContact OD1-NE 3.37Å; D158-R160 IonicContact OD1-NH2 3.9Å; D158-R160 IonicContact OD2-CZ 3.53Å; D158-R160 IonicContact OD2-NE 3.45Å; D158-R160 PolarHBondContact OD2-NE 3.03Å; D158-R160 IonicContact OD2-NH2 2.75Å; D158-R160 PolarHBondContact OD2-NH2 3.21Å; R160-W162 PolarHBondContact O-N 3.5Å; R160-T163 WeakPolarHBondContact O-CB 3.21Å; R160-T163 WeakPolarHBondContact O-CG2 3.33Å; R160-T163 PolarHBondContact O-N 3.21Å; R160-T163 PolarHBondContact O-OG1 2.91Å
161D94.6Very high92.5Very high35 Ų3557.6 Ų57.619%0.18729%0.286CS..G310 helixtrans-59.6-20.4176.4-59.7-35.6000112.5L130 V156 T157 D158 Y159 T163 D164L130-D161 HydrophobicContact CD2-CB 4.1Å; V156-D161 VanDerWaalsContact CA-OD2 3.31Å; V156-D161 WeakPolarHBondContact CA-OD2 3.47Å; V156-D161 WeakPolarHBondContact CB-OD2 3.4Å; V156-D161 PolarHBondContact N-OD2 2.93Å; T157-D161 PolarHBondContact N-OD2 2.89Å; T157-D161 PolarHBondContact OG1-OD1 3.38Å; T157-D161 PolarHBondContact OG1-OD2 2.91Å; D158-D161 PolarHBondContact N-OD2 3.18Å; D158-D161 WeakPolarHBondContact O-CB 3.39Å; D158-D161 PolarHBondContact O-N 3.43Å; Y159-D161 PolarHBondContact O-N 3.25Å; D161-T163 VanDerWaalsContact C-N 3.3Å; D161-T163 PolarHBondContact O-N 2.95Å; D161-D164 PolarHBondContact O-N 3.38Å
162W93.6Very high92.4Very high0 Ų055.3 Ų55.30%027%0.274CS..G310 helixtrans-65.7-28.7171.5-77.6101.1000113.4L130 Y133 V144 C154 Y159 R160 D164 T165 Y167 Y168 F173 P174 C177L130-W162 HydrophobicContact CD1-CD2 4.39Å; L130-W162 HydrophobicContact CD1-CH2 4.37Å; L130-W162 HydrophobicContact CD1-CZ2 3.76Å; L130-W162 HydrophobicContact CG-CH2 4.41Å; L130-W162 HydrophobicContact CG-CZ2 4.26Å; Y133-W162 AromaticContact CD1-CH2 3.75Å; Y133-W162 HydrophobicContact CD1-CH2 3.75Å; Y133-W162 AromaticContact CD1-CZ3 3.74Å; Y133-W162 HydrophobicContact CD1-CZ3 3.74Å; Y133-W162 AromaticContact CD2-CH2 3.93Å; Y133-W162 HydrophobicContact CD2-CH2 3.93Å; Y133-W162 HydrophobicContact CE1-CH2 4.13Å; Y133-W162 HydrophobicContact CE1-CZ3 4.32Å; Y133-W162 HydrophobicContact CE2-CH2 4.29Å; Y133-W162 AromaticContact CG-CH2 3.65Å; Y133-W162 HydrophobicContact CG-CH2 3.65Å; Y133-W162 AromaticContact CG-CZ3 3.93Å; Y133-W162 HydrophobicContact CG-CZ3 3.93Å; V144-W162 HydrophobicContact CG1-CH2 4.2Å; V144-W162 HydrophobicContact CG1-CZ2 3.96Å; C154-W162 PolarHBondContact SG-NE1 3.41Å; Y159-W162 PolarHBondContact O-N 2.9Å; R160-W162 PolarHBondContact O-N 3.5Å; W162-D164 PolarHBondContact O-N 3.48Å; W162-D164 VanDerWaalsContact O-N 3.09Å; W162-T165 HydrophobicContact CE3-CG2 4.11Å; W162-T165 WeakPolarHBondContact O-CB 3.39Å; W162-T165 PolarHBondContact O-N 3.02Å; W162-T165 PolarHBondContact O-OG1 3.27Å; W162-Y167 HydrophobicContact CE3-CD1 4.39Å; W162-Y167 AromaticContact CZ3-CD1 3.99Å; W162-Y167 HydrophobicContact CZ3-CD1 3.99Å; W162-Y167 HydrophobicContact CZ3-CG 4.49Å; W162-Y168 HydrophobicContact CB-CD2 3.84Å; W162-Y168 HydrophobicContact CB-CG 4.25Å; W162-Y168 WeakPolarHBondContact O-CB 3.26Å; W162-F173 HydrophobicContact CB-CD1 3.83Å; W162-F173 HydrophobicContact CB-CE1 3.77Å; W162-F173 AromaticContact CD1-CD1 3.82Å; W162-F173 AromaticContact CG-CD1 3.86Å; W162-F173 HydrophobicContact CG-CD1 3.86Å; W162-F173 HydrophobicContact CG-CE1 4.19Å; W162-P174 HydrophobicContact CD2-CG 4.46Å; W162-P174 HydrophobicContact CH2-CB 4.37Å; W162-P174 HydrophobicContact CH2-CG 3.58Å; W162-P174 HydrophobicContact CZ2-CB 4.49Å; W162-P174 HydrophobicContact CZ2-CG 3.31Å; W162-P174 HydrophobicContact CZ3-CG 4.26Å; W162-C177 PolarHBondContact NE1-SG 3Å
163T91.6Very high92.3Very high65 Ų6549.6 Ų49.640%0.39925%0.247SC..G310 helixtrans-61.1-23.5-17964.20000112.7R160 D161 T165 Y168R160-T163 WeakPolarHBondContact O-CB 3.21Å; R160-T163 WeakPolarHBondContact O-CG2 3.33Å; R160-T163 PolarHBondContact O-N 3.21Å; R160-T163 PolarHBondContact O-OG1 2.91Å; D161-T163 VanDerWaalsContact C-N 3.3Å; D161-T163 PolarHBondContact O-N 2.95Å; T163-T165 VanDerWaalsContact C-N 3.3Å; T163-Y168 HydrophobicContact CG2-CD1 4.33Å; T163-Y168 HydrophobicContact CG2-CE1 3.82Å
164D90.5Very high92.1Very high121 Ų12149.6 Ų49.665%0.64725%0.247SC*.G310 helixtrans-90.19.2179.3-62.7-13.1000112.8D161 W162D161-D164 PolarHBondContact O-N 3.38Å; W162-D164 PolarHBondContact O-N 3.48Å; W162-D164 VanDerWaalsContact O-N 3.09Å
165T92.1Very high91.8Very high3 Ų357.6 Ų57.62%0.01828%0.282CS..SBendtrans-108.5143.718071.70000112L130 W162 T163 Y167 Y168 S169L130-T165 HydrophobicContact CD2-CG2 3.55Å; L130-T165 HydrophobicContact CG-CG2 4.21Å; W162-T165 HydrophobicContact CE3-CG2 4.11Å; W162-T165 WeakPolarHBondContact O-CB 3.39Å; W162-T165 PolarHBondContact O-N 3.02Å; W162-T165 PolarHBondContact O-OG1 3.27Å; T163-T165 VanDerWaalsContact C-N 3.3Å; T165-Y167 PolarHBondContact O-N 2.95Å; T165-Y168 PolarHBondContact O-N 2.91Å; T165-Y168 WeakPolarHBondContact OG1-CB 3.47Å; T165-Y168 PolarHBondContact OG1-N 2.87Å; T165-S169 PolarHBondContact O-N 3.4Å
166N91.2Very high91.5Very high128 Ų12858.2 Ų58.268%0.68429%0.286SS*.Hα-helixtrans-60.2-36.2175.3-65.7-22.1000111.9Y168 S169 E170N166-Y168 VanDerWaalsContact C-N 3.33Å; N166-Y168 PolarHBondContact O-N 2.9Å; N166-S169 PolarHBondContact O-N 3.28Å; N166-E170 PolarHBondContact O-N 3.07Å
167Y90.3Very high91.4Very high29 Ų2958 Ų5811%0.11429%0.285CS..Hα-helixtrans-59.7-42.9179.1-177.8-91.4000112.2Y133 S135 W162 T165 S169 E170 K171 G172 P174Y133-Y167 AromaticContact CD1-CD1 3.97Å; Y133-Y167 HydrophobicContact CD1-CD1 3.97Å; Y133-Y167 AromaticContact CD1-CD2 3.74Å; Y133-Y167 HydrophobicContact CD1-CD2 3.74Å; Y133-Y167 HydrophobicContact CD1-CE1 4.43Å; Y133-Y167 HydrophobicContact CD1-CE2 4.21Å; Y133-Y167 AromaticContact CD1-CG 3.61Å; Y133-Y167 HydrophobicContact CD1-CG 3.61Å; Y133-Y167 AromaticContact CE1-CD1 3.93Å; Y133-Y167 HydrophobicContact CE1-CD1 3.93Å; Y133-Y167 AromaticContact CE1-CD2 3.74Å; Y133-Y167 HydrophobicContact CE1-CD2 3.74Å; Y133-Y167 AromaticContact CE1-CE1 3.93Å; Y133-Y167 HydrophobicContact CE1-CE1 3.93Å; Y133-Y167 AromaticContact CE1-CE2 3.71Å; Y133-Y167 HydrophobicContact CE1-CE2 3.71Å; Y133-Y167 AromaticContact CE1-CG 3.86Å; Y133-Y167 HydrophobicContact CE1-CG 3.86Å; Y133-Y167 AromaticContact CE1-CZ 3.82Å; S135-Y167 VanDerWaalsContact CB-CE2 3.45Å; W162-Y167 HydrophobicContact CE3-CD1 4.39Å; W162-Y167 AromaticContact CZ3-CD1 3.99Å; W162-Y167 HydrophobicContact CZ3-CD1 3.99Å; W162-Y167 HydrophobicContact CZ3-CG 4.49Å; T165-Y167 PolarHBondContact O-N 2.95Å; Y167-S169 VanDerWaalsContact C-N 3.35Å; Y167-S169 PolarHBondContact O-N 3.44Å; Y167-E170 PolarHBondContact O-N 2.82Å; Y167-K171 HydrophobicContact CD1-CB 4.5Å; Y167-K171 HydrophobicContact CD2-CD 4.16Å; Y167-K171 HydrophobicContact CE1-CB 3.98Å; Y167-K171 HydrophobicContact CE2-CB 4.16Å; Y167-K171 HydrophobicContact CE2-CD 3.47Å; Y167-K171 VanDerWaalsContact CE2-CD 3.47Å; Y167-K171 HydrophobicContact CE2-CG 4.38Å; Y167-K171 PolarHBondContact O-N 2.95Å; Y167-G172 WeakPolarHBondContact CD1-O 3.37Å; Y167-G172 WeakPolarHBondContact CE1-O 3.3Å; Y167-P174 HydrophobicContact CE1-CB 4.21Å
168Y91.1Very high91.1Very high38 Ų3856.2 Ų56.215%0.14927%0.274CS..Hα-helixtrans-65.4-38.3-179.4179.6-93.2000112.9W162 T163 T165 N166 E170 G172 F173 R187W162-Y168 HydrophobicContact CB-CD2 3.84Å; W162-Y168 HydrophobicContact CB-CG 4.25Å; W162-Y168 WeakPolarHBondContact O-CB 3.26Å; T163-Y168 HydrophobicContact CG2-CD1 4.33Å; T163-Y168 HydrophobicContact CG2-CE1 3.82Å; T165-Y168 PolarHBondContact O-N 2.91Å; T165-Y168 WeakPolarHBondContact OG1-CB 3.47Å; T165-Y168 PolarHBondContact OG1-N 2.87Å; N166-Y168 VanDerWaalsContact C-N 3.33Å; N166-Y168 PolarHBondContact O-N 2.9Å; Y168-E170 PolarHBondContact O-N 3.24Å; Y168-G172 WeakPolarHBondContact CA-O 3.29Å; Y168-G172 VanDerWaalsContact CD2-C 3.49Å; Y168-G172 WeakPolarHBondContact O-CA 3.47Å; Y168-G172 PolarHBondContact O-N 3.4Å; Y168-F173 HydrophobicContact CD2-CD1 4.03Å; Y168-F173 HydrophobicContact CD2-CE1 4.03Å; Y168-F173 HydrophobicContact CD2-CG 4.38Å; Y168-F173 HydrophobicContact CD2-CZ 4.38Å; Y168-F173 AromaticContact CE2-CD1 3.9Å; Y168-F173 HydrophobicContact CE2-CD1 3.9Å; Y168-F173 HydrophobicContact CE2-CD2 4.07Å; Y168-F173 AromaticContact CE2-CE1 3.59Å; Y168-F173 HydrophobicContact CE2-CE1 3.59Å; Y168-F173 AromaticContact CE2-CE2 3.78Å; Y168-F173 HydrophobicContact CE2-CE2 3.78Å; Y168-F173 HydrophobicContact CE2-CG 4.12Å; Y168-F173 AromaticContact CE2-CZ 3.5Å; Y168-F173 HydrophobicContact CE2-CZ 3.5Å; Y168-R187 HydrophobicContact CE1-CG 4.32Å; Y168-R187 HydrophobicContact CE2-CB 4.37Å; Y168-R187 HydrophobicContact CE2-CG 3.95Å
169S88Confident90.8Very high75 Ų7559 Ų5952%0.52429%0.285SS..Hα-helixtrans-57.6-37.9176.6-54.50000111.6T165 N166 Y167 R187T165-S169 PolarHBondContact O-N 3.4Å; N166-S169 PolarHBondContact O-N 3.28Å; Y167-S169 VanDerWaalsContact C-N 3.35Å; Y167-S169 PolarHBondContact O-N 3.44Å; S169-R187 PolarHBondContact O-NH2 2.82Å
170E87.9Confident90.2Very high149 Ų14966.6 Ų66.670%0.69631%0.313SS*.Hα-helixtrans-87.8-45-178.1-64.2-180-176.600113.6N166 Y167 Y168N166-E170 PolarHBondContact O-N 3.07Å; Y167-E170 PolarHBondContact O-N 2.82Å; Y168-E170 PolarHBondContact O-N 3.24Å
171K88.2Confident89Confident110 Ų11069.3 Ų69.348%0.47833%0.332SS..Hα-helixtrans-123.4-6.1-165-66.1176.9-178.9175.40114.3Y167Y167-K171 HydrophobicContact CD1-CB 4.5Å; Y167-K171 HydrophobicContact CD2-CD 4.16Å; Y167-K171 HydrophobicContact CE1-CB 3.98Å; Y167-K171 HydrophobicContact CE2-CB 4.16Å; Y167-K171 HydrophobicContact CE2-CD 3.47Å; Y167-K171 VanDerWaalsContact CE2-CD 3.47Å; Y167-K171 HydrophobicContact CE2-CG 4.38Å; Y167-K171 PolarHBondContact O-N 2.95Å
172G89.2Confident87.7Confident0 Ų075.4 Ų75.40%036%0.364CS..  trans73.4-149.6-173.600000112.6Y167 Y168Y167-G172 WeakPolarHBondContact CD1-O 3.37Å; Y167-G172 WeakPolarHBondContact CE1-O 3.3Å; Y168-G172 WeakPolarHBondContact CA-O 3.29Å; Y168-G172 VanDerWaalsContact CD2-C 3.49Å; Y168-G172 WeakPolarHBondContact O-CA 3.47Å; Y168-G172 PolarHBondContact O-N 3.4Å
173F91Very high86.5Confident2 Ų276.1 Ų76.11%0.00937%0.37CS..SBendtrans-70.5145.8-179.6-60.8-69.4000112Y159 W162 Y168 C177 P185 V192Y159-F173 AromaticContact CD2-CE1 3.88Å; Y159-F173 HydrophobicContact CD2-CE1 3.88Å; Y159-F173 HydrophobicContact CD2-CE2 4.47Å; Y159-F173 AromaticContact CD2-CZ 3.54Å; Y159-F173 HydrophobicContact CD2-CZ 3.54Å; Y159-F173 HydrophobicContact CE2-CZ 4.06Å; Y159-F173 WeakPolarHBondContact O-CE1 3.36Å; W162-F173 HydrophobicContact CB-CD1 3.83Å; W162-F173 HydrophobicContact CB-CE1 3.77Å; W162-F173 AromaticContact CD1-CD1 3.82Å; W162-F173 AromaticContact CG-CD1 3.86Å; W162-F173 HydrophobicContact CG-CD1 3.86Å; W162-F173 HydrophobicContact CG-CE1 4.19Å; Y168-F173 HydrophobicContact CD2-CD1 4.03Å; Y168-F173 HydrophobicContact CD2-CE1 4.03Å; Y168-F173 HydrophobicContact CD2-CG 4.38Å; Y168-F173 HydrophobicContact CD2-CZ 4.38Å; Y168-F173 AromaticContact CE2-CD1 3.9Å; Y168-F173 HydrophobicContact CE2-CD1 3.9Å; Y168-F173 HydrophobicContact CE2-CD2 4.07Å; Y168-F173 AromaticContact CE2-CE1 3.59Å; Y168-F173 HydrophobicContact CE2-CE1 3.59Å; Y168-F173 AromaticContact CE2-CE2 3.78Å; Y168-F173 HydrophobicContact CE2-CE2 3.78Å; Y168-F173 HydrophobicContact CE2-CG 4.12Å; Y168-F173 AromaticContact CE2-CZ 3.5Å; Y168-F173 HydrophobicContact CE2-CZ 3.5Å; F173-C177 HydrophobicContact CB-CB 4.43Å; F173-P185 HydrophobicContact CB-CB 4.21Å; F173-P185 VanDerWaalsContact O-CB 3.24Å; F173-P185 WeakPolarHBondContact O-CB 3.5Å; F173-P185 WeakPolarHBondContact O-CG 3.28Å; F173-V192 HydrophobicContact CB-CG1 3.78Å; F173-V192 HydrophobicContact CD1-CG1 4.46Å; F173-V192 HydrophobicContact CD2-CG1 3.67Å; F173-V192 HydrophobicContact CD2-CG2 4.19Å; F173-V192 HydrophobicContact CE2-CG1 4.4Å; F173-V192 HydrophobicContact CE2-CG2 4.09Å; F173-V192 HydrophobicContact CG-CG1 3.73Å; F173-V192 HydrophobicContact CG-CG2 4.48Å; F173-V192 HydrophobicContact CZ-CG2 4.31Å
174P91Very high85.3Confident0 Ų077.7 Ų77.70%038%0.379CS..  trans-70158.4171.234.1-39.8000111.2Y133 W162 Y167 S176 C177Y133-P174 HydrophobicContact CE1-CB 4.23Å; W162-P174 HydrophobicContact CD2-CG 4.46Å; W162-P174 HydrophobicContact CH2-CB 4.37Å; W162-P174 HydrophobicContact CH2-CG 3.58Å; W162-P174 HydrophobicContact CZ2-CB 4.49Å; W162-P174 HydrophobicContact CZ2-CG 3.31Å; W162-P174 HydrophobicContact CZ3-CG 4.26Å; Y167-P174 HydrophobicContact CE1-CB 4.21Å; P174-S176 WeakPolarHBondContact CB-OG 3.49Å; P174-S176 WeakPolarHBondContact CG-OG 3.46Å; P174-S176 PolarHBondContact O-N 3.4Å; P174-C177 HydrophobicContact CG-CB 4.21Å; P174-C177 WeakPolarHBondContact O-CB 3.32Å; P174-C177 PolarHBondContact O-N 3.02Å; P174-C177 VanDerWaalsContact O-N 3.12Å
175K89.3Confident83.9Confident168 Ų16873.2 Ų73.273%0.7336%0.356SS*.G310 helixtrans-60.7-29.1177.4-69.4-174.3177.4-175.40113C177 C178 P185K175-C177 PolarHBondContact O-N 3.44Å; K175-C178 WeakPolarHBondContact O-CB 3.49Å; K175-C178 PolarHBondContact O-N 2.84Å; K175-C178 VanDerWaalsContact O-N 3.15Å; K175-C178 PolarHBondContact O-SG 3.32Å; K175-P185 HydrophobicContact CG-CG 4.35Å
176S90.1Very high82.7Confident14 Ų1480.8 Ų80.810%0.09839%0.392CS..G310 helixtrans-61.7-24.9176.754.50000114D145 Q148 S149 P174 C178D145-S176 VanDerWaalsContact CA-CB 3.45Å; D145-S176 WeakPolarHBondContact O-CB 3.49Å; D145-S176 PolarHBondContact OD1-OG 3.43Å; D145-S176 VanDerWaalsContact OD1-OG 3.06Å; Q148-S176 CarbonylContact C-O 3.52Å; Q148-S176 WeakPolarHBondContact CB-O 3.48Å; Q148-S176 PolarHBondContact OE1-OG 3.03Å; S149-S176 PolarHBondContact N-O 2.93Å; P174-S176 WeakPolarHBondContact CB-OG 3.49Å; P174-S176 WeakPolarHBondContact CG-OG 3.46Å; P174-S176 PolarHBondContact O-N 3.4Å; S176-C178 VanDerWaalsContact C-N 3.31Å
177C91.9Very high82.2Confident0 Ų080.6 Ų80.60%038%0.381CS..G310 helixtrans-80.4-9.6177.4-89.10000113.9Q148 C154 W162 F173 P174 K175 V192 N193Q148-C177 PolarHBondContact OE1-SG 2.9Å; C154-C177 VanDerWaalsContact CA-SG 3.51Å; C154-C177 HydrophobicContact CB-CB 3.78Å; C154-C177 WeakPolarHBondContact CB-SG 2.84Å; C154-C177 WeakPolarHBondContact SG-CB 3.45Å; C154-C177 CovalentContact SG-SG 2.03Å; C154-C177 PolarHBondContact SG-SG 3.2Å; W162-C177 PolarHBondContact NE1-SG 3Å; F173-C177 HydrophobicContact CB-CB 4.43Å; P174-C177 HydrophobicContact CG-CB 4.21Å; P174-C177 WeakPolarHBondContact O-CB 3.32Å; P174-C177 PolarHBondContact O-N 3.02Å; P174-C177 VanDerWaalsContact O-N 3.12Å; K175-C177 PolarHBondContact O-N 3.44Å; C177-V192 HydrophobicContact CB-CB 4.27Å; C177-V192 HydrophobicContact CB-CG1 4.11Å; C177-V192 CarbonylContact O-C 3.58Å; C177-V192 VanDerWaalsContact O-CA 3.26Å; C177-V192 WeakPolarHBondContact O-CA 3.39Å; C177-V192 WeakPolarHBondContact O-CB 3.38Å; C177-N193 PolarHBondContact O-N 3.35Å; C177-N193 PolarHBondContact O-ND2 3Å
178C89.6Confident81.9Confident16 Ų1682 Ų8211%0.10839%0.391CS..BIsolated β-bridgetrans-72.1145-171.9-65.60000113K175 S176 C183 N193K175-C178 WeakPolarHBondContact O-CB 3.49Å; K175-C178 PolarHBondContact O-N 2.84Å; K175-C178 VanDerWaalsContact O-N 3.15Å; K175-C178 PolarHBondContact O-SG 3.32Å; S176-C178 VanDerWaalsContact C-N 3.31Å; C178-C183 HydrophobicContact CB-CB 3.18Å; C178-C183 WeakPolarHBondContact CB-SG 3.49Å; C178-C183 WeakPolarHBondContact SG-CB 3.47Å; C178-C183 CovalentContact SG-SG 2.02Å; C178-C183 PolarHBondContact SG-SG 3.39Å; C178-N193 PolarHBondContact O-ND2 3.49Å
179K88.1Confident81.6Confident93 Ų9382.5 Ų82.540%0.40440%0.399SS..SBendtrans-73.5-28.1173.9-74.7170.8175.9142.30113.3D190 K191 V192 N193 N194K179-D190 PolarHBondContact NZ-O 2.89Å; K179-K191 PolarHBondContact N-O 3.32Å; K179-V192 WeakPolarHBondContact CE-O 3.36Å; K179-V192 PolarHBondContact NZ-O 2.92Å; K179-N193 WeakPolarHBondContact CG-OD1 2.98Å; K179-N194 PolarHBondContact NZ-OD1 3.49Å
180R79.9Confident81.6Confident210 Ų21085.1 Ų85.179%0.79241%0.407SS*.SBendtrans-141158.9-175.6-63-174.8-177.3-1791.1110.4D182 C183R180-D182 PolarHBondContact O-N 2.96Å; R180-C183 WeakPolarHBondContact O-CB 3.39Å; R180-C183 PolarHBondContact O-N 2.95Å
181E69.1Low81.5Confident200 Ų20082.1 Ų82.194%0.93539%0.392SS*.THydrogen-bonded Turntrans-65.6-33.5-178.3-65.1-167.6161.700113.5C183E181-C183 PolarHBondContact O-N 3.44Å
182D67.3Low81.7Confident162 Ų16276.9 Ų76.987%0.86637%0.369SS*.THydrogen-bonded Turntrans-78.825176.6-66.5-35000114R180 T184R180-D182 PolarHBondContact O-N 2.96Å; D182-T184 PolarHBondContact O-N 3.47Å
183C70Confident81.9Confident16 Ų1677.8 Ų77.811%0.10837%0.374CS..  trans-74.4115.9174173.10000109.6C178 R180 E181 P185C178-C183 HydrophobicContact CB-CB 3.18Å; C178-C183 WeakPolarHBondContact CB-SG 3.49Å; C178-C183 WeakPolarHBondContact SG-CB 3.47Å; C178-C183 CovalentContact SG-SG 2.02Å; C178-C183 PolarHBondContact SG-SG 3.39Å; R180-C183 WeakPolarHBondContact O-CB 3.39Å; R180-C183 PolarHBondContact O-N 2.95Å; E181-C183 PolarHBondContact O-N 3.44Å; C183-P185 WeakPolarHBondContact O-CD 3.26Å
184T66.2Low81.9Confident98 Ų9881.7 Ų81.760%0.60140%0.395SS*.  trans-94.988.7162.2300000107.9D182 Q186D182-T184 PolarHBondContact O-N 3.47Å; T184-Q186 PolarHBondContact O-N 3Å; T184-Q186 VanDerWaalsContact O-N 3.12Å
185P61.3Low82Confident26 Ų2685 Ų8517%0.16941%0.41CS..  trans-77109.4-17431.8-32.2000108.3F173 K175 C183F173-P185 HydrophobicContact CB-CB 4.21Å; F173-P185 VanDerWaalsContact O-CB 3.24Å; F173-P185 WeakPolarHBondContact O-CB 3.5Å; F173-P185 WeakPolarHBondContact O-CG 3.28Å; K175-P185 HydrophobicContact CG-CG 4.35Å; C183-P185 WeakPolarHBondContact O-CD 3.26Å
186Q66.3Low82.3Confident163 Ų16377 Ų7776%0.76238%0.375SS*.SBendtrans-125.823.2172.3-77.7-178.3-7.300112.4T184T184-Q186 PolarHBondContact O-N 3Å; T184-Q186 VanDerWaalsContact O-N 3.12Å
187R79.6Confident82.6Confident123 Ų12376.3 Ų76.346%0.46437%0.371SS..SBendtrans100.811.9-177.4-53.8161.8-172138.1-1.5115.6Y168 S169 P189Y168-R187 HydrophobicContact CE1-CG 4.32Å; Y168-R187 HydrophobicContact CE2-CB 4.37Å; Y168-R187 HydrophobicContact CE2-CG 3.95Å; S169-R187 PolarHBondContact O-NH2 2.82Å; R187-P189 WeakPolarHBondContact O-CD 3.39Å
188D84.6Confident82.8Confident58 Ų5877.1 Ų77.131%0.3137%0.374SS..  trans-70.8111.8172.1-175.4-8.8000111.1D190 K191D188-D190 VanDerWaalsContact C-N 3.27Å; D188-D190 PolarHBondContact O-N 3.38Å; D188-D190 WeakPolarHBondContact OD1-CB 3.34Å; D188-D190 PolarHBondContact OD1-N 2.86Å; D188-K191 HydrophobicContact CB-CD 4.43Å; D188-K191 HydrophobicContact CB-CG 4.47Å; D188-K191 WeakPolarHBondContact OD2-CD 3.44Å; D188-K191 VanDerWaalsContact OD2-CE 3.25Å; D188-K191 WeakPolarHBondContact OD2-CE 3.37Å; D188-K191 WeakPolarHBondContact OD2-CG 3.34Å
189P85.2Confident83Confident49 Ų4979.7 Ų79.732%0.31839%0.386SS..G310 helixtrans-66.8-25.2179.5-20.435.8000113.6Y159 R187 K191 V192Y159-P189 HydrophobicContact CE2-CB 3.71Å; Y159-P189 HydrophobicContact CE2-CG 4.28Å; R187-P189 WeakPolarHBondContact O-CD 3.39Å; P189-K191 VanDerWaalsContact C-N 3.26Å; P189-K191 PolarHBondContact O-N 3.31Å; P189-V192 WeakPolarHBondContact O-CG2 3.45Å
190D86.8Confident83.3Confident130 Ų13078.2 Ų78.270%0.69538%0.38SS*.G310 helixtrans-73.3-24.7-173.4-67.8-34.5000111.8K179 D188K179-D190 PolarHBondContact NZ-O 2.89Å; D188-D190 VanDerWaalsContact C-N 3.27Å; D188-D190 PolarHBondContact O-N 3.38Å; D188-D190 WeakPolarHBondContact OD1-CB 3.34Å; D188-D190 PolarHBondContact OD1-N 2.86Å
191K87.8Confident83.9Confident86 Ų8669.4 Ų69.437%0.37435%0.349SS..G310 helixtrans-89.1-9.8-177.1-66.3-174.5-176.9-178.50114.9K179 D188 P189K179-K191 PolarHBondContact N-O 3.32Å; D188-K191 HydrophobicContact CB-CD 4.43Å; D188-K191 HydrophobicContact CB-CG 4.47Å; D188-K191 WeakPolarHBondContact OD2-CD 3.44Å; D188-K191 VanDerWaalsContact OD2-CE 3.25Å; D188-K191 WeakPolarHBondContact OD2-CE 3.37Å; D188-K191 WeakPolarHBondContact OD2-CG 3.34Å; P189-K191 VanDerWaalsContact C-N 3.26Å; P189-K191 PolarHBondContact O-N 3.31Å
192V91.8Very high85Confident1 Ų160.8 Ų60.81%0.00631%0.309CS..BIsolated β-bridgetrans-103.9157.4-180-63.50000111.9Y159 F173 C177 K179 P189 N194Y159-V192 HydrophobicContact CD2-CG2 4.16Å; Y159-V192 HydrophobicContact CG-CG2 4.27Å; F173-V192 HydrophobicContact CB-CG1 3.78Å; F173-V192 HydrophobicContact CD1-CG1 4.46Å; F173-V192 HydrophobicContact CD2-CG1 3.67Å; F173-V192 HydrophobicContact CD2-CG2 4.19Å; F173-V192 HydrophobicContact CE2-CG1 4.4Å; F173-V192 HydrophobicContact CE2-CG2 4.09Å; F173-V192 HydrophobicContact CG-CG1 3.73Å; F173-V192 HydrophobicContact CG-CG2 4.48Å; F173-V192 HydrophobicContact CZ-CG2 4.31Å; C177-V192 HydrophobicContact CB-CB 4.27Å; C177-V192 HydrophobicContact CB-CG1 4.11Å; C177-V192 CarbonylContact O-C 3.58Å; C177-V192 VanDerWaalsContact O-CA 3.26Å; C177-V192 WeakPolarHBondContact O-CA 3.39Å; C177-V192 WeakPolarHBondContact O-CB 3.38Å; K179-V192 WeakPolarHBondContact CE-O 3.36Å; K179-V192 PolarHBondContact NZ-O 2.92Å; P189-V192 WeakPolarHBondContact O-CG2 3.45Å; V192-N194 PolarHBondContact O-N 3.35Å; V192-N194 PolarHBondContact O-OD1 3.48Å
193N92.3Very high86.2Confident18 Ų1856.3 Ų56.310%0.09629%0.288CS..  trans-64.7130.1173.5-63.7-53.1000109.5H152 C154 Y159 C177 C178 K179H152-N193 VanDerWaalsContact C-CG 3.44Å; H152-N193 WeakPolarHBondContact O-CB 3.48Å; H152-N193 VanDerWaalsContact O-CG 3.25Å; C154-N193 HydrophobicContact CB-CB 4.19Å; C154-N193 WeakPolarHBondContact CB-O 3.3Å; Y159-N193 WeakPolarHBondContact CB-O 3.38Å; C177-N193 PolarHBondContact O-N 3.35Å; C177-N193 PolarHBondContact O-ND2 3Å; C178-N193 PolarHBondContact O-ND2 3.49Å; K179-N193 WeakPolarHBondContact CG-OD1 2.98Å
194N91.7Very high87.1Confident84 Ų8458.7 Ų58.745%0.44930%0.299SS..  trans-84.2-27.4-173.1-59.114.8000112Y159 K179 V192Y159-N194 HydrophobicContact CD1-CB 4.32Å; K179-N194 PolarHBondContact NZ-OD1 3.49Å; V192-N194 PolarHBondContact O-N 3.35Å; V192-N194 PolarHBondContact O-OD1 3.48Å
195E94Very high88.2Confident70 Ų7058.2 Ų58.233%0.32729%0.292SS..BIsolated β-bridgetrans-80.3131.7-175-168.1178.8178.600111.4C153 C154 K200C153-E195 CarbonylContact C-O 3.51Å; C153-E195 WeakPolarHBondContact CA-O 3.39Å; C153-E195 WeakPolarHBondContact CB-O 3.33Å; C154-E195 PolarHBondContact N-O 3.25Å; E195-K200 HydrophobicContact CG-CD 4.39Å; E195-K200 WeakPolarHBondContact OE1-CD 3.47Å; E195-K200 IonicContact OE1-NZ 3.4Å; E195-K200 WeakPolarHBondContact OE2-CD 3.29Å; E195-K200 IonicContact OE2-NZ 3.46Å; E195-K200 PolarHBondContact OE2-NZ 3.28Å
196G95.6Very high89.5Confident0 Ų062.9 Ų62.90%031%0.311CS..  trans-67.1142.9175.300000113.5C154 V156 T157 F198 I199 K200C154-G196 WeakPolarHBondContact O-CA 3.33Å; V156-G196 CarbonylContact O-C 3.21Å; V156-G196 VanDerWaalsContact O-CA 3.3Å; V156-G196 WeakPolarHBondContact O-CA 3.47Å; T157-G196 VanDerWaalsContact C-CA 3.41Å; T157-G196 WeakPolarHBondContact O-CA 3.44Å; T157-G196 PolarHBondContact O-N 3.35Å; G196-F198 PolarHBondContact O-N 3.42Å; G196-I199 PolarHBondContact O-N 2.84Å; G196-K200 PolarHBondContact O-N 3.44Å
197C96.1Very high90.6Very high0 Ų058.9 Ų58.90%030%0.301CS..Hα-helixtrans-66.5-33.5-177.5-66.70000113.9Y126 I147 Q148 C153 G155 V156 K200 V201Y126-C197 HydrophobicContact CE1-CB 3.81Å; Y126-C197 PolarHBondContact OH-SG 2.88Å; I147-C197 HydrophobicContact CG2-CB 3.96Å; Q148-C197 VanDerWaalsContact CG-SG 3.55Å; C153-C197 VanDerWaalsContact C-SG 3.51Å; C153-C197 HydrophobicContact CB-CB 3.93Å; C153-C197 WeakPolarHBondContact CB-SG 3.38Å; C153-C197 WeakPolarHBondContact SG-CA 3.14Å; C153-C197 WeakPolarHBondContact SG-CB 3.45Å; C153-C197 CovalentContact SG-SG 2.03Å; C153-C197 PolarHBondContact SG-SG 3.04Å; G155-C197 WeakPolarHBondContact O-CB 3.44Å; G155-C197 PolarHBondContact O-N 3.39Å; V156-C197 PolarHBondContact O-N 3Å; V156-C197 VanDerWaalsContact O-N 3.14Å; C197-K200 PolarHBondContact O-N 3.15Å; C197-V201 WeakPolarHBondContact O-CB 3.37Å; C197-V201 WeakPolarHBondContact O-CG2 3.32Å; C197-V201 PolarHBondContact O-N 3.36Å
198F95.2Very high91.2Very high17 Ų1757.5 Ų57.58%0.07530%0.3CS..Hα-helixtrans-62.9-45.5173.5172-104.1000110.9K119 F122 K123 V156 G196 M202K119-F198 HydrophobicContact CD-CZ 4.17Å; K119-F198 HydrophobicContact CG-CE2 3.71Å; K119-F198 HydrophobicContact CG-CZ 3.57Å; K119-F198 WeakPolarHBondContact O-CE2 3.41Å; F122-F198 AromaticContact CD1-CD2 3.89Å; F122-F198 HydrophobicContact CD1-CD2 3.89Å; F122-F198 HydrophobicContact CD1-CE2 4.45Å; F122-F198 HydrophobicContact CE1-CD2 4.31Å; K123-F198 HydrophobicContact CB-CD2 3.65Å; K123-F198 HydrophobicContact CB-CE2 3.57Å; K123-F198 HydrophobicContact CB-CG 4.23Å; K123-F198 HydrophobicContact CB-CZ 4.08Å; K123-F198 HydrophobicContact CD-CD1 4.18Å; K123-F198 HydrophobicContact CD-CE1 4.01Å; K123-F198 HydrophobicContact CD-CE2 4.41Å; K123-F198 HydrophobicContact CD-CG 4.45Å; K123-F198 HydrophobicContact CD-CZ 4.11Å; K123-F198 HydrophobicContact CG-CD1 4.25Å; K123-F198 HydrophobicContact CG-CD2 3.96Å; K123-F198 HydrophobicContact CG-CE1 4.4Å; K123-F198 HydrophobicContact CG-CE2 4.13Å; K123-F198 HydrophobicContact CG-CG 4.01Å; K123-F198 HydrophobicContact CG-CZ 4.33Å; V156-F198 HydrophobicContact CG1-CB 3.95Å; V156-F198 WeakPolarHBondContact O-CA 3.22Å; V156-F198 WeakPolarHBondContact O-CB 3.42Å; V156-F198 PolarHBondContact O-N 3.27Å; G196-F198 PolarHBondContact O-N 3.42Å; F198-M202 HydrophobicContact CD2-CE 4.19Å; F198-M202 HydrophobicContact CD2-CG 4.18Å; F198-M202 HydrophobicContact CE1-CG 4.34Å; F198-M202 HydrophobicContact CE2-CE 3.76Å; F198-M202 HydrophobicContact CE2-CG 3.85Å; F198-M202 HydrophobicContact CE2-SD 4.3Å; F198-M202 HydrophobicContact CZ-CG 3.95Å; F198-M202 WeakPolarHBondContact O-CB 2.98Å; F198-M202 WeakPolarHBondContact O-CG 3.49Å; F198-M202 PolarHBondContact O-N 3.45Å
199I93.9Very high91.3Very high69 Ų6960.5 Ų60.535%0.35431%0.314SS..Hα-helixtrans-63.2-47.8177.8-56.8-60.2000109.4G196 V201 M202 T203G196-I199 PolarHBondContact O-N 2.84Å; I199-V201 PolarHBondContact O-N 3.32Å; I199-M202 PolarHBondContact O-N 2.88Å; I199-M202 VanDerWaalsContact O-N 3.13Å; I199-T203 PolarHBondContact O-N 3.43Å; I199-T203 PolarHBondContact O-OG1 3.24Å
200K94.8Very high91.5Very high62 Ų6260.9 Ų60.927%0.2733%0.327SS..Hα-helixtrans-56.1-49.9178.7-165.370.1171.2-175.70112.8L151 C153 E195 G196 C197 M202 T203 I204L151-K200 HydrophobicContact CB-CG 4.43Å; C153-K200 HydrophobicContact CB-CB 4.15Å; C153-K200 HydrophobicContact CB-CG 4.44Å; E195-K200 HydrophobicContact CG-CD 4.39Å; E195-K200 WeakPolarHBondContact OE1-CD 3.47Å; E195-K200 IonicContact OE1-NZ 3.4Å; E195-K200 WeakPolarHBondContact OE2-CD 3.29Å; E195-K200 IonicContact OE2-NZ 3.46Å; E195-K200 PolarHBondContact OE2-NZ 3.28Å; G196-K200 PolarHBondContact O-N 3.44Å; C197-K200 PolarHBondContact O-N 3.15Å; K200-M202 VanDerWaalsContact C-N 3.29Å; K200-M202 PolarHBondContact O-N 2.77Å; K200-T203 PolarHBondContact O-N 2.71Å; K200-I204 HydrophobicContact CG-CD1 4.06Å; K200-I204 VanDerWaalsContact O-CG1 3.29Å; K200-I204 WeakPolarHBondContact O-CG1 3.22Å; K200-I204 PolarHBondContact O-N 2.81Å
201V93.1Very high91.8Very high25 Ų2558.6 Ų58.615%0.15232%0.317CS..Hα-helixtrans-60.1-42178.6169.30000110.7F122 L151 C197 I199 I204 I205F122-V201 HydrophobicContact CE1-CB 4.15Å; F122-V201 HydrophobicContact CE1-CG1 4.03Å; F122-V201 HydrophobicContact CE1-CG2 4.17Å; F122-V201 HydrophobicContact CZ-CG1 4.42Å; F122-V201 HydrophobicContact CZ-CG2 4.19Å; L151-V201 HydrophobicContact CD1-CG2 3.37Å; C197-V201 WeakPolarHBondContact O-CB 3.37Å; C197-V201 WeakPolarHBondContact O-CG2 3.32Å; C197-V201 PolarHBondContact O-N 3.36Å; I199-V201 PolarHBondContact O-N 3.32Å; V201-I204 PolarHBondContact O-N 3.04Å; V201-I205 HydrophobicContact CG1-CD1 3.67Å; V201-I205 HydrophobicContact CG1-CG1 4.34Å; V201-I205 WeakPolarHBondContact O-CB 3.29Å; V201-I205 VanDerWaalsContact O-CG1 3.24Å; V201-I205 WeakPolarHBondContact O-CG1 3.42Å; V201-I205 PolarHBondContact O-N 3.48Å
202M91.9Very high91.8Very high19 Ų1958.7 Ų58.79%0.09432%0.324CS..Hα-helixtrans-69.7-39.8-179.4-66.3-66144.500112K119 F122 F198 I199 K200 I204 I205 E206K119-M202 HydrophobicContact CB-CE 4.16Å; K119-M202 HydrophobicContact CB-SD 4.19Å; K119-M202 HydrophobicContact CD-CE 4.34Å; K119-M202 HydrophobicContact CD-CG 4.17Å; K119-M202 HydrophobicContact CD-SD 3.36Å; K119-M202 WeakPolarHBondContact CD-SD 3.48Å; K119-M202 WeakPolarHBondContact CE-SD 3.46Å; K119-M202 HydrophobicContact CG-CE 3.77Å; K119-M202 HydrophobicContact CG-CG 4.36Å; K119-M202 HydrophobicContact CG-SD 3.49Å; K119-M202 WeakPolarHBondContact CG-SD 3.34Å; F122-M202 HydrophobicContact CD1-CE 4.06Å; F198-M202 HydrophobicContact CD2-CE 4.19Å; F198-M202 HydrophobicContact CD2-CG 4.18Å; F198-M202 HydrophobicContact CE1-CG 4.34Å; F198-M202 HydrophobicContact CE2-CE 3.76Å; F198-M202 HydrophobicContact CE2-CG 3.85Å; F198-M202 HydrophobicContact CE2-SD 4.3Å; F198-M202 HydrophobicContact CZ-CG 3.95Å; F198-M202 WeakPolarHBondContact O-CB 2.98Å; F198-M202 WeakPolarHBondContact O-CG 3.49Å; F198-M202 PolarHBondContact O-N 3.45Å; I199-M202 PolarHBondContact O-N 2.88Å; I199-M202 VanDerWaalsContact O-N 3.13Å; K200-M202 VanDerWaalsContact C-N 3.29Å; K200-M202 PolarHBondContact O-N 2.77Å; M202-I204 VanDerWaalsContact C-N 3.35Å; M202-I205 HydrophobicContact CE-CD1 4.18Å; M202-I205 PolarHBondContact O-N 3.23Å; M202-I205 HydrophobicContact SD-CD1 4.41Å; M202-E206 WeakPolarHBondContact O-CB 3.42Å; M202-E206 VanDerWaalsContact O-CG 3.25Å; M202-E206 WeakPolarHBondContact O-CG 3.46Å; M202-E206 PolarHBondContact O-N 3.41Å
203T91.9Very high91.8Very high69 Ų6961.3 Ų61.342%0.42335%0.346SS..Hα-helixtrans-60.8-44.4172.8-56.40000111.1I199 K200 E206 S207I199-T203 PolarHBondContact O-N 3.43Å; I199-T203 PolarHBondContact O-OG1 3.24Å; K200-T203 PolarHBondContact O-N 2.71Å; T203-E206 PolarHBondContact O-N 3.25Å; T203-S207 WeakPolarHBondContact O-CB 3.18Å; T203-S207 PolarHBondContact O-N 3.22Å; T203-S207 PolarHBondContact O-OG 3.01Å
204I89.5Confident91.9Very high66 Ų6662.5 Ų62.534%0.33836%0.363SS..Hα-helixtrans-63-46.2176.1-69.1166.8000110.6L151 K200 V201 M202 E206 S207 E208L151-I204 HydrophobicContact CD2-CD1 3.99Å; K200-I204 HydrophobicContact CG-CD1 4.06Å; K200-I204 VanDerWaalsContact O-CG1 3.29Å; K200-I204 WeakPolarHBondContact O-CG1 3.22Å; K200-I204 PolarHBondContact O-N 2.81Å; V201-I204 PolarHBondContact O-N 3.04Å; M202-I204 VanDerWaalsContact C-N 3.35Å; I204-E206 VanDerWaalsContact C-N 3.3Å; I204-E206 PolarHBondContact O-N 2.81Å; I204-S207 PolarHBondContact O-N 2.91Å; I204-S207 PolarHBondContact O-OG 3.41Å; I204-S207 VanDerWaalsContact O-OG 3.09Å; I204-E208 HydrophobicContact CG2-CG 4.13Å; I204-E208 VanDerWaalsContact O-CB 3.24Å; I204-E208 WeakPolarHBondContact O-CB 3.36Å; I204-E208 VanDerWaalsContact O-CG 3.31Å; I204-E208 WeakPolarHBondContact O-CG 3.34Å; I204-E208 PolarHBondContact O-N 3.22Å
205I88.6Confident91.9Very high88 Ų8863.7 Ų63.745%0.45137%0.368SS..Hα-helixtrans-61.2-42.7178.6-72.3168.9000110.3V201 M202 M209V201-I205 HydrophobicContact CG1-CD1 3.67Å; V201-I205 HydrophobicContact CG1-CG1 4.34Å; V201-I205 WeakPolarHBondContact O-CB 3.29Å; V201-I205 VanDerWaalsContact O-CG1 3.24Å; V201-I205 WeakPolarHBondContact O-CG1 3.42Å; V201-I205 PolarHBondContact O-N 3.48Å; M202-I205 HydrophobicContact CE-CD1 4.18Å; M202-I205 PolarHBondContact O-N 3.23Å; M202-I205 HydrophobicContact SD-CD1 4.41Å; I205-M209 VanDerWaalsContact O-CA 3.31Å; I205-M209 WeakPolarHBondContact O-CA 3.47Å; I205-M209 WeakPolarHBondContact O-CB 3.37Å; I205-M209 PolarHBondContact O-N 2.96Å
206E89.1Confident91.9Very high123 Ų12363.7 Ų63.758%0.57538%0.376SS*.Hα-helixtrans-69-38.7-179.8-73.2170.1-16400111.9K119 M202 T203 I204K119-E206 IonicContact NZ-OE1 3.7Å; K119-E206 PolarHBondContact NZ-OE1 3.28Å; M202-E206 WeakPolarHBondContact O-CB 3.42Å; M202-E206 VanDerWaalsContact O-CG 3.25Å; M202-E206 WeakPolarHBondContact O-CG 3.46Å; M202-E206 PolarHBondContact O-N 3.41Å; T203-E206 PolarHBondContact O-N 3.25Å; I204-E206 VanDerWaalsContact C-N 3.3Å; I204-E206 PolarHBondContact O-N 2.81Å
207S90.1Very high91.8Very high79 Ų7970.6 Ų70.655%0.55241%0.406SS*.Hα-helixtrans-72.7-38.6177.266.90000112.9T203 I204T203-S207 WeakPolarHBondContact O-CB 3.18Å; T203-S207 PolarHBondContact O-N 3.22Å; T203-S207 PolarHBondContact O-OG 3.01Å; I204-S207 PolarHBondContact O-N 2.91Å; I204-S207 PolarHBondContact O-OG 3.41Å; I204-S207 VanDerWaalsContact O-OG 3.09Å
208E90.6Very high91.8Very high94 Ų9472.4 Ų72.444%0.43942%0.424SS..Hα-helixtrans-91.7-0.7-178.4-59.3-58.8155.500113.1I204 G210 V211 V212I204-E208 HydrophobicContact CG2-CG 4.13Å; I204-E208 VanDerWaalsContact O-CB 3.24Å; I204-E208 WeakPolarHBondContact O-CB 3.36Å; I204-E208 VanDerWaalsContact O-CG 3.31Å; I204-E208 WeakPolarHBondContact O-CG 3.34Å; I204-E208 PolarHBondContact O-N 3.22Å; E208-G210 PolarHBondContact O-N 2.97Å; E208-G210 VanDerWaalsContact O-N 3.13Å; E208-V211 WeakPolarHBondContact O-CB 3.35Å; E208-V211 PolarHBondContact O-N 3.29Å; E208-V211 WeakPolarHBondContact OE2-CG2 3.43Å; E208-V212 PolarHBondContact O-N 3.33Å
209M87.1Confident91.7Very high122 Ų12274.6 Ų74.660%0.60144%0.439SS*.Hα-helixtrans-56-36.1-177.7-161.4174.558.800111.6I205 V212 A213I205-M209 VanDerWaalsContact O-CA 3.31Å; I205-M209 WeakPolarHBondContact O-CA 3.47Å; I205-M209 WeakPolarHBondContact O-CB 3.37Å; I205-M209 PolarHBondContact O-N 2.96Å; M209-V212 PolarHBondContact O-N 2.91Å; M209-A213 WeakPolarHBondContact O-CB 3.33Å; M209-A213 PolarHBondContact O-N 2.91Å
210G89.9Confident91.8Very high57 Ų5772.4 Ų72.459%0.58843%0.431SS*.Hα-helixtrans-62.5-40.9175.600000112.9E208 G214E208-G210 PolarHBondContact O-N 2.97Å; E208-G210 VanDerWaalsContact O-N 3.13Å; G210-G214 PolarHBondContact O-N 3.49Å
211V92.1Very high91.8Very high81 Ų8171.6 Ų71.649%0.49143%0.433SS..Hα-helixtrans-68-47.2177.7179.10000110.4E208 A213 G214 I215E208-V211 WeakPolarHBondContact O-CB 3.35Å; E208-V211 PolarHBondContact O-N 3.29Å; E208-V211 WeakPolarHBondContact OE2-CG2 3.43Å; V211-A213 PolarHBondContact O-N 3.32Å; V211-G214 PolarHBondContact O-N 3.48Å; V211-I215 HydrophobicContact CG1-CD1 3.99Å; V211-I215 WeakPolarHBondContact O-CG1 3.44Å; V211-I215 PolarHBondContact O-N 2.92Å
212V89.1Confident91.9Very high88 Ų8873.7 Ų73.753%0.53344%0.44SS..Hα-helixtrans-61.5-44.3178.6176.80000111.3E208 M209 G214 I215 S216E208-V212 PolarHBondContact O-N 3.33Å; M209-V212 PolarHBondContact O-N 2.91Å; V212-G214 VanDerWaalsContact C-N 3.34Å; V212-I215 PolarHBondContact O-N 3.39Å; V212-S216 WeakPolarHBondContact O-CB 3.3Å; V212-S216 PolarHBondContact O-N 3.45Å; V212-S216 PolarHBondContact O-OG 2.97Å
213A90.8Very high92Very high56 Ų5673.1 Ų73.146%0.46344%0.437SS..Hα-helixtrans-62.6-41.7175.300000111.4M209 V211 S216 F217M209-A213 WeakPolarHBondContact O-CB 3.33Å; M209-A213 PolarHBondContact O-N 2.91Å; V211-A213 PolarHBondContact O-N 3.32Å; A213-S216 PolarHBondContact O-N 2.9Å; A213-F217 WeakPolarHBondContact O-CB 3.28Å; A213-F217 PolarHBondContact O-N 3.46Å
214G94.1Very high92.3Very high43 Ų4373.8 Ų73.844%0.44344%0.438SS..Hα-helixtrans-61.5-46.7176.500000113G210 V211 V212 S216 F217 G218G210-G214 PolarHBondContact O-N 3.49Å; V211-G214 PolarHBondContact O-N 3.48Å; V212-G214 VanDerWaalsContact C-N 3.34Å; G214-S216 PolarHBondContact O-N 3.43Å; G214-F217 PolarHBondContact O-N 2.91Å; G214-G218 PolarHBondContact O-N 3.48Å
215I93.2Very high92.6Very high110 Ų11074.8 Ų74.856%0.56444%0.443SS*.Hα-helixtrans-60.2-47.3175.5-67168000110.1V211 V212 F217 G218 V219V211-I215 HydrophobicContact CG1-CD1 3.99Å; V211-I215 WeakPolarHBondContact O-CG1 3.44Å; V211-I215 PolarHBondContact O-N 2.92Å; V212-I215 PolarHBondContact O-N 3.39Å; I215-F217 PolarHBondContact O-N 3.42Å; I215-G218 PolarHBondContact O-N 2.91Å; I215-V219 HydrophobicContact CG2-CG2 4.48Å; I215-V219 WeakPolarHBondContact O-CG2 3.23Å; I215-V219 PolarHBondContact O-N 3.41Å
216S92.3Very high92.9Very high69 Ų6970.6 Ų70.648%0.48342%0.421SS..Hα-helixtrans-61.1-44.5-179.5-55.40000111.9V212 A213 G214 G218 V219 A220V212-S216 WeakPolarHBondContact O-CB 3.3Å; V212-S216 PolarHBondContact O-N 3.45Å; V212-S216 PolarHBondContact O-OG 2.97Å; A213-S216 PolarHBondContact O-N 2.9Å; G214-S216 PolarHBondContact O-N 3.43Å; S216-G218 VanDerWaalsContact C-N 3.34Å; S216-G218 PolarHBondContact O-N 3.29Å; S216-V219 PolarHBondContact O-N 2.96Å; S216-A220 PolarHBondContact O-N 3.38Å
217F94.8Very high93.3Very high146 Ų14666.1 Ų66.164%0.6440%0.401SS*.Hα-helixtrans-64.5-39.4175.7-177.8-101.9000112.1A213 G214 I215 A220 C221A213-F217 WeakPolarHBondContact O-CB 3.28Å; A213-F217 PolarHBondContact O-N 3.46Å; G214-F217 PolarHBondContact O-N 2.91Å; I215-F217 PolarHBondContact O-N 3.42Å; F217-A220 PolarHBondContact O-N 2.97Å; F217-C221 WeakPolarHBondContact CE1-SG 3.34Å; F217-C221 VanDerWaalsContact CZ-SG 3.5Å; F217-C221 WeakPolarHBondContact O-CB 3.42Å; F217-C221 PolarHBondContact O-N 3.24Å; F217-C221 PolarHBondContact O-SG 3.46Å
218G95.3Very high93.6Very high37 Ų3768.4 Ų68.438%0.38140%0.401SS..Hα-helixtrans-60.9-45.3174.900000112.5G214 I215 S216 C221 F222G214-G218 PolarHBondContact O-N 3.48Å; I215-G218 PolarHBondContact O-N 2.91Å; S216-G218 VanDerWaalsContact C-N 3.34Å; S216-G218 PolarHBondContact O-N 3.29Å; G218-C221 PolarHBondContact O-N 2.89Å; G218-F222 VanDerWaalsContact O-CB 3.29Å; G218-F222 WeakPolarHBondContact O-CB 3.47Å; G218-F222 PolarHBondContact O-N 3.22Å
219V93.4Very high93.8Very high63 Ų6364.6 Ų64.638%0.38238%0.384SS..Hα-helixtrans-60.1-48175.21720000110.8I215 S216 C221 F222 Q223I215-V219 HydrophobicContact CG2-CG2 4.48Å; I215-V219 WeakPolarHBondContact O-CG2 3.23Å; I215-V219 PolarHBondContact O-N 3.41Å; S216-V219 PolarHBondContact O-N 2.96Å; V219-C221 PolarHBondContact O-N 3.16Å; V219-F222 PolarHBondContact O-N 3.48Å; V219-Q223 WeakPolarHBondContact O-CB 3.26Å; V219-Q223 PolarHBondContact O-N 3.41Å
220A95.3Very high94.2Very high23 Ų2358.8 Ų58.819%0.1936%0.355CS..Hα-helixtrans-58.1-47177.300000112.3F101 S216 F217 F222 Q223 L224F101-A220 HydrophobicContact CE2-CB 4.1Å; S216-A220 PolarHBondContact O-N 3.38Å; F217-A220 PolarHBondContact O-N 2.97Å; A220-F222 PolarHBondContact O-N 3.39Å; A220-Q223 PolarHBondContact O-N 2.93Å; A220-L224 WeakPolarHBondContact O-CG 3.3Å; A220-L224 PolarHBondContact O-N 3.41Å
221C95.6Very high94.4Very high45 Ų4562.5 Ų62.530%0.30435%0.353SS..Hα-helixtrans-62.1-44.5176.2-69.80000111.9F217 G218 V219 Q223 L224 I225F217-C221 WeakPolarHBondContact CE1-SG 3.34Å; F217-C221 VanDerWaalsContact CZ-SG 3.5Å; F217-C221 WeakPolarHBondContact O-CB 3.42Å; F217-C221 PolarHBondContact O-N 3.24Å; F217-C221 PolarHBondContact O-SG 3.46Å; G218-C221 PolarHBondContact O-N 2.89Å; V219-C221 PolarHBondContact O-N 3.16Å; C221-Q223 VanDerWaalsContact C-N 3.3Å; C221-Q223 PolarHBondContact O-N 3.47Å; C221-L224 PolarHBondContact O-N 3.4Å; C221-I225 WeakPolarHBondContact O-CG1 3.39Å; C221-I225 PolarHBondContact O-N 3.39Å
222F94.4Very high94.4Very high70 Ų7060 Ų6031%0.30734%0.338SS..Hα-helixtrans-62.7-38.5179.2-169.4-119.1000111.6Y24 I27 F28 G218 V219 A220 I225 G226Y24-F222 HydrophobicContact CD2-CD1 4.4Å; Y24-F222 HydrophobicContact CD2-CD2 4.34Å; Y24-F222 AromaticContact CD2-CE1 3.79Å; Y24-F222 HydrophobicContact CD2-CE1 3.79Å; Y24-F222 AromaticContact CD2-CE2 3.7Å; Y24-F222 HydrophobicContact CD2-CE2 3.7Å; Y24-F222 AromaticContact CD2-CZ 3.38Å; Y24-F222 HydrophobicContact CD2-CZ 3.38Å; Y24-F222 AromaticContact CE2-CD1 3.76Å; Y24-F222 HydrophobicContact CE2-CD1 3.76Å; Y24-F222 HydrophobicContact CE2-CD2 4.13Å; Y24-F222 AromaticContact CE2-CE1 3.54Å; Y24-F222 HydrophobicContact CE2-CE1 3.54Å; Y24-F222 AromaticContact CE2-CE2 3.91Å; Y24-F222 HydrophobicContact CE2-CE2 3.91Å; Y24-F222 HydrophobicContact CE2-CG 4.05Å; Y24-F222 AromaticContact CE2-CZ 3.6Å; Y24-F222 HydrophobicContact CE2-CZ 3.6Å; Y24-F222 VanDerWaalsContact CE2-O 3.22Å; Y24-F222 WeakPolarHBondContact CE2-O 3.36Å; Y24-F222 HydrophobicContact CG-CZ 4.4Å; Y24-F222 PolarHBondContact OH-O 3.34Å; I27-F222 HydrophobicContact CG2-CZ 4.49Å; F28-F222 HydrophobicContact CD2-CD1 4.27Å; F28-F222 AromaticContact CD2-CE1 3.62Å; F28-F222 HydrophobicContact CD2-CE1 3.62Å; F28-F222 HydrophobicContact CD2-CZ 4.48Å; F28-F222 AromaticContact CE2-CD1 3.28Å; F28-F222 HydrophobicContact CE2-CD1 3.28Å; F28-F222 AromaticContact CE2-CE1 3.06Å; F28-F222 HydrophobicContact CE2-CE1 3.06Å; F28-F222 HydrophobicContact CE2-CZ 4.16Å; F28-F222 AromaticContact CZ-CD1 3.56Å; F28-F222 HydrophobicContact CZ-CD1 3.56Å; F28-F222 AromaticContact CZ-CE1 3.75Å; F28-F222 HydrophobicContact CZ-CE1 3.75Å; G218-F222 VanDerWaalsContact O-CB 3.29Å; G218-F222 WeakPolarHBondContact O-CB 3.47Å; G218-F222 PolarHBondContact O-N 3.22Å; V219-F222 PolarHBondContact O-N 3.48Å; A220-F222 PolarHBondContact O-N 3.39Å; F222-I225 WeakPolarHBondContact O-CB 3.28Å; F222-I225 PolarHBondContact O-N 3.15Å; F222-G226 PolarHBondContact O-N 3.06Å; F222-G226 VanDerWaalsContact O-N 3.15Å
223Q95.8Very high94.6Very high7 Ų755.9 Ų55.93%0.03331%0.313CS..Hα-helixtrans-64.8-42.9174.4-171.7170.18.700113L97 I100 F101 E104 V219 A220 C221 I225 G226 I227L97-Q223 PolarHBondContact O-NE2 3.46Å; I100-Q223 VanDerWaalsContact CB-NE2 3.33Å; I100-Q223 VanDerWaalsContact CG2-NE2 3.29Å; F101-Q223 HydrophobicContact CB-CG 4.46Å; E104-Q223 PolarHBondContact OE2-OE1 3.28Å; V219-Q223 WeakPolarHBondContact O-CB 3.26Å; V219-Q223 PolarHBondContact O-N 3.41Å; A220-Q223 PolarHBondContact O-N 2.93Å; C221-Q223 VanDerWaalsContact C-N 3.3Å; C221-Q223 PolarHBondContact O-N 3.47Å; Q223-I225 VanDerWaalsContact C-N 3.29Å; Q223-I225 PolarHBondContact O-N 3.13Å; Q223-G226 WeakPolarHBondContact O-CA 3.4Å; Q223-G226 PolarHBondContact O-N 2.93Å; Q223-G226 VanDerWaalsContact O-N 3.08Å; Q223-I227 HydrophobicContact CG-CD1 4.39Å; Q223-I227 WeakPolarHBondContact O-CG1 3.42Å; Q223-I227 PolarHBondContact O-N 3.42Å
224L96.5Very high94.7Very high83 Ų8353.2 Ų53.244%0.43529%0.291SS..Hα-helixtrans-60.8-38175.1-69.7174.6000112.1F101 A220 C221 G226 I227 F228F101-L224 HydrophobicContact CD2-CD2 4.29Å; F101-L224 HydrophobicContact CD2-CG 4.42Å; F101-L224 HydrophobicContact CE1-CD2 4.38Å; F101-L224 HydrophobicContact CE2-CD1 4.25Å; F101-L224 HydrophobicContact CE2-CD2 4.06Å; F101-L224 HydrophobicContact CE2-CG 4.03Å; F101-L224 HydrophobicContact CZ-CD1 4.36Å; F101-L224 HydrophobicContact CZ-CD2 4.12Å; F101-L224 HydrophobicContact CZ-CG 4.42Å; A220-L224 WeakPolarHBondContact O-CG 3.3Å; A220-L224 PolarHBondContact O-N 3.41Å; C221-L224 PolarHBondContact O-N 3.4Å; L224-G226 VanDerWaalsContact C-N 3.33Å; L224-G226 PolarHBondContact O-N 3.22Å; L224-I227 HydrophobicContact CD2-CD1 4.32Å; L224-I227 PolarHBondContact O-N 3.15Å; L224-F228 WeakPolarHBondContact O-CB 3.31Å; L224-F228 PolarHBondContact O-N 3.38Å
225I95.8Very high94.5Very high86 Ų8658.3 Ų58.344%0.44130%0.297SS..Hα-helixtrans-59.8-45.2172.8-68.2166.7000110.4C221 F222 Q223 I227 F228 L229C221-I225 WeakPolarHBondContact O-CG1 3.39Å; C221-I225 PolarHBondContact O-N 3.39Å; F222-I225 WeakPolarHBondContact O-CB 3.28Å; F222-I225 PolarHBondContact O-N 3.15Å; Q223-I225 VanDerWaalsContact C-N 3.29Å; Q223-I225 PolarHBondContact O-N 3.13Å; I225-I227 PolarHBondContact O-N 2.89Å; I225-F228 PolarHBondContact O-N 3.29Å; I225-L229 HydrophobicContact CG2-CD1 3.71Å; I225-L229 HydrophobicContact CG2-CG 4.18Å; I225-L229 WeakPolarHBondContact O-CB 3.47Å; I225-L229 WeakPolarHBondContact O-CG 3.41Å; I225-L229 PolarHBondContact O-N 3.46Å
226G95.5Very high94.2Very high0 Ų054.4 Ų54.40%028%0.281CS..Hα-helixtrans-59-45.8176.200000113.5Y24 F222 Q223 L224 L229 A230Y24-G226 VanDerWaalsContact CZ-CA 3.41Å; F222-G226 PolarHBondContact O-N 3.06Å; F222-G226 VanDerWaalsContact O-N 3.15Å; Q223-G226 WeakPolarHBondContact O-CA 3.4Å; Q223-G226 PolarHBondContact O-N 2.93Å; Q223-G226 VanDerWaalsContact O-N 3.08Å; L224-G226 VanDerWaalsContact C-N 3.33Å; L224-G226 PolarHBondContact O-N 3.22Å; G226-L229 PolarHBondContact O-N 3.26Å; G226-A230 WeakPolarHBondContact O-CB 3.42Å; G226-A230 PolarHBondContact O-N 3.49Å
227I97.1Very high94Very high29 Ų2951.8 Ų51.815%0.14926%0.262CS..Hα-helixtrans-59.6-48.8176.3-66.1164.3000110.2L97 Q223 L224 I225 A230 Y231L97-I227 HydrophobicContact CB-CD1 4.17Å; L97-I227 HydrophobicContact CB-CG1 3.52Å; L97-I227 HydrophobicContact CD1-CG1 4.27Å; Q223-I227 HydrophobicContact CG-CD1 4.39Å; Q223-I227 WeakPolarHBondContact O-CG1 3.42Å; Q223-I227 PolarHBondContact O-N 3.42Å; L224-I227 HydrophobicContact CD2-CD1 4.32Å; L224-I227 PolarHBondContact O-N 3.15Å; I225-I227 PolarHBondContact O-N 2.89Å; I227-A230 PolarHBondContact O-N 2.94Å; I227-Y231 WeakPolarHBondContact O-CB 3.33Å; I227-Y231 PolarHBondContact O-N 3.17Å
228F96.1Very high93.7Very high128 Ų12846 Ų4656%0.56124%0.238SC*.Hα-helixtrans-59.5-49.8179.3176-100.7000111.6L224 I225 A230 Y231 C232L224-F228 WeakPolarHBondContact O-CB 3.31Å; L224-F228 PolarHBondContact O-N 3.38Å; I225-F228 PolarHBondContact O-N 3.29Å; F228-A230 PolarHBondContact O-N 2.9Å; F228-Y231 PolarHBondContact O-N 3.38Å; F228-C232 VanDerWaalsContact CE2-SG 3.55Å; F228-C232 WeakPolarHBondContact CZ-SG 3.29Å; F228-C232 WeakPolarHBondContact O-CB 3.36Å; F228-C232 PolarHBondContact O-N 3.39Å; F228-C232 PolarHBondContact O-SG 3.14Å; F228-C232 VanDerWaalsContact O-SG 3.38Å
229L95.2Very high93.1Very high14 Ų1448.2 Ų48.27%0.07324%0.241CC..Hα-helixtrans-60.7-45.7179.1-70.4171.4000112F17 V20 L21 I225 G226 Y231 C232 L233F17-L229 HydrophobicContact CD1-CD2 3.74Å; F17-L229 HydrophobicContact CE1-CD2 4.04Å; V20-L229 HydrophobicContact CG1-CD1 3.71Å; V20-L229 HydrophobicContact CG1-CD2 4.21Å; L21-L229 HydrophobicContact CD1-CB 4Å; I225-L229 HydrophobicContact CG2-CD1 3.71Å; I225-L229 HydrophobicContact CG2-CG 4.18Å; I225-L229 WeakPolarHBondContact O-CB 3.47Å; I225-L229 WeakPolarHBondContact O-CG 3.41Å; I225-L229 PolarHBondContact O-N 3.46Å; G226-L229 PolarHBondContact O-N 3.26Å; L229-Y231 PolarHBondContact O-N 2.84Å; L229-C232 PolarHBondContact O-N 3.34Å; L229-L233 VanDerWaalsContact O-CB 3.28Å; L229-L233 WeakPolarHBondContact O-CB 3.39Å; L229-L233 PolarHBondContact O-N 3.35Å
230A95.4Very high92.4Very high0 Ų047.8 Ų47.80%024%0.237CC..Hα-helixtrans-62.7-42.2178.400000112L21 Y93 A94 G226 I227 F228 S234L21-A230 HydrophobicContact CD2-CB 4.31Å; Y93-A230 HydrophobicContact CD1-CB 3.97Å; A94-A230 HydrophobicContact CB-CB 4.01Å; G226-A230 WeakPolarHBondContact O-CB 3.42Å; G226-A230 PolarHBondContact O-N 3.49Å; I227-A230 PolarHBondContact O-N 2.94Å; F228-A230 PolarHBondContact O-N 2.9Å; A230-S234 WeakPolarHBondContact O-CB 3.22Å; A230-S234 PolarHBondContact O-N 3.36Å
231Y94.7Very high91.3Very high135 Ų13552.4 Ų52.453%0.52925%0.254SS..Hα-helixtrans-67.1-47.4177.1-174.3-101.6000112.2I227 F228 L229 L233 S234 R235I227-Y231 WeakPolarHBondContact O-CB 3.33Å; I227-Y231 PolarHBondContact O-N 3.17Å; F228-Y231 PolarHBondContact O-N 3.38Å; L229-Y231 PolarHBondContact O-N 2.84Å; Y231-L233 PolarHBondContact O-N 3Å; Y231-S234 PolarHBondContact O-N 3.49Å; Y231-R235 WeakPolarHBondContact O-CB 3.48Å; Y231-R235 PolarHBondContact O-N 2.99Å
232C92.6Very high89.8Confident29 Ų2958.7 Ų58.720%0.19627%0.273CS..Hα-helixtrans-58.8-45.9176.8-77.90000111.7F17 F228 L229 R235 A236F17-C232 HydrophobicContact CE1-CB 4.19Å; F17-C232 HydrophobicContact CZ-CB 4.32Å; F228-C232 VanDerWaalsContact CE2-SG 3.55Å; F228-C232 WeakPolarHBondContact CZ-SG 3.29Å; F228-C232 WeakPolarHBondContact O-CB 3.36Å; F228-C232 PolarHBondContact O-N 3.39Å; F228-C232 PolarHBondContact O-SG 3.14Å; F228-C232 VanDerWaalsContact O-SG 3.38Å; L229-C232 PolarHBondContact O-N 3.34Å; C232-R235 PolarHBondContact O-N 2.95Å; C232-A236 WeakPolarHBondContact O-CB 3.37Å; C232-A236 PolarHBondContact O-N 3.17Å
233L92.5Very high88.2Confident0 Ų058.3 Ų58.30%027%0.272CS..Hα-helixtrans-64.5-43.9177.7-17960.3000111.6I14 F17 K18 L21 T82 L90 L229 Y231 R235 A236 I237I14-L233 HydrophobicContact CG2-CD1 4.02Å; F17-L233 HydrophobicContact CB-CB 4.33Å; F17-L233 HydrophobicContact CB-CD1 4.08Å; K18-L233 HydrophobicContact CG-CD1 3.74Å; K18-L233 HydrophobicContact CG-CD2 3.75Å; K18-L233 HydrophobicContact CG-CG 4.4Å; L21-L233 HydrophobicContact CD2-CD2 3.8Å; T82-L233 HydrophobicContact CG2-CD2 3.95Å; L90-L233 HydrophobicContact CD1-CB 4.3Å; L90-L233 HydrophobicContact CD1-CD2 3.75Å; L90-L233 HydrophobicContact CD1-CG 3.71Å; L90-L233 HydrophobicContact CD2-CD2 4.07Å; L229-L233 VanDerWaalsContact O-CB 3.28Å; L229-L233 WeakPolarHBondContact O-CB 3.39Å; L229-L233 PolarHBondContact O-N 3.35Å; Y231-L233 PolarHBondContact O-N 3Å; L233-R235 VanDerWaalsContact C-N 3.34Å; L233-R235 PolarHBondContact O-N 2.98Å; L233-A236 PolarHBondContact O-N 3.07Å; L233-I237 HydrophobicContact CD1-CD1 3.88Å; L233-I237 HydrophobicContact CD1-CG1 4.21Å; L233-I237 HydrophobicContact CG-CD1 3.83Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.37Å; L233-I237 PolarHBondContact O-N 3.36Å
234S92.8Very high86.4Confident1 Ų163.3 Ų63.31%0.00730%0.298CS..Hα-helixtrans-59.2-45.3176.2-179.10000111.9A87 K91 A230 Y231 I237 T238A87-S234 PolarHBondContact O-OG 3.27Å; K91-S234 WeakPolarHBondContact CE-OG 3.28Å; K91-S234 WeakPolarHBondContact CG-OG 2.97Å; A230-S234 WeakPolarHBondContact O-CB 3.22Å; A230-S234 PolarHBondContact O-N 3.36Å; Y231-S234 PolarHBondContact O-N 3.49Å; S234-I237 PolarHBondContact O-N 3.48Å; S234-T238 WeakPolarHBondContact O-CB 2.99Å; S234-T238 PolarHBondContact O-N 3.33Å; S234-T238 PolarHBondContact O-OG1 2.95Å
235R90.3Very high84.2Confident150 Ų15067.7 Ų67.757%0.56633%0.328SS*.Hα-helixtrans-64.7-43.1178.2-171177.3-178.6-171.4-0.1111.5Y231 C232 L233 I237 T238 N239Y231-R235 WeakPolarHBondContact O-CB 3.48Å; Y231-R235 PolarHBondContact O-N 2.99Å; C232-R235 PolarHBondContact O-N 2.95Å; L233-R235 VanDerWaalsContact C-N 3.34Å; L233-R235 PolarHBondContact O-N 2.98Å; R235-I237 PolarHBondContact O-N 3.23Å; R235-T238 PolarHBondContact O-N 3.16Å; R235-N239 WeakPolarHBondContact O-CB 3.39Å; R235-N239 VanDerWaalsContact O-CG 3.27Å; R235-N239 PolarHBondContact O-N 2.69Å; R235-N239 PolarHBondContact O-OD1 3.33Å
236A88.1Confident83.7Confident27 Ų2766.8 Ų66.822%0.22332%0.322CS..Hα-helixtrans-61.9-43.1177.800000112.1I14 C232 L233 N240I14-A236 HydrophobicContact CD1-CB 4.49Å; I14-A236 HydrophobicContact CG1-CB 3.94Å; C232-A236 WeakPolarHBondContact O-CB 3.37Å; C232-A236 PolarHBondContact O-N 3.17Å; L233-A236 PolarHBondContact O-N 3.07Å; A236-N240 WeakPolarHBondContact O-CB 3.44Å; A236-N240 PolarHBondContact O-N 3.42Å; A236-N240 VanDerWaalsContact O-N 3.14Å
237I87.8Confident83Confident15 Ų1570.3 Ų70.38%0.07734%0.339CS..Hα-helixtrans-64.5-46.6175.6-68.9164.6000110.7A85 A87 L90 L233 S234 R235 N239 N240 Q241A85-I237 HydrophobicContact CB-CD1 4.09Å; A85-I237 WeakPolarHBondContact O-CG2 3.43Å; A87-I237 HydrophobicContact CB-CB 4.45Å; A87-I237 HydrophobicContact CB-CG2 4.1Å; L90-I237 HydrophobicContact CD1-CD1 3.61Å; L233-I237 HydrophobicContact CD1-CD1 3.88Å; L233-I237 HydrophobicContact CD1-CG1 4.21Å; L233-I237 HydrophobicContact CG-CD1 3.83Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.37Å; L233-I237 PolarHBondContact O-N 3.36Å; S234-I237 PolarHBondContact O-N 3.48Å; R235-I237 PolarHBondContact O-N 3.23Å; I237-N239 PolarHBondContact O-N 3.05Å; I237-N240 PolarHBondContact O-N 3.25Å; I237-Q241 PolarHBondContact O-N 3.33Å
238T87.1Confident82.3Confident24 Ų2472.6 Ų72.615%0.14735%0.35CS..Hα-helixtrans-58.8-49.8-179.7-58.30000111.2A87 S234 R235 N240 Q241 Y242A87-T238 VanDerWaalsContact CB-OG1 3.29Å; A87-T238 WeakPolarHBondContact CB-OG1 3.35Å; S234-T238 WeakPolarHBondContact O-CB 2.99Å; S234-T238 PolarHBondContact O-N 3.33Å; S234-T238 PolarHBondContact O-OG1 2.95Å; R235-T238 PolarHBondContact O-N 3.16Å; T238-N240 VanDerWaalsContact C-N 3.31Å; T238-N240 PolarHBondContact O-N 3.01Å; T238-Q241 PolarHBondContact O-N 3.37Å; T238-Q241 VanDerWaalsContact O-N 3.15Å; T238-Y242 HydrophobicContact CG2-CD2 3.84Å; T238-Y242 HydrophobicContact CG2-CE2 3.41Å; T238-Y242 VanDerWaalsContact CG2-CE2 3.41Å; T238-Y242 WeakPolarHBondContact O-CD2 3.39Å; T238-Y242 PolarHBondContact O-N 2.94Å
239N82.8Confident81.4Confident84 Ų8469.4 Ų69.445%0.44934%0.337SS..Hα-helixtrans-60.7-41.3178.8-71.5-3.4000111.7R235 I237 Q241 Y242 E243R235-N239 WeakPolarHBondContact O-CB 3.39Å; R235-N239 VanDerWaalsContact O-CG 3.27Å; R235-N239 PolarHBondContact O-N 2.69Å; R235-N239 PolarHBondContact O-OD1 3.33Å; I237-N239 PolarHBondContact O-N 3.05Å; N239-Q241 VanDerWaalsContact C-N 3.29Å; N239-Q241 PolarHBondContact O-N 2.89Å; N239-Y242 PolarHBondContact O-N 3.28Å; N239-E243 PolarHBondContact O-N 3.32Å
240N78.4Confident80.6Confident53 Ų5372.8 Ų72.828%0.28335%0.354SS..Hα-helixtrans-66.3-29.5178.4-172.460.3000112.6I14 A236 I237 T238 I244I14-N240 HydrophobicContact CD1-CB 4.49Å; A236-N240 WeakPolarHBondContact O-CB 3.44Å; A236-N240 PolarHBondContact O-N 3.42Å; A236-N240 VanDerWaalsContact O-N 3.14Å; I237-N240 PolarHBondContact O-N 3.25Å; T238-N240 VanDerWaalsContact C-N 3.31Å; T238-N240 PolarHBondContact O-N 3.01Å; N240-I244 WeakPolarHBondContact O-CD1 3.35Å; N240-I244 WeakPolarHBondContact O-CG1 3.39Å
241Q73.6Confident79.6Confident120 Ų12077.7 Ų77.756%0.56138%0.378SS*.Hα-helixtrans-72.8-39175.6-73.5-169.8-53.100113.1I237 T238 N239 E243 I244I237-Q241 PolarHBondContact O-N 3.33Å; T238-Q241 PolarHBondContact O-N 3.37Å; T238-Q241 VanDerWaalsContact O-N 3.15Å; N239-Q241 VanDerWaalsContact C-N 3.29Å; N239-Q241 PolarHBondContact O-N 2.89Å; Q241-E243 VanDerWaalsContact C-N 3.27Å; Q241-E243 PolarHBondContact O-N 3.06Å; Q241-I244 WeakPolarHBondContact O-CG1 3.49Å; Q241-I244 PolarHBondContact O-N 3.32Å
242Y64.1Low78.5Confident177 Ų17773.6 Ų73.669%0.69437%0.367SS*.Hα-helixtrans-69.7-22.7176.4-73.3-68.7000113.3T238 N239 I244T238-Y242 HydrophobicContact CG2-CD2 3.84Å; T238-Y242 HydrophobicContact CG2-CE2 3.41Å; T238-Y242 VanDerWaalsContact CG2-CE2 3.41Å; T238-Y242 WeakPolarHBondContact O-CD2 3.39Å; T238-Y242 PolarHBondContact O-N 2.94Å; N239-Y242 PolarHBondContact O-N 3.28Å; Y242-I244 VanDerWaalsContact C-N 3.27Å; Y242-I244 PolarHBondContact O-N 3.44Å
243E59.8Low77.4Confident62 Ų6277 Ų7729%0.2938%0.38SS..THydrogen-bonded Turntrans-75.9-12.4175.1-72.3-174176.800113.5A2 R7 N239 Q241A2-E243 HydrophobicContact CB-CG 4.03Å; A2-E243 WeakPolarHBondContact CB-OE1 3.5Å; A2-E243 WeakPolarHBondContact CB-OE2 3.16Å; R7-E243 VanDerWaalsContact CZ-O 3.23Å; R7-E243 PolarHBondContact NH1-O 3.46Å; R7-E243 VanDerWaalsContact NH1-O 3.17Å; R7-E243 PolarHBondContact NH2-O 3.34Å; N239-E243 PolarHBondContact O-N 3.32Å; Q241-E243 VanDerWaalsContact C-N 3.27Å; Q241-E243 PolarHBondContact O-N 3.06Å
244I57.5Low76.2Confident112 Ų11283.4 Ų83.457%0.57441%0.412SS*.THydrogen-bonded Turntrans-91.2-14.1-177.4-26176.1000112.4N240 Q241 Y242N240-I244 WeakPolarHBondContact O-CD1 3.35Å; N240-I244 WeakPolarHBondContact O-CG1 3.39Å; Q241-I244 WeakPolarHBondContact O-CG1 3.49Å; Q241-I244 PolarHBondContact O-N 3.32Å; Y242-I244 VanDerWaalsContact C-N 3.27Å; Y242-I244 PolarHBondContact O-N 3.44Å
245V52.1Low74.7Confident176 Ų17690.9 Ų90.9100%1.06745%0.448SS*.  trans-97.20172.5-172.90000109.1

Retrieved 245 of 245 residues in 598.1 ms (Link to these results)

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