A0A077ZIA5_TRITR Loading...

CECR6 TMEM121 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZIA5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 296 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
1M59.6Low68.1Low208 Ų208128.2 Ų128.2100%1.02560%0.602SS**  0-40.30-148.7161175.400111.8W5M1-W5 PolarHBondContact O-N 3.42Å
2S66.1Low68.8Low85 Ų85120.9 Ų120.959%0.59457%0.573SS**Hα-helixtrans-62.3-45.9173.956.50000113.9I4 W5 E6S2-I4 PolarHBondContact O-N 3.41Å; S2-W5 WeakPolarHBondContact O-CB 3.35Å; S2-W5 PolarHBondContact O-N 3.03Å; S2-W5 VanDerWaalsContact O-N 3.11Å; S2-E6 PolarHBondContact O-N 3.15Å
3L69Low69.6Low121 Ų121120.2 Ų120.263%0.63457%0.566SS**Hα-helixtrans-56.7-45.2178.6-94145.7000113.4W5 E6 D7L3-W5 VanDerWaalsContact C-N 3.27Å; L3-W5 PolarHBondContact O-N 2.86Å; L3-E6 PolarHBondContact O-N 2.94Å; L3-D7 PolarHBondContact O-N 3.3Å
4I68Low70.6Confident117 Ų117118.7 Ų118.760%0.657%0.569SS**Hα-helixtrans-64.1-36.4178.7-62.4172.1000110.9S2 M8S2-I4 PolarHBondContact O-N 3.41Å; I4-M8 WeakPolarHBondContact O-CB 3.4Å; I4-M8 WeakPolarHBondContact O-CG 3.46Å; I4-M8 PolarHBondContact O-N 3.13Å
5W63.6Low71.5Confident138 Ų138113.3 Ų113.352%0.52354%0.543SS..Hα-helixtrans-73.1-39.6179.6-165.883.5000112.1M1 S2 L3 M8 Q9M1-W5 PolarHBondContact O-N 3.42Å; S2-W5 WeakPolarHBondContact O-CB 3.35Å; S2-W5 PolarHBondContact O-N 3.03Å; S2-W5 VanDerWaalsContact O-N 3.11Å; L3-W5 VanDerWaalsContact C-N 3.27Å; L3-W5 PolarHBondContact O-N 2.86Å; W5-M8 PolarHBondContact O-N 3.42Å; W5-Q9 HydrophobicContact CD2-CG 4.32Å; W5-Q9 HydrophobicContact CE3-CG 4.14Å; W5-Q9 HydrophobicContact CH2-CG 4.14Å; W5-Q9 HydrophobicContact CZ2-CG 4.28Å; W5-Q9 HydrophobicContact CZ3-CG 4.05Å; W5-Q9 PolarHBondContact O-N 3.03Å
6E68.7Low72.2Confident122 Ų122106.6 Ų106.657%0.5751%0.511SS*.Hα-helixtrans-62.5-43.9173.3-75.9-175.916500111.8S2 L3 Q9 R10S2-E6 PolarHBondContact O-N 3.15Å; L3-E6 PolarHBondContact O-N 2.94Å; E6-Q9 PolarHBondContact O-N 2.93Å; E6-R10 WeakPolarHBondContact O-CB 3.32Å; E6-R10 PolarHBondContact O-N 3.28Å
7D69.4Low73.1Confident84 Ų84104.6 Ų104.645%0.44951%0.507SS..Hα-helixtrans-61.8-48.9176-80.6-25000111L3 Q9 R10 Y11L3-D7 PolarHBondContact O-N 3.3Å; D7-Q9 VanDerWaalsContact C-N 3.31Å; D7-Q9 PolarHBondContact O-N 3.13Å; D7-R10 WeakPolarHBondContact O-CB 3.41Å; D7-R10 PolarHBondContact O-N 3.37Å; D7-Y11 HydrophobicContact CB-CE2 4.46Å; D7-Y11 WeakPolarHBondContact O-CD2 3.49Å; D7-Y11 PolarHBondContact O-N 3.46Å
8M67.6Low74Confident120 Ų120105.3 Ų105.359%0.59151%0.507SS*.Hα-helixtrans-56.7-42.2175.8-85.3-175.659.800112.8I4 W5 R10 T12I4-M8 WeakPolarHBondContact O-CB 3.4Å; I4-M8 WeakPolarHBondContact O-CG 3.46Å; I4-M8 PolarHBondContact O-N 3.13Å; W5-M8 PolarHBondContact O-N 3.42Å; M8-R10 VanDerWaalsContact C-N 3.33Å; M8-T12 WeakPolarHBondContact O-CB 3.34Å; M8-T12 PolarHBondContact O-N 3Å; M8-T12 VanDerWaalsContact O-N 3.09Å; M8-T12 PolarHBondContact O-OG1 3.23Å
9Q70.3Confident74.8Confident55 Ų5599.8 Ų99.826%0.25748%0.481SS..Hα-helixtrans-64-38.9175.2-82.3-152.3-33.100112.3W5 E6 D7 T12 K13W5-Q9 HydrophobicContact CD2-CG 4.32Å; W5-Q9 HydrophobicContact CE3-CG 4.14Å; W5-Q9 HydrophobicContact CH2-CG 4.14Å; W5-Q9 HydrophobicContact CZ2-CG 4.28Å; W5-Q9 HydrophobicContact CZ3-CG 4.05Å; W5-Q9 PolarHBondContact O-N 3.03Å; E6-Q9 PolarHBondContact O-N 2.93Å; D7-Q9 VanDerWaalsContact C-N 3.31Å; D7-Q9 PolarHBondContact O-N 3.13Å; Q9-T12 PolarHBondContact O-N 2.96Å; Q9-K13 WeakPolarHBondContact O-CG 3.39Å; Q9-K13 PolarHBondContact O-N 3.34Å
10R71.2Confident75.5Confident187 Ų18797 Ų9771%0.70647%0.468SS*.Hα-helixtrans-65.5-45.7179.6-156178.8-161.3-177.34.9111.5E6 D7 M8 T12 K13 V14E6-R10 WeakPolarHBondContact O-CB 3.32Å; E6-R10 PolarHBondContact O-N 3.28Å; D7-R10 WeakPolarHBondContact O-CB 3.41Å; D7-R10 PolarHBondContact O-N 3.37Å; M8-R10 VanDerWaalsContact C-N 3.33Å; R10-T12 VanDerWaalsContact C-N 3.34Å; R10-T12 PolarHBondContact O-N 3.5Å; R10-K13 PolarHBondContact O-N 2.99Å; R10-V14 WeakPolarHBondContact O-CG2 3.35Å; R10-V14 PolarHBondContact O-N 3.28Å; R10-V14 VanDerWaalsContact O-N 3.09Å
11Y75.4Confident76.4Confident173 Ų17396 Ų9668%0.67847%0.468SS*.Hα-helixtrans-58.2-46.9174.5-78-73000111.6D7 K13 V14 Q15D7-Y11 HydrophobicContact CB-CE2 4.46Å; D7-Y11 WeakPolarHBondContact O-CD2 3.49Å; D7-Y11 PolarHBondContact O-N 3.46Å; Y11-K13 VanDerWaalsContact C-N 3.33Å; Y11-K13 PolarHBondContact O-N 3.33Å; Y11-V14 PolarHBondContact O-N 3.4Å; Y11-Q15 WeakPolarHBondContact O-CB 3.46Å; Y11-Q15 PolarHBondContact O-N 3.38Å
12T76.4Confident78Confident41 Ų4186.3 Ų86.325%0.25242%0.421SS..Hα-helixtrans-60.7-41.6180-530000111.8M8 Q9 R10 Q15 L16M8-T12 WeakPolarHBondContact O-CB 3.34Å; M8-T12 PolarHBondContact O-N 3Å; M8-T12 VanDerWaalsContact O-N 3.09Å; M8-T12 PolarHBondContact O-OG1 3.23Å; Q9-T12 PolarHBondContact O-N 2.96Å; R10-T12 VanDerWaalsContact C-N 3.34Å; R10-T12 PolarHBondContact O-N 3.5Å; T12-Q15 PolarHBondContact O-N 3.46Å; T12-L16 HydrophobicContact CG2-CD1 3.94Å; T12-L16 WeakPolarHBondContact O-CB 3.46Å; T12-L16 WeakPolarHBondContact O-CD1 3.32Å; T12-L16 WeakPolarHBondContact O-CG 3.23Å; T12-L16 PolarHBondContact O-N 3.31Å
13K79.8Confident79.3Confident111 Ų11182.3 Ų82.348%0.48339%0.393SS..Hα-helixtrans-65-44.8177.2-77.9179.6179.9174.10112.9Q9 R10 Y11 Q15 T17Q9-K13 WeakPolarHBondContact O-CG 3.39Å; Q9-K13 PolarHBondContact O-N 3.34Å; R10-K13 PolarHBondContact O-N 2.99Å; Y11-K13 VanDerWaalsContact C-N 3.33Å; Y11-K13 PolarHBondContact O-N 3.33Å; K13-Q15 VanDerWaalsContact C-N 3.28Å; K13-Q15 PolarHBondContact O-N 2.93Å; K13-T17 WeakPolarHBondContact O-CB 3.32Å; K13-T17 PolarHBondContact O-N 2.65Å; K13-T17 PolarHBondContact O-OG1 3.49Å
14V83.7Confident80.5Confident100 Ų10079.4 Ų79.461%0.60638%0.38SS*.Hα-helixtrans-60.9-44178.2171.50000110R10 Y11 T17 F18R10-V14 WeakPolarHBondContact O-CG2 3.35Å; R10-V14 PolarHBondContact O-N 3.28Å; R10-V14 VanDerWaalsContact O-N 3.09Å; Y11-V14 PolarHBondContact O-N 3.4Å; V14-T17 WeakPolarHBondContact O-CB 3.26Å; V14-T17 PolarHBondContact O-N 2.92Å; V14-F18 PolarHBondContact O-N 3.36Å
15Q83.3Confident81.9Confident37 Ų3777.7 Ų77.717%0.17337%0.371CS..Hα-helixtrans-65.5-47.7-179.7-165.1-162.8-54.100112.9Y11 T12 K13 T17 F18 E19 H148 F149Y11-Q15 WeakPolarHBondContact O-CB 3.46Å; Y11-Q15 PolarHBondContact O-N 3.38Å; T12-Q15 PolarHBondContact O-N 3.46Å; K13-Q15 VanDerWaalsContact C-N 3.28Å; K13-Q15 PolarHBondContact O-N 2.93Å; Q15-T17 PolarHBondContact O-N 3.37Å; Q15-F18 WeakPolarHBondContact O-CB 3.42Å; Q15-F18 PolarHBondContact O-N 2.89Å; Q15-E19 WeakPolarHBondContact CG-OE1 3.34Å; Q15-E19 PolarHBondContact NE2-OE1 3.45Å; Q15-E19 WeakPolarHBondContact O-CG 3.37Å; Q15-E19 PolarHBondContact O-N 3.47Å; Q15-H148 PolarHBondContact NE2-CE1 3.46Å; Q15-H148 PolarHBondContact NE2-ND1 3.11Å; Q15-F149 VanDerWaalsContact NE2-C 3.32Å; Q15-F149 VanDerWaalsContact NE2-N 3.16Å; Q15-F149 PolarHBondContact NE2-O 3.16Å; Q15-F149 PolarHBondContact OE1-O 3.27Å
16L83.3Confident83.5Confident7 Ų771.1 Ų71.14%0.03735%0.346CS..Hα-helixtrans-57.8-34.9174.3-77.1162.8000112T12 L20 Y74 Q75 C78T12-L16 HydrophobicContact CG2-CD1 3.94Å; T12-L16 WeakPolarHBondContact O-CB 3.46Å; T12-L16 WeakPolarHBondContact O-CD1 3.32Å; T12-L16 WeakPolarHBondContact O-CG 3.23Å; T12-L16 PolarHBondContact O-N 3.31Å; L16-L20 PolarHBondContact O-N 2.94Å; L16-Y74 HydrophobicContact CD2-CD1 4.2Å; L16-Y74 HydrophobicContact CD2-CE1 4.25Å; L16-Q75 HydrophobicContact CB-CG 4.09Å; L16-Q75 HydrophobicContact CD1-CG 4.38Å; L16-Q75 HydrophobicContact CD2-CB 4.37Å; L16-Q75 HydrophobicContact CD2-CG 4.49Å; L16-C78 HydrophobicContact CD1-CB 3.95Å
17T87Confident84.8Confident72 Ų7267.2 Ų67.244%0.44233%0.328SS..Hα-helixtrans-67.6-43.7176-53.70000111.2K13 V14 Q15 E19 L20 V21K13-T17 WeakPolarHBondContact O-CB 3.32Å; K13-T17 PolarHBondContact O-N 2.65Å; K13-T17 PolarHBondContact O-OG1 3.49Å; V14-T17 WeakPolarHBondContact O-CB 3.26Å; V14-T17 PolarHBondContact O-N 2.92Å; Q15-T17 PolarHBondContact O-N 3.37Å; T17-E19 PolarHBondContact O-N 2.91Å; T17-L20 PolarHBondContact O-N 3.26Å; T17-V21 VanDerWaalsContact O-CG2 3.29Å; T17-V21 WeakPolarHBondContact O-CG2 3.26Å; T17-V21 PolarHBondContact O-N 2.91Å
18F89.5Confident86.2Confident117 Ų11767.4 Ų67.451%0.51333%0.329SS..Hα-helixtrans-60.5-44.2175.1-179.8-93.6000111.9V14 Q15 L20 V21 A22 L145V14-F18 PolarHBondContact O-N 3.36Å; Q15-F18 WeakPolarHBondContact O-CB 3.42Å; Q15-F18 PolarHBondContact O-N 2.89Å; F18-L20 PolarHBondContact O-N 3.2Å; F18-V21 PolarHBondContact O-N 3.4Å; F18-A22 WeakPolarHBondContact O-CB 3.49Å; F18-A22 PolarHBondContact O-N 2.93Å; F18-L145 HydrophobicContact CE1-CB 4.42Å
19E88.6Confident87.6Confident2 Ų263.3 Ų63.31%0.00931%0.311CS..Hα-helixtrans-59.2-44.7176.8-71.7162.4-149.400112.1Q15 T17 A22 F23 N88 H148Q15-E19 WeakPolarHBondContact CG-OE1 3.34Å; Q15-E19 PolarHBondContact NE2-OE1 3.45Å; Q15-E19 WeakPolarHBondContact O-CG 3.37Å; Q15-E19 PolarHBondContact O-N 3.47Å; T17-E19 PolarHBondContact O-N 2.91Å; E19-A22 PolarHBondContact O-N 3.38Å; E19-F23 PolarHBondContact O-N 2.88Å; E19-N88 PolarHBondContact OE2-ND2 3.15Å; E19-H148 VanDerWaalsContact CD-CA 3.44Å; E19-H148 VanDerWaalsContact OE1-CA 3.28Å; E19-H148 WeakPolarHBondContact OE1-CA 3.17Å; E19-H148 IonicContact OE1-CE1 3.82Å; E19-H148 IonicContact OE1-CG 3.75Å; E19-H148 IonicContact OE1-ND1 2.62Å; E19-H148 PolarHBondContact OE1-ND1 2.71Å; E19-H148 WeakPolarHBondContact OE2-CA 3.36Å; E19-H148 WeakPolarHBondContact OE2-CB 3.41Å; E19-H148 IonicContact OE2-CG 2.67Å; E19-H148 IonicContact OE2-ND1 3.4Å; E19-H148 PolarHBondContact OE2-ND1 2.87Å
20L90.1Very high88.9Confident43 Ų4360.7 Ų60.723%0.22530%0.299CS..Hα-helixtrans-64.1-45.2177.2-17571.6000111.2L16 T17 F18 A22 F23 V24 L68 I72L16-L20 PolarHBondContact O-N 2.94Å; T17-L20 PolarHBondContact O-N 3.26Å; F18-L20 PolarHBondContact O-N 3.2Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.47Å; L20-F23 PolarHBondContact O-N 3.06Å; L20-V24 WeakPolarHBondContact O-CG2 3.17Å; L20-V24 PolarHBondContact O-N 3.23Å; L20-L68 HydrophobicContact CD1-CD1 3.61Å; L20-I72 HydrophobicContact CD1-CD1 4.44Å; L20-I72 HydrophobicContact CD1-CG1 3.66Å
21V93.2Very high90.2Very high77 Ų7753.4 Ų53.447%0.46728%0.277SS..Hα-helixtrans-60.8-45177.2170.30000110.5T17 F18 F23 V24 L25T17-V21 VanDerWaalsContact O-CG2 3.29Å; T17-V21 WeakPolarHBondContact O-CG2 3.26Å; T17-V21 PolarHBondContact O-N 2.91Å; F18-V21 PolarHBondContact O-N 3.4Å; V21-F23 VanDerWaalsContact C-N 3.3Å; V21-F23 PolarHBondContact O-N 3.35Å; V21-V24 PolarHBondContact O-N 3.49Å; V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CG 2.97Å; V21-L25 PolarHBondContact O-N 3.4Å
22A94.1Very high91.2Very high4 Ų449.6 Ų49.63%0.03327%0.274CS..Hα-helixtrans-59-42.1175.700000111.6F18 E19 L20 L25 C26 L142 L145F18-A22 WeakPolarHBondContact O-CB 3.49Å; F18-A22 PolarHBondContact O-N 2.93Å; E19-A22 PolarHBondContact O-N 3.38Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.47Å; A22-L25 PolarHBondContact O-N 3.35Å; A22-C26 WeakPolarHBondContact O-CB 3.39Å; A22-C26 PolarHBondContact O-N 2.85Å; A22-L142 HydrophobicContact CB-CD2 4.45Å; A22-L145 HydrophobicContact CB-CB 4.18Å
23F93.6Very high92.2Very high1 Ų147.8 Ų47.80%0.00426%0.263CS..Hα-helixtrans-66.3-43.1176.6-159.2-75.8000112.5E19 L20 V21 L25 C26 F27 F64 L67 L68 I89 L143 S146E19-F23 PolarHBondContact O-N 2.88Å; L20-F23 PolarHBondContact O-N 3.06Å; V21-F23 VanDerWaalsContact C-N 3.3Å; V21-F23 PolarHBondContact O-N 3.35Å; F23-L25 VanDerWaalsContact C-N 3.32Å; F23-L25 PolarHBondContact O-N 3.42Å; F23-C26 VanDerWaalsContact O-CB 3.25Å; F23-C26 WeakPolarHBondContact O-CB 3.5Å; F23-C26 PolarHBondContact O-N 3.04Å; F23-C26 VanDerWaalsContact O-N 3.14Å; F23-F27 PolarHBondContact O-N 2.99Å; F23-F64 HydrophobicContact CE1-CD1 4.25Å; F23-F64 VanDerWaalsContact CE1-O 3.27Å; F23-F64 WeakPolarHBondContact CE1-O 3.19Å; F23-F64 HydrophobicContact CZ-CD1 4.01Å; F23-F64 WeakPolarHBondContact CZ-O 3.24Å; F23-L67 HydrophobicContact CE2-CB 4.02Å; F23-L67 HydrophobicContact CZ-CB 3.54Å; F23-L67 HydrophobicContact CZ-CD1 4.44Å; F23-L68 HydrophobicContact CB-CD1 4.42Å; F23-L68 HydrophobicContact CD1-CB 3.78Å; F23-L68 HydrophobicContact CD1-CD1 3.72Å; F23-L68 HydrophobicContact CD1-CG 4.22Å; F23-L68 HydrophobicContact CE1-CB 3.61Å; F23-L68 HydrophobicContact CE1-CD1 4.43Å; F23-L68 HydrophobicContact CG-CD1 4.26Å; F23-L68 HydrophobicContact CZ-CB 4.47Å; F23-I89 HydrophobicContact CD2-CD1 3.48Å; F23-I89 VanDerWaalsContact CD2-CD1 3.48Å; F23-I89 HydrophobicContact CD2-CG1 4.43Å; F23-I89 HydrophobicContact CE2-CD1 3.81Å; F23-I89 HydrophobicContact CE2-CG1 4.44Å; F23-I89 HydrophobicContact CE2-CG2 4.44Å; F23-L143 HydrophobicContact CE2-CD1 4Å; F23-S146 WeakPolarHBondContact CD2-OG 3.27Å
24V94.9Very high93.1Very high59 Ų5942.6 Ų42.636%0.35824%0.241SC..Hα-helixtrans-61.2-44.3177.2170.50000110.3L20 V21 C26 F27 L28 L68L20-V24 WeakPolarHBondContact O-CG2 3.17Å; L20-V24 PolarHBondContact O-N 3.23Å; V21-V24 PolarHBondContact O-N 3.49Å; V24-C26 VanDerWaalsContact C-N 3.32Å; V24-C26 PolarHBondContact O-N 2.97Å; V24-F27 PolarHBondContact O-N 3.37Å; V24-L28 HydrophobicContact CG1-CD1 4.13Å; V24-L28 WeakPolarHBondContact O-CG 3.2Å; V24-L28 PolarHBondContact O-N 3Å; V24-L68 HydrophobicContact CG2-CD1 4.4Å
25L96.9Very high93.7Very high81 Ų8139.7 Ų39.742%0.42423%0.23SC..Hα-helixtrans-61.7-40.7173.7-68.9173.8000111.6V21 A22 F23 F27 L28 C29 L142V21-L25 HydrophobicContact CG1-CD1 4.04Å; V21-L25 HydrophobicContact CG1-CG 4.42Å; V21-L25 WeakPolarHBondContact O-CG 2.97Å; V21-L25 PolarHBondContact O-N 3.4Å; A22-L25 PolarHBondContact O-N 3.35Å; F23-L25 VanDerWaalsContact C-N 3.32Å; F23-L25 PolarHBondContact O-N 3.42Å; L25-F27 VanDerWaalsContact C-N 3.34Å; L25-F27 PolarHBondContact O-N 3.41Å; L25-L28 PolarHBondContact O-N 3.26Å; L25-C29 WeakPolarHBondContact O-CB 3.32Å; L25-C29 PolarHBondContact O-N 3.14Å; L25-C29 PolarHBondContact O-SG 2.86Å; L25-C29 VanDerWaalsContact O-SG 3.36Å; L25-L142 HydrophobicContact CB-CD1 3.94Å; L25-L142 HydrophobicContact CB-CD2 4.16Å; L25-L142 HydrophobicContact CD1-CD2 4.48Å
26C96.8Very high94.3Very high0 Ų039.2 Ų39.20%023%0.233CC..Hα-helixtrans-57.9-46.8175.6-170.20000111.4A22 F23 V24 T30 I139 L142A22-C26 WeakPolarHBondContact O-CB 3.39Å; A22-C26 PolarHBondContact O-N 2.85Å; F23-C26 VanDerWaalsContact O-CB 3.25Å; F23-C26 WeakPolarHBondContact O-CB 3.5Å; F23-C26 PolarHBondContact O-N 3.04Å; F23-C26 VanDerWaalsContact O-N 3.14Å; V24-C26 VanDerWaalsContact C-N 3.32Å; V24-C26 PolarHBondContact O-N 2.97Å; C26-T30 WeakPolarHBondContact O-CB 3.25Å; C26-T30 PolarHBondContact O-N 2.95Å; C26-T30 PolarHBondContact O-OG1 3.49Å; C26-I139 PolarHBondContact SG-O 3.43Å; C26-L142 HydrophobicContact CB-CB 3.69Å
27F96.6Very high94.9Very high40 Ų4038.9 Ų38.918%0.17523%0.231CC..Hα-helixtrans-62.4-45.1177.4175-98.3000112.3F23 V24 L25 T30 S31 L61 F64 L65F23-F27 PolarHBondContact O-N 2.99Å; V24-F27 PolarHBondContact O-N 3.37Å; L25-F27 VanDerWaalsContact C-N 3.34Å; L25-F27 PolarHBondContact O-N 3.41Å; F27-T30 PolarHBondContact O-N 3.12Å; F27-S31 WeakPolarHBondContact O-CB 3.44Å; F27-S31 PolarHBondContact O-N 3.24Å; F27-S31 PolarHBondContact O-OG 3.38Å; F27-L61 HydrophobicContact CD2-CD2 4.4Å; F27-L61 HydrophobicContact CE2-CB 4.18Å; F27-L61 HydrophobicContact CE2-CD2 3.91Å; F27-L61 HydrophobicContact CZ-CD2 4.48Å; F27-F64 HydrophobicContact CD2-CB 3.86Å; F27-L65 HydrophobicContact CD2-CD2 4.34Å; F27-L65 HydrophobicContact CD2-CG 4.37Å; F27-L65 HydrophobicContact CE1-CD2 4.36Å; F27-L65 HydrophobicContact CE2-CD1 4.3Å; F27-L65 HydrophobicContact CE2-CD2 3.79Å; F27-L65 HydrophobicContact CE2-CG 3.63Å; F27-L65 HydrophobicContact CZ-CD1 4.31Å; F27-L65 HydrophobicContact CZ-CD2 3.81Å; F27-L65 HydrophobicContact CZ-CG 3.96Å
28L97.3Very high95.2Very high89 Ų8936.3 Ų36.347%0.46621%0.214SC..Hα-helixtrans-64.3-47.2178.5-69.1173.5000111.4V24 L25 T30 S31 C32V24-L28 HydrophobicContact CG1-CD1 4.13Å; V24-L28 WeakPolarHBondContact O-CG 3.2Å; V24-L28 PolarHBondContact O-N 3Å; L25-L28 PolarHBondContact O-N 3.26Å; L28-T30 VanDerWaalsContact C-N 3.32Å; L28-T30 PolarHBondContact O-N 3.44Å; L28-S31 PolarHBondContact O-N 3.01Å; L28-C32 WeakPolarHBondContact O-CB 3.47Å; L28-C32 PolarHBondContact O-N 3.44Å; L28-C32 PolarHBondContact O-SG 3.28Å; L28-C32 VanDerWaalsContact O-SG 3.34Å
29C97.6Very high95.4Very high33 Ų3335.7 Ų35.722%0.22321%0.209CC..Hα-helixtrans-59.4-43.6176.3-73.80000111.6L25 C32 Q33 I139L25-C29 WeakPolarHBondContact O-CB 3.32Å; L25-C29 PolarHBondContact O-N 3.14Å; L25-C29 PolarHBondContact O-SG 2.86Å; L25-C29 VanDerWaalsContact O-SG 3.36Å; C29-C32 PolarHBondContact O-N 2.93Å; C29-Q33 VanDerWaalsContact O-CB 3.32Å; C29-Q33 WeakPolarHBondContact O-CB 3.43Å; C29-Q33 PolarHBondContact O-N 3.22Å; C29-I139 HydrophobicContact CB-CD1 4.43Å; C29-I139 HydrophobicContact CB-CG1 3.77Å
30T97.8Very high95.6Very high0 Ų035.6 Ų35.60%021%0.209CC..Hα-helixtrans-60.7-46.9176.6-56.40000111.2C26 F27 L28 C32 Q33 L34 V60 L61 Y99 I139C26-T30 WeakPolarHBondContact O-CB 3.25Å; C26-T30 PolarHBondContact O-N 2.95Å; C26-T30 PolarHBondContact O-OG1 3.49Å; F27-T30 PolarHBondContact O-N 3.12Å; L28-T30 VanDerWaalsContact C-N 3.32Å; L28-T30 PolarHBondContact O-N 3.44Å; T30-C32 PolarHBondContact O-N 3.34Å; T30-Q33 PolarHBondContact O-N 3.28Å; T30-L34 HydrophobicContact CG2-CD1 3.97Å; T30-L34 HydrophobicContact CG2-CG 4.35Å; T30-L34 WeakPolarHBondContact O-CB 3.39Å; T30-L34 VanDerWaalsContact O-CG 3.31Å; T30-L34 WeakPolarHBondContact O-CG 3.45Å; T30-L34 PolarHBondContact O-N 2.95Å; T30-V60 HydrophobicContact CG2-CG1 4.35Å; T30-L61 HydrophobicContact CG2-CD2 4.27Å; T30-Y99 HydrophobicContact CG2-CD2 3.84Å; T30-Y99 HydrophobicContact CG2-CE2 4.11Å; T30-I139 WeakPolarHBondContact OG1-CG2 3.17Å
31S97.5Very high95.8Very high35 Ų3533.9 Ų33.925%0.24520%0.2CC..Hα-helixtrans-60.6-46.9178.2-54.90000111.9F27 L28 G35 L61F27-S31 WeakPolarHBondContact O-CB 3.44Å; F27-S31 PolarHBondContact O-N 3.24Å; F27-S31 PolarHBondContact O-OG 3.38Å; L28-S31 PolarHBondContact O-N 3.01Å; S31-G35 PolarHBondContact O-N 3.31Å; S31-G35 VanDerWaalsContact O-N 3.08Å; S31-L61 VanDerWaalsContact OG-CD2 3.29Å; S31-L61 WeakPolarHBondContact OG-CD2 3.3Å
32C97.6Very high95.8Very high92 Ų9233.4 Ų33.462%0.62220%0.195SC*.Hα-helixtrans-63.2-43.5178-700000111.9L28 C29 T30 A36L28-C32 WeakPolarHBondContact O-CB 3.47Å; L28-C32 PolarHBondContact O-N 3.44Å; L28-C32 PolarHBondContact O-SG 3.28Å; L28-C32 VanDerWaalsContact O-SG 3.34Å; C29-C32 PolarHBondContact O-N 2.93Å; T30-C32 PolarHBondContact O-N 3.34Å; C32-A36 WeakPolarHBondContact O-CB 3.35Å; C32-A36 PolarHBondContact O-N 3.35Å
33Q98Very high95.6Very high4 Ų437.7 Ų37.72%0.01921%0.214CC..Hα-helixtrans-64.5-48.3179.9-173.4-169.337.200111.7C29 T30 G35 A36 L37 Y99 T132 S135 S136 I139C29-Q33 VanDerWaalsContact O-CB 3.32Å; C29-Q33 WeakPolarHBondContact O-CB 3.43Å; C29-Q33 PolarHBondContact O-N 3.22Å; T30-Q33 PolarHBondContact O-N 3.28Å; Q33-G35 VanDerWaalsContact C-N 3.33Å; Q33-G35 PolarHBondContact O-N 2.8Å; Q33-A36 PolarHBondContact O-N 2.86Å; Q33-L37 HydrophobicContact CG-CD1 4.35Å; Q33-L37 WeakPolarHBondContact O-CG 3.19Å; Q33-L37 PolarHBondContact O-N 2.76Å; Q33-Y99 PolarHBondContact NE2-OH 3.23Å; Q33-Y99 VanDerWaalsContact OE1-CE2 3.24Å; Q33-Y99 VanDerWaalsContact OE1-CZ 3.3Å; Q33-Y99 PolarHBondContact OE1-OH 3.44Å; Q33-T132 HydrophobicContact CG-CG2 3.78Å; Q33-T132 WeakPolarHBondContact CG-O 3.37Å; Q33-T132 PolarHBondContact NE2-O 3.12Å; Q33-S135 WeakPolarHBondContact CB-OG 3.26Å; Q33-S135 WeakPolarHBondContact CG-OG 3.44Å; Q33-S135 PolarHBondContact NE2-OG 3.15Å; Q33-S135 VanDerWaalsContact NE2-OG 3.12Å; Q33-S136 PolarHBondContact NE2-OG 2.92Å; Q33-I139 HydrophobicContact CB-CD1 4.21Å
34L97.5Very high95.4Very high2 Ų239.8 Ų39.81%0.0122%0.222CC..Hα-helixtrans-60.4-44.3-179.9-73.2-179.8000111.4T30 A36 L37 D38 D57 V60 L61 K106T30-L34 HydrophobicContact CG2-CD1 3.97Å; T30-L34 HydrophobicContact CG2-CG 4.35Å; T30-L34 WeakPolarHBondContact O-CB 3.39Å; T30-L34 VanDerWaalsContact O-CG 3.31Å; T30-L34 WeakPolarHBondContact O-CG 3.45Å; T30-L34 PolarHBondContact O-N 2.95Å; L34-A36 PolarHBondContact O-N 2.85Å; L34-L37 PolarHBondContact O-N 3.39Å; L34-D38 PolarHBondContact O-N 3.15Å; L34-D57 WeakPolarHBondContact CB-OD2 3.42Å; L34-D57 HydrophobicContact CD1-CB 4.14Å; L34-V60 HydrophobicContact CD1-CB 4.29Å; L34-V60 HydrophobicContact CD1-CG1 4.14Å; L34-L61 HydrophobicContact CD1-CD2 4.37Å; L34-L61 HydrophobicContact CD1-CG 4.49Å; L34-K106 PolarHBondContact O-NZ 3.36Å
35G95.8Very high94.9Very high38 Ų3839.2 Ų39.239%0.39222%0.216SC..Hα-helixtrans-63.7-37.7174.900000113.6S31 Q33 D38 Y39S31-G35 PolarHBondContact O-N 3.31Å; S31-G35 VanDerWaalsContact O-N 3.08Å; Q33-G35 VanDerWaalsContact C-N 3.33Å; Q33-G35 PolarHBondContact O-N 2.8Å; G35-D38 PolarHBondContact O-N 3.22Å; G35-Y39 PolarHBondContact O-N 3.46Å
36A96.1Very high94Very high27 Ų2744 Ų4422%0.22323%0.234CC..Hα-helixtrans-65.2-41.2174.300000111.8C32 Q33 L34 Y39 F40 T132C32-A36 WeakPolarHBondContact O-CB 3.35Å; C32-A36 PolarHBondContact O-N 3.35Å; Q33-A36 PolarHBondContact O-N 2.86Å; L34-A36 PolarHBondContact O-N 2.85Å; A36-Y39 WeakPolarHBondContact O-CB 3.39Å; A36-Y39 PolarHBondContact O-N 2.92Å; A36-F40 WeakPolarHBondContact O-CD2 3.19Å; A36-F40 PolarHBondContact O-N 3.23Å; A36-T132 HydrophobicContact CB-CG2 3.72Å
37L96Very high93Very high0 Ų047.3 Ų47.30%025%0.252CS..Hα-helixtrans-65.8-37.8175.4-65.7174000112.2Q33 L34 Y39 F40 I41 L103 K106 I110 L129 T132 L133Q33-L37 HydrophobicContact CG-CD1 4.35Å; Q33-L37 WeakPolarHBondContact O-CG 3.19Å; Q33-L37 PolarHBondContact O-N 2.76Å; L34-L37 PolarHBondContact O-N 3.39Å; L37-Y39 VanDerWaalsContact C-N 3.32Å; L37-Y39 PolarHBondContact O-N 3.41Å; L37-F40 WeakPolarHBondContact O-CB 3.31Å; L37-F40 PolarHBondContact O-N 3.46Å; L37-I41 WeakPolarHBondContact O-CG1 3.32Å; L37-I41 PolarHBondContact O-N 3.35Å; L37-I41 VanDerWaalsContact O-N 3.13Å; L37-L103 HydrophobicContact CD1-CD1 3.5Å; L37-K106 HydrophobicContact CB-CD 3.88Å; L37-K106 HydrophobicContact CD1-CB 4.47Å; L37-K106 HydrophobicContact CD1-CD 4.15Å; L37-I110 HydrophobicContact CB-CD1 4.23Å; L37-I110 HydrophobicContact CD2-CD1 3.65Å; L37-I110 HydrophobicContact CG-CD1 4.49Å; L37-L129 HydrophobicContact CD2-CD1 4.02Å; L37-T132 HydrophobicContact CD2-CG2 3.72Å; L37-T132 HydrophobicContact CG-CG2 3.81Å; L37-L133 HydrophobicContact CD2-CD2 4.02Å
38D94.6Very high92Very high18 Ų1851.6 Ų51.610%0.09628%0.277CS..Hα-helixtrans-63-39.1172.9-83.2-21.5000112.4L34 G35 F40 I41 L42 K106L34-D38 PolarHBondContact O-N 3.15Å; G35-D38 PolarHBondContact O-N 3.22Å; D38-F40 VanDerWaalsContact C-N 3.32Å; D38-F40 PolarHBondContact O-N 3.03Å; D38-I41 PolarHBondContact O-N 3.47Å; D38-I41 VanDerWaalsContact O-N 3.15Å; D38-L42 HydrophobicContact CB-CD1 4.49Å; D38-L42 WeakPolarHBondContact O-CB 3.5Å; D38-L42 PolarHBondContact O-N 3.27Å; D38-K106 IonicContact OD1-NZ 2.85Å; D38-K106 PolarHBondContact OD1-NZ 3Å; D38-K106 IonicContact OD2-NZ 2.82Å; D38-K106 PolarHBondContact OD2-NZ 3.45Å
39Y93.6Very high91.1Very high104 Ų10455.7 Ų55.741%0.40829%0.286SS..Hα-helixtrans-57.5-46.2174.2175.1-89.7000111.5G35 A36 L37 I41 L42 H43 M124G35-Y39 PolarHBondContact O-N 3.46Å; A36-Y39 WeakPolarHBondContact O-CB 3.39Å; A36-Y39 PolarHBondContact O-N 2.92Å; L37-Y39 VanDerWaalsContact C-N 3.32Å; L37-Y39 PolarHBondContact O-N 3.41Å; Y39-I41 VanDerWaalsContact C-N 3.3Å; Y39-I41 PolarHBondContact O-N 3.02Å; Y39-L42 PolarHBondContact O-N 3.29Å; Y39-H43 HydrophobicContact CE1-CB 4.33Å; Y39-H43 WeakPolarHBondContact O-CB 3.3Å; Y39-H43 PolarHBondContact O-N 2.84Å; Y39-M124 HydrophobicContact CD1-CB 4.34Å; Y39-M124 HydrophobicContact CD1-CG 4.08Å; Y39-M124 HydrophobicContact CE1-CB 3.7Å; Y39-M124 HydrophobicContact CE1-CG 3.55Å
40F93.2Very high90.4Very high0 Ų058.2 Ų58.20%029%0.291CS..Hα-helixtrans-58.2-42.2175.5-79-74.4000112.1A36 L37 D38 Y44 I110 L118 M124 A128 L129A36-F40 WeakPolarHBondContact O-CD2 3.19Å; A36-F40 PolarHBondContact O-N 3.23Å; L37-F40 WeakPolarHBondContact O-CB 3.31Å; L37-F40 PolarHBondContact O-N 3.46Å; D38-F40 VanDerWaalsContact C-N 3.32Å; D38-F40 PolarHBondContact O-N 3.03Å; F40-Y44 HydrophobicContact CD1-CE2 4.16Å; F40-Y44 VanDerWaalsContact O-CD2 3.3Å; F40-Y44 WeakPolarHBondContact O-CD2 3.5Å; F40-Y44 PolarHBondContact O-N 3.3Å; F40-I110 HydrophobicContact CB-CD1 4.4Å; F40-L118 HydrophobicContact CD1-CD2 3.88Å; F40-L118 HydrophobicContact CE1-CD2 3.67Å; F40-M124 HydrophobicContact CE1-CB 4.29Å; F40-M124 WeakPolarHBondContact CE1-O 3.47Å; F40-M124 HydrophobicContact CZ-CB 4.33Å; F40-M124 HydrophobicContact CZ-SD 4.49Å; F40-A128 HydrophobicContact CZ-CB 4.16Å; F40-L129 HydrophobicContact CD2-CD1 4.17Å; F40-L129 HydrophobicContact CE1-CB 4.14Å; F40-L129 HydrophobicContact CE2-CB 4.2Å; F40-L129 HydrophobicContact CE2-CD1 4.16Å; F40-L129 HydrophobicContact CZ-CB 3.79Å
41I93.3Very high89.9Confident7 Ų762.6 Ų62.64%0.03631%0.314CS..Hα-helixtrans-70.3-51.5-178.9-66.1173.4000110.3L37 D38 Y39 H43 L45 L53 K106 I109 I110L37-I41 WeakPolarHBondContact O-CG1 3.32Å; L37-I41 PolarHBondContact O-N 3.35Å; L37-I41 VanDerWaalsContact O-N 3.13Å; D38-I41 PolarHBondContact O-N 3.47Å; D38-I41 VanDerWaalsContact O-N 3.15Å; Y39-I41 VanDerWaalsContact C-N 3.3Å; Y39-I41 PolarHBondContact O-N 3.02Å; I41-H43 PolarHBondContact O-N 3.05Å; I41-L45 HydrophobicContact CG2-CD1 3.9Å; I41-L45 VanDerWaalsContact O-CB 3.29Å; I41-L45 WeakPolarHBondContact O-CB 3.42Å; I41-L45 PolarHBondContact O-N 2.94Å; I41-L53 HydrophobicContact CD1-CD1 3.53Å; I41-L53 HydrophobicContact CG2-CD1 4.05Å; I41-K106 HydrophobicContact CD1-CB 4.32Å; I41-K106 HydrophobicContact CD1-CD 4.45Å; I41-K106 HydrophobicContact CD1-CG 4.15Å; I41-I109 HydrophobicContact CD1-CG2 4.32Å; I41-I109 HydrophobicContact CG1-CG2 4.39Å; I41-I110 HydrophobicContact CD1-CD1 4.3Å; I41-I110 HydrophobicContact CD1-CG1 4.13Å; I41-I110 HydrophobicContact CG1-CD1 4.17Å; I41-I110 HydrophobicContact CG1-CG1 3.74Å
42L92.3Very high89.7Confident67 Ų6765 Ų6535%0.35132%0.323SS..Hα-helixtrans-60.6-45.4-178.3-82.6161.3000112.8D38 Y39 K46 W50D38-L42 HydrophobicContact CB-CD1 4.49Å; D38-L42 WeakPolarHBondContact O-CB 3.5Å; D38-L42 PolarHBondContact O-N 3.27Å; Y39-L42 PolarHBondContact O-N 3.29Å; L42-K46 PolarHBondContact O-N 3.29Å; L42-W50 HydrophobicContact CD2-CB 3.52Å; L42-W50 HydrophobicContact CD2-CD2 3.59Å; L42-W50 HydrophobicContact CD2-CE3 3.89Å; L42-W50 HydrophobicContact CD2-CG 3.42Å; L42-W50 VanDerWaalsContact CD2-CG 3.42Å; L42-W50 HydrophobicContact CG-CB 4.01Å; L42-W50 HydrophobicContact CG-CG 4.41Å
43H90.6Very high89.5Confident94 Ų9460.9 Ų60.944%0.43530%0.295SS..Hα-helixtrans-65.6-42.3-174.5-170.174.6000112Y39 I41Y39-H43 HydrophobicContact CE1-CB 4.33Å; Y39-H43 WeakPolarHBondContact O-CB 3.3Å; Y39-H43 PolarHBondContact O-N 2.84Å; I41-H43 PolarHBondContact O-N 3.05Å
44Y88.5Confident89.3Confident46 Ų4663.3 Ų63.318%0.1831%0.308CS..Hα-helixtrans-96.8-32.8-172.5-67.7-80.4000114.5F40 V114 H117 L118 E122F40-Y44 HydrophobicContact CD1-CE2 4.16Å; F40-Y44 VanDerWaalsContact O-CD2 3.3Å; F40-Y44 WeakPolarHBondContact O-CD2 3.5Å; F40-Y44 PolarHBondContact O-N 3.3Å; Y44-V114 HydrophobicContact CD2-CG1 3.59Å; Y44-V114 HydrophobicContact CE2-CG1 4.35Å; Y44-V114 HydrophobicContact CG-CG1 3.86Å; Y44-H117 HydrophobicContact CD1-CB 3.65Å; Y44-H117 HydrophobicContact CE1-CB 4.07Å; Y44-H117 HydrophobicContact CG-CB 4.47Å; Y44-L118 HydrophobicContact CE2-CD2 3.74Å; Y44-E122 PolarHBondContact OH-OE2 3.15Å
45L86Confident89.2Confident46 Ų4669 Ų6924%0.24134%0.337CS..Hα-helixtrans-88.6-32-177.4-83151.3000113.9I41 D47 I109 M113 V114I41-L45 HydrophobicContact CG2-CD1 3.9Å; I41-L45 VanDerWaalsContact O-CB 3.29Å; I41-L45 WeakPolarHBondContact O-CB 3.42Å; I41-L45 PolarHBondContact O-N 2.94Å; L45-D47 HydrophobicContact CB-CB 4.3Å; L45-D47 PolarHBondContact O-N 3.48Å; L45-I109 HydrophobicContact CD1-CG2 3.66Å; L45-M113 HydrophobicContact CD1-CB 4.17Å; L45-M113 HydrophobicContact CD2-CB 3.84Å; L45-M113 HydrophobicContact CD2-CE 3.8Å; L45-M113 HydrophobicContact CD2-CG 4.35Å; L45-M113 HydrophobicContact CD2-SD 4.43Å; L45-M113 HydrophobicContact CG-CB 4.32Å; L45-V114 HydrophobicContact CD1-CG2 3.68Å; L45-V114 HydrophobicContact CG-CG2 4.11Å
46K78.5Confident89.2Confident182 Ų18270.4 Ų70.479%0.79134%0.335SS*.  trans46.528-173.7-60.7-174.3-179.9179.90114.4L42L42-K46 PolarHBondContact O-N 3.29Å
47D74.6Confident89.2Confident70 Ų7069.5 Ų69.537%0.37433%0.326SS..  trans-109.9145.2-171.6-171.27.7000111.6L45 W49 W50L45-D47 HydrophobicContact CB-CB 4.3Å; L45-D47 PolarHBondContact O-N 3.48Å; D47-W49 PolarHBondContact O-N 2.84Å; D47-W49 VanDerWaalsContact OD2-CD1 3.3Å; D47-W50 PolarHBondContact O-N 3.28Å
48N75.6Confident89.3Confident130 Ų13073.8 Ų73.870%0.69535%0.353SS*.THydrogen-bonded Turntrans-59.9-16.2-170.5-72.7-20.7000115.5W50 L51N48-W50 PolarHBondContact O-N 2.88Å; N48-W50 VanDerWaalsContact O-N 3.11Å; N48-L51 PolarHBondContact O-N 2.8Å
49W79Confident89.4Confident174 Ų17474.7 Ų74.766%0.65937%0.366SS*.THydrogen-bonded Turntrans-63.2-14.3176.9-68.993.9000113.8D47 L51 L52 L53D47-W49 PolarHBondContact O-N 2.84Å; D47-W49 VanDerWaalsContact OD2-CD1 3.3Å; W49-L51 PolarHBondContact O-N 3.1Å; W49-L52 HydrophobicContact CZ3-CD1 4.39Å; W49-L52 PolarHBondContact O-N 3.48Å; W49-L52 VanDerWaalsContact O-N 3.17Å; W49-L53 PolarHBondContact O-N 3.19Å
50W83Confident89.6Confident86 Ų8669.9 Ų69.933%0.32635%0.348SS..Hα-helixtrans-54.5-36.9177.372-100000113.1L42 D47 N48 L52 L53 I54L42-W50 HydrophobicContact CD2-CB 3.52Å; L42-W50 HydrophobicContact CD2-CD2 3.59Å; L42-W50 HydrophobicContact CD2-CE3 3.89Å; L42-W50 HydrophobicContact CD2-CG 3.42Å; L42-W50 VanDerWaalsContact CD2-CG 3.42Å; L42-W50 HydrophobicContact CG-CB 4.01Å; L42-W50 HydrophobicContact CG-CG 4.41Å; D47-W50 PolarHBondContact O-N 3.28Å; N48-W50 PolarHBondContact O-N 2.88Å; N48-W50 VanDerWaalsContact O-N 3.11Å; W50-L52 PolarHBondContact O-N 2.93Å; W50-L53 PolarHBondContact O-N 3.09Å; W50-I54 HydrophobicContact CE3-CD1 3.42Å; W50-I54 VanDerWaalsContact CE3-CD1 3.42Å; W50-I54 HydrophobicContact CE3-CG1 4.36Å; W50-I54 HydrophobicContact CZ3-CD1 3.5Å; W50-I54 VanDerWaalsContact CZ3-CD1 3.5Å; W50-I54 PolarHBondContact O-N 3.48Å; W50-I54 VanDerWaalsContact O-N 3.12Å
51L87.7Confident89.8Confident92 Ų9271.8 Ų71.848%0.48236%0.357SS..Hα-helixtrans-63.5-41179.9-80167.4000112.5N48 W49 L53 I54 I55N48-L51 PolarHBondContact O-N 2.8Å; W49-L51 PolarHBondContact O-N 3.1Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 3.46Å; L51-I54 PolarHBondContact O-N 2.96Å; L51-I55 WeakPolarHBondContact O-CG1 3.47Å; L51-I55 PolarHBondContact O-N 3.04Å; L51-I55 VanDerWaalsContact O-N 3.07Å
52L92.6Very high90Very high86 Ų8673.9 Ų73.945%0.4538%0.376SS..Hα-helixtrans-65.9-37.6-180-175.5144.1000111W49 W50 I55 L56W49-L52 HydrophobicContact CZ3-CD1 4.39Å; W49-L52 PolarHBondContact O-N 3.48Å; W49-L52 VanDerWaalsContact O-N 3.17Å; W50-L52 PolarHBondContact O-N 2.93Å; L52-I55 PolarHBondContact O-N 2.87Å; L52-L56 HydrophobicContact CD2-CD1 3.79Å; L52-L56 HydrophobicContact CD2-CG 4.31Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.16Å
53L93.1Very high90.2Very high5 Ų572.8 Ų72.83%0.02637%0.374CS..Hα-helixtrans-67.1-40.2177.3-63.5177.4000112.1I41 W49 W50 L51 I55 L56 D57 V105 I109I41-L53 HydrophobicContact CD1-CD1 3.53Å; I41-L53 HydrophobicContact CG2-CD1 4.05Å; W49-L53 PolarHBondContact O-N 3.19Å; W50-L53 PolarHBondContact O-N 3.09Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 3.46Å; L53-I55 VanDerWaalsContact C-N 3.32Å; L53-I55 PolarHBondContact O-N 3.39Å; L53-L56 HydrophobicContact CD2-CD1 4.38Å; L53-L56 WeakPolarHBondContact O-CB 3.37Å; L53-L56 PolarHBondContact O-N 3.39Å; L53-D57 PolarHBondContact O-N 3.13Å; L53-V105 HydrophobicContact CD2-CG1 4.03Å; L53-I109 HydrophobicContact CD1-CD1 3.93Å; L53-I109 HydrophobicContact CD2-CD1 4.09Å
54I93.5Very high90.4Very high56 Ų5668.3 Ų68.329%0.28735%0.353SS..Hα-helixtrans-63.3-39.5174.3-68.4-179.7000111.2W50 L51 L56 D57 V58W50-I54 HydrophobicContact CE3-CD1 3.42Å; W50-I54 VanDerWaalsContact CE3-CD1 3.42Å; W50-I54 HydrophobicContact CE3-CG1 4.36Å; W50-I54 HydrophobicContact CZ3-CD1 3.5Å; W50-I54 VanDerWaalsContact CZ3-CD1 3.5Å; W50-I54 PolarHBondContact O-N 3.48Å; W50-I54 VanDerWaalsContact O-N 3.12Å; L51-I54 PolarHBondContact O-N 2.96Å; I54-L56 VanDerWaalsContact C-N 3.3Å; I54-L56 PolarHBondContact O-N 3.49Å; I54-D57 WeakPolarHBondContact O-CB 3.22Å; I54-D57 PolarHBondContact O-N 3.08Å; I54-V58 WeakPolarHBondContact O-CG2 3.41Å; I54-V58 PolarHBondContact O-N 2.99Å
55I95Very high90.7Very high121 Ų12170.5 Ų70.562%0.62137%0.367SS*.Hα-helixtrans-61.1-42.4175.8-68.8166000110.6L51 L52 L53 D57 V58 G59L51-I55 WeakPolarHBondContact O-CG1 3.47Å; L51-I55 PolarHBondContact O-N 3.04Å; L51-I55 VanDerWaalsContact O-N 3.07Å; L52-I55 PolarHBondContact O-N 2.87Å; L53-I55 VanDerWaalsContact C-N 3.32Å; L53-I55 PolarHBondContact O-N 3.39Å; I55-D57 VanDerWaalsContact C-N 3.35Å; I55-V58 PolarHBondContact O-N 3.23Å; I55-G59 PolarHBondContact O-N 3.16Å
56L96.6Very high91.1Very high67 Ų6774.8 Ų74.835%0.35138%0.38SS..Hα-helixtrans-62.4-42.1175.7-69.8175.4000111.7L52 L53 I54 V58 G59 V60 V102L52-L56 HydrophobicContact CD2-CD1 3.79Å; L52-L56 HydrophobicContact CD2-CG 4.31Å; L52-L56 WeakPolarHBondContact O-CG 3.39Å; L52-L56 PolarHBondContact O-N 3.16Å; L53-L56 HydrophobicContact CD2-CD1 4.38Å; L53-L56 WeakPolarHBondContact O-CB 3.37Å; L53-L56 PolarHBondContact O-N 3.39Å; I54-L56 VanDerWaalsContact C-N 3.3Å; I54-L56 PolarHBondContact O-N 3.49Å; L56-V58 PolarHBondContact O-N 3.26Å; L56-G59 WeakPolarHBondContact O-CA 3.23Å; L56-G59 PolarHBondContact O-N 2.9Å; L56-G59 VanDerWaalsContact O-N 3.1Å; L56-V60 WeakPolarHBondContact O-CG2 3.46Å; L56-V60 PolarHBondContact O-N 3.49Å; L56-V102 HydrophobicContact CB-CG1 4.14Å; L56-V102 HydrophobicContact CB-CG2 3.9Å
57D96.8Very high91.8Very high8 Ų866.1 Ų66.14%0.04334%0.343CS..Hα-helixtrans-61.7-44176.6-73.74.3000112.3L34 L53 I54 I55 G59 V60 L61 V102 K106L34-D57 WeakPolarHBondContact CB-OD2 3.42Å; L34-D57 HydrophobicContact CD1-CB 4.14Å; L53-D57 PolarHBondContact O-N 3.13Å; I54-D57 WeakPolarHBondContact O-CB 3.22Å; I54-D57 PolarHBondContact O-N 3.08Å; I55-D57 VanDerWaalsContact C-N 3.35Å; D57-G59 PolarHBondContact O-N 3.33Å; D57-V60 WeakPolarHBondContact O-CB 3.3Å; D57-V60 PolarHBondContact O-N 3.36Å; D57-V60 VanDerWaalsContact O-N 3.11Å; D57-L61 WeakPolarHBondContact O-CG 3.49Å; D57-L61 PolarHBondContact O-N 3.47Å; D57-V102 WeakPolarHBondContact OD1-CG1 3.19Å; D57-K106 WeakPolarHBondContact OD1-CE 3.35Å; D57-K106 IonicContact OD1-NZ 2.84Å; D57-K106 PolarHBondContact OD1-NZ 2.91Å; D57-K106 IonicContact OD2-NZ 3.22Å; D57-K106 PolarHBondContact OD2-NZ 3.16Å
58V96.9Very high92.6Very high91 Ų9164 Ų6455%0.55233%0.331SS*.Hα-helixtrans-58.4-39.8174172.40000110.5I54 I55 L56 L61 A62I54-V58 WeakPolarHBondContact O-CG2 3.41Å; I54-V58 PolarHBondContact O-N 2.99Å; I55-V58 PolarHBondContact O-N 3.23Å; L56-V58 PolarHBondContact O-N 3.26Å; V58-L61 PolarHBondContact O-N 3.4Å; V58-A62 VanDerWaalsContact O-CB 3.24Å; V58-A62 WeakPolarHBondContact O-CB 3.49Å; V58-A62 PolarHBondContact O-N 3.45Å
59G97.1Very high93.3Very high37 Ų3759.1 Ų59.138%0.38131%0.312SS..Hα-helixtrans-61-43.9173.600000113.3I55 L56 D57 A62 C63I55-G59 PolarHBondContact O-N 3.16Å; L56-G59 WeakPolarHBondContact O-CA 3.23Å; L56-G59 PolarHBondContact O-N 2.9Å; L56-G59 VanDerWaalsContact O-N 3.1Å; D57-G59 PolarHBondContact O-N 3.33Å; G59-A62 PolarHBondContact O-N 3.19Å; G59-C63 PolarHBondContact O-N 2.93Å; G59-C63 PolarHBondContact O-SG 3.18Å
60V97.7Very high93.8Very high3 Ų352.9 Ų52.92%0.01829%0.291CS..Hα-helixtrans-62.7-49.6175.5175.80000110.5T30 L34 L56 D57 A62 C63 F64 A98 Y99 V102T30-V60 HydrophobicContact CG2-CG1 4.35Å; L34-V60 HydrophobicContact CD1-CB 4.29Å; L34-V60 HydrophobicContact CD1-CG1 4.14Å; L56-V60 WeakPolarHBondContact O-CG2 3.46Å; L56-V60 PolarHBondContact O-N 3.49Å; D57-V60 WeakPolarHBondContact O-CB 3.3Å; D57-V60 PolarHBondContact O-N 3.36Å; D57-V60 VanDerWaalsContact O-N 3.11Å; V60-A62 VanDerWaalsContact C-N 3.31Å; V60-A62 PolarHBondContact O-N 3.4Å; V60-C63 WeakPolarHBondContact O-CA 3.33Å; V60-C63 WeakPolarHBondContact O-CB 3.37Å; V60-C63 PolarHBondContact O-N 2.86Å; V60-F64 HydrophobicContact CG1-CD2 4.08Å; V60-F64 HydrophobicContact CG1-CE2 4.05Å; V60-F64 WeakPolarHBondContact O-CD2 3.18Å; V60-F64 PolarHBondContact O-N 2.93Å; V60-A98 HydrophobicContact CG2-CB 4.39Å; V60-Y99 HydrophobicContact CG1-CD2 4.43Å; V60-V102 HydrophobicContact CG2-CB 3.94Å; V60-V102 HydrophobicContact CG2-CG1 4.41Å; V60-V102 HydrophobicContact CG2-CG2 3.58Å
61L97.6Very high93.9Very high39 Ų3949 Ų4920%0.20428%0.277CS..Hα-helixtrans-62.8-38.3179.7-65.9-178.9000111.8F27 T30 S31 L34 D57 V58 C63 F64 L65F27-L61 HydrophobicContact CD2-CD2 4.4Å; F27-L61 HydrophobicContact CE2-CB 4.18Å; F27-L61 HydrophobicContact CE2-CD2 3.91Å; F27-L61 HydrophobicContact CZ-CD2 4.48Å; T30-L61 HydrophobicContact CG2-CD2 4.27Å; S31-L61 VanDerWaalsContact OG-CD2 3.29Å; S31-L61 WeakPolarHBondContact OG-CD2 3.3Å; L34-L61 HydrophobicContact CD1-CD2 4.37Å; L34-L61 HydrophobicContact CD1-CG 4.49Å; D57-L61 WeakPolarHBondContact O-CG 3.49Å; D57-L61 PolarHBondContact O-N 3.47Å; V58-L61 PolarHBondContact O-N 3.4Å; L61-C63 VanDerWaalsContact C-N 3.33Å; L61-C63 PolarHBondContact O-N 3.42Å; L61-F64 PolarHBondContact O-N 2.88Å; L61-L65 WeakPolarHBondContact O-CB 3.47Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 2.98Å
62A97.1Very high93.9Very high52 Ų5248.3 Ų48.343%0.4327%0.273SS..Hα-helixtrans-61.9-40172.800000111.9V58 G59 V60 L65 W66V58-A62 VanDerWaalsContact O-CB 3.24Å; V58-A62 WeakPolarHBondContact O-CB 3.49Å; V58-A62 PolarHBondContact O-N 3.45Å; G59-A62 PolarHBondContact O-N 3.19Å; V60-A62 VanDerWaalsContact C-N 3.31Å; V60-A62 PolarHBondContact O-N 3.4Å; A62-L65 PolarHBondContact O-N 3.42Å; A62-W66 WeakPolarHBondContact O-CB 3.37Å; A62-W66 PolarHBondContact O-N 3.01Å
63C95.9Very high93.6Very high44 Ų4453.3 Ų53.330%0.29729%0.286SS..Hα-helixtrans-61.6-44.5173.8-68.70000111.7G59 V60 L61 W66 L67G59-C63 PolarHBondContact O-N 2.93Å; G59-C63 PolarHBondContact O-SG 3.18Å; V60-C63 WeakPolarHBondContact O-CA 3.33Å; V60-C63 WeakPolarHBondContact O-CB 3.37Å; V60-C63 PolarHBondContact O-N 2.86Å; L61-C63 VanDerWaalsContact C-N 3.33Å; L61-C63 PolarHBondContact O-N 3.42Å; C63-W66 PolarHBondContact O-N 2.88Å; C63-L67 WeakPolarHBondContact O-CG 3.21Å; C63-L67 PolarHBondContact O-N 3.05Å
64F95.4Very high93.1Very high0 Ų054.8 Ų54.80%029%0.292CS..Hα-helixtrans-66.8-40.2177.1-85.3-105.3000112.5F23 F27 V60 L61 W66 L67 L68 G95 L143F23-F64 HydrophobicContact CE1-CD1 4.25Å; F23-F64 VanDerWaalsContact CE1-O 3.27Å; F23-F64 WeakPolarHBondContact CE1-O 3.19Å; F23-F64 HydrophobicContact CZ-CD1 4.01Å; F23-F64 WeakPolarHBondContact CZ-O 3.24Å; F27-F64 HydrophobicContact CD2-CB 3.86Å; V60-F64 HydrophobicContact CG1-CD2 4.08Å; V60-F64 HydrophobicContact CG1-CE2 4.05Å; V60-F64 WeakPolarHBondContact O-CD2 3.18Å; V60-F64 PolarHBondContact O-N 2.93Å; L61-F64 PolarHBondContact O-N 2.88Å; F64-W66 VanDerWaalsContact C-N 3.3Å; F64-W66 PolarHBondContact O-N 3.17Å; F64-L67 PolarHBondContact O-N 3.17Å; F64-L68 WeakPolarHBondContact O-CB 3.18Å; F64-L68 PolarHBondContact O-N 3.32Å; F64-G95 WeakPolarHBondContact CE2-O 3.48Å; F64-L143 HydrophobicContact CE1-CD1 4.34Å
65L95.2Very high92.5Very high91 Ų9154.3 Ų54.348%0.47629%0.288SS..Hα-helixtrans-62.4-39.1174.2-75172.7000111.9F27 L61 A62 L68 G69F27-L65 HydrophobicContact CD2-CD2 4.34Å; F27-L65 HydrophobicContact CD2-CG 4.37Å; F27-L65 HydrophobicContact CE1-CD2 4.36Å; F27-L65 HydrophobicContact CE2-CD1 4.3Å; F27-L65 HydrophobicContact CE2-CD2 3.79Å; F27-L65 HydrophobicContact CE2-CG 3.63Å; F27-L65 HydrophobicContact CZ-CD1 4.31Å; F27-L65 HydrophobicContact CZ-CD2 3.81Å; F27-L65 HydrophobicContact CZ-CG 3.96Å; L61-L65 WeakPolarHBondContact O-CB 3.47Å; L61-L65 WeakPolarHBondContact O-CG 3.5Å; L61-L65 PolarHBondContact O-N 2.98Å; A62-L65 PolarHBondContact O-N 3.42Å; L65-L68 WeakPolarHBondContact O-CB 3.43Å; L65-L68 PolarHBondContact O-N 2.7Å; L65-G69 PolarHBondContact O-N 2.96Å
66W94.7Very high91.9Very high136 Ų13651.5 Ų51.552%0.51528%0.276SS..Hα-helixtrans-62.4-45.4174.617456.4000111.7A62 C63 F64 L68 G69 I70 Y91 L94A62-W66 WeakPolarHBondContact O-CB 3.37Å; A62-W66 PolarHBondContact O-N 3.01Å; C63-W66 PolarHBondContact O-N 2.88Å; F64-W66 VanDerWaalsContact C-N 3.3Å; F64-W66 PolarHBondContact O-N 3.17Å; W66-L68 PolarHBondContact O-N 2.96Å; W66-G69 PolarHBondContact O-N 3.37Å; W66-I70 HydrophobicContact CD2-CD1 4.26Å; W66-I70 HydrophobicContact CH2-CD1 4.48Å; W66-I70 HydrophobicContact CZ2-CD1 3.91Å; W66-I70 WeakPolarHBondContact O-CG1 3.3Å; W66-I70 PolarHBondContact O-N 3.08Å; W66-I70 VanDerWaalsContact O-N 3.08Å; W66-Y91 HydrophobicContact CH2-CD2 4.4Å; W66-Y91 HydrophobicContact CH2-CG 4.47Å; W66-L94 HydrophobicContact CH2-CD1 4.43Å; W66-L94 HydrophobicContact CZ3-CD1 4.15Å
67L92.9Very high91.2Very high1 Ų153.4 Ų53.41%0.00529%0.286CS..Hα-helixtrans-61.5-41.3174.4-69.4175.3000112.2F23 C63 F64 G69 I70 A71 I89F23-L67 HydrophobicContact CE2-CB 4.02Å; F23-L67 HydrophobicContact CZ-CB 3.54Å; F23-L67 HydrophobicContact CZ-CD1 4.44Å; C63-L67 WeakPolarHBondContact O-CG 3.21Å; C63-L67 PolarHBondContact O-N 3.05Å; F64-L67 PolarHBondContact O-N 3.17Å; L67-G69 VanDerWaalsContact C-N 3.32Å; L67-G69 PolarHBondContact O-N 2.64Å; L67-I70 WeakPolarHBondContact O-CB 3.42Å; L67-I70 PolarHBondContact O-N 3.5Å; L67-I70 VanDerWaalsContact O-N 3.17Å; L67-A71 PolarHBondContact O-N 3.44Å; L67-I89 HydrophobicContact CB-CG2 4.46Å; L67-I89 HydrophobicContact CD2-CG2 4.05Å
68L91.2Very high90.3Very high24 Ų2453.5 Ų53.513%0.12629%0.287CS..Hα-helixtrans-60.4-42.5173.8179.757.9000111.3L20 F23 V24 F64 L65 W66 I70 A71 I72L20-L68 HydrophobicContact CD1-CD1 3.61Å; F23-L68 HydrophobicContact CB-CD1 4.42Å; F23-L68 HydrophobicContact CD1-CB 3.78Å; F23-L68 HydrophobicContact CD1-CD1 3.72Å; F23-L68 HydrophobicContact CD1-CG 4.22Å; F23-L68 HydrophobicContact CE1-CB 3.61Å; F23-L68 HydrophobicContact CE1-CD1 4.43Å; F23-L68 HydrophobicContact CG-CD1 4.26Å; F23-L68 HydrophobicContact CZ-CB 4.47Å; V24-L68 HydrophobicContact CG2-CD1 4.4Å; F64-L68 WeakPolarHBondContact O-CB 3.18Å; F64-L68 PolarHBondContact O-N 3.32Å; L65-L68 WeakPolarHBondContact O-CB 3.43Å; L65-L68 PolarHBondContact O-N 2.7Å; W66-L68 PolarHBondContact O-N 2.96Å; L68-I70 VanDerWaalsContact C-N 3.28Å; L68-I70 PolarHBondContact O-N 3.26Å; L68-A71 PolarHBondContact O-N 3.2Å; L68-A71 VanDerWaalsContact O-N 3.13Å; L68-I72 HydrophobicContact CD1-CD1 4.04Å; L68-I72 HydrophobicContact CD1-CG1 4.14Å; L68-I72 HydrophobicContact CG-CD1 3.88Å; L68-I72 HydrophobicContact CG-CG1 4.42Å; L68-I72 WeakPolarHBondContact O-CG1 3.27Å; L68-I72 PolarHBondContact O-N 3.15Å
69G91Very high89.2Confident29 Ų2951.7 Ų51.730%0.29928%0.278SS..Hα-helixtrans-59.6-38.3175.200000112.7L65 W66 L67 R73L65-G69 PolarHBondContact O-N 2.96Å; W66-G69 PolarHBondContact O-N 3.37Å; L67-G69 VanDerWaalsContact C-N 3.32Å; L67-G69 PolarHBondContact O-N 2.64Å; G69-R73 WeakPolarHBondContact O-CB 3.48Å; G69-R73 VanDerWaalsContact O-CG 3.26Å; G69-R73 WeakPolarHBondContact O-CG 3.39Å; G69-R73 PolarHBondContact O-N 2.9Å; G69-R73 VanDerWaalsContact O-N 3.1Å
70I88.4Confident88.1Confident43 Ų4359.9 Ų59.922%0.22130%0.298CS..Hα-helixtrans-65.3-45.9173.1-64.6170.6000110.5W66 L67 L68 I72 R73 Y74 Y91W66-I70 HydrophobicContact CD2-CD1 4.26Å; W66-I70 HydrophobicContact CH2-CD1 4.48Å; W66-I70 HydrophobicContact CZ2-CD1 3.91Å; W66-I70 WeakPolarHBondContact O-CG1 3.3Å; W66-I70 PolarHBondContact O-N 3.08Å; W66-I70 VanDerWaalsContact O-N 3.08Å; L67-I70 WeakPolarHBondContact O-CB 3.42Å; L67-I70 PolarHBondContact O-N 3.5Å; L67-I70 VanDerWaalsContact O-N 3.17Å; L68-I70 VanDerWaalsContact C-N 3.28Å; L68-I70 PolarHBondContact O-N 3.26Å; I70-I72 PolarHBondContact O-N 2.99Å; I70-R73 PolarHBondContact O-N 3.15Å; I70-Y74 WeakPolarHBondContact O-CB 3.33Å; I70-Y74 PolarHBondContact O-N 3.5Å; I70-Y91 HydrophobicContact CD1-CD2 3.99Å; I70-Y91 HydrophobicContact CD1-CE2 4.5Å
71A86.3Confident86.9Confident5 Ų562.3 Ų62.34%0.04132%0.318CS..Hα-helixtrans-61.7-44.4179.600000112.5L67 L68 Y74 Q75 I89L67-A71 PolarHBondContact O-N 3.44Å; L68-A71 PolarHBondContact O-N 3.2Å; L68-A71 VanDerWaalsContact O-N 3.13Å; A71-Y74 WeakPolarHBondContact O-CB 3.39Å; A71-Y74 PolarHBondContact O-N 2.9Å; A71-Q75 PolarHBondContact O-N 3.46Å; A71-I89 HydrophobicContact CB-CG1 4.13Å
72I86.7Confident85.4Confident77 Ų7764.2 Ų64.240%0.39534%0.34SS..Hα-helixtrans-63.3-43.8176.9-68168.6000111L20 L68 I70 Y74 Q75 T76L20-I72 HydrophobicContact CD1-CD1 4.44Å; L20-I72 HydrophobicContact CD1-CG1 3.66Å; L68-I72 HydrophobicContact CD1-CD1 4.04Å; L68-I72 HydrophobicContact CD1-CG1 4.14Å; L68-I72 HydrophobicContact CG-CD1 3.88Å; L68-I72 HydrophobicContact CG-CG1 4.42Å; L68-I72 WeakPolarHBondContact O-CG1 3.27Å; L68-I72 PolarHBondContact O-N 3.15Å; I70-I72 PolarHBondContact O-N 2.99Å; I72-Y74 VanDerWaalsContact C-N 3.32Å; I72-Y74 PolarHBondContact O-N 3.39Å; I72-Q75 PolarHBondContact O-N 3.12Å; I72-T76 PolarHBondContact O-N 3.45Å; I72-T76 PolarHBondContact O-OG1 2.94Å
73R86.9Confident83.9Confident191 Ų19163.4 Ų63.472%0.72133%0.33SS*.Hα-helixtrans-60.7-44.1175.7-76.7-180-178.3-162.12.3111G69 I70 T76 I77G69-R73 WeakPolarHBondContact O-CB 3.48Å; G69-R73 VanDerWaalsContact O-CG 3.26Å; G69-R73 WeakPolarHBondContact O-CG 3.39Å; G69-R73 PolarHBondContact O-N 2.9Å; G69-R73 VanDerWaalsContact O-N 3.1Å; I70-R73 PolarHBondContact O-N 3.15Å; R73-T76 PolarHBondContact O-N 3.01Å; R73-I77 VanDerWaalsContact O-CG1 3.31Å; R73-I77 WeakPolarHBondContact O-CG1 3.43Å; R73-I77 PolarHBondContact O-N 3.01Å
74Y82.5Confident82Confident36 Ų3671.2 Ų71.214%0.14136%0.355CS..Hα-helixtrans-58.9-49.7176.4-174.9-95.9000111.4L16 I70 A71 I72 T76 I77 C78 D86 N88 H148L16-Y74 HydrophobicContact CD2-CD1 4.2Å; L16-Y74 HydrophobicContact CD2-CE1 4.25Å; I70-Y74 WeakPolarHBondContact O-CB 3.33Å; I70-Y74 PolarHBondContact O-N 3.5Å; A71-Y74 WeakPolarHBondContact O-CB 3.39Å; A71-Y74 PolarHBondContact O-N 2.9Å; I72-Y74 VanDerWaalsContact C-N 3.32Å; I72-Y74 PolarHBondContact O-N 3.39Å; Y74-T76 VanDerWaalsContact C-N 3.31Å; Y74-T76 PolarHBondContact O-N 3.23Å; Y74-I77 PolarHBondContact O-N 2.95Å; Y74-I77 VanDerWaalsContact O-N 3.15Å; Y74-C78 WeakPolarHBondContact CE1-SG 3.43Å; Y74-C78 PolarHBondContact O-N 3.29Å; Y74-C78 PolarHBondContact O-SG 3.04Å; Y74-D86 PolarHBondContact OH-O 3.18Å; Y74-N88 HydrophobicContact CD1-CB 3.26Å; Y74-N88 HydrophobicContact CE1-CB 3.71Å; Y74-N88 HydrophobicContact CG-CB 3.73Å; Y74-H148 HydrophobicContact CE1-CB 4.28Å
75Q80.8Confident80.2Confident46 Ų4674.7 Ų74.722%0.21537%0.374CS..Hα-helixtrans-58.3-42.6176.9-178.9177.513.900112.4L16 A71 I72 I77 C78 S79L16-Q75 HydrophobicContact CB-CG 4.09Å; L16-Q75 HydrophobicContact CD1-CG 4.38Å; L16-Q75 HydrophobicContact CD2-CB 4.37Å; L16-Q75 HydrophobicContact CD2-CG 4.49Å; A71-Q75 PolarHBondContact O-N 3.46Å; I72-Q75 PolarHBondContact O-N 3.12Å; Q75-I77 VanDerWaalsContact C-N 3.31Å; Q75-I77 PolarHBondContact O-N 2.89Å; Q75-C78 PolarHBondContact O-N 2.73Å; Q75-S79 WeakPolarHBondContact O-CB 3.49Å; Q75-S79 PolarHBondContact O-N 2.9Å
76T82.7Confident78.2Confident61 Ų6174.1 Ų74.137%0.37437%0.371SS..Hα-helixtrans-62.1-40.5178.6-51.60000111.1I72 R73 Y74 S79I72-T76 PolarHBondContact O-N 3.45Å; I72-T76 PolarHBondContact O-OG1 2.94Å; R73-T76 PolarHBondContact O-N 3.01Å; Y74-T76 VanDerWaalsContact C-N 3.31Å; Y74-T76 PolarHBondContact O-N 3.23Å; T76-S79 PolarHBondContact O-OG 3.2Å
77I82.2Confident76.5Confident108 Ų10868 Ų6855%0.55435%0.349SS*.Hα-helixtrans-67-49175.8-65.7163.8000110.6R73 Y74 Q75 S79 R80 A81R73-I77 VanDerWaalsContact O-CG1 3.31Å; R73-I77 WeakPolarHBondContact O-CG1 3.43Å; R73-I77 PolarHBondContact O-N 3.01Å; Y74-I77 PolarHBondContact O-N 2.95Å; Y74-I77 VanDerWaalsContact O-N 3.15Å; Q75-I77 VanDerWaalsContact C-N 3.31Å; Q75-I77 PolarHBondContact O-N 2.89Å; I77-S79 VanDerWaalsContact C-N 3.25Å; I77-S79 PolarHBondContact O-N 3.45Å; I77-R80 PolarHBondContact O-N 2.64Å; I77-A81 PolarHBondContact O-N 3.09Å; I77-A81 VanDerWaalsContact O-N 3.11Å
78C77.9Confident75.1Confident9 Ų968.3 Ų68.36%0.06135%0.351CS..Hα-helixtrans-69.1-21.7-178.4-59.40000114L16 Y74 Q75 R80 A81 C83L16-C78 HydrophobicContact CD1-CB 3.95Å; Y74-C78 WeakPolarHBondContact CE1-SG 3.43Å; Y74-C78 PolarHBondContact O-N 3.29Å; Y74-C78 PolarHBondContact O-SG 3.04Å; Q75-C78 PolarHBondContact O-N 2.73Å; C78-R80 PolarHBondContact O-N 2.82Å; C78-A81 CarbonylContact C-O 3.57Å; C78-A81 WeakPolarHBondContact CA-O 3.49Å; C78-C83 WeakPolarHBondContact CA-SG 3.27Å; C78-C83 HydrophobicContact CB-CB 3.73Å; C78-C83 WeakPolarHBondContact CB-SG 3.47Å; C78-C83 WeakPolarHBondContact SG-CB 3.4Å; C78-C83 CovalentContact SG-SG 2.01Å; C78-C83 PolarHBondContact SG-SG 3.23Å
79S73.7Confident74.2Confident53 Ų5367.3 Ų67.337%0.37135%0.345SS..THydrogen-bonded Turntrans-68.5-22.6170.774.90000113.1Q75 T76 I77Q75-S79 WeakPolarHBondContact O-CB 3.49Å; Q75-S79 PolarHBondContact O-N 2.9Å; T76-S79 PolarHBondContact O-OG 3.2Å; I77-S79 VanDerWaalsContact C-N 3.25Å; I77-S79 PolarHBondContact O-N 3.45Å
80R74.5Confident73.5Confident210 Ų21070 Ų7079%0.79235%0.347SS*.THydrogen-bonded Turntrans-103-23.3-175.9-64.9178.8-179.1-178.20113I77 C78I77-R80 PolarHBondContact O-N 2.64Å; C78-R80 PolarHBondContact O-N 2.82Å
81A71.1Confident73.4Confident53 Ų5371.2 Ų71.244%0.43835%0.349SS..SBendtrans-139.9153.7-178.300000111.1I77 C78 C83I77-A81 PolarHBondContact O-N 3.09Å; I77-A81 VanDerWaalsContact O-N 3.11Å; C78-A81 CarbonylContact C-O 3.57Å; C78-A81 WeakPolarHBondContact CA-O 3.49Å; A81-C83 PolarHBondContact O-N 2.85Å; A81-C83 VanDerWaalsContact O-N 3.07Å
82A67.3Low73.6Confident80 Ų8071 Ų7166%0.66135%0.348SS*.  trans-64.4111172.200000109.4
83C65Low73.9Confident35 Ų3568.3 Ų68.324%0.23633%0.333CS..  trans-82.8127.6173.8-80.30000110.2C78 A81C78-C83 WeakPolarHBondContact CA-SG 3.27Å; C78-C83 HydrophobicContact CB-CB 3.73Å; C78-C83 WeakPolarHBondContact CB-SG 3.47Å; C78-C83 WeakPolarHBondContact SG-CB 3.4Å; C78-C83 CovalentContact SG-SG 2.01Å; C78-C83 PolarHBondContact SG-SG 3.23Å; A81-C83 PolarHBondContact O-N 2.85Å; A81-C83 VanDerWaalsContact O-N 3.07Å
84Y55.7Low74.2Confident207 Ų20762.5 Ų62.581%0.81232%0.316SS*.  trans-74.2161.9165.5-86-91.2000110.3D86Y84-D86 PolarHBondContact O-N 3.45Å
85D57Low74.8Confident74 Ų7460.8 Ų60.840%0.39631%0.309SS..SBendtrans-56.623.4-164-137-0.2000117.5S150 R156D85-S150 PolarHBondContact OD1-N 2.88Å; D85-R156 PolarHBondContact O-NH1 2.99Å
86D53.5Low75.5Confident79 Ų7958.6 Ų58.642%0.42230%0.299SS..  trans-83.6142.7-177.6-126.3-22.6000111.3Y74 Y84 R90Y74-D86 PolarHBondContact OH-O 3.18Å; Y84-D86 PolarHBondContact O-N 3.45Å; D86-R90 VanDerWaalsContact CG-NH2 3.29Å; D86-R90 IonicContact OD1-NH2 3.04Å; D86-R90 IonicContact OD2-CZ 3.69Å; D86-R90 IonicContact OD2-NH2 3.65Å; D86-R90 PolarHBondContact OD2-NH2 3Å
87S59.2Low76.2Confident7 Ų758.3 Ų58.35%0.04930%0.295CS..  trans-69.1137.5-173.377.50000112.3I89 R90 R156S87-I89 VanDerWaalsContact C-N 3.31Å; S87-I89 PolarHBondContact O-N 3.36Å; S87-R90 WeakPolarHBondContact O-CG 3.39Å; S87-R90 WeakPolarHBondContact OG-CG 3.45Å; S87-R156 VanDerWaalsContact CB-CZ 3.5Å
88N64.6Low76.9Confident7 Ų754.4 Ų54.44%0.03728%0.279CS..SBendtrans-67-29.617468.2-12.9000112.5E19 Y74 S146 H147 H148E19-N88 PolarHBondContact OE2-ND2 3.15Å; Y74-N88 HydrophobicContact CD1-CB 3.26Å; Y74-N88 HydrophobicContact CE1-CB 3.71Å; Y74-N88 HydrophobicContact CG-CB 3.73Å; N88-S146 PolarHBondContact ND2-O 2.99Å; N88-S146 PolarHBondContact OD1-O 3.48Å; N88-S146 VanDerWaalsContact OD1-O 3.13Å; N88-H147 WeakPolarHBondContact OD1-CA 3.49Å; N88-H148 HydrophobicContact CB-CB 3.95Å; N88-H148 PolarHBondContact OD1-N 2.87Å; N88-H148 VanDerWaalsContact OD1-N 3.16Å
89I72.4Confident77.9Confident3 Ų354 Ų542%0.01528%0.276CS..  trans-122.270.8-175.3-54.2155.3000109.8F23 L67 A71 S87 Y91 A92 S146 H147F23-I89 HydrophobicContact CD2-CD1 3.48Å; F23-I89 VanDerWaalsContact CD2-CD1 3.48Å; F23-I89 HydrophobicContact CD2-CG1 4.43Å; F23-I89 HydrophobicContact CE2-CD1 3.81Å; F23-I89 HydrophobicContact CE2-CG1 4.44Å; F23-I89 HydrophobicContact CE2-CG2 4.44Å; L67-I89 HydrophobicContact CB-CG2 4.46Å; L67-I89 HydrophobicContact CD2-CG2 4.05Å; A71-I89 HydrophobicContact CB-CG1 4.13Å; S87-I89 VanDerWaalsContact C-N 3.31Å; S87-I89 PolarHBondContact O-N 3.36Å; I89-Y91 PolarHBondContact O-N 2.92Å; I89-A92 HydrophobicContact CG2-CB 3.76Å; I89-A92 PolarHBondContact O-N 3.1Å; I89-S146 VanDerWaalsContact CD1-O 3.31Å; I89-S146 WeakPolarHBondContact CD1-O 3.36Å; I89-S146 WeakPolarHBondContact CD1-OG 3.32Å; I89-H147 PolarHBondContact O-NE2 3.37Å
90R75.9Confident79Confident86 Ų8651.4 Ų51.433%0.32526%0.258SS..THydrogen-bonded Turntrans-57.1-20178.3-70.6172.3169.8-165.21.7114.3D86 S87 R219D86-R90 VanDerWaalsContact CG-NH2 3.29Å; D86-R90 IonicContact OD1-NH2 3.04Å; D86-R90 IonicContact OD2-CZ 3.69Å; D86-R90 IonicContact OD2-NH2 3.65Å; D86-R90 PolarHBondContact OD2-NH2 3Å; S87-R90 WeakPolarHBondContact O-CG 3.39Å; S87-R90 WeakPolarHBondContact OG-CG 3.45Å; R90-R219 VanDerWaalsContact CG-NH1 3.31Å; R90-R219 WeakPolarHBondContact O-CB 3.25Å; R90-R219 WeakPolarHBondContact O-CD 3.37Å; R90-R219 WeakPolarHBondContact O-CG 3.4Å
91Y85.7Confident80.1Confident68 Ų6845.7 Ų45.727%0.26724%0.243SC..THydrogen-bonded Turntrans-118.821.9-171.4-55.5-69.4000113.2W66 I70 I89 F93 L94W66-Y91 HydrophobicContact CH2-CD2 4.4Å; W66-Y91 HydrophobicContact CH2-CG 4.47Å; I70-Y91 HydrophobicContact CD1-CD2 3.99Å; I70-Y91 HydrophobicContact CD1-CE2 4.5Å; I89-Y91 PolarHBondContact O-N 2.92Å; Y91-F93 HydrophobicContact CD1-CE1 4.09Å; Y91-F93 PolarHBondContact O-N 3.3Å; Y91-F93 VanDerWaalsContact O-N 3.12Å; Y91-L94 HydrophobicContact CD1-CD1 4.35Å; Y91-L94 WeakPolarHBondContact O-CB 3.39Å; Y91-L94 PolarHBondContact O-N 3.31Å
92A91.3Very high81.4Confident2 Ų243.8 Ų43.82%0.01723%0.225CC..Hα-helixtrans-54.9-32.6178.700000112.8I89 L94 G95 W96 L143 H147I89-A92 HydrophobicContact CG2-CB 3.76Å; I89-A92 PolarHBondContact O-N 3.1Å; A92-L94 VanDerWaalsContact C-N 3.26Å; A92-L94 PolarHBondContact O-N 2.88Å; A92-G95 PolarHBondContact O-N 2.97Å; A92-W96 PolarHBondContact O-N 3.07Å; A92-L143 HydrophobicContact CB-CD1 4.24Å; A92-L143 HydrophobicContact CB-CD2 4.48Å; A92-L143 HydrophobicContact CB-CG 4.35Å; A92-H147 VanDerWaalsContact CB-CE1 3.4Å; A92-H147 WeakPolarHBondContact CB-CE1 3.39Å; A92-H147 WeakPolarHBondContact CB-NE2 3.41Å
93F92.2Very high82.9Confident20 Ų2040 Ų409%0.08819%0.194CC..Hα-helixtrans-60.1-33.3176.277.2-89.4000112.9Y91 L97 T212 L215 F216 R219 Y220Y91-F93 HydrophobicContact CD1-CE1 4.09Å; Y91-F93 PolarHBondContact O-N 3.3Å; Y91-F93 VanDerWaalsContact O-N 3.12Å; F93-L97 WeakPolarHBondContact O-CB 3.5Å; F93-L97 PolarHBondContact O-N 3.06Å; F93-T212 HydrophobicContact CB-CG2 4.35Å; F93-T212 HydrophobicContact CD2-CG2 4.47Å; F93-L215 HydrophobicContact CB-CB 3.59Å; F93-F216 HydrophobicContact CB-CB 4.32Å; F93-F216 HydrophobicContact CD1-CD2 4.36Å; F93-F216 AromaticContact CD2-CD2 3.83Å; F93-F216 HydrophobicContact CD2-CD2 3.83Å; F93-F216 HydrophobicContact CE1-CD2 4.29Å; F93-F216 AromaticContact CE2-CD2 3.74Å; F93-F216 HydrophobicContact CE2-CD2 3.74Å; F93-F216 HydrophobicContact CE2-CE2 4.2Å; F93-F216 HydrophobicContact CG-CB 4.32Å; F93-F216 HydrophobicContact CG-CD2 4.15Å; F93-F216 AromaticContact CZ-CD2 3.98Å; F93-F216 HydrophobicContact CZ-CD2 3.98Å; F93-F216 HydrophobicContact CZ-CE2 4.24Å; F93-R219 HydrophobicContact CD1-CB 4.48Å; F93-R219 HydrophobicContact CE1-CG 4.43Å; F93-Y220 HydrophobicContact CE1-CE2 4.18Å; F93-Y220 HydrophobicContact CZ-CE2 4.27Å
94L93.6Very high84.4Confident68 Ų6838.9 Ų38.936%0.35619%0.187SC..Hα-helixtrans-69.9-42.9176.5-68.7177.9000111.1W66 Y91 A92 L97 A98W66-L94 HydrophobicContact CH2-CD1 4.43Å; W66-L94 HydrophobicContact CZ3-CD1 4.15Å; Y91-L94 HydrophobicContact CD1-CD1 4.35Å; Y91-L94 WeakPolarHBondContact O-CB 3.39Å; Y91-L94 PolarHBondContact O-N 3.31Å; A92-L94 VanDerWaalsContact C-N 3.26Å; A92-L94 PolarHBondContact O-N 2.88Å; L94-L97 PolarHBondContact O-N 2.87Å; L94-A98 WeakPolarHBondContact O-CB 3.34Å; L94-A98 PolarHBondContact O-N 3.1Å
95G94.7Very high86.3Confident1 Ų132.2 Ų32.21%0.0117%0.168CC..Hα-helixtrans-60.9-48.4176.400000111.4F64 A92 A98 Y99F64-G95 WeakPolarHBondContact CE2-O 3.48Å; A92-G95 PolarHBondContact O-N 2.97Å; G95-A98 PolarHBondContact O-N 3.44Å; G95-Y99 VanDerWaalsContact O-CB 3.31Å; G95-Y99 WeakPolarHBondContact O-CB 3.26Å; G95-Y99 PolarHBondContact O-N 3.15Å
96W96.6Very high88.2Confident0 Ų028.7 Ų28.70%015%0.149CC..Hα-helixtrans-64.5-40.5176.8-174.5-95.9000112.8A92 Y99 S100 I139 F140 L143 V171 F208 P211 L215A92-W96 PolarHBondContact O-N 3.07Å; W96-Y99 HydrophobicContact CD2-CD1 4.28Å; W96-Y99 AromaticContact CE3-CD1 3.81Å; W96-Y99 HydrophobicContact CE3-CD1 3.81Å; W96-Y99 HydrophobicContact CE3-CE1 4.17Å; W96-Y99 HydrophobicContact CH2-CD1 4.11Å; W96-Y99 AromaticContact CH2-CE1 3.71Å; W96-Y99 HydrophobicContact CH2-CE1 3.71Å; W96-Y99 HydrophobicContact CZ2-CE1 4.38Å; W96-Y99 AromaticContact CZ3-CD1 3.71Å; W96-Y99 HydrophobicContact CZ3-CD1 3.71Å; W96-Y99 AromaticContact CZ3-CE1 3.57Å; W96-Y99 HydrophobicContact CZ3-CE1 3.57Å; W96-Y99 PolarHBondContact O-N 3.38Å; W96-S100 VanDerWaalsContact O-CB 3.26Å; W96-S100 WeakPolarHBondContact O-CB 3.34Å; W96-S100 PolarHBondContact O-N 3.35Å; W96-S100 PolarHBondContact O-OG 3.05Å; W96-I139 HydrophobicContact CZ3-CG2 4.19Å; W96-F140 AromaticContact CD2-CD2 3.73Å; W96-F140 HydrophobicContact CD2-CD2 3.73Å; W96-F140 HydrophobicContact CD2-CE2 4.26Å; W96-F140 AromaticContact CE2-CD2 3.8Å; W96-F140 HydrophobicContact CE3-CB 4.36Å; W96-F140 AromaticContact CE3-CD2 3.66Å; W96-F140 HydrophobicContact CE3-CD2 3.66Å; W96-F140 HydrophobicContact CH2-CB 3.57Å; W96-F140 AromaticContact CH2-CD2 3.72Å; W96-F140 HydrophobicContact CH2-CD2 3.72Å; W96-F140 HydrophobicContact CH2-CG 4.05Å; W96-F140 HydrophobicContact CZ2-CB 4.39Å; W96-F140 AromaticContact CZ2-CD2 3.8Å; W96-F140 HydrophobicContact CZ2-CD2 3.8Å; W96-F140 HydrophobicContact CZ2-CG 4.42Å; W96-F140 HydrophobicContact CZ3-CB 3.56Å; W96-F140 AromaticContact CZ3-CD2 3.66Å; W96-F140 HydrophobicContact CZ3-CD2 3.66Å; W96-F140 HydrophobicContact CZ3-CG 4.1Å; W96-L143 HydrophobicContact CB-CD2 3.99Å; W96-L143 HydrophobicContact CE3-CD2 4.15Å; W96-V171 HydrophobicContact CZ2-CG2 4.42Å; W96-F208 PolarHBondContact NE1-O 2.9Å; W96-P211 HydrophobicContact CZ2-CB 4.39Å; W96-P211 HydrophobicContact CZ2-CG 4.1Å; W96-L215 HydrophobicContact CB-CD1 3.57Å; W96-L215 HydrophobicContact CG-CD1 3.97Å
97L96.9Very high90.2Very high54 Ų5425 Ų2528%0.28313%0.129SC..Hα-helixtrans-62.4-49.1177.7-179.259.3000111.4F93 L94 Y99 S100 L101 V209 T212F93-L97 WeakPolarHBondContact O-CB 3.5Å; F93-L97 PolarHBondContact O-N 3.06Å; L94-L97 PolarHBondContact O-N 2.87Å; L97-Y99 VanDerWaalsContact C-N 3.33Å; L97-Y99 PolarHBondContact O-N 3.14Å; L97-S100 WeakPolarHBondContact CA-OG 3.22Å; L97-S100 PolarHBondContact O-N 3.29Å; L97-S100 PolarHBondContact O-OG 3.47Å; L97-S100 VanDerWaalsContact O-OG 3.12Å; L97-L101 HydrophobicContact CD1-CD1 3.89Å; L97-L101 HydrophobicContact CD1-CG 3.99Å; L97-L101 HydrophobicContact CG-CD1 4.02Å; L97-L101 HydrophobicContact CG-CG 4.49Å; L97-L101 WeakPolarHBondContact O-CB 2.85Å; L97-L101 VanDerWaalsContact O-CG 3.27Å; L97-L101 WeakPolarHBondContact O-CG 3.38Å; L97-L101 PolarHBondContact O-N 3.25Å; L97-V209 HydrophobicContact CD1-CG1 4.07Å; L97-T212 HydrophobicContact CB-CG2 3.79Å; L97-T212 HydrophobicContact CD1-CG2 4.09Å; L97-T212 HydrophobicContact CD2-CG2 4.27Å; L97-T212 HydrophobicContact CG-CG2 4.26Å
98A97.1Very high92Very high26 Ų2627 Ų2722%0.21514%0.143CC..Hα-helixtrans-58.2-48.4177.600000110.9V60 L94 G95 V102V60-A98 HydrophobicContact CG2-CB 4.39Å; L94-A98 WeakPolarHBondContact O-CB 3.34Å; L94-A98 PolarHBondContact O-N 3.1Å; G95-A98 PolarHBondContact O-N 3.44Å; A98-V102 WeakPolarHBondContact O-CG2 3.5Å; A98-V102 PolarHBondContact O-N 3.21Å
99Y98.2Very high93.4Very high0 Ų028.9 Ų28.90%015%0.152CC..Hα-helixtrans-59.1-51.5177.1165.6-99.7000112.8T30 Q33 V60 G95 W96 L97 L101 V102 L103 S136 I139T30-Y99 HydrophobicContact CG2-CD2 3.84Å; T30-Y99 HydrophobicContact CG2-CE2 4.11Å; Q33-Y99 PolarHBondContact NE2-OH 3.23Å; Q33-Y99 VanDerWaalsContact OE1-CE2 3.24Å; Q33-Y99 VanDerWaalsContact OE1-CZ 3.3Å; Q33-Y99 PolarHBondContact OE1-OH 3.44Å; V60-Y99 HydrophobicContact CG1-CD2 4.43Å; G95-Y99 VanDerWaalsContact O-CB 3.31Å; G95-Y99 WeakPolarHBondContact O-CB 3.26Å; G95-Y99 PolarHBondContact O-N 3.15Å; W96-Y99 HydrophobicContact CD2-CD1 4.28Å; W96-Y99 AromaticContact CE3-CD1 3.81Å; W96-Y99 HydrophobicContact CE3-CD1 3.81Å; W96-Y99 HydrophobicContact CE3-CE1 4.17Å; W96-Y99 HydrophobicContact CH2-CD1 4.11Å; W96-Y99 AromaticContact CH2-CE1 3.71Å; W96-Y99 HydrophobicContact CH2-CE1 3.71Å; W96-Y99 HydrophobicContact CZ2-CE1 4.38Å; W96-Y99 AromaticContact CZ3-CD1 3.71Å; W96-Y99 HydrophobicContact CZ3-CD1 3.71Å; W96-Y99 AromaticContact CZ3-CE1 3.57Å; W96-Y99 HydrophobicContact CZ3-CE1 3.57Å; W96-Y99 PolarHBondContact O-N 3.38Å; L97-Y99 VanDerWaalsContact C-N 3.33Å; L97-Y99 PolarHBondContact O-N 3.14Å; Y99-L101 VanDerWaalsContact C-N 3.34Å; Y99-L101 PolarHBondContact O-N 2.9Å; Y99-V102 PolarHBondContact O-N 3.49Å; Y99-L103 HydrophobicContact CE1-CD2 3.96Å; Y99-L103 VanDerWaalsContact O-CB 3.26Å; Y99-L103 WeakPolarHBondContact O-CB 3.37Å; Y99-L103 PolarHBondContact O-N 3.45Å; Y99-S136 WeakPolarHBondContact OH-CA 3.38Å; Y99-S136 VanDerWaalsContact OH-CB 3.26Å; Y99-S136 WeakPolarHBondContact OH-CB 3.25Å; Y99-S136 PolarHBondContact OH-OG 2.98Å; Y99-S136 VanDerWaalsContact OH-OG 3.11Å; Y99-I139 HydrophobicContact CE2-CD1 4.08Å
100S97.7Very high94.5Very high0 Ų028.8 Ų28.80%015%0.152CC..Hα-helixtrans-66.4-33.9-175.355.40000112.7W96 L97 S104 F208W96-S100 VanDerWaalsContact O-CB 3.26Å; W96-S100 WeakPolarHBondContact O-CB 3.34Å; W96-S100 PolarHBondContact O-N 3.35Å; W96-S100 PolarHBondContact O-OG 3.05Å; L97-S100 WeakPolarHBondContact CA-OG 3.22Å; L97-S100 PolarHBondContact O-N 3.29Å; L97-S100 PolarHBondContact O-OG 3.47Å; L97-S100 VanDerWaalsContact O-OG 3.12Å; S100-S104 VanDerWaalsContact O-CB 3.27Å; S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 2.86Å; S100-S104 PolarHBondContact O-OG 3.42Å; S100-F208 VanDerWaalsContact CB-O 3.25Å; S100-F208 WeakPolarHBondContact CB-O 3.29Å
101L97.6Very high95.3Very high90 Ų9025 Ų2547%0.47114%0.138SC..Hα-helixtrans-66.8-48174.1-70.9175.2000111.7L97 Y99 S104 V105 V209L97-L101 HydrophobicContact CD1-CD1 3.89Å; L97-L101 HydrophobicContact CD1-CG 3.99Å; L97-L101 HydrophobicContact CG-CD1 4.02Å; L97-L101 HydrophobicContact CG-CG 4.49Å; L97-L101 WeakPolarHBondContact O-CB 2.85Å; L97-L101 VanDerWaalsContact O-CG 3.27Å; L97-L101 WeakPolarHBondContact O-CG 3.38Å; L97-L101 PolarHBondContact O-N 3.25Å; Y99-L101 VanDerWaalsContact C-N 3.34Å; Y99-L101 PolarHBondContact O-N 2.9Å; L101-S104 WeakPolarHBondContact O-CB 3.27Å; L101-S104 PolarHBondContact O-N 3.32Å; L101-V105 WeakPolarHBondContact O-CG2 3.37Å; L101-V105 PolarHBondContact O-N 2.86Å; L101-V105 VanDerWaalsContact O-N 3.08Å; L101-V209 HydrophobicContact CD2-CG2 4.17Å
102V97.5Very high95.6Very high12 Ų1227.2 Ų27.27%0.07315%0.149CC..Hα-helixtrans-64.6-43.8178.2174.80000110.9L56 D57 V60 A98 Y99 S104 V105 K106L56-V102 HydrophobicContact CB-CG1 4.14Å; L56-V102 HydrophobicContact CB-CG2 3.9Å; D57-V102 WeakPolarHBondContact OD1-CG1 3.19Å; V60-V102 HydrophobicContact CG2-CB 3.94Å; V60-V102 HydrophobicContact CG2-CG1 4.41Å; V60-V102 HydrophobicContact CG2-CG2 3.58Å; A98-V102 WeakPolarHBondContact O-CG2 3.5Å; A98-V102 PolarHBondContact O-N 3.21Å; Y99-V102 PolarHBondContact O-N 3.49Å; V102-S104 VanDerWaalsContact C-N 3.31Å; V102-S104 PolarHBondContact O-N 2.92Å; V102-V105 PolarHBondContact O-N 2.93Å; V102-K106 WeakPolarHBondContact O-CG 3.48Å; V102-K106 PolarHBondContact O-N 3.01Å
103L97.9Very high95.6Very high0 Ų031.5 Ų31.50%017%0.169CC..Hα-helixtrans-57.2-44.4174-179.866.7000111.4L37 Y99 V105 K106 I107 L133 F208L37-L103 HydrophobicContact CD1-CD1 3.5Å; Y99-L103 HydrophobicContact CE1-CD2 3.96Å; Y99-L103 VanDerWaalsContact O-CB 3.26Å; Y99-L103 WeakPolarHBondContact O-CB 3.37Å; Y99-L103 PolarHBondContact O-N 3.45Å; L103-V105 VanDerWaalsContact C-N 3.34Å; L103-V105 PolarHBondContact O-N 2.88Å; L103-K106 PolarHBondContact O-N 2.98Å; L103-I107 HydrophobicContact CD1-CD1 4.18Å; L103-I107 HydrophobicContact CD1-CG1 4.31Å; L103-I107 HydrophobicContact CD2-CD1 4.28Å; L103-I107 HydrophobicContact CG-CD1 3.78Å; L103-I107 HydrophobicContact CG-CG1 4.32Å; L103-I107 WeakPolarHBondContact O-CB 3.38Å; L103-I107 VanDerWaalsContact O-CG1 3.3Å; L103-I107 WeakPolarHBondContact O-CG1 3.44Å; L103-I107 PolarHBondContact O-N 3.17Å; L103-L133 HydrophobicContact CD1-CD2 4.26Å; L103-F208 HydrophobicContact CD2-CD1 3.8Å; L103-F208 HydrophobicContact CD2-CE1 3.85Å; L103-F208 HydrophobicContact CD2-CG 4.19Å; L103-F208 HydrophobicContact CD2-CZ 4.32Å
104S97.5Very high95.6Very high13 Ų1330.5 Ų30.59%0.09117%0.165CC..Hα-helixtrans-61.1-42179.1-64.70000112.2S100 L101 V102 I107 C108S100-S104 VanDerWaalsContact O-CB 3.27Å; S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 2.86Å; S100-S104 PolarHBondContact O-OG 3.42Å; L101-S104 WeakPolarHBondContact O-CB 3.27Å; L101-S104 PolarHBondContact O-N 3.32Å; V102-S104 VanDerWaalsContact C-N 3.31Å; V102-S104 PolarHBondContact O-N 2.92Å; S104-I107 PolarHBondContact O-N 2.89Å; S104-C108 PolarHBondContact O-N 3.07Å; S104-C108 PolarHBondContact O-SG 2.73Å
105V96.1Very high95.5Very high67 Ų6727.4 Ų27.441%0.40615%0.149SC..Hα-helixtrans-61.1-47.7174.7172.80000110.4L53 L101 V102 L103 I107 C108 I109L53-V105 HydrophobicContact CD2-CG1 4.03Å; L101-V105 WeakPolarHBondContact O-CG2 3.37Å; L101-V105 PolarHBondContact O-N 2.86Å; L101-V105 VanDerWaalsContact O-N 3.08Å; V102-V105 PolarHBondContact O-N 2.93Å; L103-V105 VanDerWaalsContact C-N 3.34Å; L103-V105 PolarHBondContact O-N 2.88Å; V105-I107 PolarHBondContact O-N 3.5Å; V105-C108 PolarHBondContact O-N 3.32Å; V105-I109 HydrophobicContact CG1-CD1 3.92Å; V105-I109 WeakPolarHBondContact O-CG1 3.49Å; V105-I109 PolarHBondContact O-N 3.09Å
106K96Very high95.2Very high0 Ų033.5 Ų33.50%018%0.177CC..Hα-helixtrans-63-42.3178.5-67.6-168-176.3-149.60112.5L34 L37 D38 I41 D57 V102 L103 C108 I109 I110L34-K106 PolarHBondContact O-NZ 3.36Å; L37-K106 HydrophobicContact CB-CD 3.88Å; L37-K106 HydrophobicContact CD1-CB 4.47Å; L37-K106 HydrophobicContact CD1-CD 4.15Å; D38-K106 IonicContact OD1-NZ 2.85Å; D38-K106 PolarHBondContact OD1-NZ 3Å; D38-K106 IonicContact OD2-NZ 2.82Å; D38-K106 PolarHBondContact OD2-NZ 3.45Å; I41-K106 HydrophobicContact CD1-CB 4.32Å; I41-K106 HydrophobicContact CD1-CD 4.45Å; I41-K106 HydrophobicContact CD1-CG 4.15Å; D57-K106 WeakPolarHBondContact OD1-CE 3.35Å; D57-K106 IonicContact OD1-NZ 2.84Å; D57-K106 PolarHBondContact OD1-NZ 2.91Å; D57-K106 IonicContact OD2-NZ 3.22Å; D57-K106 PolarHBondContact OD2-NZ 3.16Å; V102-K106 WeakPolarHBondContact O-CG 3.48Å; V102-K106 PolarHBondContact O-N 3.01Å; L103-K106 PolarHBondContact O-N 2.98Å; K106-C108 VanDerWaalsContact C-N 3.34Å; K106-C108 PolarHBondContact O-N 2.69Å; K106-I109 PolarHBondContact O-N 2.86Å; K106-I110 WeakPolarHBondContact O-CB 3.02Å; K106-I110 VanDerWaalsContact O-CG1 3.25Å; K106-I110 WeakPolarHBondContact O-CG1 3.3Å; K106-I110 PolarHBondContact O-N 2.89Å
107I96.7Very high94.8Very high0 Ų038 Ų380%020%0.198CC..Hα-helixtrans-57-49.6174.2-73.5170.3000109.7L103 S104 V105 I109 I110 F111 L133 L178 L201 F208L103-I107 HydrophobicContact CD1-CD1 4.18Å; L103-I107 HydrophobicContact CD1-CG1 4.31Å; L103-I107 HydrophobicContact CD2-CD1 4.28Å; L103-I107 HydrophobicContact CG-CD1 3.78Å; L103-I107 HydrophobicContact CG-CG1 4.32Å; L103-I107 WeakPolarHBondContact O-CB 3.38Å; L103-I107 VanDerWaalsContact O-CG1 3.3Å; L103-I107 WeakPolarHBondContact O-CG1 3.44Å; L103-I107 PolarHBondContact O-N 3.17Å; S104-I107 PolarHBondContact O-N 2.89Å; V105-I107 PolarHBondContact O-N 3.5Å; I107-I109 VanDerWaalsContact C-N 3.33Å; I107-I109 PolarHBondContact O-N 3.05Å; I107-I110 PolarHBondContact O-N 3.1Å; I107-F111 HydrophobicContact CG2-CD2 3.75Å; I107-F111 HydrophobicContact CG2-CE2 4.04Å; I107-F111 WeakPolarHBondContact O-CB 3.47Å; I107-F111 VanDerWaalsContact O-CD2 3.26Å; I107-F111 WeakPolarHBondContact O-CD2 3.44Å; I107-F111 PolarHBondContact O-N 2.89Å; I107-L133 HydrophobicContact CD1-CD2 4.13Å; I107-L133 HydrophobicContact CG1-CD2 3.82Å; I107-L178 HydrophobicContact CD1-CD1 4.09Å; I107-L178 HydrophobicContact CG2-CD1 3.98Å; I107-L178 HydrophobicContact CG2-CD2 4.09Å; I107-L201 HydrophobicContact CG2-CD2 4.03Å; I107-F208 HydrophobicContact CD1-CD2 3.94Å; I107-F208 HydrophobicContact CD1-CE2 3.54Å; I107-F208 HydrophobicContact CD1-CZ 4.16Å
108C95.8Very high94.5Very high51 Ų5136 Ų3635%0.34519%0.188SC..Hα-helixtrans-58.6-44.1179.6-69.70000112.4S104 V105 K106 K112S104-C108 PolarHBondContact O-N 3.07Å; S104-C108 PolarHBondContact O-SG 2.73Å; V105-C108 PolarHBondContact O-N 3.32Å; K106-C108 VanDerWaalsContact C-N 3.34Å; K106-C108 PolarHBondContact O-N 2.69Å; C108-K112 WeakPolarHBondContact O-CB 3.24Å; C108-K112 WeakPolarHBondContact O-CG 3.38Å; C108-K112 PolarHBondContact O-N 3.42Å; C108-K112 VanDerWaalsContact O-N 3.15Å
109I94.1Very high94Very high46 Ų4641 Ų4124%0.23620%0.204CC..Hα-helixtrans-64.4-51.1178.2-66.3168.7000110.7I41 L45 L53 V105 K106 I107 F111 K112 M113I41-I109 HydrophobicContact CD1-CG2 4.32Å; I41-I109 HydrophobicContact CG1-CG2 4.39Å; L45-I109 HydrophobicContact CD1-CG2 3.66Å; L53-I109 HydrophobicContact CD1-CD1 3.93Å; L53-I109 HydrophobicContact CD2-CD1 4.09Å; V105-I109 HydrophobicContact CG1-CD1 3.92Å; V105-I109 WeakPolarHBondContact O-CG1 3.49Å; V105-I109 PolarHBondContact O-N 3.09Å; K106-I109 PolarHBondContact O-N 2.86Å; I107-I109 VanDerWaalsContact C-N 3.33Å; I107-I109 PolarHBondContact O-N 3.05Å; I109-F111 PolarHBondContact O-N 3.08Å; I109-K112 PolarHBondContact O-N 3.39Å; I109-M113 VanDerWaalsContact O-CB 3.3Å; I109-M113 WeakPolarHBondContact O-CB 3.38Å; I109-M113 PolarHBondContact O-N 3.21Å
110I94.8Very high93.3Very high1 Ų145.6 Ų45.61%0.00524%0.242CC..Iπ-helixtrans-61.2-48.1-176.5-71.9167.4000110.5L37 F40 I41 K106 I107 K112 V114 V115 L129L37-I110 HydrophobicContact CB-CD1 4.23Å; L37-I110 HydrophobicContact CD2-CD1 3.65Å; L37-I110 HydrophobicContact CG-CD1 4.49Å; F40-I110 HydrophobicContact CB-CD1 4.4Å; I41-I110 HydrophobicContact CD1-CD1 4.3Å; I41-I110 HydrophobicContact CD1-CG1 4.13Å; I41-I110 HydrophobicContact CG1-CD1 4.17Å; I41-I110 HydrophobicContact CG1-CG1 3.74Å; K106-I110 WeakPolarHBondContact O-CB 3.02Å; K106-I110 VanDerWaalsContact O-CG1 3.25Å; K106-I110 WeakPolarHBondContact O-CG1 3.3Å; K106-I110 PolarHBondContact O-N 2.89Å; I107-I110 PolarHBondContact O-N 3.1Å; I110-K112 PolarHBondContact O-N 3.05Å; I110-V114 HydrophobicContact CB-CB 4.49Å; I110-V114 HydrophobicContact CG2-CB 4.23Å; I110-V114 CarbonylContact O-C 3.24Å; I110-V114 WeakPolarHBondContact O-CA 3.3Å; I110-V114 WeakPolarHBondContact O-CB 3.18Å; I110-V114 PolarHBondContact O-N 3.39Å; I110-V115 HydrophobicContact CG2-CG2 4.03Å; I110-V115 WeakPolarHBondContact O-CG2 3.27Å; I110-V115 PolarHBondContact O-N 3.31Å; I110-L129 HydrophobicContact CD1-CD1 4.41Å; I110-L129 HydrophobicContact CG2-CD1 3.98Å; I110-L129 HydrophobicContact CG2-CD2 3.65Å; I110-L129 HydrophobicContact CG2-CG 4.49Å
111F94.4Very high92.7Very high7 Ų751.8 Ų51.83%0.03128%0.281CS..Iπ-helixtrans-71.8-28.9-176.5-83.2-96000114.1I107 I109 V115 L133 L178 L181 I182 L201I107-F111 HydrophobicContact CG2-CD2 3.75Å; I107-F111 HydrophobicContact CG2-CE2 4.04Å; I107-F111 WeakPolarHBondContact O-CB 3.47Å; I107-F111 VanDerWaalsContact O-CD2 3.26Å; I107-F111 WeakPolarHBondContact O-CD2 3.44Å; I107-F111 PolarHBondContact O-N 2.89Å; I109-F111 PolarHBondContact O-N 3.08Å; F111-V115 HydrophobicContact CD1-CG2 4.07Å; F111-V115 HydrophobicContact CE1-CG2 4.41Å; F111-V115 HydrophobicContact CG-CG2 4.16Å; F111-L133 HydrophobicContact CE2-CD1 3.76Å; F111-L133 HydrophobicContact CZ-CD1 4.02Å; F111-L178 HydrophobicContact CE1-CB 4.05Å; F111-L178 HydrophobicContact CE1-CD2 4.31Å; F111-L178 VanDerWaalsContact CE1-O 3.3Å; F111-L178 WeakPolarHBondContact CE1-O 3.4Å; F111-L178 HydrophobicContact CE2-CB 4.41Å; F111-L178 HydrophobicContact CE2-CD1 4.28Å; F111-L178 HydrophobicContact CE2-CD2 4.32Å; F111-L178 HydrophobicContact CZ-CB 3.67Å; F111-L178 HydrophobicContact CZ-CD1 4.34Å; F111-L178 HydrophobicContact CZ-CD2 4.17Å; F111-L178 HydrophobicContact CZ-CG 4.28Å; F111-L181 HydrophobicContact CD1-CB 3.57Å; F111-L181 HydrophobicContact CD1-CD1 3.85Å; F111-L181 HydrophobicContact CD1-CG 4.34Å; F111-L181 HydrophobicContact CE1-CB 3.78Å; F111-L181 HydrophobicContact CE1-CD1 4.44Å; F111-I182 HydrophobicContact CE1-CD1 4.13Å; F111-I182 HydrophobicContact CE1-CG1 3.51Å; F111-I182 HydrophobicContact CZ-CD1 3.86Å; F111-I182 HydrophobicContact CZ-CG1 3.78Å; F111-L201 HydrophobicContact CB-CD1 4.32Å; F111-L201 HydrophobicContact CB-CD2 3.57Å; F111-L201 HydrophobicContact CD1-CD2 4.35Å; F111-L201 HydrophobicContact CD2-CD2 4.32Å; F111-L201 HydrophobicContact CG-CD2 3.83Å
112K91.7Very high92.2Very high114 Ų11451 Ų5150%0.49628%0.275SS..Iπ-helixtrans-83.5-32.6176.1-70.8-153.7174.2-163.40113.4C108 I109 I110 L201C108-K112 WeakPolarHBondContact O-CB 3.24Å; C108-K112 WeakPolarHBondContact O-CG 3.38Å; C108-K112 PolarHBondContact O-N 3.42Å; C108-K112 VanDerWaalsContact O-N 3.15Å; I109-K112 PolarHBondContact O-N 3.39Å; I110-K112 PolarHBondContact O-N 3.05Å; K112-L201 HydrophobicContact CG-CD1 4.06Å
113M91.5Very high91.7Very high91 Ų9158.1 Ų58.145%0.44831%0.311SS..Iπ-helixtrans-117.9-36-166.5-55.1-94.4-104.900113.7L45 I109 Q116 H117L45-M113 HydrophobicContact CD1-CB 4.17Å; L45-M113 HydrophobicContact CD2-CB 3.84Å; L45-M113 HydrophobicContact CD2-CE 3.8Å; L45-M113 HydrophobicContact CD2-CG 4.35Å; L45-M113 HydrophobicContact CD2-SD 4.43Å; L45-M113 HydrophobicContact CG-CB 4.32Å; I109-M113 VanDerWaalsContact O-CB 3.3Å; I109-M113 WeakPolarHBondContact O-CB 3.38Å; I109-M113 PolarHBondContact O-N 3.21Å; M113-Q116 PolarHBondContact O-NE2 3.42Å; M113-H117 PolarHBondContact O-CE1 2.63Å; M113-H117 VanDerWaalsContact O-CE1 3.23Å; M113-H117 PolarHBondContact O-ND1 3.34Å
114V91.3Very high91.4Very high0 Ų061.6 Ų61.60%033%0.328CS..Iπ-helixtrans-96.2-41-170.8177.50000111.9Y44 L45 I110 Q116 H117 L118Y44-V114 HydrophobicContact CD2-CG1 3.59Å; Y44-V114 HydrophobicContact CE2-CG1 4.35Å; Y44-V114 HydrophobicContact CG-CG1 3.86Å; L45-V114 HydrophobicContact CD1-CG2 3.68Å; L45-V114 HydrophobicContact CG-CG2 4.11Å; I110-V114 HydrophobicContact CB-CB 4.49Å; I110-V114 HydrophobicContact CG2-CB 4.23Å; I110-V114 CarbonylContact O-C 3.24Å; I110-V114 WeakPolarHBondContact O-CA 3.3Å; I110-V114 WeakPolarHBondContact O-CB 3.18Å; I110-V114 PolarHBondContact O-N 3.39Å; V114-Q116 PolarHBondContact O-N 2.7Å; V114-Q116 VanDerWaalsContact O-N 3.09Å; V114-H117 WeakPolarHBondContact O-CB 3.34Å; V114-H117 PolarHBondContact O-N 2.85Å; V114-L118 HydrophobicContact CG1-CG 4.48Å
115V91Very high91.1Very high3 Ų361.1 Ų61.12%0.01833%0.325CS..G310 helixtrans-55.5-37.3-169.8162.40000112.9I110 F111 H117 L118 L129 R187I110-V115 HydrophobicContact CG2-CG2 4.03Å; I110-V115 WeakPolarHBondContact O-CG2 3.27Å; I110-V115 PolarHBondContact O-N 3.31Å; F111-V115 HydrophobicContact CD1-CG2 4.07Å; F111-V115 HydrophobicContact CE1-CG2 4.41Å; F111-V115 HydrophobicContact CG-CG2 4.16Å; V115-H117 PolarHBondContact O-N 3Å; V115-H117 VanDerWaalsContact O-N 3.16Å; V115-L118 HydrophobicContact CB-CD1 4.48Å; V115-L118 HydrophobicContact CG2-CD1 4.11Å; V115-L118 WeakPolarHBondContact O-CB 3.4Å; V115-L118 PolarHBondContact O-N 2.81Å; V115-L118 VanDerWaalsContact O-N 3.15Å; V115-L129 HydrophobicContact CG2-CD2 3.92Å; V115-R187 PolarHBondContact O-NH1 2.85Å
116Q88.1Confident90.9Very high129 Ų12959 Ų5960%0.60331%0.313SS*.G310 helixtrans-58.8-24.1176.567.3-172.6-23.100114.6M113 V114M113-Q116 PolarHBondContact O-NE2 3.42Å; V114-Q116 PolarHBondContact O-N 2.7Å; V114-Q116 VanDerWaalsContact O-N 3.09Å
117H89Confident90.7Very high95 Ų9561.3 Ų61.344%0.4434%0.336SS..G310 helixtrans-93.7-12.5-178.5-55.8104.4000113.2Y44 M113 V114 V115 K119Y44-H117 HydrophobicContact CD1-CB 3.65Å; Y44-H117 HydrophobicContact CE1-CB 4.07Å; Y44-H117 HydrophobicContact CG-CB 4.47Å; M113-H117 PolarHBondContact O-CE1 2.63Å; M113-H117 VanDerWaalsContact O-CE1 3.23Å; M113-H117 PolarHBondContact O-ND1 3.34Å; V114-H117 WeakPolarHBondContact O-CB 3.34Å; V114-H117 PolarHBondContact O-N 2.85Å; V115-H117 PolarHBondContact O-N 3Å; V115-H117 VanDerWaalsContact O-N 3.16Å; H117-K119 PolarHBondContact O-N 2.82Å
118L89.6Confident90.5Very high12 Ų1262.2 Ų62.26%0.06334%0.344CS..  trans-71.4122.9-176.9-69.4171.5000111.4F40 Y44 V114 V115 M124 P126 L129F40-L118 HydrophobicContact CD1-CD2 3.88Å; F40-L118 HydrophobicContact CE1-CD2 3.67Å; Y44-L118 HydrophobicContact CE2-CD2 3.74Å; V114-L118 HydrophobicContact CG1-CG 4.48Å; V115-L118 HydrophobicContact CB-CD1 4.48Å; V115-L118 HydrophobicContact CG2-CD1 4.11Å; V115-L118 WeakPolarHBondContact O-CB 3.4Å; V115-L118 PolarHBondContact O-N 2.81Å; V115-L118 VanDerWaalsContact O-N 3.15Å; L118-M124 WeakPolarHBondContact CD2-O 3.45Å; L118-P126 HydrophobicContact CB-CG 3.98Å; L118-L129 HydrophobicContact CD1-CD2 3.78Å
119K86.6Confident90.5Very high129 Ų12959.8 Ų59.856%0.56133%0.327SS*.  trans-100.4138.8174.4-65.1177-176.6172.70110.6H117 T121 E122 P126H117-K119 PolarHBondContact O-N 2.82Å; K119-T121 PolarHBondContact O-N 2.85Å; K119-T121 VanDerWaalsContact O-N 3.15Å; K119-E122 HydrophobicContact CB-CG 4.17Å; K119-E122 PolarHBondContact O-N 3.17Å; K119-E122 VanDerWaalsContact O-N 3.17Å; K119-P126 WeakPolarHBondContact O-CD 3.48Å
120A84.3Confident90.5Very high97 Ų9759.8 Ų59.880%0.80233%0.327SS*.THydrogen-bonded Turntrans-63.6-18.5178.400000113.8
121T84.6Confident90.5Very high131 Ų13165.9 Ų65.980%0.80436%0.358SS*.THydrogen-bonded Turntrans-82-14.4178.853.70000113.7K119K119-T121 PolarHBondContact O-N 2.85Å; K119-T121 VanDerWaalsContact O-N 3.15Å
122E87.1Confident90.6Very high74 Ų7466.4 Ų66.435%0.34636%0.362SS..SBendtrans-86.7141.5-177-69177.3171.100110.7Y44 K119 M124 G125Y44-E122 PolarHBondContact OH-OE2 3.15Å; K119-E122 HydrophobicContact CB-CG 4.17Å; K119-E122 PolarHBondContact O-N 3.17Å; K119-E122 VanDerWaalsContact O-N 3.17Å; E122-M124 VanDerWaalsContact C-N 3.27Å; E122-M124 PolarHBondContact O-N 3Å; E122-G125 WeakPolarHBondContact O-CA 3.48Å; E122-G125 PolarHBondContact O-N 3.47Å
123L88.4Confident90.9Very high161 Ų16161 Ų6184%0.84334%0.339SS*.THydrogen-bonded Turntrans-57.9-43.4177.1-178.767.4000111G125 A128L123-G125 PolarHBondContact O-N 3.11Å; L123-A128 VanDerWaalsContact O-CB 3.28Å; L123-A128 WeakPolarHBondContact O-CB 3.48Å
124M90Very high91.1Very high73 Ų7358.6 Ų58.636%0.3633%0.331SS..THydrogen-bonded Turntrans-90.748.6172.1-66.4-65.8173.400110.6Y39 F40 L118 E122 A128Y39-M124 HydrophobicContact CD1-CB 4.34Å; Y39-M124 HydrophobicContact CD1-CG 4.08Å; Y39-M124 HydrophobicContact CE1-CB 3.7Å; Y39-M124 HydrophobicContact CE1-CG 3.55Å; F40-M124 HydrophobicContact CE1-CB 4.29Å; F40-M124 WeakPolarHBondContact CE1-O 3.47Å; F40-M124 HydrophobicContact CZ-CB 4.33Å; F40-M124 HydrophobicContact CZ-SD 4.49Å; L118-M124 WeakPolarHBondContact CD2-O 3.45Å; E122-M124 VanDerWaalsContact C-N 3.27Å; E122-M124 PolarHBondContact O-N 3Å; M124-A128 HydrophobicContact SD-CB 4.1Å
125G91.4Very high91.4Very high2 Ų260 Ų602%0.02134%0.34CS..SBendtrans-91-161.9177.500000113.4E122 L123 G127 A128 L129E122-G125 WeakPolarHBondContact O-CA 3.48Å; E122-G125 PolarHBondContact O-N 3.47Å; L123-G125 PolarHBondContact O-N 3.11Å; G125-G127 VanDerWaalsContact C-N 3.31Å; G125-G127 PolarHBondContact O-N 3.47Å; G125-A128 PolarHBondContact O-N 3.08Å; G125-A128 VanDerWaalsContact O-N 3.16Å; G125-L129 PolarHBondContact O-N 3.43Å; G125-L129 VanDerWaalsContact O-N 3.11Å
126P91.9Very high91.7Very high23 Ų2359.8 Ų59.815%0.14934%0.34CS..Hα-helixtrans-52.7-41.6178.4-3038.3000114.7L118 K119 L129 E130 I182L118-P126 HydrophobicContact CB-CG 3.98Å; K119-P126 WeakPolarHBondContact O-CD 3.48Å; P126-L129 PolarHBondContact O-N 3.03Å; P126-E130 PolarHBondContact O-N 2.8Å; P126-I182 HydrophobicContact CB-CG2 3.56Å; P126-I182 HydrophobicContact CG-CG2 4.46Å
127G91.6Very high92.1Very high48 Ų4854 Ų5450%0.49531%0.314SS..Hα-helixtrans-67.9-36.8-179.800000112.9G125 E130 L131G125-G127 VanDerWaalsContact C-N 3.31Å; G125-G127 PolarHBondContact O-N 3.47Å; G127-E130 PolarHBondContact O-N 2.97Å; G127-L131 WeakPolarHBondContact O-CB 3.13Å; G127-L131 PolarHBondContact O-N 3.4Å
128A94.5Very high92.4Very high19 Ų1953.4 Ų53.416%0.15731%0.313CS..Hα-helixtrans-68.9-36.7174.800000111.8F40 L123 M124 G125 L131 T132F40-A128 HydrophobicContact CZ-CB 4.16Å; L123-A128 VanDerWaalsContact O-CB 3.28Å; L123-A128 WeakPolarHBondContact O-CB 3.48Å; M124-A128 HydrophobicContact SD-CB 4.1Å; G125-A128 PolarHBondContact O-N 3.08Å; G125-A128 VanDerWaalsContact O-N 3.16Å; A128-L131 PolarHBondContact O-N 3.26Å; A128-T132 VanDerWaalsContact O-CB 3.3Å; A128-T132 WeakPolarHBondContact O-CB 3.26Å; A128-T132 PolarHBondContact O-N 3.41Å; A128-T132 PolarHBondContact O-OG1 3.28Å
129L95.4Very high92.8Very high0 Ų052.8 Ų52.80%031%0.31CS..Hα-helixtrans-63.6-46.2172.3178.962000110.9L37 F40 I110 V115 L118 G125 P126 L131 T132 L133 I182L37-L129 HydrophobicContact CD2-CD1 4.02Å; F40-L129 HydrophobicContact CD2-CD1 4.17Å; F40-L129 HydrophobicContact CE1-CB 4.14Å; F40-L129 HydrophobicContact CE2-CB 4.2Å; F40-L129 HydrophobicContact CE2-CD1 4.16Å; F40-L129 HydrophobicContact CZ-CB 3.79Å; I110-L129 HydrophobicContact CD1-CD1 4.41Å; I110-L129 HydrophobicContact CG2-CD1 3.98Å; I110-L129 HydrophobicContact CG2-CD2 3.65Å; I110-L129 HydrophobicContact CG2-CG 4.49Å; V115-L129 HydrophobicContact CG2-CD2 3.92Å; L118-L129 HydrophobicContact CD1-CD2 3.78Å; G125-L129 PolarHBondContact O-N 3.43Å; G125-L129 VanDerWaalsContact O-N 3.11Å; P126-L129 PolarHBondContact O-N 3.03Å; L129-L131 VanDerWaalsContact C-N 3.35Å; L129-L131 PolarHBondContact O-N 3.36Å; L129-T132 PolarHBondContact O-N 2.95Å; L129-L133 HydrophobicContact CD1-CD1 4.1Å; L129-L133 HydrophobicContact CD1-CG 4.14Å; L129-L133 HydrophobicContact CG-CD1 4.06Å; L129-L133 HydrophobicContact CG-CG 4.48Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.26Å; L129-L133 PolarHBondContact O-N 2.76Å; L129-I182 HydrophobicContact CD2-CD1 4.3Å
130E93.7Very high93.3Very high47 Ų4746.7 Ų46.722%0.2228%0.283CS..Hα-helixtrans-58.3-45.5176.2-176.6176.6174.800111.5P126 G127 L133 S134 I175 K179P126-E130 PolarHBondContact O-N 2.8Å; G127-E130 PolarHBondContact O-N 2.97Å; E130-L133 PolarHBondContact O-N 3.44Å; E130-S134 VanDerWaalsContact O-CB 3.26Å; E130-S134 WeakPolarHBondContact O-CB 3.49Å; E130-S134 PolarHBondContact O-N 2.84Å; E130-S134 PolarHBondContact O-OG 3.21Å; E130-I175 HydrophobicContact CG-CG2 4.41Å; E130-K179 VanDerWaalsContact CD-NZ 3.26Å; E130-K179 IonicContact OE1-NZ 3.79Å; E130-K179 PolarHBondContact OE1-NZ 3.1Å; E130-K179 WeakPolarHBondContact OE2-CE 3.25Å; E130-K179 IonicContact OE2-NZ 2.66Å; E130-K179 PolarHBondContact OE2-NZ 3.03Å
131L95Very high93.8Very high128 Ų12844.6 Ų44.667%0.6726%0.259SS*.Hα-helixtrans-63.4-43.6176.4-178.564000111.9G127 A128 L129 L133 S134 S135G127-L131 WeakPolarHBondContact O-CB 3.13Å; G127-L131 PolarHBondContact O-N 3.4Å; A128-L131 PolarHBondContact O-N 3.26Å; L129-L131 VanDerWaalsContact C-N 3.35Å; L129-L131 PolarHBondContact O-N 3.36Å; L131-L133 PolarHBondContact O-N 3.24Å; L131-S134 WeakPolarHBondContact O-CB 3.3Å; L131-S134 PolarHBondContact O-N 3.31Å; L131-S135 PolarHBondContact O-N 3.03Å; L131-S135 VanDerWaalsContact O-N 3.11Å
132T96.7Very high94.4Very high18 Ų1839.2 Ų39.211%0.1123%0.225CC..Hα-helixtrans-59.9-48.9177.8-60.10000109.9Q33 A36 L37 A128 L129 S134 S135Q33-T132 HydrophobicContact CG-CG2 3.78Å; Q33-T132 WeakPolarHBondContact CG-O 3.37Å; Q33-T132 PolarHBondContact NE2-O 3.12Å; A36-T132 HydrophobicContact CB-CG2 3.72Å; L37-T132 HydrophobicContact CD2-CG2 3.72Å; L37-T132 HydrophobicContact CG-CG2 3.81Å; A128-T132 VanDerWaalsContact O-CB 3.3Å; A128-T132 WeakPolarHBondContact O-CB 3.26Å; A128-T132 PolarHBondContact O-N 3.41Å; A128-T132 PolarHBondContact O-OG1 3.28Å; L129-T132 PolarHBondContact O-N 2.95Å; T132-S134 VanDerWaalsContact C-N 3.31Å; T132-S134 PolarHBondContact O-N 2.82Å; T132-S135 WeakPolarHBondContact O-CB 3.48Å; T132-S135 PolarHBondContact O-N 2.81Å; T132-S135 PolarHBondContact O-OG 3.38Å
133L97.1Very high94.7Very high1 Ų135.7 Ų35.71%0.00521%0.208CC..Hα-helixtrans-65.2-36.2176.6-64.9173.6000111.8L37 L103 I107 F111 L129 E130 L131 S135 S136 I175L37-L133 HydrophobicContact CD2-CD2 4.02Å; L103-L133 HydrophobicContact CD1-CD2 4.26Å; I107-L133 HydrophobicContact CD1-CD2 4.13Å; I107-L133 HydrophobicContact CG1-CD2 3.82Å; F111-L133 HydrophobicContact CE2-CD1 3.76Å; F111-L133 HydrophobicContact CZ-CD1 4.02Å; L129-L133 HydrophobicContact CD1-CD1 4.1Å; L129-L133 HydrophobicContact CD1-CG 4.14Å; L129-L133 HydrophobicContact CG-CD1 4.06Å; L129-L133 HydrophobicContact CG-CG 4.48Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.26Å; L129-L133 PolarHBondContact O-N 2.76Å; E130-L133 PolarHBondContact O-N 3.44Å; L131-L133 PolarHBondContact O-N 3.24Å; L133-S135 PolarHBondContact O-N 2.68Å; L133-S136 VanDerWaalsContact O-CB 3.27Å; L133-S136 WeakPolarHBondContact O-CB 3.27Å; L133-S136 PolarHBondContact O-N 2.91Å; L133-S136 PolarHBondContact O-OG 3.39Å; L133-I175 HydrophobicContact CB-CG1 4.27Å; L133-I175 HydrophobicContact CB-CG2 4.1Å; L133-I175 WeakPolarHBondContact O-CD1 3.34Å
134S95.9Very high94.9Very high41 Ų4128.2 Ų28.229%0.28717%0.169SC..Hα-helixtrans-60.4-29.3176.9-61.90000113.8E130 L131 T132 S136 A137E130-S134 VanDerWaalsContact O-CB 3.26Å; E130-S134 WeakPolarHBondContact O-CB 3.49Å; E130-S134 PolarHBondContact O-N 2.84Å; E130-S134 PolarHBondContact O-OG 3.21Å; L131-S134 WeakPolarHBondContact O-CB 3.3Å; L131-S134 PolarHBondContact O-N 3.31Å; T132-S134 VanDerWaalsContact C-N 3.31Å; T132-S134 PolarHBondContact O-N 2.82Å; S134-S136 PolarHBondContact O-N 3.13Å; S134-S136 VanDerWaalsContact O-N 3.11Å; S134-A137 WeakPolarHBondContact O-CB 3.42Å; S134-A137 PolarHBondContact O-N 3.28Å; S134-A137 VanDerWaalsContact O-N 3.14Å
135S96.7Very high94.9Very high28 Ų2827.5 Ų27.520%0.19617%0.167CC..Hα-helixtrans-61.8-17.6175.372.80000113.7Q33 L131 T132 L133 A137 L138 I139Q33-S135 WeakPolarHBondContact CB-OG 3.26Å; Q33-S135 WeakPolarHBondContact CG-OG 3.44Å; Q33-S135 PolarHBondContact NE2-OG 3.15Å; Q33-S135 VanDerWaalsContact NE2-OG 3.12Å; L131-S135 PolarHBondContact O-N 3.03Å; L131-S135 VanDerWaalsContact O-N 3.11Å; T132-S135 WeakPolarHBondContact O-CB 3.48Å; T132-S135 PolarHBondContact O-N 2.81Å; T132-S135 PolarHBondContact O-OG 3.38Å; L133-S135 PolarHBondContact O-N 2.68Å; S135-A137 VanDerWaalsContact C-N 3.25Å; S135-A137 PolarHBondContact O-N 2.84Å; S135-L138 WeakPolarHBondContact O-CB 3.45Å; S135-L138 PolarHBondContact O-N 3.48Å; S135-L138 VanDerWaalsContact O-N 3.08Å; S135-I139 VanDerWaalsContact O-CG1 3.32Å; S135-I139 WeakPolarHBondContact O-CG1 3.28Å; S135-I139 PolarHBondContact O-N 3.44Å
136S97.4Very high94.8Very high0 Ų027.4 Ų27.40%017%0.166CC..Hα-helixtrans-58.7-36.9173.3-43.10000112.6Q33 Y99 L133 S134 I139 F140Q33-S136 PolarHBondContact NE2-OG 2.92Å; Y99-S136 WeakPolarHBondContact OH-CA 3.38Å; Y99-S136 VanDerWaalsContact OH-CB 3.26Å; Y99-S136 WeakPolarHBondContact OH-CB 3.25Å; Y99-S136 PolarHBondContact OH-OG 2.98Å; Y99-S136 VanDerWaalsContact OH-OG 3.11Å; L133-S136 VanDerWaalsContact O-CB 3.27Å; L133-S136 WeakPolarHBondContact O-CB 3.27Å; L133-S136 PolarHBondContact O-N 2.91Å; L133-S136 PolarHBondContact O-OG 3.39Å; S134-S136 PolarHBondContact O-N 3.13Å; S134-S136 VanDerWaalsContact O-N 3.11Å; S136-I139 PolarHBondContact O-N 3.46Å; S136-F140 PolarHBondContact O-N 2.91Å
137A96.7Very high94.5Very high7 Ų726.5 Ų26.56%0.05816%0.159CC..Hα-helixtrans-65.9-41.4176.400000111S134 S135 F140 L141 T168 V171 I172S134-A137 WeakPolarHBondContact O-CB 3.42Å; S134-A137 PolarHBondContact O-N 3.28Å; S134-A137 VanDerWaalsContact O-N 3.14Å; S135-A137 VanDerWaalsContact C-N 3.25Å; S135-A137 PolarHBondContact O-N 2.84Å; A137-F140 PolarHBondContact O-N 3.5Å; A137-L141 WeakPolarHBondContact O-CB 3.38Å; A137-L141 PolarHBondContact O-N 3.29Å; A137-T168 HydrophobicContact CB-CG2 3.91Å; A137-V171 HydrophobicContact CB-CB 4.38Å; A137-V171 HydrophobicContact CB-CG1 3.98Å; A137-I172 HydrophobicContact CB-CD1 4.13Å; A137-I172 HydrophobicContact CB-CG1 3.47Å; A137-I172 VanDerWaalsContact CB-CG1 3.47Å
138L96.8Very high93.5Very high82 Ų8224.2 Ų24.243%0.42914%0.136SC..Hα-helixtrans-65.7-42.7175.218061.3000111.6S135 F140 L141 L142S135-L138 WeakPolarHBondContact O-CB 3.45Å; S135-L138 PolarHBondContact O-N 3.48Å; S135-L138 VanDerWaalsContact O-N 3.08Å; L138-F140 VanDerWaalsContact C-N 3.35Å; L138-F140 PolarHBondContact O-N 3.22Å; L138-L141 PolarHBondContact O-N 2.93Å; L138-L142 HydrophobicContact CD1-CD1 4Å; L138-L142 HydrophobicContact CD1-CG 4.06Å; L138-L142 HydrophobicContact CG-CD1 3.83Å; L138-L142 HydrophobicContact CG-CG 4.34Å; L138-L142 WeakPolarHBondContact O-CB 3.13Å; L138-L142 VanDerWaalsContact O-CG 3.25Å; L138-L142 WeakPolarHBondContact O-CG 3.4Å; L138-L142 PolarHBondContact O-N 3.29Å
139I97.6Very high92.4Very high0 Ų026 Ų260%014%0.14CC..Hα-helixtrans-59.5-46.8176.5-69.5161.3000110.2C26 C29 T30 Q33 W96 Y99 S135 S136 L142 L143C26-I139 PolarHBondContact SG-O 3.43Å; C29-I139 HydrophobicContact CB-CD1 4.43Å; C29-I139 HydrophobicContact CB-CG1 3.77Å; T30-I139 WeakPolarHBondContact OG1-CG2 3.17Å; Q33-I139 HydrophobicContact CB-CD1 4.21Å; W96-I139 HydrophobicContact CZ3-CG2 4.19Å; Y99-I139 HydrophobicContact CE2-CD1 4.08Å; S135-I139 VanDerWaalsContact O-CG1 3.32Å; S135-I139 WeakPolarHBondContact O-CG1 3.28Å; S135-I139 PolarHBondContact O-N 3.44Å; S136-I139 PolarHBondContact O-N 3.46Å; I139-L142 PolarHBondContact O-N 2.64Å; I139-L143 WeakPolarHBondContact O-CB 3.15Å; I139-L143 PolarHBondContact O-N 3.06Å
140F96.6Very high90.6Very high0 Ų029 Ų290%016%0.161CC..Hα-helixtrans-60.3-48.6176.5-171.9-100.7000111.8W96 S136 A137 L138 L142 L143 V144 L163 V167 P211 L215W96-F140 AromaticContact CD2-CD2 3.73Å; W96-F140 HydrophobicContact CD2-CD2 3.73Å; W96-F140 HydrophobicContact CD2-CE2 4.26Å; W96-F140 AromaticContact CE2-CD2 3.8Å; W96-F140 HydrophobicContact CE3-CB 4.36Å; W96-F140 AromaticContact CE3-CD2 3.66Å; W96-F140 HydrophobicContact CE3-CD2 3.66Å; W96-F140 HydrophobicContact CH2-CB 3.57Å; W96-F140 AromaticContact CH2-CD2 3.72Å; W96-F140 HydrophobicContact CH2-CD2 3.72Å; W96-F140 HydrophobicContact CH2-CG 4.05Å; W96-F140 HydrophobicContact CZ2-CB 4.39Å; W96-F140 AromaticContact CZ2-CD2 3.8Å; W96-F140 HydrophobicContact CZ2-CD2 3.8Å; W96-F140 HydrophobicContact CZ2-CG 4.42Å; W96-F140 HydrophobicContact CZ3-CB 3.56Å; W96-F140 AromaticContact CZ3-CD2 3.66Å; W96-F140 HydrophobicContact CZ3-CD2 3.66Å; W96-F140 HydrophobicContact CZ3-CG 4.1Å; S136-F140 PolarHBondContact O-N 2.91Å; A137-F140 PolarHBondContact O-N 3.5Å; L138-F140 VanDerWaalsContact C-N 3.35Å; L138-F140 PolarHBondContact O-N 3.22Å; F140-L142 PolarHBondContact O-N 3.18Å; F140-L143 WeakPolarHBondContact O-CB 3.39Å; F140-L143 PolarHBondContact O-N 3.39Å; F140-V144 HydrophobicContact CD1-CG2 4.03Å; F140-V144 HydrophobicContact CE1-CG2 3.52Å; F140-V144 HydrophobicContact CE2-CG2 4.32Å; F140-V144 HydrophobicContact CZ-CG2 3.7Å; F140-V144 WeakPolarHBondContact O-CG2 3.34Å; F140-V144 PolarHBondContact O-N 3.25Å; F140-L163 HydrophobicContact CE1-CB 4.49Å; F140-L163 WeakPolarHBondContact CE1-O 3.18Å; F140-V167 HydrophobicContact CD1-CB 4.37Å; F140-V167 HydrophobicContact CD1-CG1 4.12Å; F140-V167 HydrophobicContact CE1-CB 3.6Å; F140-V167 HydrophobicContact CE1-CG1 3.5Å; F140-V167 VanDerWaalsContact CE1-CG1 3.5Å; F140-V167 HydrophobicContact CE2-CG1 4.18Å; F140-V167 HydrophobicContact CZ-CB 3.97Å; F140-V167 HydrophobicContact CZ-CG1 3.53Å; F140-P211 HydrophobicContact CD2-CB 4.06Å; F140-P211 HydrophobicContact CE2-CB 3.38Å; F140-P211 HydrophobicContact CE2-CG 4.31Å; F140-P211 HydrophobicContact CZ-CB 3.88Å; F140-L215 HydrophobicContact CE2-CD1 4.04Å; F140-L215 HydrophobicContact CE2-CG 4.33Å
141L95.8Very high89.5Confident54 Ų5430.4 Ų30.428%0.28317%0.17SC..Hα-helixtrans-57.6-48.5178.7177.563.3000111.3A137 L138 L143 V144 L145 A164 T168A137-L141 WeakPolarHBondContact O-CB 3.38Å; A137-L141 PolarHBondContact O-N 3.29Å; L138-L141 PolarHBondContact O-N 2.93Å; L141-L143 VanDerWaalsContact C-N 3.32Å; L141-L143 PolarHBondContact O-N 3.35Å; L141-V144 PolarHBondContact O-N 3.43Å; L141-L145 HydrophobicContact CD1-CD1 4.14Å; L141-L145 HydrophobicContact CD1-CG 4.19Å; L141-L145 HydrophobicContact CG-CD1 3.99Å; L141-L145 HydrophobicContact CG-CG 4.41Å; L141-L145 WeakPolarHBondContact O-CB 3.49Å; L141-L145 VanDerWaalsContact O-CG 3.28Å; L141-L145 WeakPolarHBondContact O-CG 3.3Å; L141-L145 PolarHBondContact O-N 3.44Å; L141-A164 HydrophobicContact CD1-CB 3.76Å; L141-T168 HydrophobicContact CB-CG2 4.44Å
142L95.5Very high88.3Confident17 Ų1728.9 Ų28.99%0.08917%0.168CC..Hα-helixtrans-63.2-38.2178.5-69.9168.9000111.9A22 L25 C26 L138 I139 F140 L145 S146A22-L142 HydrophobicContact CB-CD2 4.45Å; L25-L142 HydrophobicContact CB-CD1 3.94Å; L25-L142 HydrophobicContact CB-CD2 4.16Å; L25-L142 HydrophobicContact CD1-CD2 4.48Å; C26-L142 HydrophobicContact CB-CB 3.69Å; L138-L142 HydrophobicContact CD1-CD1 4Å; L138-L142 HydrophobicContact CD1-CG 4.06Å; L138-L142 HydrophobicContact CG-CD1 3.83Å; L138-L142 HydrophobicContact CG-CG 4.34Å; L138-L142 WeakPolarHBondContact O-CB 3.13Å; L138-L142 VanDerWaalsContact O-CG 3.25Å; L138-L142 WeakPolarHBondContact O-CG 3.4Å; L138-L142 PolarHBondContact O-N 3.29Å; I139-L142 PolarHBondContact O-N 2.64Å; F140-L142 PolarHBondContact O-N 3.18Å; L142-L145 PolarHBondContact O-N 3.19Å; L142-S146 WeakPolarHBondContact O-CB 3.42Å; L142-S146 PolarHBondContact O-N 2.83Å
143L94.5Very high87.2Confident0 Ų036.5 Ų36.50%020%0.199CC..Hα-helixtrans-63.7-42.7174.5-175.663.8000111.3F23 F64 A92 W96 I139 F140 L141 S146 H147 L215F23-L143 HydrophobicContact CE2-CD1 4Å; F64-L143 HydrophobicContact CE1-CD1 4.34Å; A92-L143 HydrophobicContact CB-CD1 4.24Å; A92-L143 HydrophobicContact CB-CD2 4.48Å; A92-L143 HydrophobicContact CB-CG 4.35Å; W96-L143 HydrophobicContact CB-CD2 3.99Å; W96-L143 HydrophobicContact CE3-CD2 4.15Å; I139-L143 WeakPolarHBondContact O-CB 3.15Å; I139-L143 PolarHBondContact O-N 3.06Å; F140-L143 WeakPolarHBondContact O-CB 3.39Å; F140-L143 PolarHBondContact O-N 3.39Å; L141-L143 VanDerWaalsContact C-N 3.32Å; L141-L143 PolarHBondContact O-N 3.35Å; L143-S146 PolarHBondContact O-N 2.87Å; L143-S146 PolarHBondContact O-OG 3.43Å; L143-H147 PolarHBondContact O-CE1 3.33Å; L143-H147 PolarHBondContact O-ND1 3.39Å; L143-L215 HydrophobicContact CD2-CD1 4.15Å
144V91.7Very high86.2Confident4 Ų437 Ų372%0.02420%0.203CC..Hα-helixtrans-64.9-46.3175.6175.40000110.8F140 L141 S146 H147 L160 L163 A164F140-V144 HydrophobicContact CD1-CG2 4.03Å; F140-V144 HydrophobicContact CE1-CG2 3.52Å; F140-V144 HydrophobicContact CE2-CG2 4.32Å; F140-V144 HydrophobicContact CZ-CG2 3.7Å; F140-V144 WeakPolarHBondContact O-CG2 3.34Å; F140-V144 PolarHBondContact O-N 3.25Å; L141-V144 PolarHBondContact O-N 3.43Å; V144-S146 PolarHBondContact O-N 3.5Å; V144-H147 WeakPolarHBondContact O-CB 3.3Å; V144-H147 PolarHBondContact O-N 3.24Å; V144-H147 VanDerWaalsContact O-N 3.11Å; V144-H147 PolarHBondContact O-ND1 2.93Å; V144-L160 HydrophobicContact CG1-CB 4.45Å; V144-L160 HydrophobicContact CG1-CD2 3.89Å; V144-L160 WeakPolarHBondContact CG1-O 3.31Å; V144-L163 HydrophobicContact CG1-CB 4.28Å; V144-L163 HydrophobicContact CG2-CB 4.23Å; V144-A164 HydrophobicContact CG1-CB 3.96Å
145L90.5Very high85.2Confident59 Ų5940.4 Ų40.431%0.30922%0.224SC..Hα-helixtrans-63.9-22.5179.3-71177.2000113.9F18 A22 L141 L142 H147F18-L145 HydrophobicContact CE1-CB 4.42Å; A22-L145 HydrophobicContact CB-CB 4.18Å; L141-L145 HydrophobicContact CD1-CD1 4.14Å; L141-L145 HydrophobicContact CD1-CG 4.19Å; L141-L145 HydrophobicContact CG-CD1 3.99Å; L141-L145 HydrophobicContact CG-CG 4.41Å; L141-L145 WeakPolarHBondContact O-CB 3.49Å; L141-L145 VanDerWaalsContact O-CG 3.28Å; L141-L145 WeakPolarHBondContact O-CG 3.3Å; L141-L145 PolarHBondContact O-N 3.44Å; L142-L145 PolarHBondContact O-N 3.19Å; L145-H147 PolarHBondContact O-N 3.44Å
146S90Very high84.3Confident0 Ų041.5 Ų41.50%022%0.224CC..THydrogen-bonded Turntrans-72.6-7.9175.6710000114.2F23 N88 I89 L142 L143 V144F23-S146 WeakPolarHBondContact CD2-OG 3.27Å; N88-S146 PolarHBondContact ND2-O 2.99Å; N88-S146 PolarHBondContact OD1-O 3.48Å; N88-S146 VanDerWaalsContact OD1-O 3.13Å; I89-S146 VanDerWaalsContact CD1-O 3.31Å; I89-S146 WeakPolarHBondContact CD1-O 3.36Å; I89-S146 WeakPolarHBondContact CD1-OG 3.32Å; L142-S146 WeakPolarHBondContact O-CB 3.42Å; L142-S146 PolarHBondContact O-N 2.83Å; L143-S146 PolarHBondContact O-N 2.87Å; L143-S146 PolarHBondContact O-OG 3.43Å; V144-S146 PolarHBondContact O-N 3.5Å
147H84.7Confident83.6Confident3 Ų342.7 Ų42.71%0.01423%0.229CC..SBendtrans-77.4136.9178.7-72.675000112.9N88 I89 A92 L143 V144 L145 L160N88-H147 WeakPolarHBondContact OD1-CA 3.49Å; I89-H147 PolarHBondContact O-NE2 3.37Å; A92-H147 VanDerWaalsContact CB-CE1 3.4Å; A92-H147 WeakPolarHBondContact CB-CE1 3.39Å; A92-H147 WeakPolarHBondContact CB-NE2 3.41Å; L143-H147 PolarHBondContact O-CE1 3.33Å; L143-H147 PolarHBondContact O-ND1 3.39Å; V144-H147 WeakPolarHBondContact O-CB 3.3Å; V144-H147 PolarHBondContact O-N 3.24Å; V144-H147 VanDerWaalsContact O-N 3.11Å; V144-H147 PolarHBondContact O-ND1 2.93Å; L145-H147 PolarHBondContact O-N 3.44Å; H147-L160 HydrophobicContact CB-CD1 4.18Å; H147-L160 HydrophobicContact CB-CD2 4.08Å
148H71.7Confident82.8Confident1 Ų147.6 Ų47.61%0.00525%0.254CS..  trans-69.3133.1176.9-167.863.6000114.9Q15 E19 Y74 N88 R156Q15-H148 PolarHBondContact NE2-CE1 3.46Å; Q15-H148 PolarHBondContact NE2-ND1 3.11Å; E19-H148 VanDerWaalsContact CD-CA 3.44Å; E19-H148 VanDerWaalsContact OE1-CA 3.28Å; E19-H148 WeakPolarHBondContact OE1-CA 3.17Å; E19-H148 IonicContact OE1-CE1 3.82Å; E19-H148 IonicContact OE1-CG 3.75Å; E19-H148 IonicContact OE1-ND1 2.62Å; E19-H148 PolarHBondContact OE1-ND1 2.71Å; E19-H148 WeakPolarHBondContact OE2-CA 3.36Å; E19-H148 WeakPolarHBondContact OE2-CB 3.41Å; E19-H148 IonicContact OE2-CG 2.67Å; E19-H148 IonicContact OE2-ND1 3.4Å; E19-H148 PolarHBondContact OE2-ND1 2.87Å; Y74-H148 HydrophobicContact CE1-CB 4.28Å; N88-H148 HydrophobicContact CB-CB 3.95Å; N88-H148 PolarHBondContact OD1-N 2.87Å; N88-H148 VanDerWaalsContact OD1-N 3.16Å; H148-R156 VanDerWaalsContact O-CZ 3.31Å; H148-R156 PolarHBondContact O-NH1 3.37Å; H148-R156 PolarHBondContact O-NH2 3.07Å
149F69.7Low82.2Confident57 Ų5745.3 Ų45.325%0.2524%0.239CC..  trans-148.3124.3174.166-89.5000114.1Q15 Q157Q15-F149 VanDerWaalsContact NE2-C 3.32Å; Q15-F149 VanDerWaalsContact NE2-N 3.16Å; Q15-F149 PolarHBondContact NE2-O 3.16Å; Q15-F149 PolarHBondContact OE1-O 3.27Å; F149-Q157 VanDerWaalsContact CD1-OE1 3.31Å; F149-Q157 VanDerWaalsContact CD2-CD 3.44Å; F149-Q157 HydrophobicContact CD2-CG 4.21Å; F149-Q157 VanDerWaalsContact CD2-OE1 3.26Å
150S58.1Low81.7Confident62 Ų6245.7 Ų45.743%0.43424%0.241SC..SBendtrans-94.9-26.6178.4-42.40000113.4D85D85-S150 PolarHBondContact OD1-N 2.88Å
151N70.7Confident81.2Confident76 Ų7648.6 Ų48.641%0.40626%0.262SS..  trans-117.4113.6-171.7-173.5-13.3000112.4K153 S154N151-K153 PolarHBondContact O-N 2.86Å; N151-K153 PolarHBondContact OD1-N 2.95Å; N151-S154 WeakPolarHBondContact O-CB 3.41Å; N151-S154 PolarHBondContact O-N 3.16Å; N151-S154 VanDerWaalsContact O-N 3.09Å; N151-S154 PolarHBondContact O-OG 3.23Å
152P69.8Low80.7Confident96 Ų9650.1 Ų50.162%0.62326%0.264SS*.THydrogen-bonded Turntrans-66.2-20.5-179.125.3-33000114
153K72.7Confident80.4Confident178 Ų17849.3 Ų49.377%0.77426%0.26SS*.THydrogen-bonded Turntrans-92.30.1177.6-62.5-176.2179.4-179.60113N151N151-K153 PolarHBondContact O-N 2.86Å; N151-K153 PolarHBondContact OD1-N 2.95Å
154S75.9Confident80.2Confident12 Ų1250.3 Ų50.38%0.08427%0.268CS..SBendtrans-65.6142.1178.6660000110.3N151 R156 Q157 I158N151-S154 WeakPolarHBondContact O-CB 3.41Å; N151-S154 PolarHBondContact O-N 3.16Å; N151-S154 VanDerWaalsContact O-N 3.09Å; N151-S154 PolarHBondContact O-OG 3.23Å; S154-R156 PolarHBondContact O-N 2.92Å; S154-R156 VanDerWaalsContact O-N 3.12Å; S154-Q157 PolarHBondContact O-N 3.32Å; S154-Q157 WeakPolarHBondContact OG-CB 3.39Å; S154-Q157 PolarHBondContact OG-N 3.45Å; S154-Q157 VanDerWaalsContact OG-N 3.07Å; S154-I158 PolarHBondContact O-N 3Å; S154-I158 VanDerWaalsContact O-N 3.15Å
155P76.4Confident80.2Confident112 Ų11253.4 Ų53.473%0.72729%0.29SS*.Hα-helixtrans-53.6-32.8172.6-2734.7000112.5I158 Y159P155-I158 PolarHBondContact O-N 3.04Å; P155-Y159 WeakPolarHBondContact O-CB 3.41Å; P155-Y159 PolarHBondContact O-N 2.68Å
156R78Confident80.1Confident51 Ų5152 Ų5219%0.19229%0.285CS..Hα-helixtrans-64.8-44175.7-177.2174.8169.4-137.8-24.3112.3D85 S87 H148 S154 I158 Y159 L160 L218D85-R156 PolarHBondContact O-NH1 2.99Å; S87-R156 VanDerWaalsContact CB-CZ 3.5Å; H148-R156 VanDerWaalsContact O-CZ 3.31Å; H148-R156 PolarHBondContact O-NH1 3.37Å; H148-R156 PolarHBondContact O-NH2 3.07Å; S154-R156 PolarHBondContact O-N 2.92Å; S154-R156 VanDerWaalsContact O-N 3.12Å; R156-I158 VanDerWaalsContact C-N 3.35Å; R156-Y159 PolarHBondContact O-N 3.25Å; R156-L160 HydrophobicContact CG-CD1 4.45Å; R156-L160 WeakPolarHBondContact O-CG 3.36Å; R156-L160 PolarHBondContact O-N 3.2Å; R156-L218 HydrophobicContact CG-CD1 3.98Å
157Q81.4Confident80Confident25 Ų2552 Ų5212%0.11729%0.285CS..Hα-helixtrans-66-40.8178-175.662.69.900111.6F149 S154 Y159 L160 S161F149-Q157 VanDerWaalsContact CD1-OE1 3.31Å; F149-Q157 VanDerWaalsContact CD2-CD 3.44Å; F149-Q157 HydrophobicContact CD2-CG 4.21Å; F149-Q157 VanDerWaalsContact CD2-OE1 3.26Å; S154-Q157 PolarHBondContact O-N 3.32Å; S154-Q157 WeakPolarHBondContact OG-CB 3.39Å; S154-Q157 PolarHBondContact OG-N 3.45Å; S154-Q157 VanDerWaalsContact OG-N 3.07Å; Q157-Y159 PolarHBondContact O-N 3.46Å; Q157-L160 PolarHBondContact O-N 3.44Å; Q157-S161 PolarHBondContact O-N 3.17Å; Q157-S161 PolarHBondContact O-OG 2.95Å
158I80.8Confident80.4Confident110 Ų11052.7 Ų52.756%0.56429%0.289SS*.Hα-helixtrans-57.8-43.7174.5-66.2166.4000110S154 P155 R156 S161 Y162S154-I158 PolarHBondContact O-N 3Å; S154-I158 VanDerWaalsContact O-N 3.15Å; P155-I158 PolarHBondContact O-N 3.04Å; R156-I158 VanDerWaalsContact C-N 3.35Å; I158-S161 PolarHBondContact O-N 3.07Å; I158-Y162 PolarHBondContact O-N 3.37Å
159Y84Confident81.4Confident34 Ų3456.1 Ų56.113%0.13331%0.307CS..Hα-helixtrans-66-41.1176.2-174.5-114.4000112.7P155 R156 Q157 S161 Y162 L163 C214 K217 L218P155-Y159 WeakPolarHBondContact O-CB 3.41Å; P155-Y159 PolarHBondContact O-N 2.68Å; R156-Y159 PolarHBondContact O-N 3.25Å; Q157-Y159 PolarHBondContact O-N 3.46Å; Y159-S161 VanDerWaalsContact C-N 3.35Å; Y159-S161 PolarHBondContact O-N 3.22Å; Y159-Y162 HydrophobicContact CD2-CD1 4.12Å; Y159-Y162 HydrophobicContact CE2-CD1 4.12Å; Y159-Y162 HydrophobicContact CE2-CE1 4.44Å; Y159-Y162 WeakPolarHBondContact O-CB 3.43Å; Y159-Y162 PolarHBondContact O-N 2.95Å; Y159-L163 HydrophobicContact CD1-CD1 4.09Å; Y159-L163 HydrophobicContact CD1-CG 4.37Å; Y159-L163 HydrophobicContact CE1-CD1 3.7Å; Y159-L163 HydrophobicContact CE1-CD2 4.32Å; Y159-L163 HydrophobicContact CE1-CG 4.1Å; Y159-L163 HydrophobicContact CE2-CD2 4.25Å; Y159-L163 HydrophobicContact CE2-CG 4.5Å; Y159-L163 WeakPolarHBondContact O-CG 3.26Å; Y159-L163 PolarHBondContact O-N 3.49Å; Y159-C214 WeakPolarHBondContact OH-CA 3.43Å; Y159-C214 PolarHBondContact OH-O 3.2Å; Y159-C214 PolarHBondContact OH-SG 3.17Å; Y159-K217 HydrophobicContact CE1-CD 4.24Å; Y159-K217 HydrophobicContact CE2-CD 4.15Å; Y159-K217 WeakPolarHBondContact OH-CD 3.45Å; Y159-L218 HydrophobicContact CD1-CD1 3.85Å; Y159-L218 HydrophobicContact CE1-CB 4.16Å; Y159-L218 HydrophobicContact CE1-CD1 4.24Å
160L86.2Confident82.4Confident8 Ų853.5 Ų53.54%0.04230%0.295CS..Hα-helixtrans-60.7-42.4173.5-76.3170.5000112V144 H147 R156 Q157 Y162 L163 A164 L218V144-L160 HydrophobicContact CG1-CB 4.45Å; V144-L160 HydrophobicContact CG1-CD2 3.89Å; V144-L160 WeakPolarHBondContact CG1-O 3.31Å; H147-L160 HydrophobicContact CB-CD1 4.18Å; H147-L160 HydrophobicContact CB-CD2 4.08Å; R156-L160 HydrophobicContact CG-CD1 4.45Å; R156-L160 WeakPolarHBondContact O-CG 3.36Å; R156-L160 PolarHBondContact O-N 3.2Å; Q157-L160 PolarHBondContact O-N 3.44Å; L160-Y162 VanDerWaalsContact C-N 3.34Å; L160-L163 PolarHBondContact O-N 3.45Å; L160-A164 WeakPolarHBondContact O-CB 3.28Å; L160-A164 PolarHBondContact O-N 3.13Å; L160-L218 HydrophobicContact CD2-CD1 4.14Å; L160-L218 HydrophobicContact CD2-CD2 3.67Å; L160-L218 HydrophobicContact CG-CD1 4.31Å
161S86.9Confident84.1Confident61 Ų6150.6 Ų50.643%0.42728%0.275SS..Hα-helixtrans-64.1-38.2174.9-63.10000112.4Q157 I158 Y159 S165Q157-S161 PolarHBondContact O-N 3.17Å; Q157-S161 PolarHBondContact O-OG 2.95Å; I158-S161 PolarHBondContact O-N 3.07Å; Y159-S161 VanDerWaalsContact C-N 3.35Å; Y159-S161 PolarHBondContact O-N 3.22Å; S161-S165 WeakPolarHBondContact O-CB 3.44Å; S161-S165 PolarHBondContact O-N 3.45Å; S161-S165 VanDerWaalsContact O-N 3.11Å; S161-S165 PolarHBondContact O-OG 3.24Å
162Y86.4Confident85.2Confident86 Ų8650 Ų5034%0.33727%0.271SS..Hα-helixtrans-61.3-48.2171.2166.8-96.9000111.5I158 Y159 L160 A164 S165 T166I158-Y162 PolarHBondContact O-N 3.37Å; Y159-Y162 HydrophobicContact CD2-CD1 4.12Å; Y159-Y162 HydrophobicContact CE2-CD1 4.12Å; Y159-Y162 HydrophobicContact CE2-CE1 4.44Å; Y159-Y162 WeakPolarHBondContact O-CB 3.43Å; Y159-Y162 PolarHBondContact O-N 2.95Å; L160-Y162 VanDerWaalsContact C-N 3.34Å; Y162-A164 PolarHBondContact O-N 3.04Å; Y162-S165 PolarHBondContact O-N 2.93Å; Y162-S165 PolarHBondContact O-OG 2.83Å; Y162-T166 WeakPolarHBondContact CD2-OG1 3.41Å; Y162-T166 HydrophobicContact CE2-CG2 3.82Å; Y162-T166 WeakPolarHBondContact CE2-OG1 3.35Å; Y162-T166 WeakPolarHBondContact O-CB 3.42Å; Y162-T166 PolarHBondContact O-N 3.34Å
163L88.8Confident86.3Confident0 Ų045.5 Ų45.50%024%0.242CC..Iπ-helixtrans-59-49.8176.3-66.1-177.3000111.2F140 V144 Y159 L160 S165 V167 C214 L215F140-L163 HydrophobicContact CE1-CB 4.49Å; F140-L163 WeakPolarHBondContact CE1-O 3.18Å; V144-L163 HydrophobicContact CG1-CB 4.28Å; V144-L163 HydrophobicContact CG2-CB 4.23Å; Y159-L163 HydrophobicContact CD1-CD1 4.09Å; Y159-L163 HydrophobicContact CD1-CG 4.37Å; Y159-L163 HydrophobicContact CE1-CD1 3.7Å; Y159-L163 HydrophobicContact CE1-CD2 4.32Å; Y159-L163 HydrophobicContact CE1-CG 4.1Å; Y159-L163 HydrophobicContact CE2-CD2 4.25Å; Y159-L163 HydrophobicContact CE2-CG 4.5Å; Y159-L163 WeakPolarHBondContact O-CG 3.26Å; Y159-L163 PolarHBondContact O-N 3.49Å; L160-L163 PolarHBondContact O-N 3.45Å; L163-S165 PolarHBondContact O-N 3.12Å; L163-V167 HydrophobicContact CD2-CG2 3.82Å; L163-V167 VanDerWaalsContact O-CB 3.31Å; L163-V167 WeakPolarHBondContact O-CB 3.45Å; L163-V167 PolarHBondContact O-N 3.3Å; L163-C214 HydrophobicContact CD2-CB 3.46Å; L163-C214 VanDerWaalsContact CD2-CB 3.46Å; L163-C214 WeakPolarHBondContact CD2-SG 3.49Å; L163-L215 HydrophobicContact CD1-CD2 4.34Å
164A90.7Very high87.4Confident21 Ų2137 Ų3717%0.17421%0.205CC..Iπ-helixtrans-59.6-30-178.400000113.3L141 V144 L160 Y162 T168L141-A164 HydrophobicContact CD1-CB 3.76Å; V144-A164 HydrophobicContact CG1-CB 3.96Å; L160-A164 WeakPolarHBondContact O-CB 3.28Å; L160-A164 PolarHBondContact O-N 3.13Å; Y162-A164 PolarHBondContact O-N 3.04Å; A164-T168 WeakPolarHBondContact O-CB 3.29Å; A164-T168 PolarHBondContact O-OG1 3.4Å
165S90.2Very high88.2Confident69 Ų6936.6 Ų36.648%0.48320%0.202SC..Iπ-helixtrans-95.6-67.2-179.1530000111.9S161 Y162 L163 L169S161-S165 WeakPolarHBondContact O-CB 3.44Å; S161-S165 PolarHBondContact O-N 3.45Å; S161-S165 VanDerWaalsContact O-N 3.11Å; S161-S165 PolarHBondContact O-OG 3.24Å; Y162-S165 PolarHBondContact O-N 2.93Å; Y162-S165 PolarHBondContact O-OG 2.83Å; L163-S165 PolarHBondContact O-N 3.12Å; S165-L169 WeakPolarHBondContact O-CB 3.31Å; S165-L169 PolarHBondContact O-N 2.8Å
166T88Confident89Confident31 Ų3132.3 Ų32.319%0.1917%0.173CC..Iπ-helixtrans-62.3-49.7-172.6-57.50000111.9Y162 L169 D170 M276Y162-T166 WeakPolarHBondContact CD2-OG1 3.41Å; Y162-T166 HydrophobicContact CE2-CG2 3.82Å; Y162-T166 WeakPolarHBondContact CE2-OG1 3.35Å; Y162-T166 WeakPolarHBondContact O-CB 3.42Å; Y162-T166 PolarHBondContact O-N 3.34Å; T166-L169 WeakPolarHBondContact O-CB 3.03Å; T166-L169 PolarHBondContact O-N 3.44Å; T166-L169 VanDerWaalsContact O-N 3.16Å; T166-D170 PolarHBondContact O-N 3.43Å; T166-M276 HydrophobicContact CG2-CE 3.96Å
167V89.7Confident89.7Confident0 Ų029.9 Ų29.90%016%0.164CC..Iπ-helixtrans-71.4-37.4-175.3-178.90000111.3F140 L163 L169 D170 V171 P211F140-V167 HydrophobicContact CD1-CB 4.37Å; F140-V167 HydrophobicContact CD1-CG1 4.12Å; F140-V167 HydrophobicContact CE1-CB 3.6Å; F140-V167 HydrophobicContact CE1-CG1 3.5Å; F140-V167 VanDerWaalsContact CE1-CG1 3.5Å; F140-V167 HydrophobicContact CE2-CG1 4.18Å; F140-V167 HydrophobicContact CZ-CB 3.97Å; F140-V167 HydrophobicContact CZ-CG1 3.53Å; L163-V167 HydrophobicContact CD2-CG2 3.82Å; L163-V167 VanDerWaalsContact O-CB 3.31Å; L163-V167 WeakPolarHBondContact O-CB 3.45Å; L163-V167 PolarHBondContact O-N 3.3Å; V167-L169 VanDerWaalsContact C-N 3.27Å; V167-L169 PolarHBondContact O-N 3.44Å; V167-D170 PolarHBondContact O-N 2.99Å; V167-V171 WeakPolarHBondContact O-CG2 3.46Å; V167-V171 PolarHBondContact O-N 2.9Å; V167-P211 HydrophobicContact CG1-CB 3.65Å; V167-P211 HydrophobicContact CG1-CG 3.47Å; V167-P211 VanDerWaalsContact CG1-CG 3.47Å
168T93.2Very high90.2Very high16 Ų1628.7 Ų28.710%0.09816%0.159CC..Hα-helixtrans-58.2-42.1171.2-56.80000111.2A137 L141 A164 V171 I172A137-T168 HydrophobicContact CB-CG2 3.91Å; L141-T168 HydrophobicContact CB-CG2 4.44Å; A164-T168 WeakPolarHBondContact O-CB 3.29Å; A164-T168 PolarHBondContact O-OG1 3.4Å; T168-V171 PolarHBondContact O-N 2.61Å; T168-I172 HydrophobicContact CG2-CD1 4.42Å; T168-I172 WeakPolarHBondContact O-CG1 3.33Å; T168-I172 PolarHBondContact O-N 2.62Å
169L91.5Very high90.7Very high74 Ų7426.6 Ų26.639%0.38715%0.145SC..Hα-helixtrans-63.9-41.6176.7-162.4157.3000111.3S165 T166 V167 V171 I172 D173 F269 K272S165-L169 WeakPolarHBondContact O-CB 3.31Å; S165-L169 PolarHBondContact O-N 2.8Å; T166-L169 WeakPolarHBondContact O-CB 3.03Å; T166-L169 PolarHBondContact O-N 3.44Å; T166-L169 VanDerWaalsContact O-N 3.16Å; V167-L169 VanDerWaalsContact C-N 3.27Å; V167-L169 PolarHBondContact O-N 3.44Å; L169-V171 VanDerWaalsContact C-N 3.31Å; L169-V171 PolarHBondContact O-N 3.04Å; L169-I172 PolarHBondContact O-N 3.47Å; L169-D173 WeakPolarHBondContact O-CB 3.4Å; L169-D173 PolarHBondContact O-N 2.94Å; L169-F269 HydrophobicContact CD2-CE1 4.3Å; L169-K272 HydrophobicContact CD2-CD 3.89Å; L169-K272 VanDerWaalsContact CD2-CE 3.42Å; L169-K272 HydrophobicContact CD2-CG 3.59Å
170D91.1Very high91Very high2 Ų225.4 Ų25.41%0.01114%0.141CC..Hα-helixtrans-64.1-35.1175.9-67-37.2000112.8T166 V167 D173 S174 N207 Y240 K272T166-D170 PolarHBondContact O-N 3.43Å; V167-D170 PolarHBondContact O-N 2.99Å; D170-D173 WeakPolarHBondContact O-CB 3.33Å; D170-D173 PolarHBondContact O-N 3.01Å; D170-S174 PolarHBondContact O-N 3.25Å; D170-S174 PolarHBondContact O-OG 2.96Å; D170-N207 PolarHBondContact O-ND2 2.95Å; D170-N207 VanDerWaalsContact O-ND2 3.09Å; D170-Y240 HydrophobicContact CB-CE1 3.94Å; D170-Y240 WeakPolarHBondContact OD2-CE1 3.47Å; D170-K272 WeakPolarHBondContact OD1-CE 2.98Å; D170-K272 IonicContact OD1-NZ 2.7Å; D170-K272 PolarHBondContact OD1-NZ 3.26Å
171V93.7Very high91.2Very high1 Ų125.2 Ų25.21%0.00614%0.14CC..Hα-helixtrans-63.3-49.3172.2172.70000110W96 A137 V167 T168 L169 D173 S174 I175 F208 P211W96-V171 HydrophobicContact CZ2-CG2 4.42Å; A137-V171 HydrophobicContact CB-CB 4.38Å; A137-V171 HydrophobicContact CB-CG1 3.98Å; V167-V171 WeakPolarHBondContact O-CG2 3.46Å; V167-V171 PolarHBondContact O-N 2.9Å; T168-V171 PolarHBondContact O-N 2.61Å; L169-V171 VanDerWaalsContact C-N 3.31Å; L169-V171 PolarHBondContact O-N 3.04Å; V171-D173 VanDerWaalsContact C-N 3.28Å; V171-D173 PolarHBondContact O-N 3.4Å; V171-S174 VanDerWaalsContact O-CB 3.3Å; V171-S174 WeakPolarHBondContact O-CB 3.46Å; V171-S174 PolarHBondContact O-N 3.48Å; V171-S174 VanDerWaalsContact O-N 3.08Å; V171-I175 HydrophobicContact CG1-CD1 4.12Å; V171-I175 WeakPolarHBondContact O-CD1 3.48Å; V171-I175 PolarHBondContact O-N 2.98Å; V171-F208 HydrophobicContact CG1-CD1 4.18Å; V171-F208 HydrophobicContact CG1-CE1 3.69Å; V171-P211 HydrophobicContact CG2-CG 4.5Å
172I94.3Very high91.4Very high64 Ų6422.8 Ų22.833%0.32812%0.122SC..Hα-helixtrans-57.3-43.7176.1-62.6169000110.8A137 T168 L169 S174 I175 V176 F269A137-I172 HydrophobicContact CB-CD1 4.13Å; A137-I172 HydrophobicContact CB-CG1 3.47Å; A137-I172 VanDerWaalsContact CB-CG1 3.47Å; T168-I172 HydrophobicContact CG2-CD1 4.42Å; T168-I172 WeakPolarHBondContact O-CG1 3.33Å; T168-I172 PolarHBondContact O-N 2.62Å; L169-I172 PolarHBondContact O-N 3.47Å; I172-S174 PolarHBondContact O-N 3.43Å; I172-I175 WeakPolarHBondContact O-CB 3.26Å; I172-I175 PolarHBondContact O-N 3.19Å; I172-V176 PolarHBondContact O-N 2.54Å; I172-F269 HydrophobicContact CB-CZ 4.48Å; I172-F269 HydrophobicContact CG2-CE1 4.05Å; I172-F269 HydrophobicContact CG2-CZ 3.56Å
173D93.1Very high91.3Very high0 Ų020.1 Ų20.10%011%0.114CC..Hα-helixtrans-58.7-37.6178.2-170.821000112L169 D170 V171 V176 F177 R252 F269 K272 N273L169-D173 WeakPolarHBondContact O-CB 3.4Å; L169-D173 PolarHBondContact O-N 2.94Å; D170-D173 WeakPolarHBondContact O-CB 3.33Å; D170-D173 PolarHBondContact O-N 3.01Å; V171-D173 VanDerWaalsContact C-N 3.28Å; V171-D173 PolarHBondContact O-N 3.4Å; D173-V176 PolarHBondContact O-N 3.39Å; D173-F177 VanDerWaalsContact O-CB 3.27Å; D173-F177 WeakPolarHBondContact O-CB 3.21Å; D173-F177 PolarHBondContact O-N 3.11Å; D173-R252 PolarHBondContact O-NH2 2.94Å; D173-R252 VanDerWaalsContact O-NH2 3.09Å; D173-R252 IonicContact OD1-CZ 3.12Å; D173-R252 IonicContact OD1-NH1 2.73Å; D173-R252 PolarHBondContact OD1-NH1 3.21Å; D173-R252 IonicContact OD1-NH2 2.64Å; D173-R252 PolarHBondContact OD1-NH2 3.2Å; D173-R252 IonicContact OD2-NH1 3.8Å; D173-F269 HydrophobicContact CB-CD1 3.63Å; D173-F269 HydrophobicContact CB-CE1 3.9Å; D173-F269 WeakPolarHBondContact OD1-CB 3.4Å; D173-F269 VanDerWaalsContact OD1-CD1 3.24Å; D173-F269 WeakPolarHBondContact OD1-CD1 3.32Å; D173-K272 IonicContact OD2-NZ 2.81Å; D173-K272 PolarHBondContact OD2-NZ 2.89Å; D173-N273 PolarHBondContact OD2-OD1 3.28Å
174S94.4Very high90.9Very high0 Ų024.5 Ų24.50%014%0.142CC..Hα-helixtrans-65-37.2174.6-51.50000112.7D170 V171 I172 F177 L178 N207D170-S174 PolarHBondContact O-N 3.25Å; D170-S174 PolarHBondContact O-OG 2.96Å; V171-S174 VanDerWaalsContact O-CB 3.3Å; V171-S174 WeakPolarHBondContact O-CB 3.46Å; V171-S174 PolarHBondContact O-N 3.48Å; V171-S174 VanDerWaalsContact O-N 3.08Å; I172-S174 PolarHBondContact O-N 3.43Å; S174-F177 WeakPolarHBondContact O-CB 3.38Å; S174-F177 PolarHBondContact O-N 2.67Å; S174-L178 WeakPolarHBondContact O-CG 3.39Å; S174-L178 PolarHBondContact O-N 2.96Å; S174-N207 PolarHBondContact OG-ND2 3.35Å
175I94.1Very high90.4Very high4 Ų427.6 Ų27.62%0.02116%0.155CC..Hα-helixtrans-69.3-44.1177.8-62142.7000110.1E130 L133 V171 I172 F177 L178 K179 F208E130-I175 HydrophobicContact CG-CG2 4.41Å; L133-I175 HydrophobicContact CB-CG1 4.27Å; L133-I175 HydrophobicContact CB-CG2 4.1Å; L133-I175 WeakPolarHBondContact O-CD1 3.34Å; V171-I175 HydrophobicContact CG1-CD1 4.12Å; V171-I175 WeakPolarHBondContact O-CD1 3.48Å; V171-I175 PolarHBondContact O-N 2.98Å; I172-I175 WeakPolarHBondContact O-CB 3.26Å; I172-I175 PolarHBondContact O-N 3.19Å; I175-F177 PolarHBondContact O-N 3.15Å; I175-L178 WeakPolarHBondContact O-CB 3.47Å; I175-L178 PolarHBondContact O-N 3.2Å; I175-K179 PolarHBondContact O-N 2.95Å; I175-F208 HydrophobicContact CG1-CZ 3.97Å
176V92Very high90.1Very high22 Ų2224.8 Ų24.813%0.13313%0.134CC..Hα-helixtrans-65.8-31.6174.7177.20000111.2I172 D173 K179 F269I172-V176 PolarHBondContact O-N 2.54Å; D173-V176 PolarHBondContact O-N 3.39Å; V176-K179 VanDerWaalsContact O-CB 3.27Å; V176-K179 WeakPolarHBondContact O-CB 3.39Å; V176-K179 PolarHBondContact O-N 3Å; V176-F269 HydrophobicContact CB-CD2 4.03Å; V176-F269 HydrophobicContact CB-CE2 4.16Å; V176-F269 HydrophobicContact CB-CG 4.47Å; V176-F269 HydrophobicContact CG1-CD2 3.74Å; V176-F269 HydrophobicContact CG1-CE2 4.23Å; V176-F269 HydrophobicContact CG1-CG 4.34Å; V176-F269 HydrophobicContact CG2-CD2 3.97Å; V176-F269 HydrophobicContact CG2-CE2 3.59Å; V176-F269 HydrophobicContact CG2-CZ 4.06Å
177F92.4Very high89.7Confident0 Ų026 Ų260%014%0.135CC..Hα-helixtrans-66.5-43.5171.7-168.6-123.5000112.1D173 S174 I175 K179 L180 I200 L203 A204 F248 I251 R252D173-F177 VanDerWaalsContact O-CB 3.27Å; D173-F177 WeakPolarHBondContact O-CB 3.21Å; D173-F177 PolarHBondContact O-N 3.11Å; S174-F177 WeakPolarHBondContact O-CB 3.38Å; S174-F177 PolarHBondContact O-N 2.67Å; I175-F177 PolarHBondContact O-N 3.15Å; F177-K179 PolarHBondContact O-N 3.39Å; F177-L180 HydrophobicContact CD2-CD1 3.67Å; F177-L180 HydrophobicContact CE2-CD1 3.74Å; F177-L180 VanDerWaalsContact O-CB 3.26Å; F177-L180 WeakPolarHBondContact O-CB 3.34Å; F177-L180 WeakPolarHBondContact O-CG 3.32Å; F177-L180 PolarHBondContact O-N 3.45Å; F177-L180 VanDerWaalsContact O-N 3.17Å; F177-I200 HydrophobicContact CD1-CG2 3.91Å; F177-I200 HydrophobicContact CE1-CB 4.01Å; F177-I200 HydrophobicContact CE1-CG1 4.01Å; F177-I200 HydrophobicContact CE1-CG2 3.69Å; F177-I200 HydrophobicContact CE2-CG1 4.46Å; F177-I200 HydrophobicContact CZ-CB 4.27Å; F177-I200 HydrophobicContact CZ-CG1 3.74Å; F177-I200 HydrophobicContact CZ-CG2 4.18Å; F177-L203 HydrophobicContact CE1-CB 4.27Å; F177-A204 HydrophobicContact CD1-CB 4.39Å; F177-F248 HydrophobicContact CB-CD2 3.9Å; F177-F248 HydrophobicContact CB-CE2 3.69Å; F177-F248 HydrophobicContact CB-CZ 4.21Å; F177-F248 AromaticContact CD1-CD1 3.87Å; F177-F248 HydrophobicContact CD1-CD1 3.87Å; F177-F248 HydrophobicContact CD1-CD2 4.17Å; F177-F248 AromaticContact CD1-CE1 3.62Å; F177-F248 HydrophobicContact CD1-CE1 3.62Å; F177-F248 AromaticContact CD1-CE2 3.93Å; F177-F248 HydrophobicContact CD1-CE2 3.93Å; F177-F248 HydrophobicContact CD1-CG 4.14Å; F177-F248 AromaticContact CD1-CZ 3.64Å; F177-F248 HydrophobicContact CD1-CZ 3.64Å; F177-F248 HydrophobicContact CD2-CB 4.33Å; F177-F248 HydrophobicContact CD2-CD1 4.45Å; F177-F248 HydrophobicContact CD2-CD2 4.13Å; F177-F248 HydrophobicContact CD2-CG 4.04Å; F177-F248 AromaticContact CE1-CD1 3.75Å; F177-F248 HydrophobicContact CE1-CD1 3.75Å; F177-F248 AromaticContact CE1-CE1 3.73Å; F177-F248 HydrophobicContact CE1-CE1 3.73Å; F177-F248 HydrophobicContact CE1-CG 4.28Å; F177-F248 HydrophobicContact CE1-CZ 4.24Å; F177-F248 HydrophobicContact CE2-CB 4.31Å; F177-F248 HydrophobicContact CE2-CD1 4.37Å; F177-F248 HydrophobicContact CE2-CG 4.22Å; F177-F248 HydrophobicContact CG-CD1 4.23Å; F177-F248 AromaticContact CG-CD2 3.82Å; F177-F248 HydrophobicContact CG-CD2 3.82Å; F177-F248 HydrophobicContact CG-CE1 4.26Å; F177-F248 AromaticContact CG-CE2 3.85Å; F177-F248 HydrophobicContact CG-CE2 3.85Å; F177-F248 HydrophobicContact CG-CG 4.01Å; F177-F248 HydrophobicContact CG-CZ 4.07Å; F177-F248 HydrophobicContact CZ-CD1 4.02Å; F177-F248 HydrophobicContact CZ-CE1 4.46Å; F177-F248 HydrophobicContact CZ-CG 4.33Å; F177-I251 HydrophobicContact CE2-CB 3.88Å; F177-I251 HydrophobicContact CE2-CG2 3.65Å; F177-I251 HydrophobicContact CZ-CB 3.93Å; F177-I251 HydrophobicContact CZ-CD1 3.72Å; F177-I251 HydrophobicContact CZ-CG1 4.42Å; F177-I251 HydrophobicContact CZ-CG2 3.75Å; F177-R252 HydrophobicContact CD2-CG 4.38Å; F177-R252 HydrophobicContact CE2-CG 4.49Å
178L93.8Very high89.2Confident0 Ų033.2 Ų33.20%017%0.169CC..Hα-helixtrans-62.9-29.6173.6-75.6172000112.6I107 F111 S174 I175 L180 L181 L201 A204 F208I107-L178 HydrophobicContact CD1-CD1 4.09Å; I107-L178 HydrophobicContact CG2-CD1 3.98Å; I107-L178 HydrophobicContact CG2-CD2 4.09Å; F111-L178 HydrophobicContact CE1-CB 4.05Å; F111-L178 HydrophobicContact CE1-CD2 4.31Å; F111-L178 VanDerWaalsContact CE1-O 3.3Å; F111-L178 WeakPolarHBondContact CE1-O 3.4Å; F111-L178 HydrophobicContact CE2-CB 4.41Å; F111-L178 HydrophobicContact CE2-CD1 4.28Å; F111-L178 HydrophobicContact CE2-CD2 4.32Å; F111-L178 HydrophobicContact CZ-CB 3.67Å; F111-L178 HydrophobicContact CZ-CD1 4.34Å; F111-L178 HydrophobicContact CZ-CD2 4.17Å; F111-L178 HydrophobicContact CZ-CG 4.28Å; S174-L178 WeakPolarHBondContact O-CG 3.39Å; S174-L178 PolarHBondContact O-N 2.96Å; I175-L178 WeakPolarHBondContact O-CB 3.47Å; I175-L178 PolarHBondContact O-N 3.2Å; L178-L180 PolarHBondContact O-N 3.27Å; L178-L180 VanDerWaalsContact O-N 3.08Å; L178-L181 WeakPolarHBondContact O-CB 3.41Å; L178-L181 PolarHBondContact O-N 3.23Å; L178-L201 HydrophobicContact CD2-CD2 3.81Å; L178-A204 HydrophobicContact CD1-CB 4.09Å; L178-A204 HydrophobicContact CD2-CB 3.64Å; L178-A204 HydrophobicContact CG-CB 3.66Å; L178-F208 HydrophobicContact CD1-CE2 4.07Å
179K91Very high88.8Confident65 Ų6533.6 Ų33.628%0.28317%0.17SC..Hα-helixtrans-56.1-25.2174.9-168.5177.1-175.7146.60113.3E130 I175 V176 F177 L181 I182 D183E130-K179 VanDerWaalsContact CD-NZ 3.26Å; E130-K179 IonicContact OE1-NZ 3.79Å; E130-K179 PolarHBondContact OE1-NZ 3.1Å; E130-K179 WeakPolarHBondContact OE2-CE 3.25Å; E130-K179 IonicContact OE2-NZ 2.66Å; E130-K179 PolarHBondContact OE2-NZ 3.03Å; I175-K179 PolarHBondContact O-N 2.95Å; V176-K179 VanDerWaalsContact O-CB 3.27Å; V176-K179 WeakPolarHBondContact O-CB 3.39Å; V176-K179 PolarHBondContact O-N 3Å; F177-K179 PolarHBondContact O-N 3.39Å; K179-L181 PolarHBondContact O-N 2.87Å; K179-L181 VanDerWaalsContact O-N 3.17Å; K179-I182 PolarHBondContact O-N 3.28Å; K179-D183 PolarHBondContact O-N 3.47Å
180L89.4Confident88.5Confident10 Ų1030.2 Ų30.25%0.05215%0.152CC..Hα-helixtrans-56.9-28.8172.5-60.9178.1000112.6F177 L178 R186 I251 R252 V255F177-L180 HydrophobicContact CD2-CD1 3.67Å; F177-L180 HydrophobicContact CE2-CD1 3.74Å; F177-L180 VanDerWaalsContact O-CB 3.26Å; F177-L180 WeakPolarHBondContact O-CB 3.34Å; F177-L180 WeakPolarHBondContact O-CG 3.32Å; F177-L180 PolarHBondContact O-N 3.45Å; F177-L180 VanDerWaalsContact O-N 3.17Å; L178-L180 PolarHBondContact O-N 3.27Å; L178-L180 VanDerWaalsContact O-N 3.08Å; L180-R186 WeakPolarHBondContact O-CB 3.49Å; L180-I251 HydrophobicContact CD1-CG2 4.37Å; L180-R252 HydrophobicContact CD1-CG 4.25Å; L180-V255 HydrophobicContact CD2-CG1 4.37Å
181L91.3Very high88.2Confident4 Ų433.4 Ų33.42%0.02118%0.179CC..Hα-helixtrans-91.7-14.7177.2-55.1-178.5000113F111 L178 K179 M190 Q197 I200 L201F111-L181 HydrophobicContact CD1-CB 3.57Å; F111-L181 HydrophobicContact CD1-CD1 3.85Å; F111-L181 HydrophobicContact CD1-CG 4.34Å; F111-L181 HydrophobicContact CE1-CB 3.78Å; F111-L181 HydrophobicContact CE1-CD1 4.44Å; L178-L181 WeakPolarHBondContact O-CB 3.41Å; L178-L181 PolarHBondContact O-N 3.23Å; K179-L181 PolarHBondContact O-N 2.87Å; K179-L181 VanDerWaalsContact O-N 3.17Å; L181-M190 HydrophobicContact CD2-CB 4.24Å; L181-M190 HydrophobicContact CD2-CG 3.72Å; L181-M190 HydrophobicContact CD2-SD 3.79Å; L181-Q197 HydrophobicContact CD1-CG 4.08Å; L181-Q197 HydrophobicContact CD2-CB 4.32Å; L181-Q197 HydrophobicContact CD2-CG 3.89Å; L181-I200 HydrophobicContact CD1-CB 4.24Å; L181-I200 HydrophobicContact CD1-CG2 3.74Å; L181-I200 HydrophobicContact CD2-CD1 3.86Å; L181-I200 HydrophobicContact CD2-CG2 4.36Å; L181-I200 HydrophobicContact CG-CG2 3.91Å; L181-L201 HydrophobicContact CD1-CD2 3.82Å; L181-L201 HydrophobicContact CD1-CG 3.82Å
182I89.7Confident87.8Confident9 Ų939.3 Ų39.35%0.04621%0.211CC..Hα-helixtrans-85.8-33.3177.2-57.5-175.6000110.8F111 P126 L129 K179 P184 R187F111-I182 HydrophobicContact CE1-CD1 4.13Å; F111-I182 HydrophobicContact CE1-CG1 3.51Å; F111-I182 HydrophobicContact CZ-CD1 3.86Å; F111-I182 HydrophobicContact CZ-CG1 3.78Å; P126-I182 HydrophobicContact CB-CG2 3.56Å; P126-I182 HydrophobicContact CG-CG2 4.46Å; L129-I182 HydrophobicContact CD2-CD1 4.3Å; K179-I182 PolarHBondContact O-N 3.28Å; I182-P184 WeakPolarHBondContact O-CD 3.32Å; I182-R187 PolarHBondContact O-NH2 3.11Å
183D84.6Confident87.6Confident31 Ų3140.1 Ų40.117%0.16621%0.213CC..  trans-63.3124-178.3-168.1-38.6000111K179 I185 R186 R187K179-D183 PolarHBondContact O-N 3.47Å; D183-I185 VanDerWaalsContact C-N 3.28Å; D183-I185 PolarHBondContact O-N 3.26Å; D183-I185 WeakPolarHBondContact OD1-CB 3.41Å; D183-I185 PolarHBondContact OD1-N 3.19Å; D183-R186 HydrophobicContact CB-CB 4.16Å; D183-R186 HydrophobicContact CB-CG 4.2Å; D183-R186 PolarHBondContact O-N 2.97Å; D183-R187 WeakPolarHBondContact O-CB 3.49Å; D183-R187 PolarHBondContact O-N 3.41Å
184P81.2Confident87.4Confident91 Ų9144 Ų4459%0.59124%0.238SC*.Hα-helixtrans-57.4-37.1178.8-22.632.4000113.7I182 R187I182-P184 WeakPolarHBondContact O-CD 3.32Å; P184-R187 WeakPolarHBondContact O-CB 3.18Å; P184-R187 PolarHBondContact O-N 3.31Å
185I80.6Confident87.3Confident86 Ų8648 Ų4844%0.44127%0.271SS..Hα-helixtrans-66.9-51-177.3-60.8172.4000109.1D183 R187 Q188 P262D183-I185 VanDerWaalsContact C-N 3.28Å; D183-I185 PolarHBondContact O-N 3.26Å; D183-I185 WeakPolarHBondContact OD1-CB 3.41Å; D183-I185 PolarHBondContact OD1-N 3.19Å; I185-R187 PolarHBondContact O-N 3.14Å; I185-Q188 PolarHBondContact O-N 2.84Å; I185-P262 HydrophobicContact CD1-CG 4.44Å
186R82.3Confident87.2Confident11 Ų1149.3 Ų49.34%0.04228%0.278CS..Hα-helixtrans-68.6-21.5179.9-62.7176176.5144.96.3112.6L180 D183 Q188 L189 M190 V255 T264L180-R186 WeakPolarHBondContact O-CB 3.49Å; D183-R186 HydrophobicContact CB-CB 4.16Å; D183-R186 HydrophobicContact CB-CG 4.2Å; D183-R186 PolarHBondContact O-N 2.97Å; R186-Q188 VanDerWaalsContact C-N 3.29Å; R186-Q188 PolarHBondContact O-N 3.08Å; R186-L189 WeakPolarHBondContact O-CB 3.49Å; R186-L189 PolarHBondContact O-N 3.11Å; R186-M190 VanDerWaalsContact O-CG 3.23Å; R186-M190 WeakPolarHBondContact O-CG 3.49Å; R186-M190 PolarHBondContact O-N 3.28Å; R186-V255 HydrophobicContact CG-CG1 4.13Å; R186-T264 PolarHBondContact NH1-O 3.45Å; R186-T264 PolarHBondContact NH2-O 2.96Å; R186-T264 PolarHBondContact NH2-OG1 3.48Å
187R79.9Confident87.3Confident55 Ų5550.5 Ų50.521%0.20828%0.282CS..Hα-helixtrans-64.4-33.2-179-128.7179-63.6-176.20.6113.3V115 I182 D183 P184 I185 M190 A191V115-R187 PolarHBondContact O-NH1 2.85Å; I182-R187 PolarHBondContact O-NH2 3.11Å; D183-R187 WeakPolarHBondContact O-CB 3.49Å; D183-R187 PolarHBondContact O-N 3.41Å; P184-R187 WeakPolarHBondContact O-CB 3.18Å; P184-R187 PolarHBondContact O-N 3.31Å; I185-R187 PolarHBondContact O-N 3.14Å; R187-M190 PolarHBondContact O-N 2.64Å; R187-A191 PolarHBondContact O-N 2.82Å
188Q80.5Confident87.4Confident153 Ų15353.6 Ų53.672%0.71530%0.301SS*.Hα-helixtrans-64-49.4174.4-77.3-178.2-23.400110.6I185 R186 M190 A191 D192I185-Q188 PolarHBondContact O-N 2.84Å; R186-Q188 VanDerWaalsContact C-N 3.29Å; R186-Q188 PolarHBondContact O-N 3.08Å; Q188-M190 PolarHBondContact O-N 3.12Å; Q188-A191 WeakPolarHBondContact O-CB 3.44Å; Q188-A191 PolarHBondContact O-N 3.37Å; Q188-D192 PolarHBondContact O-N 3.24Å
189L83.7Confident87.4Confident24 Ų2454.8 Ų54.813%0.12631%0.313CS..Hα-helixtrans-54.9-40.4173.5-179.170000112.3R186 A191 D192 H193 V255 D258R186-L189 WeakPolarHBondContact O-CB 3.49Å; R186-L189 PolarHBondContact O-N 3.11Å; L189-A191 VanDerWaalsContact C-N 3.33Å; L189-A191 PolarHBondContact O-N 2.94Å; L189-D192 PolarHBondContact O-N 2.74Å; L189-H193 PolarHBondContact O-CD2 2.64Å; L189-H193 PolarHBondContact O-N 3.29Å; L189-V255 HydrophobicContact CD2-CG1 4.42Å; L189-D258 HydrophobicContact CD2-CB 4.17Å
190M85.8Confident87.5Confident2 Ų251.7 Ų51.71%0.0130%0.3CS..Hα-helixtrans-71.4-27.1179.2-64.4-68.2163.700113.1L181 R186 R187 Q188 D192 H193 L196 I200 V255L181-M190 HydrophobicContact CD2-CB 4.24Å; L181-M190 HydrophobicContact CD2-CG 3.72Å; L181-M190 HydrophobicContact CD2-SD 3.79Å; R186-M190 VanDerWaalsContact O-CG 3.23Å; R186-M190 WeakPolarHBondContact O-CG 3.49Å; R186-M190 PolarHBondContact O-N 3.28Å; R187-M190 PolarHBondContact O-N 2.64Å; Q188-M190 PolarHBondContact O-N 3.12Å; M190-D192 VanDerWaalsContact C-N 3.32Å; M190-H193 CarbonylContact O-C 3.43Å; M190-H193 VanDerWaalsContact O-C 3.24Å; M190-H193 PolarHBondContact O-N 3.11Å; M190-L196 HydrophobicContact CE-CD2 3.9Å; M190-L196 HydrophobicContact CE-CG 4.43Å; M190-L196 HydrophobicContact SD-CD2 3.77Å; M190-L196 HydrophobicContact SD-CG 3.95Å; M190-I200 HydrophobicContact CE-CD1 3.67Å; M190-I200 HydrophobicContact SD-CD1 3.68Å; M190-V255 HydrophobicContact CE-CG1 4.46Å; M190-V255 HydrophobicContact CE-CG2 3.42Å; M190-V255 VanDerWaalsContact CE-CG2 3.42Å
191A83.7Confident87.8Confident70 Ų7051.4 Ų51.458%0.57930%0.298SS*.Hα-helixtrans-68.1-35175.700000111.4R187 Q188 L189 H193R187-A191 PolarHBondContact O-N 2.82Å; Q188-A191 WeakPolarHBondContact O-CB 3.44Å; Q188-A191 PolarHBondContact O-N 3.37Å; L189-A191 VanDerWaalsContact C-N 3.33Å; L189-A191 PolarHBondContact O-N 2.94Å; A191-H193 VanDerWaalsContact C-N 3.26Å; A191-H193 PolarHBondContact O-N 3.48Å
192D86Confident88Confident125 Ų12557.6 Ų57.667%0.66833%0.325SS*.Hα-helixtrans-74.2-19.9175.5-63.2-26.7000112.5Q188 L189 M190 P194Q188-D192 PolarHBondContact O-N 3.24Å; L189-D192 PolarHBondContact O-N 2.74Å; M190-D192 VanDerWaalsContact C-N 3.32Å; D192-P194 WeakPolarHBondContact O-CD 3.33Å
193H90.3Very high88.3Confident80 Ų8058.3 Ų58.337%0.3733%0.329SS..  trans-123.970.7-178.9-62.6-57.2000112.9L189 M190 A191 A195 L196 Q197L189-H193 PolarHBondContact O-CD2 2.64Å; L189-H193 PolarHBondContact O-N 3.29Å; M190-H193 CarbonylContact O-C 3.43Å; M190-H193 VanDerWaalsContact O-C 3.24Å; M190-H193 PolarHBondContact O-N 3.11Å; A191-H193 VanDerWaalsContact C-N 3.26Å; A191-H193 PolarHBondContact O-N 3.48Å; H193-A195 PolarHBondContact O-N 3.39Å; H193-A195 VanDerWaalsContact O-N 3.15Å; H193-L196 HydrophobicContact CB-CB 3.77Å; H193-L196 HydrophobicContact CB-CD2 4.41Å; H193-L196 WeakPolarHBondContact O-CA 3.48Å; H193-L196 WeakPolarHBondContact O-CB 3.43Å; H193-L196 PolarHBondContact O-N 2.97Å; H193-Q197 PolarHBondContact O-N 2.84Å; H193-Q197 VanDerWaalsContact O-N 3.13Å
194P90Very high88.8Confident82 Ų8256.9 Ų56.953%0.53232%0.321SS..Hα-helixtrans-62.1-27.8-178.424.7-34.8000113.5D192 T198D192-P194 WeakPolarHBondContact O-CD 3.33Å; P194-T198 WeakPolarHBondContact O-CB 3.42Å; P194-T198 PolarHBondContact O-N 3.07Å; P194-T198 PolarHBondContact O-OG1 3.39Å
195A92.1Very high89.5Confident84 Ų8453.2 Ų53.269%0.69430%0.298SS*.Hα-helixtrans-66.1-39.6173.100000111.7H193 T198 G199H193-A195 PolarHBondContact O-N 3.39Å; H193-A195 VanDerWaalsContact O-N 3.15Å; A195-T198 PolarHBondContact O-N 3.23Å; A195-G199 PolarHBondContact O-N 3.11Å
196L91.9Very high90.2Very high32 Ų3252.3 Ų52.317%0.16829%0.291CS..Hα-helixtrans-66.9-45176.9-177.162000110.8M190 H193 T198 G199 I200 I251 F254M190-L196 HydrophobicContact CE-CD2 3.9Å; M190-L196 HydrophobicContact CE-CG 4.43Å; M190-L196 HydrophobicContact SD-CD2 3.77Å; M190-L196 HydrophobicContact SD-CG 3.95Å; H193-L196 HydrophobicContact CB-CB 3.77Å; H193-L196 HydrophobicContact CB-CD2 4.41Å; H193-L196 WeakPolarHBondContact O-CA 3.48Å; H193-L196 WeakPolarHBondContact O-CB 3.43Å; H193-L196 PolarHBondContact O-N 2.97Å; L196-T198 VanDerWaalsContact C-N 3.32Å; L196-T198 PolarHBondContact O-N 3.46Å; L196-G199 PolarHBondContact O-N 3.5Å; L196-I200 HydrophobicContact CD1-CD1 4.44Å; L196-I200 HydrophobicContact CG-CD1 4.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.36Å; L196-I200 PolarHBondContact O-N 3.23Å; L196-I251 HydrophobicContact CD1-CD1 4.34Å; L196-I251 HydrophobicContact CD1-CG1 4.06Å; L196-I251 HydrophobicContact CD1-CG2 4.02Å; L196-F254 HydrophobicContact CD2-CD1 3.78Å; L196-F254 HydrophobicContact CD2-CE1 3.59Å
197Q93.2Very high90.7Very high47 Ų4751.8 Ų51.822%0.2229%0.289CS..Hα-helixtrans-57.4-46.1174.9-176.2-175.815.500111.6L181 H193 G199 I200 L201L181-Q197 HydrophobicContact CD1-CG 4.08Å; L181-Q197 HydrophobicContact CD2-CB 4.32Å; L181-Q197 HydrophobicContact CD2-CG 3.89Å; H193-Q197 PolarHBondContact O-N 2.84Å; H193-Q197 VanDerWaalsContact O-N 3.13Å; Q197-G199 VanDerWaalsContact C-N 3.35Å; Q197-I200 PolarHBondContact O-N 2.91Å; Q197-L201 HydrophobicContact CG-CD1 4.47Å; Q197-L201 WeakPolarHBondContact O-CG 3.5Å; Q197-L201 PolarHBondContact O-N 3.02Å
198T94.1Very high91.4Very high65 Ų6549.2 Ų49.240%0.39928%0.279SS..Hα-helixtrans-66-39.3178.6-58.40000111.3P194 A195 L196 L201 F202P194-T198 WeakPolarHBondContact O-CB 3.42Å; P194-T198 PolarHBondContact O-N 3.07Å; P194-T198 PolarHBondContact O-OG1 3.39Å; A195-T198 PolarHBondContact O-N 3.23Å; L196-T198 VanDerWaalsContact C-N 3.32Å; L196-T198 PolarHBondContact O-N 3.46Å; T198-L201 PolarHBondContact O-N 3.33Å; T198-F202 WeakPolarHBondContact O-CB 3.37Å; T198-F202 PolarHBondContact O-N 3.1Å
199G93.8Very high92.1Very high24 Ų2443.2 Ų43.225%0.24725%0.253CS..Hα-helixtrans-60.9-45173.600000112.5A195 L196 Q197 L201 F202 L203A195-G199 PolarHBondContact O-N 3.11Å; L196-G199 PolarHBondContact O-N 3.5Å; Q197-G199 VanDerWaalsContact C-N 3.35Å; G199-L201 PolarHBondContact O-N 2.94Å; G199-F202 PolarHBondContact O-N 3.25Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 WeakPolarHBondContact O-CD1 3.41Å; G199-L203 WeakPolarHBondContact O-CG 3.27Å; G199-L203 PolarHBondContact O-N 2.85Å
200I94Very high92.5Very high0 Ų042.3 Ų42.30%025%0.248CC..Hα-helixtrans-59.2-48.2176.7-70.4165.6000110.6F177 L181 M190 L196 Q197 L203 A204 I251F177-I200 HydrophobicContact CD1-CG2 3.91Å; F177-I200 HydrophobicContact CE1-CB 4.01Å; F177-I200 HydrophobicContact CE1-CG1 4.01Å; F177-I200 HydrophobicContact CE1-CG2 3.69Å; F177-I200 HydrophobicContact CE2-CG1 4.46Å; F177-I200 HydrophobicContact CZ-CB 4.27Å; F177-I200 HydrophobicContact CZ-CG1 3.74Å; F177-I200 HydrophobicContact CZ-CG2 4.18Å; L181-I200 HydrophobicContact CD1-CB 4.24Å; L181-I200 HydrophobicContact CD1-CG2 3.74Å; L181-I200 HydrophobicContact CD2-CD1 3.86Å; L181-I200 HydrophobicContact CD2-CG2 4.36Å; L181-I200 HydrophobicContact CG-CG2 3.91Å; M190-I200 HydrophobicContact CE-CD1 3.67Å; M190-I200 HydrophobicContact SD-CD1 3.68Å; L196-I200 HydrophobicContact CD1-CD1 4.44Å; L196-I200 HydrophobicContact CG-CD1 4.08Å; L196-I200 WeakPolarHBondContact O-CG1 3.36Å; L196-I200 PolarHBondContact O-N 3.23Å; Q197-I200 PolarHBondContact O-N 2.91Å; I200-L203 PolarHBondContact O-N 3.32Å; I200-A204 VanDerWaalsContact O-CB 3.3Å; I200-A204 WeakPolarHBondContact O-CB 3.2Å; I200-A204 PolarHBondContact O-N 3.32Å; I200-I251 HydrophobicContact CD1-CG2 4Å; I200-I251 HydrophobicContact CG1-CD1 4.42Å; I200-I251 HydrophobicContact CG1-CG2 3.93Å
201L96Very high92.8Very high4 Ų442.2 Ų42.22%0.02125%0.248CC..Hα-helixtrans-62.2-46178.8-71.7171.6000112I107 F111 K112 L178 L181 Q197 T198 G199 A204 C205I107-L201 HydrophobicContact CG2-CD2 4.03Å; F111-L201 HydrophobicContact CB-CD1 4.32Å; F111-L201 HydrophobicContact CB-CD2 3.57Å; F111-L201 HydrophobicContact CD1-CD2 4.35Å; F111-L201 HydrophobicContact CD2-CD2 4.32Å; F111-L201 HydrophobicContact CG-CD2 3.83Å; K112-L201 HydrophobicContact CG-CD1 4.06Å; L178-L201 HydrophobicContact CD2-CD2 3.81Å; L181-L201 HydrophobicContact CD1-CD2 3.82Å; L181-L201 HydrophobicContact CD1-CG 3.82Å; Q197-L201 HydrophobicContact CG-CD1 4.47Å; Q197-L201 WeakPolarHBondContact O-CG 3.5Å; Q197-L201 PolarHBondContact O-N 3.02Å; T198-L201 PolarHBondContact O-N 3.33Å; G199-L201 PolarHBondContact O-N 2.94Å; L201-A204 PolarHBondContact O-N 2.94Å; L201-C205 WeakPolarHBondContact O-CB 3.31Å; L201-C205 PolarHBondContact O-N 3.11Å; L201-C205 PolarHBondContact O-SG 3.28Å
202F95.4Very high93.2Very high134 Ų13439.5 Ų39.559%0.58822%0.224SC*.Hα-helixtrans-59.4-50.9178.7174.3-99.2000111.3T198 G199 A204 C205 F206T198-F202 WeakPolarHBondContact O-CB 3.37Å; T198-F202 PolarHBondContact O-N 3.1Å; G199-F202 PolarHBondContact O-N 3.25Å; F202-A204 PolarHBondContact O-N 3.11Å; F202-C205 PolarHBondContact O-N 3.29Å; F202-F206 WeakPolarHBondContact O-CB 3.44Å; F202-F206 PolarHBondContact O-N 3.39Å
203L95.2Very high93.2Very high25 Ų2539 Ų3913%0.13122%0.216CC..Hα-helixtrans-64.7-40.4-177.9-67.2167.8000111.7F177 G199 I200 N207 T243 P247 F248 I251F177-L203 HydrophobicContact CE1-CB 4.27Å; G199-L203 WeakPolarHBondContact O-CB 3.47Å; G199-L203 WeakPolarHBondContact O-CD1 3.41Å; G199-L203 WeakPolarHBondContact O-CG 3.27Å; G199-L203 PolarHBondContact O-N 2.85Å; I200-L203 PolarHBondContact O-N 3.32Å; L203-N207 WeakPolarHBondContact O-CB 3.37Å; L203-N207 PolarHBondContact O-N 3.2Å; L203-T243 WeakPolarHBondContact CD2-O 3.31Å; L203-P247 HydrophobicContact CD1-CB 3.68Å; L203-P247 HydrophobicContact CD2-CB 4.1Å; L203-P247 HydrophobicContact CD2-CG 4.34Å; L203-F248 HydrophobicContact CB-CD1 4.45Å; L203-F248 HydrophobicContact CB-CE1 3.86Å; L203-I251 HydrophobicContact CD1-CD1 3.6Å
204A95.4Very high93Very high0 Ų035.1 Ų35.10%020%0.198CC..Hα-helixtrans-64-49.5175.600000112F177 L178 I200 L201 F202 F206 N207 F208F177-A204 HydrophobicContact CD1-CB 4.39Å; L178-A204 HydrophobicContact CD1-CB 4.09Å; L178-A204 HydrophobicContact CD2-CB 3.64Å; L178-A204 HydrophobicContact CG-CB 3.66Å; I200-A204 VanDerWaalsContact O-CB 3.3Å; I200-A204 WeakPolarHBondContact O-CB 3.2Å; I200-A204 PolarHBondContact O-N 3.32Å; L201-A204 PolarHBondContact O-N 2.94Å; F202-A204 PolarHBondContact O-N 3.11Å; A204-F206 VanDerWaalsContact C-N 3.33Å; A204-F206 PolarHBondContact O-N 2.74Å; A204-N207 PolarHBondContact O-N 3.42Å; A204-F208 WeakPolarHBondContact O-CD2 3.41Å; A204-F208 PolarHBondContact O-N 3.12Å; A204-F208 VanDerWaalsContact O-N 3.1Å
205C96.3Very high93Very high14 Ų1431.4 Ų31.410%0.09517%0.174CC..Hα-helixtrans-61.9-41.7178.4-670000111.6L201 F202 N207 F208 V209L201-C205 WeakPolarHBondContact O-CB 3.31Å; L201-C205 PolarHBondContact O-N 3.11Å; L201-C205 PolarHBondContact O-SG 3.28Å; F202-C205 PolarHBondContact O-N 3.29Å; C205-N207 VanDerWaalsContact C-N 3.28Å; C205-N207 PolarHBondContact O-N 2.97Å; C205-F208 WeakPolarHBondContact O-CB 3.41Å; C205-F208 PolarHBondContact O-N 3.36Å; C205-F208 VanDerWaalsContact O-N 3.15Å; C205-V209 PolarHBondContact O-N 3.02Å
206F94.1Very high92.7Very high67 Ų6730.6 Ų30.629%0.29416%0.155SC..Hα-helixtrans-59.2-41.4175.6-172.7-107.8000111.6F202 A204 F208 V209 L210 T243F202-F206 WeakPolarHBondContact O-CB 3.44Å; F202-F206 PolarHBondContact O-N 3.39Å; A204-F206 VanDerWaalsContact C-N 3.33Å; A204-F206 PolarHBondContact O-N 2.74Å; F206-F208 VanDerWaalsContact C-N 3.34Å; F206-F208 PolarHBondContact O-N 3.4Å; F206-V209 PolarHBondContact O-N 3.49Å; F206-V209 VanDerWaalsContact O-N 3.1Å; F206-L210 HydrophobicContact CD1-CD1 3.43Å; F206-L210 VanDerWaalsContact CD1-CD1 3.43Å; F206-L210 HydrophobicContact CD2-CD1 4.39Å; F206-L210 HydrophobicContact CE1-CD1 3.1Å; F206-L210 HydrophobicContact CE1-CG 4.47Å; F206-L210 HydrophobicContact CE2-CD1 4.12Å; F206-L210 HydrophobicContact CG-CD1 4.08Å; F206-L210 HydrophobicContact CZ-CD1 3.49Å; F206-L210 VanDerWaalsContact CZ-CD1 3.49Å; F206-L210 WeakPolarHBondContact O-CD1 3.36Å; F206-L210 PolarHBondContact O-N 2.94Å; F206-T243 HydrophobicContact CD1-CG2 4.46Å; F206-T243 HydrophobicContact CE1-CG2 3.74Å; F206-T243 WeakPolarHBondContact CE1-OG1 3.44Å
207N93.7Very high92.2Very high1 Ų130.2 Ų30.21%0.00515%0.152CC..Hα-helixtrans-69.2-28.1177.4-160.731.7000113.4D170 S174 L203 A204 C205 V209 P211 V244 F248D170-N207 PolarHBondContact O-ND2 2.95Å; D170-N207 VanDerWaalsContact O-ND2 3.09Å; S174-N207 PolarHBondContact OG-ND2 3.35Å; L203-N207 WeakPolarHBondContact O-CB 3.37Å; L203-N207 PolarHBondContact O-N 3.2Å; A204-N207 PolarHBondContact O-N 3.42Å; C205-N207 VanDerWaalsContact C-N 3.28Å; C205-N207 PolarHBondContact O-N 2.97Å; N207-V209 VanDerWaalsContact C-N 3.3Å; N207-P211 WeakPolarHBondContact O-CD 3.38Å; N207-V244 HydrophobicContact CB-CG2 4.26Å; N207-V244 WeakPolarHBondContact ND2-CG1 3.48Å; N207-V244 VanDerWaalsContact OD1-CG2 3.27Å; N207-V244 WeakPolarHBondContact OD1-CG2 3.37Å; N207-F248 HydrophobicContact CB-CZ 4.4Å
208F95.5Very high91.6Very high0 Ų029.1 Ų29.10%015%0.147CC..Hα-helixtrans-67.3-30.6169.3-77.8-72.2000112.8W96 S100 L103 I107 V171 I175 L178 A204 C205 F206 P211W96-F208 PolarHBondContact NE1-O 2.9Å; S100-F208 VanDerWaalsContact CB-O 3.25Å; S100-F208 WeakPolarHBondContact CB-O 3.29Å; L103-F208 HydrophobicContact CD2-CD1 3.8Å; L103-F208 HydrophobicContact CD2-CE1 3.85Å; L103-F208 HydrophobicContact CD2-CG 4.19Å; L103-F208 HydrophobicContact CD2-CZ 4.32Å; I107-F208 HydrophobicContact CD1-CD2 3.94Å; I107-F208 HydrophobicContact CD1-CE2 3.54Å; I107-F208 HydrophobicContact CD1-CZ 4.16Å; V171-F208 HydrophobicContact CG1-CD1 4.18Å; V171-F208 HydrophobicContact CG1-CE1 3.69Å; I175-F208 HydrophobicContact CG1-CZ 3.97Å; L178-F208 HydrophobicContact CD1-CE2 4.07Å; A204-F208 WeakPolarHBondContact O-CD2 3.41Å; A204-F208 PolarHBondContact O-N 3.12Å; A204-F208 VanDerWaalsContact O-N 3.1Å; C205-F208 WeakPolarHBondContact O-CB 3.41Å; C205-F208 PolarHBondContact O-N 3.36Å; C205-F208 VanDerWaalsContact O-N 3.15Å; F206-F208 VanDerWaalsContact C-N 3.34Å; F206-F208 PolarHBondContact O-N 3.4Å; F208-P211 WeakPolarHBondContact O-CD 3.37Å
209V95.1Very high90.9Very high28 Ų2828.9 Ų28.917%0.1714%0.139CC..Hα-helixtrans-81.8-31.7179.81770000111.9L97 L101 C205 F206 N207 T212L97-V209 HydrophobicContact CD1-CG1 4.07Å; L101-V209 HydrophobicContact CD2-CG2 4.17Å; C205-V209 PolarHBondContact O-N 3.02Å; F206-V209 PolarHBondContact O-N 3.49Å; F206-V209 VanDerWaalsContact O-N 3.1Å; N207-V209 VanDerWaalsContact C-N 3.3Å; V209-T212 WeakPolarHBondContact O-CB 3.4Å; V209-T212 PolarHBondContact O-N 2.91Å; V209-T212 PolarHBondContact O-OG1 3.41Å
210L91.1Very high89.9Confident5 Ų533 Ų333%0.02615%0.148CC..THydrogen-bonded Turntrans-49.9-41.6-177.4-115.778.9000116F206 T212 F213 Y240 V244F206-L210 HydrophobicContact CD1-CD1 3.43Å; F206-L210 VanDerWaalsContact CD1-CD1 3.43Å; F206-L210 HydrophobicContact CD2-CD1 4.39Å; F206-L210 HydrophobicContact CE1-CD1 3.1Å; F206-L210 HydrophobicContact CE1-CG 4.47Å; F206-L210 HydrophobicContact CE2-CD1 4.12Å; F206-L210 HydrophobicContact CG-CD1 4.08Å; F206-L210 HydrophobicContact CZ-CD1 3.49Å; F206-L210 VanDerWaalsContact CZ-CD1 3.49Å; F206-L210 WeakPolarHBondContact O-CD1 3.36Å; F206-L210 PolarHBondContact O-N 2.94Å; L210-T212 PolarHBondContact O-N 3.08Å; L210-F213 WeakPolarHBondContact O-CD2 3.38Å; L210-F213 PolarHBondContact O-N 3.12Å; L210-Y240 HydrophobicContact CB-CE2 4.12Å; L210-Y240 HydrophobicContact CD2-CD2 3.39Å; L210-Y240 HydrophobicContact CD2-CE1 4.35Å; L210-Y240 HydrophobicContact CD2-CE2 3.08Å; L210-Y240 HydrophobicContact CD2-CG 4.14Å; L210-Y240 HydrophobicContact CG-CE2 4.06Å; L210-V244 HydrophobicContact CD2-CG2 4.28Å
211P91.9Very high88.7Confident0 Ų039.8 Ų39.80%018%0.184CC..Hα-helixtrans-56.8-21.2178.3-23.929.5000113.9W96 F140 V167 V171 N207 F208 F213 C214 L215W96-P211 HydrophobicContact CZ2-CB 4.39Å; W96-P211 HydrophobicContact CZ2-CG 4.1Å; F140-P211 HydrophobicContact CD2-CB 4.06Å; F140-P211 HydrophobicContact CE2-CB 3.38Å; F140-P211 HydrophobicContact CE2-CG 4.31Å; F140-P211 HydrophobicContact CZ-CB 3.88Å; V167-P211 HydrophobicContact CG1-CB 3.65Å; V167-P211 HydrophobicContact CG1-CG 3.47Å; V167-P211 VanDerWaalsContact CG1-CG 3.47Å; V171-P211 HydrophobicContact CG2-CG 4.5Å; N207-P211 WeakPolarHBondContact O-CD 3.38Å; F208-P211 WeakPolarHBondContact O-CD 3.37Å; P211-F213 VanDerWaalsContact C-N 3.28Å; P211-F213 PolarHBondContact O-N 3.01Å; P211-C214 WeakPolarHBondContact O-CB 3.48Å; P211-C214 PolarHBondContact O-N 3.49Å; P211-C214 VanDerWaalsContact O-N 3.15Å; P211-L215 WeakPolarHBondContact O-CG 3.47Å; P211-L215 PolarHBondContact O-N 3.07Å
212T92.1Very high87Confident13 Ų1344.4 Ų44.48%0.0820%0.204CC..Hα-helixtrans-54.3-44.4171.7-550000111.7F93 L97 V209 L210 C214 L215 F216F93-T212 HydrophobicContact CB-CG2 4.35Å; F93-T212 HydrophobicContact CD2-CG2 4.47Å; L97-T212 HydrophobicContact CB-CG2 3.79Å; L97-T212 HydrophobicContact CD1-CG2 4.09Å; L97-T212 HydrophobicContact CD2-CG2 4.27Å; L97-T212 HydrophobicContact CG-CG2 4.26Å; V209-T212 WeakPolarHBondContact O-CB 3.4Å; V209-T212 PolarHBondContact O-N 2.91Å; V209-T212 PolarHBondContact O-OG1 3.41Å; L210-T212 PolarHBondContact O-N 3.08Å; T212-C214 VanDerWaalsContact C-N 3.3Å; T212-C214 PolarHBondContact O-N 3.24Å; T212-L215 PolarHBondContact O-N 2.94Å; T212-F216 VanDerWaalsContact O-CB 3.29Å; T212-F216 WeakPolarHBondContact O-CB 3.42Å; T212-F216 PolarHBondContact O-N 3.25Å
213F86.7Confident85Confident113 Ų11340.4 Ų40.450%0.49620%0.201SC..Hα-helixtrans-64.2-39.9179.9-66.4-78.5000111.1L210 P211 F216 K217 Y232L210-F213 WeakPolarHBondContact O-CD2 3.38Å; L210-F213 PolarHBondContact O-N 3.12Å; P211-F213 VanDerWaalsContact C-N 3.28Å; P211-F213 PolarHBondContact O-N 3.01Å; F213-F216 WeakPolarHBondContact O-CB 3.28Å; F213-F216 PolarHBondContact O-N 3.22Å; F213-K217 PolarHBondContact O-N 2.87Å; F213-Y232 PolarHBondContact O-OH 3.07Å
214C85.9Confident82.8Confident0 Ų041.2 Ų41.20%021%0.205CC..Hα-helixtrans-61.8-45.3176.1-103.40000113.5Y159 L163 P211 T212 F216 K217 L218 Y236Y159-C214 WeakPolarHBondContact OH-CA 3.43Å; Y159-C214 PolarHBondContact OH-O 3.2Å; Y159-C214 PolarHBondContact OH-SG 3.17Å; L163-C214 HydrophobicContact CD2-CB 3.46Å; L163-C214 VanDerWaalsContact CD2-CB 3.46Å; L163-C214 WeakPolarHBondContact CD2-SG 3.49Å; P211-C214 WeakPolarHBondContact O-CB 3.48Å; P211-C214 PolarHBondContact O-N 3.49Å; P211-C214 VanDerWaalsContact O-N 3.15Å; T212-C214 VanDerWaalsContact C-N 3.3Å; T212-C214 PolarHBondContact O-N 3.24Å; C214-F216 VanDerWaalsContact C-N 3.32Å; C214-K217 PolarHBondContact O-N 3.44Å; C214-L218 PolarHBondContact O-N 2.86Å; C214-Y236 HydrophobicContact CB-CE2 4.44Å; C214-Y236 WeakPolarHBondContact SG-CE2 3.24Å; C214-Y236 PolarHBondContact SG-OH 2.86Å
215L89.1Confident80.7Confident4 Ų443.5 Ų43.52%0.02122%0.22CC..Hα-helixtrans-69-32.7175.7-66.7173.9000111.5F93 W96 F140 L143 L163 P211 T212 L218 R219F93-L215 HydrophobicContact CB-CB 3.59Å; W96-L215 HydrophobicContact CB-CD1 3.57Å; W96-L215 HydrophobicContact CG-CD1 3.97Å; F140-L215 HydrophobicContact CE2-CD1 4.04Å; F140-L215 HydrophobicContact CE2-CG 4.33Å; L143-L215 HydrophobicContact CD2-CD1 4.15Å; L163-L215 HydrophobicContact CD1-CD2 4.34Å; P211-L215 WeakPolarHBondContact O-CG 3.47Å; P211-L215 PolarHBondContact O-N 3.07Å; T212-L215 PolarHBondContact O-N 2.94Å; L215-L218 WeakPolarHBondContact O-CB 3.5Å; L215-L218 PolarHBondContact O-N 3Å; L215-R219 PolarHBondContact O-N 3.43Å
216F86.1Confident78.7Confident67 Ų6752.9 Ų52.929%0.29426%0.259SS..Hα-helixtrans-65.8-43.2175-174.7-92000111.6F93 T212 F213 C214 L218 R219 Y220 F222F93-F216 HydrophobicContact CB-CB 4.32Å; F93-F216 HydrophobicContact CD1-CD2 4.36Å; F93-F216 AromaticContact CD2-CD2 3.83Å; F93-F216 HydrophobicContact CD2-CD2 3.83Å; F93-F216 HydrophobicContact CE1-CD2 4.29Å; F93-F216 AromaticContact CE2-CD2 3.74Å; F93-F216 HydrophobicContact CE2-CD2 3.74Å; F93-F216 HydrophobicContact CE2-CE2 4.2Å; F93-F216 HydrophobicContact CG-CB 4.32Å; F93-F216 HydrophobicContact CG-CD2 4.15Å; F93-F216 AromaticContact CZ-CD2 3.98Å; F93-F216 HydrophobicContact CZ-CD2 3.98Å; F93-F216 HydrophobicContact CZ-CE2 4.24Å; T212-F216 VanDerWaalsContact O-CB 3.29Å; T212-F216 WeakPolarHBondContact O-CB 3.42Å; T212-F216 PolarHBondContact O-N 3.25Å; F213-F216 WeakPolarHBondContact O-CB 3.28Å; F213-F216 PolarHBondContact O-N 3.22Å; C214-F216 VanDerWaalsContact C-N 3.32Å; F216-L218 VanDerWaalsContact C-N 3.28Å; F216-L218 PolarHBondContact O-N 2.9Å; F216-R219 PolarHBondContact O-N 2.92Å; F216-R219 VanDerWaalsContact O-N 3.11Å; F216-Y220 HydrophobicContact CD1-CD2 4.23Å; F216-Y220 AromaticContact CD2-CD2 3.88Å; F216-Y220 HydrophobicContact CD2-CD2 3.88Å; F216-Y220 AromaticContact CD2-CE2 3.94Å; F216-Y220 HydrophobicContact CD2-CE2 3.94Å; F216-Y220 AromaticContact CE1-CD2 3.82Å; F216-Y220 HydrophobicContact CE1-CD2 3.82Å; F216-Y220 AromaticContact CE2-CD2 3.44Å; F216-Y220 HydrophobicContact CE2-CD2 3.44Å; F216-Y220 VanDerWaalsContact CE2-CD2 3.44Å; F216-Y220 AromaticContact CE2-CE2 3.37Å; F216-Y220 HydrophobicContact CE2-CE2 3.37Å; F216-Y220 HydrophobicContact CG-CD2 4.26Å; F216-Y220 AromaticContact CZ-CD2 3.4Å; F216-Y220 HydrophobicContact CZ-CD2 3.4Å; F216-Y220 AromaticContact CZ-CE2 3.73Å; F216-Y220 HydrophobicContact CZ-CE2 3.73Å; F216-Y220 HydrophobicContact CZ-CG 4.32Å; F216-Y220 PolarHBondContact O-N 2.88Å; F216-Y220 VanDerWaalsContact O-N 3.11Å; F216-F222 HydrophobicContact CE1-CB 4.35Å; F216-F222 HydrophobicContact CE1-CG 4.36Å
217K82Confident77.1Confident23 Ų2359.5 Ų59.510%0.128%0.282CS..Hα-helixtrans-57.4-42.4172.6-167.7-152.2-169.8178.10111.3Y159 F213 C214 R219 N221 Y232 E233Y159-K217 HydrophobicContact CE1-CD 4.24Å; Y159-K217 HydrophobicContact CE2-CD 4.15Å; Y159-K217 WeakPolarHBondContact OH-CD 3.45Å; F213-K217 PolarHBondContact O-N 2.87Å; C214-K217 PolarHBondContact O-N 3.44Å; K217-R219 PolarHBondContact O-N 3.42Å; K217-N221 VanDerWaalsContact O-CA 3.27Å; K217-N221 WeakPolarHBondContact O-CA 3.5Å; K217-N221 PolarHBondContact O-N 3.31Å; K217-Y232 HydrophobicContact CB-CE1 3.98Å; K217-Y232 HydrophobicContact CB-CE2 4.35Å; K217-Y232 HydrophobicContact CD-CD1 3.61Å; K217-Y232 HydrophobicContact CD-CE1 3.35Å; K217-Y232 HydrophobicContact CD-CG 4.48Å; K217-Y232 HydrophobicContact CG-CD1 4.02Å; K217-Y232 HydrophobicContact CG-CE1 3.7Å; K217-Y232 HydrophobicContact CG-CE2 4.31Å; K217-Y232 HydrophobicContact CG-CG 4.5Å; K217-E233 IonicContact NZ-OE1 2.61Å; K217-E233 PolarHBondContact NZ-OE1 3.2Å
218L79.8Confident74.9Confident25 Ų2560.8 Ų60.813%0.13129%0.289CS..Hα-helixtrans-57.9-34.8178-17470.5000112.1R156 Y159 L160 C214 L215 F216R156-L218 HydrophobicContact CG-CD1 3.98Å; Y159-L218 HydrophobicContact CD1-CD1 3.85Å; Y159-L218 HydrophobicContact CE1-CB 4.16Å; Y159-L218 HydrophobicContact CE1-CD1 4.24Å; L160-L218 HydrophobicContact CD2-CD1 4.14Å; L160-L218 HydrophobicContact CD2-CD2 3.67Å; L160-L218 HydrophobicContact CG-CD1 4.31Å; C214-L218 PolarHBondContact O-N 2.86Å; L215-L218 WeakPolarHBondContact O-CB 3.5Å; L215-L218 PolarHBondContact O-N 3Å; F216-L218 VanDerWaalsContact C-N 3.28Å; F216-L218 PolarHBondContact O-N 2.9Å
219R79.7Confident73Confident60 Ų6064.5 Ų64.523%0.22631%0.313CS..Hα-helixtrans-76.9-54.1178.9172.653.1177.3156.5-0.2112.9R90 F93 L215 F216 K217R90-R219 VanDerWaalsContact CG-NH1 3.31Å; R90-R219 WeakPolarHBondContact O-CB 3.25Å; R90-R219 WeakPolarHBondContact O-CD 3.37Å; R90-R219 WeakPolarHBondContact O-CG 3.4Å; F93-R219 HydrophobicContact CD1-CB 4.48Å; F93-R219 HydrophobicContact CE1-CG 4.43Å; L215-R219 PolarHBondContact O-N 3.43Å; F216-R219 PolarHBondContact O-N 2.92Å; F216-R219 VanDerWaalsContact O-N 3.11Å; K217-R219 PolarHBondContact O-N 3.42Å
220Y73.9Confident71.2Confident111 Ų11165.3 Ų65.344%0.43532%0.317SS..Hα-helixtrans-96.8-2-167.3-68.2-69.6000113.8F93 F216 F222F93-Y220 HydrophobicContact CE1-CE2 4.18Å; F93-Y220 HydrophobicContact CZ-CE2 4.27Å; F216-Y220 HydrophobicContact CD1-CD2 4.23Å; F216-Y220 AromaticContact CD2-CD2 3.88Å; F216-Y220 HydrophobicContact CD2-CD2 3.88Å; F216-Y220 AromaticContact CD2-CE2 3.94Å; F216-Y220 HydrophobicContact CD2-CE2 3.94Å; F216-Y220 AromaticContact CE1-CD2 3.82Å; F216-Y220 HydrophobicContact CE1-CD2 3.82Å; F216-Y220 AromaticContact CE2-CD2 3.44Å; F216-Y220 HydrophobicContact CE2-CD2 3.44Å; F216-Y220 VanDerWaalsContact CE2-CD2 3.44Å; F216-Y220 AromaticContact CE2-CE2 3.37Å; F216-Y220 HydrophobicContact CE2-CE2 3.37Å; F216-Y220 HydrophobicContact CG-CD2 4.26Å; F216-Y220 AromaticContact CZ-CD2 3.4Å; F216-Y220 HydrophobicContact CZ-CD2 3.4Å; F216-Y220 AromaticContact CZ-CE2 3.73Å; F216-Y220 HydrophobicContact CZ-CE2 3.73Å; F216-Y220 HydrophobicContact CZ-CG 4.32Å; F216-Y220 PolarHBondContact O-N 2.88Å; F216-Y220 VanDerWaalsContact O-N 3.11Å; Y220-F222 PolarHBondContact O-N 3.48Å
221N68.8Low70.1Confident141 Ų14168.3 Ų68.375%0.75434%0.336SS*.  trans41.541.3-166.9-16328000111.1K217 G223K217-N221 VanDerWaalsContact O-CA 3.27Å; K217-N221 WeakPolarHBondContact O-CA 3.5Å; K217-N221 PolarHBondContact O-N 3.31Å; N221-G223 PolarHBondContact O-N 3.36Å; N221-G223 VanDerWaalsContact O-N 3.13Å
222F58.6Low69Low101 Ų10169.9 Ų69.944%0.44334%0.342SS..  trans-73112.4-165.1-158.7-95.5000108.5F216 Y220F216-F222 HydrophobicContact CE1-CB 4.35Å; F216-F222 HydrophobicContact CE1-CG 4.36Å; Y220-F222 PolarHBondContact O-N 3.48Å
223G53.4Low67.8Low51 Ų5175.2 Ų75.253%0.52637%0.366SS..PPolyproline II helixtrans-71.1143.5161.200000109N221N221-G223 PolarHBondContact O-N 3.36Å; N221-G223 VanDerWaalsContact O-N 3.13Å
224L50.3Low66.9Low41 Ų4171.4 Ų71.422%0.21535%0.35CS..PPolyproline II helixtrans-57.1146.3172.2-79.3171000110.4K226 L228 L230 Y232 F235L224-K226 PolarHBondContact O-N 3.15Å; L224-L228 HydrophobicContact CB-CB 4.24Å; L224-L228 HydrophobicContact CD1-CB 4.27Å; L224-L228 HydrophobicContact CD1-CD2 3.67Å; L224-L228 HydrophobicContact CD2-CD2 4.2Å; L224-L228 HydrophobicContact CG-CD2 4.46Å; L224-L230 WeakPolarHBondContact CD1-O 3.34Å; L224-Y232 HydrophobicContact CD2-CD2 4.3Å; L224-Y232 HydrophobicContact CG-CD2 3.95Å; L224-Y232 HydrophobicContact CG-CG 4.44Å; L224-F235 HydrophobicContact CD1-CB 3.35Å; L224-F235 HydrophobicContact CD1-CD1 3.94Å; L224-F235 HydrophobicContact CD1-CG 3.7Å; L224-F235 HydrophobicContact CD2-CD1 4.39Å
225P51.2Low66.3Low48 Ų4874.7 Ų74.731%0.31237%0.365SS..PPolyproline II helixtrans-60.2141.1176.627.5-34.5000109.6W227 L228P225-W227 VanDerWaalsContact CB-NE1 3.3Å; P225-W227 HydrophobicContact CG-CZ2 4.03Å; P225-W227 PolarHBondContact O-N 3.19Å; P225-L228 HydrophobicContact CG-CD1 4.49Å; P225-L228 PolarHBondContact O-N 3.37Å
226K54.1Low65.4Low212 Ų21275.4 Ų75.492%0.92237%0.367SS*.THydrogen-bonded Turntrans-55.3-18-168.5-66.6-175.4178.2-178.10115.5L224 L228L224-K226 PolarHBondContact O-N 3.15Å; K226-L228 VanDerWaalsContact C-N 3.31Å
227W59.3Low64.7Low205 Ų20573.1 Ų73.178%0.77736%0.359SS*.THydrogen-bonded Turntrans-74.2-19.7175.961.9-93.6000113.1P225P225-W227 VanDerWaalsContact CB-NE1 3.3Å; P225-W227 HydrophobicContact CG-CZ2 4.03Å; P225-W227 PolarHBondContact O-N 3.19Å
228L48.6Very low64.3Low29 Ų2974.5 Ų74.515%0.15237%0.368CS..SBendtrans-75.1126167.2-105.994.3000109.2L224 P225 K226 L230 F235L224-L228 HydrophobicContact CB-CB 4.24Å; L224-L228 HydrophobicContact CD1-CB 4.27Å; L224-L228 HydrophobicContact CD1-CD2 3.67Å; L224-L228 HydrophobicContact CD2-CD2 4.2Å; L224-L228 HydrophobicContact CG-CD2 4.46Å; P225-L228 HydrophobicContact CG-CD1 4.49Å; P225-L228 PolarHBondContact O-N 3.37Å; K226-L228 VanDerWaalsContact C-N 3.31Å; L228-L230 PolarHBondContact O-N 2.86Å; L228-L230 VanDerWaalsContact O-N 3.1Å; L228-F235 HydrophobicContact CD2-CB 4.44Å; L228-F235 HydrophobicContact CD2-CD1 4.37Å; L228-F235 HydrophobicContact CD2-CD2 3.39Å; L228-F235 HydrophobicContact CD2-CE2 3.62Å; L228-F235 HydrophobicContact CD2-CG 3.81Å; L228-F235 HydrophobicContact CD2-CZ 4.2Å
229P55.8Low64Low77 Ų7776.1 Ų76.150%0.538%0.375SS..SBendtrans-74.10.8-176.630.5-35.4000113R291P229-R291 PolarHBondContact O-NH1 2.98Å; P229-R291 PolarHBondContact O-NH2 2.75Å
230L57.1Low63.9Low46 Ų4673.8 Ų73.824%0.24137%0.367CS..SBendtrans-119.9136.9-176.2-66.3171.1000110.1L224 L228 Q234 F235 L238L224-L230 WeakPolarHBondContact CD1-O 3.34Å; L228-L230 PolarHBondContact O-N 2.86Å; L228-L230 VanDerWaalsContact O-N 3.1Å; L230-Q234 HydrophobicContact CB-CB 4.12Å; L230-Q234 HydrophobicContact CD2-CB 4.22Å; L230-F235 HydrophobicContact CB-CB 4.25Å; L230-L238 HydrophobicContact CD1-CD2 3.98Å
231P67.3Low64Low68 Ų6871 Ų7144%0.44236%0.357SS..  trans-50.4146.3162.6-2130.8000110.1E233 Q234 F235P231-E233 PolarHBondContact O-N 3.48Å; P231-Q234 VanDerWaalsContact CD-OE1 3.29Å; P231-Q234 HydrophobicContact CG-CG 4.48Å; P231-Q234 PolarHBondContact O-N 3.39Å; P231-F235 PolarHBondContact O-N 2.85Å
232Y68.1Low64.4Low32 Ų3268.3 Ų68.313%0.12534%0.341CS..Hα-helixtrans-45-42.8-178.9179.8-79.7000112.8F213 K217 L224 F235 Y236F213-Y232 PolarHBondContact O-OH 3.07Å; K217-Y232 HydrophobicContact CB-CE1 3.98Å; K217-Y232 HydrophobicContact CB-CE2 4.35Å; K217-Y232 HydrophobicContact CD-CD1 3.61Å; K217-Y232 HydrophobicContact CD-CE1 3.35Å; K217-Y232 HydrophobicContact CD-CG 4.48Å; K217-Y232 HydrophobicContact CG-CD1 4.02Å; K217-Y232 HydrophobicContact CG-CE1 3.7Å; K217-Y232 HydrophobicContact CG-CE2 4.31Å; K217-Y232 HydrophobicContact CG-CG 4.5Å; L224-Y232 HydrophobicContact CD2-CD2 4.3Å; L224-Y232 HydrophobicContact CG-CD2 3.95Å; L224-Y232 HydrophobicContact CG-CG 4.44Å; Y232-F235 PolarHBondContact O-N 3.44Å; Y232-Y236 HydrophobicContact CE1-CD2 4.49Å; Y232-Y236 HydrophobicContact CE1-CG 4.4Å; Y232-Y236 VanDerWaalsContact O-CB 3.28Å; Y232-Y236 WeakPolarHBondContact O-CB 3.5Å; Y232-Y236 PolarHBondContact O-N 3.03Å
233E67.9Low65.3Low125 Ų12564.7 Ų64.758%0.58433%0.328SS*.Hα-helixtrans-67-39.1-177.6-51.1-151.4156.300112.8K217 P231 Y236 S237K217-E233 IonicContact NZ-OE1 2.61Å; K217-E233 PolarHBondContact NZ-OE1 3.2Å; P231-E233 PolarHBondContact O-N 3.48Å; E233-Y236 PolarHBondContact O-N 3.41Å; E233-S237 VanDerWaalsContact O-CB 3.22Å; E233-S237 WeakPolarHBondContact O-CB 3.38Å; E233-S237 PolarHBondContact O-N 2.91Å
234Q68.2Low66.7Low34 Ų3462.2 Ų62.216%0.15930%0.303CS..Hα-helixtrans-70.9-38.8177.2-71.7173.418.600111.6L230 P231 L238L230-Q234 HydrophobicContact CB-CB 4.12Å; L230-Q234 HydrophobicContact CD2-CB 4.22Å; P231-Q234 VanDerWaalsContact CD-OE1 3.29Å; P231-Q234 HydrophobicContact CG-CG 4.48Å; P231-Q234 PolarHBondContact O-N 3.39Å; Q234-L238 VanDerWaalsContact O-CB 3.23Å; Q234-L238 WeakPolarHBondContact O-CB 3.14Å; Q234-L238 PolarHBondContact O-N 3.26Å
235F72.1Confident68.5Low68 Ų6860.5 Ų60.530%0.29829%0.293SS..Hα-helixtrans-65.8-44.1174.7179.1-101.3000111.7L224 L228 L230 P231 Y232 L238 M239L224-F235 HydrophobicContact CD1-CB 3.35Å; L224-F235 HydrophobicContact CD1-CD1 3.94Å; L224-F235 HydrophobicContact CD1-CG 3.7Å; L224-F235 HydrophobicContact CD2-CD1 4.39Å; L228-F235 HydrophobicContact CD2-CB 4.44Å; L228-F235 HydrophobicContact CD2-CD1 4.37Å; L228-F235 HydrophobicContact CD2-CD2 3.39Å; L228-F235 HydrophobicContact CD2-CE2 3.62Å; L228-F235 HydrophobicContact CD2-CG 3.81Å; L228-F235 HydrophobicContact CD2-CZ 4.2Å; L230-F235 HydrophobicContact CB-CB 4.25Å; P231-F235 PolarHBondContact O-N 2.85Å; Y232-F235 PolarHBondContact O-N 3.44Å; F235-L238 PolarHBondContact O-N 3.01Å; F235-M239 HydrophobicContact CD1-CG 4.18Å; F235-M239 HydrophobicContact CE1-CG 3.72Å; F235-M239 HydrophobicContact CE1-SD 4.47Å; F235-M239 HydrophobicContact CE2-CE 4.23Å; F235-M239 HydrophobicContact CE2-CG 4.26Å; F235-M239 HydrophobicContact CE2-SD 4.48Å; F235-M239 HydrophobicContact CZ-CE 4.33Å; F235-M239 HydrophobicContact CZ-CG 3.77Å; F235-M239 HydrophobicContact CZ-SD 3.99Å; F235-M239 WeakPolarHBondContact O-CG 3.33Å; F235-M239 PolarHBondContact O-N 3.34Å
236Y72Confident70.4Confident20 Ų2061 Ų618%0.07829%0.293CS..Hα-helixtrans-62.9-44.5177.1-179-93.1000111.6C214 Y232 E233 L238 M239 Y240C214-Y236 HydrophobicContact CB-CE2 4.44Å; C214-Y236 WeakPolarHBondContact SG-CE2 3.24Å; C214-Y236 PolarHBondContact SG-OH 2.86Å; Y232-Y236 HydrophobicContact CE1-CD2 4.49Å; Y232-Y236 HydrophobicContact CE1-CG 4.4Å; Y232-Y236 VanDerWaalsContact O-CB 3.28Å; Y232-Y236 WeakPolarHBondContact O-CB 3.5Å; Y232-Y236 PolarHBondContact O-N 3.03Å; E233-Y236 PolarHBondContact O-N 3.41Å; Y236-L238 VanDerWaalsContact C-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.86Å; Y236-M239 PolarHBondContact O-N 3.42Å; Y236-Y240 HydrophobicContact CD1-CD2 4.21Å; Y236-Y240 AromaticContact CE1-CD2 3.58Å; Y236-Y240 HydrophobicContact CE1-CD2 3.58Å; Y236-Y240 AromaticContact CE1-CE2 3.73Å; Y236-Y240 HydrophobicContact CE1-CE2 3.73Å; Y236-Y240 HydrophobicContact CE2-CD2 4.01Å; Y236-Y240 AromaticContact CE2-CE2 3.76Å; Y236-Y240 HydrophobicContact CE2-CE2 3.76Å; Y236-Y240 AromaticContact CZ-CD2 3.47Å; Y236-Y240 VanDerWaalsContact CZ-CD2 3.47Å; Y236-Y240 AromaticContact CZ-CE2 3.17Å; Y236-Y240 PolarHBondContact O-N 3.42Å; Y236-Y240 WeakPolarHBondContact OH-CE2 3.27Å
237S70.7Confident72.2Confident18 Ų1852.1 Ų52.113%0.12626%0.257CS..Hα-helixtrans-60.3-42.7174.2-172.30000111.4E233 Y240 F241 E283E233-S237 VanDerWaalsContact O-CB 3.22Å; E233-S237 WeakPolarHBondContact O-CB 3.38Å; E233-S237 PolarHBondContact O-N 2.91Å; S237-Y240 PolarHBondContact O-N 3Å; S237-F241 WeakPolarHBondContact O-CB 3.38Å; S237-F241 PolarHBondContact O-N 3.27Å; S237-E283 WeakPolarHBondContact CB-OE2 3.47Å; S237-E283 PolarHBondContact OG-OE2 3.42Å
238L73.6Confident73.8Confident53 Ų5342.4 Ų42.428%0.27722%0.22SC..Hα-helixtrans-65-41.3175.8-174.367.1000112.6L230 Q234 F235 Y236 F241 I242L230-L238 HydrophobicContact CD1-CD2 3.98Å; Q234-L238 VanDerWaalsContact O-CB 3.23Å; Q234-L238 WeakPolarHBondContact O-CB 3.14Å; Q234-L238 PolarHBondContact O-N 3.26Å; F235-L238 PolarHBondContact O-N 3.01Å; Y236-L238 VanDerWaalsContact C-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.86Å; L238-F241 WeakPolarHBondContact O-CB 3.47Å; L238-F241 PolarHBondContact O-N 2.74Å; L238-I242 HydrophobicContact CD1-CD1 3.8Å; L238-I242 HydrophobicContact CD1-CG1 4.19Å; L238-I242 HydrophobicContact CD2-CD1 4.4Å; L238-I242 HydrophobicContact CG-CD1 3.79Å; L238-I242 HydrophobicContact CG-CG1 4.41Å; L238-I242 WeakPolarHBondContact O-CB 3.49Å; L238-I242 WeakPolarHBondContact O-CG1 3.48Å; L238-I242 PolarHBondContact O-N 2.81Å
239M73.6Confident75.8Confident59 Ų5941.9 Ų41.929%0.29122%0.218SC..Hα-helixtrans-59.1-51.9173.6-74.9-68.597.700110.3F235 Y236 F241 I242 T243F235-M239 HydrophobicContact CD1-CG 4.18Å; F235-M239 HydrophobicContact CE1-CG 3.72Å; F235-M239 HydrophobicContact CE1-SD 4.47Å; F235-M239 HydrophobicContact CE2-CE 4.23Å; F235-M239 HydrophobicContact CE2-CG 4.26Å; F235-M239 HydrophobicContact CE2-SD 4.48Å; F235-M239 HydrophobicContact CZ-CE 4.33Å; F235-M239 HydrophobicContact CZ-CG 3.77Å; F235-M239 HydrophobicContact CZ-SD 3.99Å; F235-M239 WeakPolarHBondContact O-CG 3.33Å; F235-M239 PolarHBondContact O-N 3.34Å; Y236-M239 PolarHBondContact O-N 3.42Å; M239-F241 VanDerWaalsContact C-N 3.27Å; M239-F241 PolarHBondContact O-N 3.18Å; M239-I242 PolarHBondContact O-N 3.46Å; M239-T243 WeakPolarHBondContact O-CB 3.47Å; M239-T243 PolarHBondContact O-N 3.14Å; M239-T243 PolarHBondContact O-OG1 2.9Å
240Y76.3Confident77.6Confident11 Ų1143.1 Ų43.14%0.04322%0.219CC..Hα-helixtrans-57.8-38.8176-104.6-88000113.5D170 L210 Y236 S237 V244 N245D170-Y240 HydrophobicContact CB-CE1 3.94Å; D170-Y240 WeakPolarHBondContact OD2-CE1 3.47Å; L210-Y240 HydrophobicContact CB-CE2 4.12Å; L210-Y240 HydrophobicContact CD2-CD2 3.39Å; L210-Y240 HydrophobicContact CD2-CE1 4.35Å; L210-Y240 HydrophobicContact CD2-CE2 3.08Å; L210-Y240 HydrophobicContact CD2-CG 4.14Å; L210-Y240 HydrophobicContact CG-CE2 4.06Å; Y236-Y240 HydrophobicContact CD1-CD2 4.21Å; Y236-Y240 AromaticContact CE1-CD2 3.58Å; Y236-Y240 HydrophobicContact CE1-CD2 3.58Å; Y236-Y240 AromaticContact CE1-CE2 3.73Å; Y236-Y240 HydrophobicContact CE1-CE2 3.73Å; Y236-Y240 HydrophobicContact CE2-CD2 4.01Å; Y236-Y240 AromaticContact CE2-CE2 3.76Å; Y236-Y240 HydrophobicContact CE2-CE2 3.76Å; Y236-Y240 AromaticContact CZ-CD2 3.47Å; Y236-Y240 VanDerWaalsContact CZ-CD2 3.47Å; Y236-Y240 AromaticContact CZ-CE2 3.17Å; Y236-Y240 PolarHBondContact O-N 3.42Å; Y236-Y240 WeakPolarHBondContact OH-CE2 3.27Å; S237-Y240 PolarHBondContact O-N 3Å; Y240-V244 HydrophobicContact CD1-CB 3.99Å; Y240-V244 HydrophobicContact CD1-CG1 4.39Å; Y240-V244 HydrophobicContact CD1-CG2 3.81Å; Y240-V244 HydrophobicContact CE1-CB 4.37Å; Y240-V244 HydrophobicContact CE1-CG1 4.41Å; Y240-V244 HydrophobicContact CE1-CG2 3.96Å; Y240-V244 HydrophobicContact CG-CG2 4.41Å; Y240-V244 WeakPolarHBondContact O-CB 3.48Å; Y240-V244 PolarHBondContact O-N 2.98Å; Y240-V244 VanDerWaalsContact O-N 3.1Å; Y240-N245 PolarHBondContact O-N 2.64Å; Y240-N245 PolarHBondContact O-ND2 2.81Å
241F76.9Confident79.2Confident51 Ų5142 Ų4222%0.22421%0.214CC..Iπ-helixtrans-60.4-52.8176.1-177.8-83.9000111.1S237 L238 M239 L246 L277 T281S237-F241 WeakPolarHBondContact O-CB 3.38Å; S237-F241 PolarHBondContact O-N 3.27Å; L238-F241 WeakPolarHBondContact O-CB 3.47Å; L238-F241 PolarHBondContact O-N 2.74Å; M239-F241 VanDerWaalsContact C-N 3.27Å; M239-F241 PolarHBondContact O-N 3.18Å; F241-L246 HydrophobicContact CE1-CD2 4.22Å; F241-L246 VanDerWaalsContact O-CB 3.25Å; F241-L246 WeakPolarHBondContact O-CB 3.4Å; F241-L246 PolarHBondContact O-N 3.45Å; F241-L246 VanDerWaalsContact O-N 3.14Å; F241-L277 HydrophobicContact CD1-CD2 4.37Å; F241-L277 HydrophobicContact CD2-CB 4.43Å; F241-L277 HydrophobicContact CD2-CD2 3.35Å; F241-L277 HydrophobicContact CD2-CG 4.45Å; F241-L277 HydrophobicContact CE1-CD2 4.25Å; F241-L277 HydrophobicContact CE2-CB 3.9Å; F241-L277 HydrophobicContact CE2-CD2 3.18Å; F241-L277 HydrophobicContact CE2-CG 4.11Å; F241-L277 HydrophobicContact CG-CD2 3.96Å; F241-L277 HydrophobicContact CZ-CD2 3.67Å; F241-T281 HydrophobicContact CE2-CG2 3.78Å; F241-T281 HydrophobicContact CZ-CG2 4.23Å
242I77.7Confident80.3Confident85 Ų8539 Ų3944%0.43619%0.194SC..Iπ-helixtrans-76.5-35.8-172.7-65.1175.1000112.1L238 M239 P247L238-I242 HydrophobicContact CD1-CD1 3.8Å; L238-I242 HydrophobicContact CD1-CG1 4.19Å; L238-I242 HydrophobicContact CD2-CD1 4.4Å; L238-I242 HydrophobicContact CG-CD1 3.79Å; L238-I242 HydrophobicContact CG-CG1 4.41Å; L238-I242 WeakPolarHBondContact O-CB 3.49Å; L238-I242 WeakPolarHBondContact O-CG1 3.48Å; L238-I242 PolarHBondContact O-N 2.81Å; M239-I242 PolarHBondContact O-N 3.46Å; I242-P247 WeakPolarHBondContact O-CD 3.01Å; I242-P247 WeakPolarHBondContact O-CG 3.29Å
243T77.1Confident81.3Confident25 Ų2541.1 Ų41.115%0.15321%0.206CC..Iπ-helixtrans-101.8-20.4-17065.90000114L203 F206 M239L203-T243 WeakPolarHBondContact CD2-O 3.31Å; F206-T243 HydrophobicContact CD1-CG2 4.46Å; F206-T243 HydrophobicContact CE1-CG2 3.74Å; F206-T243 WeakPolarHBondContact CE1-OG1 3.44Å; M239-T243 WeakPolarHBondContact O-CB 3.47Å; M239-T243 PolarHBondContact O-N 3.14Å; M239-T243 PolarHBondContact O-OG1 2.9Å
244V83.4Confident82.3Confident0 Ų040.1 Ų40.10%020%0.2CC..Iπ-helixtrans-118.3-70.3-174.3-171.10000110.8N207 L210 Y240 L246 P247 F248N207-V244 HydrophobicContact CB-CG2 4.26Å; N207-V244 WeakPolarHBondContact ND2-CG1 3.48Å; N207-V244 VanDerWaalsContact OD1-CG2 3.27Å; N207-V244 WeakPolarHBondContact OD1-CG2 3.37Å; L210-V244 HydrophobicContact CD2-CG2 4.28Å; Y240-V244 HydrophobicContact CD1-CB 3.99Å; Y240-V244 HydrophobicContact CD1-CG1 4.39Å; Y240-V244 HydrophobicContact CD1-CG2 3.81Å; Y240-V244 HydrophobicContact CE1-CB 4.37Å; Y240-V244 HydrophobicContact CE1-CG1 4.41Å; Y240-V244 HydrophobicContact CE1-CG2 3.96Å; Y240-V244 HydrophobicContact CG-CG2 4.41Å; Y240-V244 WeakPolarHBondContact O-CB 3.48Å; Y240-V244 PolarHBondContact O-N 2.98Å; Y240-V244 VanDerWaalsContact O-N 3.1Å; V244-L246 PolarHBondContact O-N 3.32Å; V244-P247 WeakPolarHBondContact O-CD 3.34Å; V244-F248 HydrophobicContact CG1-CD2 4.49Å; V244-F248 HydrophobicContact CG1-CE1 4.41Å; V244-F248 HydrophobicContact CG1-CE2 4.28Å; V244-F248 HydrophobicContact CG1-CZ 4.25Å; V244-F248 WeakPolarHBondContact O-CB 3.25Å; V244-F248 WeakPolarHBondContact O-CD1 3.41Å; V244-F248 VanDerWaalsContact O-CG 3.24Å; V244-F248 WeakPolarHBondContact O-CG 3.47Å; V244-F248 PolarHBondContact O-N 3.4Å
245N87.9Confident83.2Confident4 Ų438.5 Ų38.52%0.02119%0.193CC..Iπ-helixtrans-68.4-44.8-166.8-66.4-65.9000112.4Y240 L249 K272 N273 M276 L277Y240-N245 PolarHBondContact O-N 2.64Å; Y240-N245 PolarHBondContact O-ND2 2.81Å; N245-L249 VanDerWaalsContact O-CB 3.3Å; N245-L249 WeakPolarHBondContact O-CB 3.44Å; N245-L249 PolarHBondContact O-N 2.88Å; N245-L249 VanDerWaalsContact O-N 3.12Å; N245-K272 PolarHBondContact OD1-NZ 3.29Å; N245-N273 HydrophobicContact CB-CB 4.43Å; N245-N273 PolarHBondContact O-ND2 3.31Å; N245-N273 PolarHBondContact OD1-OD1 2.87Å; N245-M276 HydrophobicContact CB-CB 4.33Å; N245-M276 WeakPolarHBondContact OD1-CB 3.49Å; N245-L277 HydrophobicContact CB-CD2 3.89Å; N245-L277 HydrophobicContact CB-CG 4.11Å
246L90.2Very high83.7Confident60 Ų6037.2 Ų37.231%0.31419%0.19SC..Hα-helixtrans-69.5-51.3-179.2-177.764.2000111.9F241 V244 F248 L249 L250 L277F241-L246 HydrophobicContact CE1-CD2 4.22Å; F241-L246 VanDerWaalsContact O-CB 3.25Å; F241-L246 WeakPolarHBondContact O-CB 3.4Å; F241-L246 PolarHBondContact O-N 3.45Å; F241-L246 VanDerWaalsContact O-N 3.14Å; V244-L246 PolarHBondContact O-N 3.32Å; L246-F248 PolarHBondContact O-N 3.45Å; L246-L249 PolarHBondContact O-N 3.11Å; L246-L250 HydrophobicContact CD1-CD1 4.17Å; L246-L250 HydrophobicContact CD1-CG 4.16Å; L246-L250 HydrophobicContact CG-CD1 4.06Å; L246-L250 HydrophobicContact CG-CG 4.45Å; L246-L250 WeakPolarHBondContact O-CG 3.37Å; L246-L250 PolarHBondContact O-N 3.22Å; L246-L277 HydrophobicContact CB-CD2 3.82Å; L246-L277 HydrophobicContact CD1-CD1 4.14Å
247P92Very high84.3Confident25 Ų2540.3 Ų40.316%0.16221%0.214CC..Hα-helixtrans-61.9-42.1179.7-24.536.2000112.9L203 I242 V244 L249 L250 I251L203-P247 HydrophobicContact CD1-CB 3.68Å; L203-P247 HydrophobicContact CD2-CB 4.1Å; L203-P247 HydrophobicContact CD2-CG 4.34Å; I242-P247 WeakPolarHBondContact O-CD 3.01Å; I242-P247 WeakPolarHBondContact O-CG 3.29Å; V244-P247 WeakPolarHBondContact O-CD 3.34Å; P247-L249 VanDerWaalsContact C-N 3.3Å; P247-L249 PolarHBondContact O-N 3.41Å; P247-L250 PolarHBondContact O-N 2.99Å; P247-I251 WeakPolarHBondContact O-CB 3.5Å; P247-I251 WeakPolarHBondContact O-CG1 3.4Å; P247-I251 PolarHBondContact O-N 2.86Å
248F92.5Very high84.9Confident0 Ų041.2 Ų41.20%022%0.218CC..Hα-helixtrans-62.9-40178.7-79.531.6000111F177 L203 N207 V244 L246 R252 N273F177-F248 HydrophobicContact CB-CD2 3.9Å; F177-F248 HydrophobicContact CB-CE2 3.69Å; F177-F248 HydrophobicContact CB-CZ 4.21Å; F177-F248 AromaticContact CD1-CD1 3.87Å; F177-F248 HydrophobicContact CD1-CD1 3.87Å; F177-F248 HydrophobicContact CD1-CD2 4.17Å; F177-F248 AromaticContact CD1-CE1 3.62Å; F177-F248 HydrophobicContact CD1-CE1 3.62Å; F177-F248 AromaticContact CD1-CE2 3.93Å; F177-F248 HydrophobicContact CD1-CE2 3.93Å; F177-F248 HydrophobicContact CD1-CG 4.14Å; F177-F248 AromaticContact CD1-CZ 3.64Å; F177-F248 HydrophobicContact CD1-CZ 3.64Å; F177-F248 HydrophobicContact CD2-CB 4.33Å; F177-F248 HydrophobicContact CD2-CD1 4.45Å; F177-F248 HydrophobicContact CD2-CD2 4.13Å; F177-F248 HydrophobicContact CD2-CG 4.04Å; F177-F248 AromaticContact CE1-CD1 3.75Å; F177-F248 HydrophobicContact CE1-CD1 3.75Å; F177-F248 AromaticContact CE1-CE1 3.73Å; F177-F248 HydrophobicContact CE1-CE1 3.73Å; F177-F248 HydrophobicContact CE1-CG 4.28Å; F177-F248 HydrophobicContact CE1-CZ 4.24Å; F177-F248 HydrophobicContact CE2-CB 4.31Å; F177-F248 HydrophobicContact CE2-CD1 4.37Å; F177-F248 HydrophobicContact CE2-CG 4.22Å; F177-F248 HydrophobicContact CG-CD1 4.23Å; F177-F248 AromaticContact CG-CD2 3.82Å; F177-F248 HydrophobicContact CG-CD2 3.82Å; F177-F248 HydrophobicContact CG-CE1 4.26Å; F177-F248 AromaticContact CG-CE2 3.85Å; F177-F248 HydrophobicContact CG-CE2 3.85Å; F177-F248 HydrophobicContact CG-CG 4.01Å; F177-F248 HydrophobicContact CG-CZ 4.07Å; F177-F248 HydrophobicContact CZ-CD1 4.02Å; F177-F248 HydrophobicContact CZ-CE1 4.46Å; F177-F248 HydrophobicContact CZ-CG 4.33Å; L203-F248 HydrophobicContact CB-CD1 4.45Å; L203-F248 HydrophobicContact CB-CE1 3.86Å; N207-F248 HydrophobicContact CB-CZ 4.4Å; V244-F248 HydrophobicContact CG1-CD2 4.49Å; V244-F248 HydrophobicContact CG1-CE1 4.41Å; V244-F248 HydrophobicContact CG1-CE2 4.28Å; V244-F248 HydrophobicContact CG1-CZ 4.25Å; V244-F248 WeakPolarHBondContact O-CB 3.25Å; V244-F248 WeakPolarHBondContact O-CD1 3.41Å; V244-F248 VanDerWaalsContact O-CG 3.24Å; V244-F248 WeakPolarHBondContact O-CG 3.47Å; V244-F248 PolarHBondContact O-N 3.4Å; L246-F248 PolarHBondContact O-N 3.45Å; F248-R252 VanDerWaalsContact O-CB 3.32Å; F248-R252 WeakPolarHBondContact O-CB 3.37Å; F248-R252 WeakPolarHBondContact O-CD 3.5Å; F248-R252 WeakPolarHBondContact O-CG 3.45Å; F248-R252 PolarHBondContact O-N 2.81Å; F248-N273 WeakPolarHBondContact CB-ND2 3.34Å
249L91.8Very high84.9Confident19 Ų1944.6 Ų44.610%0.09924%0.243CC..Hα-helixtrans-64.6-49.9177-178.962.6000111.5N245 L246 P247 I251 R252 I253 M270 N273 V274 L277N245-L249 VanDerWaalsContact O-CB 3.3Å; N245-L249 WeakPolarHBondContact O-CB 3.44Å; N245-L249 PolarHBondContact O-N 2.88Å; N245-L249 VanDerWaalsContact O-N 3.12Å; L246-L249 PolarHBondContact O-N 3.11Å; P247-L249 VanDerWaalsContact C-N 3.3Å; P247-L249 PolarHBondContact O-N 3.41Å; L249-I251 VanDerWaalsContact C-N 3.34Å; L249-I251 PolarHBondContact O-N 3.34Å; L249-R252 PolarHBondContact O-N 3.09Å; L249-I253 HydrophobicContact CD1-CD1 4Å; L249-I253 HydrophobicContact CD1-CG1 4.25Å; L249-I253 HydrophobicContact CG-CD1 3.87Å; L249-I253 HydrophobicContact CG-CG1 4.48Å; L249-I253 WeakPolarHBondContact O-CG1 3.39Å; L249-I253 PolarHBondContact O-N 3.49Å; L249-M270 HydrophobicContact CD1-CB 4.05Å; L249-M270 HydrophobicContact CD1-CE 4.32Å; L249-M270 HydrophobicContact CD1-CG 4.48Å; L249-N273 HydrophobicContact CB-CB 3.98Å; L249-N273 HydrophobicContact CD1-CB 4.47Å; L249-N273 PolarHBondContact N-ND2 3.46Å; L249-V274 HydrophobicContact CD1-CG2 4.03Å; L249-V274 HydrophobicContact CD2-CG2 3.69Å; L249-L277 HydrophobicContact CD2-CD1 3.69Å
250L92.4Very high85Confident102 Ų10248.2 Ų48.253%0.53426%0.263SS..Hα-helixtrans-59.8-45.1-179-69.4175.9000111.7L246 P247 I253 F254L246-L250 HydrophobicContact CD1-CD1 4.17Å; L246-L250 HydrophobicContact CD1-CG 4.16Å; L246-L250 HydrophobicContact CG-CD1 4.06Å; L246-L250 HydrophobicContact CG-CG 4.45Å; L246-L250 WeakPolarHBondContact O-CG 3.37Å; L246-L250 PolarHBondContact O-N 3.22Å; P247-L250 PolarHBondContact O-N 2.99Å; L250-I253 PolarHBondContact O-N 3.08Å; L250-F254 WeakPolarHBondContact O-CB 3.32Å; L250-F254 PolarHBondContact O-N 2.96Å
251I91.5Very high84.6Confident23 Ų2348 Ų4812%0.11826%0.263CS..Hα-helixtrans-65.8-41178.6-69.2167.8000110.8F177 L180 L196 I200 L203 P247 L249 F254 V255F177-I251 HydrophobicContact CE2-CB 3.88Å; F177-I251 HydrophobicContact CE2-CG2 3.65Å; F177-I251 HydrophobicContact CZ-CB 3.93Å; F177-I251 HydrophobicContact CZ-CD1 3.72Å; F177-I251 HydrophobicContact CZ-CG1 4.42Å; F177-I251 HydrophobicContact CZ-CG2 3.75Å; L180-I251 HydrophobicContact CD1-CG2 4.37Å; L196-I251 HydrophobicContact CD1-CD1 4.34Å; L196-I251 HydrophobicContact CD1-CG1 4.06Å; L196-I251 HydrophobicContact CD1-CG2 4.02Å; I200-I251 HydrophobicContact CD1-CG2 4Å; I200-I251 HydrophobicContact CG1-CD1 4.42Å; I200-I251 HydrophobicContact CG1-CG2 3.93Å; L203-I251 HydrophobicContact CD1-CD1 3.6Å; P247-I251 WeakPolarHBondContact O-CB 3.5Å; P247-I251 WeakPolarHBondContact O-CG1 3.4Å; P247-I251 PolarHBondContact O-N 2.86Å; L249-I251 VanDerWaalsContact C-N 3.34Å; L249-I251 PolarHBondContact O-N 3.34Å; I251-F254 PolarHBondContact O-N 3.13Å; I251-V255 HydrophobicContact CG2-CG2 4.36Å; I251-V255 WeakPolarHBondContact O-CG2 3.36Å; I251-V255 PolarHBondContact O-N 3.37Å
252R90.8Very high84.2Confident6 Ų648.9 Ų48.92%0.02327%0.274CS..Hα-helixtrans-63.6-42.2175.9-76.9172.9179.7144.60.9112.3D173 F177 L180 F248 L249 F254 V255 V256 M270 N273D173-R252 PolarHBondContact O-NH2 2.94Å; D173-R252 VanDerWaalsContact O-NH2 3.09Å; D173-R252 IonicContact OD1-CZ 3.12Å; D173-R252 IonicContact OD1-NH1 2.73Å; D173-R252 PolarHBondContact OD1-NH1 3.21Å; D173-R252 IonicContact OD1-NH2 2.64Å; D173-R252 PolarHBondContact OD1-NH2 3.2Å; D173-R252 IonicContact OD2-NH1 3.8Å; F177-R252 HydrophobicContact CD2-CG 4.38Å; F177-R252 HydrophobicContact CE2-CG 4.49Å; L180-R252 HydrophobicContact CD1-CG 4.25Å; F248-R252 VanDerWaalsContact O-CB 3.32Å; F248-R252 WeakPolarHBondContact O-CB 3.37Å; F248-R252 WeakPolarHBondContact O-CD 3.5Å; F248-R252 WeakPolarHBondContact O-CG 3.45Å; F248-R252 PolarHBondContact O-N 2.81Å; L249-R252 PolarHBondContact O-N 3.09Å; R252-F254 VanDerWaalsContact C-N 3.34Å; R252-V255 PolarHBondContact O-N 3.46Å; R252-V256 VanDerWaalsContact O-CB 3.26Å; R252-V256 WeakPolarHBondContact O-CB 3.4Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.28Å; R252-V256 PolarHBondContact O-N 3.35Å; R252-M270 HydrophobicContact CB-CE 4.26Å; R252-M270 HydrophobicContact CB-CG 3.82Å; R252-M270 HydrophobicContact CB-SD 4.08Å; R252-M270 HydrophobicContact CG-CG 4.33Å; R252-N273 PolarHBondContact NH1-ND2 2.96Å
253I89.1Confident83.5Confident75 Ų7550.9 Ų50.939%0.38529%0.285SS..Hα-helixtrans-60.8-46.8175.4-68.8169.7000109.8L249 L250 V255 V256 S257 M270L249-I253 HydrophobicContact CD1-CD1 4Å; L249-I253 HydrophobicContact CD1-CG1 4.25Å; L249-I253 HydrophobicContact CG-CD1 3.87Å; L249-I253 HydrophobicContact CG-CG1 4.48Å; L249-I253 WeakPolarHBondContact O-CG1 3.39Å; L249-I253 PolarHBondContact O-N 3.49Å; L250-I253 PolarHBondContact O-N 3.08Å; I253-V255 PolarHBondContact O-N 3.45Å; I253-V256 PolarHBondContact O-N 3.34Å; I253-S257 WeakPolarHBondContact O-CB 3.34Å; I253-S257 PolarHBondContact O-N 2.66Å; I253-S257 PolarHBondContact O-OG 3.49Å; I253-M270 HydrophobicContact CB-CE 4.46Å; I253-M270 HydrophobicContact CG1-CE 3.52Å
254F89Confident82.7Confident105 Ų10552.8 Ų52.846%0.46130%0.297SS..Hα-helixtrans-56.8-51.7177.8175.2-96.8000111.8L196 L250 I251 R252 V256 S257L196-F254 HydrophobicContact CD2-CD1 3.78Å; L196-F254 HydrophobicContact CD2-CE1 3.59Å; L250-F254 WeakPolarHBondContact O-CB 3.32Å; L250-F254 PolarHBondContact O-N 2.96Å; I251-F254 PolarHBondContact O-N 3.13Å; R252-F254 VanDerWaalsContact C-N 3.34Å; F254-V256 PolarHBondContact O-N 2.94Å; F254-S257 PolarHBondContact O-N 3.17Å
255V86Confident81.7Confident0 Ų055.6 Ų55.60%033%0.325CS..Hα-helixtrans-63.5-43-179.8175.30000111.4L180 R186 L189 M190 I251 R252 I253 S257 D258 S261L180-V255 HydrophobicContact CD2-CG1 4.37Å; R186-V255 HydrophobicContact CG-CG1 4.13Å; L189-V255 HydrophobicContact CD2-CG1 4.42Å; M190-V255 HydrophobicContact CE-CG1 4.46Å; M190-V255 HydrophobicContact CE-CG2 3.42Å; M190-V255 VanDerWaalsContact CE-CG2 3.42Å; I251-V255 HydrophobicContact CG2-CG2 4.36Å; I251-V255 WeakPolarHBondContact O-CG2 3.36Å; I251-V255 PolarHBondContact O-N 3.37Å; R252-V255 PolarHBondContact O-N 3.46Å; I253-V255 PolarHBondContact O-N 3.45Å; V255-S257 VanDerWaalsContact C-N 3.27Å; V255-S257 PolarHBondContact O-N 2.9Å; V255-D258 VanDerWaalsContact O-CB 3.32Å; V255-D258 WeakPolarHBondContact O-CB 3.43Å; V255-D258 PolarHBondContact O-N 2.7Å; V255-S261 PolarHBondContact O-OG 2.88Å
256V83.5Confident80.9Confident41 Ų4156.4 Ų56.425%0.24834%0.335CS..Hα-helixtrans-69.7-23.6180165.10000113R252 I253 F254 D258 I263 M270R252-V256 VanDerWaalsContact O-CB 3.26Å; R252-V256 WeakPolarHBondContact O-CB 3.4Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.28Å; R252-V256 PolarHBondContact O-N 3.35Å; I253-V256 PolarHBondContact O-N 3.34Å; F254-V256 PolarHBondContact O-N 2.94Å; V256-D258 PolarHBondContact O-N 3.16Å; V256-I263 HydrophobicContact CG1-CD1 4.06Å; V256-I263 HydrophobicContact CG1-CG1 3.95Å; V256-M270 HydrophobicContact CG2-SD 4.39Å
257S85Confident80.4Confident84 Ų8456.9 Ų56.959%0.58734%0.343SS*.THydrogen-bonded Turntrans-76.8-10.2178.5-57.40000112.8I253 F254 V255 P259I253-S257 WeakPolarHBondContact O-CB 3.34Å; I253-S257 PolarHBondContact O-N 2.66Å; I253-S257 PolarHBondContact O-OG 3.49Å; F254-S257 PolarHBondContact O-N 3.17Å; V255-S257 VanDerWaalsContact C-N 3.27Å; V255-S257 PolarHBondContact O-N 2.9Å; S257-P259 WeakPolarHBondContact O-CD 3.43Å
258D81.7Confident80.1Confident38 Ų3861 Ų6120%0.20337%0.367CS..  trans-68.3117.8175.6-175.119.9000110.2L189 V255 V256 D260 S261L189-D258 HydrophobicContact CD2-CB 4.17Å; V255-D258 VanDerWaalsContact O-CB 3.32Å; V255-D258 WeakPolarHBondContact O-CB 3.43Å; V255-D258 PolarHBondContact O-N 2.7Å; V256-D258 PolarHBondContact O-N 3.16Å; D258-D260 PolarHBondContact O-N 2.81Å; D258-D260 VanDerWaalsContact O-N 3.13Å; D258-S261 PolarHBondContact O-N 3.13Å
259P75.2Confident79.7Confident123 Ų12362.9 Ų62.980%0.79938%0.376SS*.THydrogen-bonded Turntrans-57.6-29.4-176-23.433000113.7S257 S261S257-P259 WeakPolarHBondContact O-CD 3.43Å; P259-S261 VanDerWaalsContact C-N 3.31Å
260D74.5Confident79.5Confident135 Ų13563.7 Ų63.772%0.72238%0.379SS*.THydrogen-bonded Turntrans-85.5-6.4-176.5-63.9-34.7000112.7D258 P262D258-D260 PolarHBondContact O-N 2.81Å; D258-D260 VanDerWaalsContact O-N 3.13Å; D260-P262 WeakPolarHBondContact O-CD 3.42Å
261S69Low79.4Confident6 Ų663.2 Ų63.24%0.04238%0.38CS..SBendtrans-109.9102.7-1791010000111.1V255 D258 P259V255-S261 PolarHBondContact O-OG 2.88Å; D258-S261 PolarHBondContact O-N 3.13Å; P259-S261 VanDerWaalsContact C-N 3.31Å
262P67.4Low79.3Confident70 Ų7063.3 Ų63.346%0.45538%0.38SS..  trans-63.5149.2178.222.4-30.2000111.4I185 D260 T264I185-P262 HydrophobicContact CD1-CG 4.44Å; D260-P262 WeakPolarHBondContact O-CD 3.42Å; P262-T264 VanDerWaalsContact C-N 3.3Å; P262-T264 PolarHBondContact O-N 2.98Å; P262-T264 PolarHBondContact O-OG1 3.22Å
263I62.7Low79.2Confident128 Ų12863 Ų6366%0.65638%0.379SS*.  trans-68.785.7178.2-47.9-174.1000109.6V256V256-I263 HydrophobicContact CG1-CD1 4.06Å; V256-I263 HydrophobicContact CG1-CG1 3.95Å
264T61.2Low79.3Confident65 Ų6562.4 Ų62.440%0.39938%0.379SS..  trans-113.6116177.742.60000110.7R186 P262R186-T264 PolarHBondContact NH1-O 3.45Å; R186-T264 PolarHBondContact NH2-O 2.96Å; R186-T264 PolarHBondContact NH2-OG1 3.48Å; P262-T264 VanDerWaalsContact C-N 3.3Å; P262-T264 PolarHBondContact O-N 2.98Å; P262-T264 PolarHBondContact O-OG1 3.22Å
265G61.5Low79.3Confident58 Ų5861 Ų6160%0.59838%0.378SS*.SBendtrans56.787.2162.600000115.6
266G71.5Confident79.3Confident22 Ų2263.4 Ų63.423%0.22739%0.39CS..  trans168.9-11.6176.300000115.2V268 F269 M270G266-V268 VanDerWaalsContact C-N 3.31Å; G266-V268 PolarHBondContact O-N 2.84Å; G266-F269 PolarHBondContact O-N 3.29Å; G266-M270 PolarHBondContact O-N 3.05Å
267S80.9Confident79.4Confident69 Ų6962.5 Ų62.548%0.48338%0.384SS..Hα-helixtrans-56.8-40-179.453.40000113.3F269 M270 V271S267-F269 VanDerWaalsContact C-N 3.25Å; S267-F269 PolarHBondContact O-N 2.75Å; S267-M270 WeakPolarHBondContact O-CB 3.44Å; S267-M270 PolarHBondContact O-N 3.46Å; S267-M270 VanDerWaalsContact O-N 3.1Å; S267-V271 WeakPolarHBondContact O-CG2 3.26Å; S267-V271 PolarHBondContact O-N 3.35Å
268V84.9Confident79.6Confident111 Ų11163.9 Ų63.967%0.67338%0.384SS*.Hα-helixtrans-57.8-40.8176.8179.60000111.2G266 V271 K272G266-V268 VanDerWaalsContact C-N 3.31Å; G266-V268 PolarHBondContact O-N 2.84Å; V268-V271 PolarHBondContact O-N 2.96Å; V268-K272 PolarHBondContact O-N 3.4Å
269F85Confident79.7Confident40 Ų4065.2 Ų65.218%0.17539%0.393CS..Hα-helixtrans-77.2-26.2178.6-73.1-78.9000113L169 I172 D173 V176 G266 S267 N273L169-F269 HydrophobicContact CD2-CE1 4.3Å; I172-F269 HydrophobicContact CB-CZ 4.48Å; I172-F269 HydrophobicContact CG2-CE1 4.05Å; I172-F269 HydrophobicContact CG2-CZ 3.56Å; D173-F269 HydrophobicContact CB-CD1 3.63Å; D173-F269 HydrophobicContact CB-CE1 3.9Å; D173-F269 WeakPolarHBondContact OD1-CB 3.4Å; D173-F269 VanDerWaalsContact OD1-CD1 3.24Å; D173-F269 WeakPolarHBondContact OD1-CD1 3.32Å; V176-F269 HydrophobicContact CB-CD2 4.03Å; V176-F269 HydrophobicContact CB-CE2 4.16Å; V176-F269 HydrophobicContact CB-CG 4.47Å; V176-F269 HydrophobicContact CG1-CD2 3.74Å; V176-F269 HydrophobicContact CG1-CE2 4.23Å; V176-F269 HydrophobicContact CG1-CG 4.34Å; V176-F269 HydrophobicContact CG2-CD2 3.97Å; V176-F269 HydrophobicContact CG2-CE2 3.59Å; V176-F269 HydrophobicContact CG2-CZ 4.06Å; G266-F269 PolarHBondContact O-N 3.29Å; S267-F269 VanDerWaalsContact C-N 3.25Å; S267-F269 PolarHBondContact O-N 2.75Å; F269-N273 VanDerWaalsContact O-CG 3.29Å; F269-N273 PolarHBondContact O-N 3.4Å
270M87.4Confident79.9Confident36 Ų3659.5 Ų59.518%0.17736%0.357CS..Hα-helixtrans-63.9-46.9166.6-63.9177.270.900110.9L249 R252 I253 V256 G266 S267 K272 N273 V274L249-M270 HydrophobicContact CD1-CB 4.05Å; L249-M270 HydrophobicContact CD1-CE 4.32Å; L249-M270 HydrophobicContact CD1-CG 4.48Å; R252-M270 HydrophobicContact CB-CE 4.26Å; R252-M270 HydrophobicContact CB-CG 3.82Å; R252-M270 HydrophobicContact CB-SD 4.08Å; R252-M270 HydrophobicContact CG-CG 4.33Å; I253-M270 HydrophobicContact CB-CE 4.46Å; I253-M270 HydrophobicContact CG1-CE 3.52Å; V256-M270 HydrophobicContact CG2-SD 4.39Å; G266-M270 PolarHBondContact O-N 3.05Å; S267-M270 WeakPolarHBondContact O-CB 3.44Å; S267-M270 PolarHBondContact O-N 3.46Å; S267-M270 VanDerWaalsContact O-N 3.1Å; M270-K272 VanDerWaalsContact C-N 3.34Å; M270-K272 PolarHBondContact O-N 2.93Å; M270-N273 PolarHBondContact O-N 3.2Å; M270-N273 VanDerWaalsContact O-N 3.15Å; M270-V274 WeakPolarHBondContact O-CG2 3.23Å; M270-V274 PolarHBondContact O-N 2.64Å
271V88.9Confident80.3Confident92 Ų9256.1 Ų56.156%0.55834%0.342SS*.Hα-helixtrans-61.9-43.5176.5175.50000110.6S267 V268 N273 V274 V275S267-V271 WeakPolarHBondContact O-CG2 3.26Å; S267-V271 PolarHBondContact O-N 3.35Å; V268-V271 PolarHBondContact O-N 2.96Å; V271-N273 VanDerWaalsContact C-N 3.29Å; V271-N273 PolarHBondContact O-N 3.48Å; V271-V274 PolarHBondContact O-N 3.47Å; V271-V275 HydrophobicContact CG1-CG2 4.33Å; V271-V275 WeakPolarHBondContact O-CG2 3.29Å; V271-V275 PolarHBondContact O-N 2.89Å
272K89.7Confident81.1Confident25 Ų2563.8 Ų63.811%0.10937%0.369CS..Hα-helixtrans-53.6-47.7172.5173.3-93.4-170.9-176.30111.3L169 D170 D173 N245 V268 M270 V274 V275 M276L169-K272 HydrophobicContact CD2-CD 3.89Å; L169-K272 VanDerWaalsContact CD2-CE 3.42Å; L169-K272 HydrophobicContact CD2-CG 3.59Å; D170-K272 WeakPolarHBondContact OD1-CE 2.98Å; D170-K272 IonicContact OD1-NZ 2.7Å; D170-K272 PolarHBondContact OD1-NZ 3.26Å; D173-K272 IonicContact OD2-NZ 2.81Å; D173-K272 PolarHBondContact OD2-NZ 2.89Å; N245-K272 PolarHBondContact OD1-NZ 3.29Å; V268-K272 PolarHBondContact O-N 3.4Å; M270-K272 VanDerWaalsContact C-N 3.34Å; M270-K272 PolarHBondContact O-N 2.93Å; K272-V274 VanDerWaalsContact C-N 3.34Å; K272-V274 PolarHBondContact O-N 3.5Å; K272-V275 PolarHBondContact O-N 3.26Å; K272-M276 HydrophobicContact CD-CG 4.11Å; K272-M276 HydrophobicContact CG-CG 4.27Å; K272-M276 WeakPolarHBondContact O-CB 3.35Å; K272-M276 VanDerWaalsContact O-CG 3.3Å; K272-M276 WeakPolarHBondContact O-CG 3.45Å; K272-M276 PolarHBondContact O-N 3.32Å
273N89.6Confident81.7Confident0 Ų064.4 Ų64.40%037%0.366CS..Hα-helixtrans-63-42.8-179.8-73.1-10.9000111.3D173 N245 F248 L249 R252 F269 M270 V271 V275 M276 L277D173-N273 PolarHBondContact OD2-OD1 3.28Å; N245-N273 HydrophobicContact CB-CB 4.43Å; N245-N273 PolarHBondContact O-ND2 3.31Å; N245-N273 PolarHBondContact OD1-OD1 2.87Å; F248-N273 WeakPolarHBondContact CB-ND2 3.34Å; L249-N273 HydrophobicContact CB-CB 3.98Å; L249-N273 HydrophobicContact CD1-CB 4.47Å; L249-N273 PolarHBondContact N-ND2 3.46Å; R252-N273 PolarHBondContact NH1-ND2 2.96Å; F269-N273 VanDerWaalsContact O-CG 3.29Å; F269-N273 PolarHBondContact O-N 3.4Å; M270-N273 PolarHBondContact O-N 3.2Å; M270-N273 VanDerWaalsContact O-N 3.15Å; V271-N273 VanDerWaalsContact C-N 3.29Å; V271-N273 PolarHBondContact O-N 3.48Å; N273-V275 PolarHBondContact O-N 2.85Å; N273-M276 PolarHBondContact O-N 2.92Å; N273-L277 WeakPolarHBondContact O-CG 3.29Å; N273-L277 PolarHBondContact O-N 2.94Å
274V90.4Very high82.4Confident63 Ų6360.7 Ų60.738%0.38235%0.35SS..Hα-helixtrans-58-47.9174.11740000111.2L249 M270 V271 K272 M276 L277 L278L249-V274 HydrophobicContact CD1-CG2 4.03Å; L249-V274 HydrophobicContact CD2-CG2 3.69Å; M270-V274 WeakPolarHBondContact O-CG2 3.23Å; M270-V274 PolarHBondContact O-N 2.64Å; V271-V274 PolarHBondContact O-N 3.47Å; K272-V274 VanDerWaalsContact C-N 3.34Å; K272-V274 PolarHBondContact O-N 3.5Å; V274-M276 PolarHBondContact O-N 3.1Å; V274-L277 PolarHBondContact O-N 3.35Å; V274-L278 HydrophobicContact CG1-CD1 4.32Å; V274-L278 WeakPolarHBondContact O-CG 3.41Å; V274-L278 PolarHBondContact O-N 2.01Å
275V88.6Confident83.4Confident75 Ų7561.1 Ų61.146%0.45535%0.354SS..Hα-helixtrans-59.3-46.8177.71710000110.9V271 K272 N273 L277 L278 V279V271-V275 HydrophobicContact CG1-CG2 4.33Å; V271-V275 WeakPolarHBondContact O-CG2 3.29Å; V271-V275 PolarHBondContact O-N 2.89Å; K272-V275 PolarHBondContact O-N 3.26Å; N273-V275 PolarHBondContact O-N 2.85Å; V275-L277 VanDerWaalsContact C-N 3.31Å; V275-L277 PolarHBondContact O-N 3.5Å; V275-L278 WeakPolarHBondContact O-CB 3.39Å; V275-L278 PolarHBondContact O-N 3.22Å; V275-L278 VanDerWaalsContact O-N 3.15Å; V275-V279 HydrophobicContact CG1-CG2 4.42Å; V275-V279 WeakPolarHBondContact O-CG2 2.97Å; V275-V279 PolarHBondContact O-N 2.9Å
276M86Confident84.4Confident51 Ų5161.4 Ų61.425%0.25134%0.341SS..Hα-helixtrans-65.9-32.1179.7-67.8-57.4-69.700112.6T166 N245 K272 N273 V274 V279 G280T166-M276 HydrophobicContact CG2-CE 3.96Å; N245-M276 HydrophobicContact CB-CB 4.33Å; N245-M276 WeakPolarHBondContact OD1-CB 3.49Å; K272-M276 HydrophobicContact CD-CG 4.11Å; K272-M276 HydrophobicContact CG-CG 4.27Å; K272-M276 WeakPolarHBondContact O-CB 3.35Å; K272-M276 VanDerWaalsContact O-CG 3.3Å; K272-M276 WeakPolarHBondContact O-CG 3.45Å; K272-M276 PolarHBondContact O-N 3.32Å; N273-M276 PolarHBondContact O-N 2.92Å; V274-M276 PolarHBondContact O-N 3.1Å; M276-V279 PolarHBondContact O-N 2.78Å; M276-G280 PolarHBondContact O-N 3.34Å
277L86.5Confident84.5Confident22 Ų2260.6 Ų60.612%0.11533%0.333CS..Hα-helixtrans-66.9-40.6172-67.1170.8000111.6F241 N245 L246 L249 N273 V274 V275 T281F241-L277 HydrophobicContact CD1-CD2 4.37Å; F241-L277 HydrophobicContact CD2-CB 4.43Å; F241-L277 HydrophobicContact CD2-CD2 3.35Å; F241-L277 HydrophobicContact CD2-CG 4.45Å; F241-L277 HydrophobicContact CE1-CD2 4.25Å; F241-L277 HydrophobicContact CE2-CB 3.9Å; F241-L277 HydrophobicContact CE2-CD2 3.18Å; F241-L277 HydrophobicContact CE2-CG 4.11Å; F241-L277 HydrophobicContact CG-CD2 3.96Å; F241-L277 HydrophobicContact CZ-CD2 3.67Å; N245-L277 HydrophobicContact CB-CD2 3.89Å; N245-L277 HydrophobicContact CB-CG 4.11Å; L246-L277 HydrophobicContact CB-CD2 3.82Å; L246-L277 HydrophobicContact CD1-CD1 4.14Å; L249-L277 HydrophobicContact CD2-CD1 3.69Å; N273-L277 WeakPolarHBondContact O-CG 3.29Å; N273-L277 PolarHBondContact O-N 2.94Å; V274-L277 PolarHBondContact O-N 3.35Å; V275-L277 VanDerWaalsContact C-N 3.31Å; V275-L277 PolarHBondContact O-N 3.5Å; L277-T281 WeakPolarHBondContact O-CB 3.31Å; L277-T281 VanDerWaalsContact O-CG2 3.31Å; L277-T281 WeakPolarHBondContact O-CG2 3.46Å; L277-T281 PolarHBondContact O-N 3.42Å; L277-T281 PolarHBondContact O-OG1 2.97Å
278L88.6Confident84.4Confident113 Ų11360.8 Ų60.859%0.59233%0.334SS*.Hα-helixtrans-66.2-39.7175.4-67.9174.1000112V274 V275 T281 R282V274-L278 HydrophobicContact CG1-CD1 4.32Å; V274-L278 WeakPolarHBondContact O-CG 3.41Å; V274-L278 PolarHBondContact O-N 2.01Å; V275-L278 WeakPolarHBondContact O-CB 3.39Å; V275-L278 PolarHBondContact O-N 3.22Å; V275-L278 VanDerWaalsContact O-N 3.15Å; L278-T281 WeakPolarHBondContact CA-OG1 3.36Å; L278-T281 PolarHBondContact O-OG1 3.04Å; L278-R282 WeakPolarHBondContact O-CB 3.45Å; L278-R282 PolarHBondContact O-N 3.23Å; L278-R282 VanDerWaalsContact O-N 3.12Å
279V84.4Confident84.3Confident65 Ų6561 Ų6139%0.39433%0.328SS..Hα-helixtrans-65.7-49175.71730000110.5V275 M276 T281 R282 E283V275-V279 HydrophobicContact CG1-CG2 4.42Å; V275-V279 WeakPolarHBondContact O-CG2 2.97Å; V275-V279 PolarHBondContact O-N 2.9Å; M276-V279 PolarHBondContact O-N 2.78Å; V279-T281 PolarHBondContact O-N 2.89Å; V279-R282 WeakPolarHBondContact O-CB 3.5Å; V279-R282 PolarHBondContact O-N 3.25Å; V279-E283 WeakPolarHBondContact O-CG 3.49Å; V279-E283 PolarHBondContact O-N 3.46Å
280G80Confident83.9Confident4 Ų462 Ų624%0.04134%0.341CS..Hα-helixtrans-62.2-42179.800000113M276 R282 E283 V284M276-G280 PolarHBondContact O-N 3.34Å; G280-R282 VanDerWaalsContact C-N 3.34Å; G280-R282 PolarHBondContact O-N 2.76Å; G280-E283 PolarHBondContact O-N 3.01Å; G280-V284 WeakPolarHBondContact O-CG2 3.48Å; G280-V284 PolarHBondContact O-N 3.09Å
281T82.5Confident83.1Confident64 Ų6465.8 Ų65.839%0.39335%0.353SS..Hα-helixtrans-62.4-40.9175.147.40000111.8F241 L277 L278 V279 E283 V284 C285F241-T281 HydrophobicContact CE2-CG2 3.78Å; F241-T281 HydrophobicContact CZ-CG2 4.23Å; L277-T281 WeakPolarHBondContact O-CB 3.31Å; L277-T281 VanDerWaalsContact O-CG2 3.31Å; L277-T281 WeakPolarHBondContact O-CG2 3.46Å; L277-T281 PolarHBondContact O-N 3.42Å; L277-T281 PolarHBondContact O-OG1 2.97Å; L278-T281 WeakPolarHBondContact CA-OG1 3.36Å; L278-T281 PolarHBondContact O-OG1 3.04Å; V279-T281 PolarHBondContact O-N 2.89Å; T281-E283 PolarHBondContact O-N 3.46Å; T281-V284 PolarHBondContact O-N 3.29Å; T281-C285 WeakPolarHBondContact O-CB 3.43Å; T281-C285 PolarHBondContact O-N 3.07Å; T281-C285 PolarHBondContact O-SG 3.04Å
282R84.9Confident82.4Confident166 Ų16670.5 Ų70.563%0.62636%0.361SS*.Hα-helixtrans-60.5-44.9174.5-178.1-177.4177.3-83-1.4111.9L278 V279 G280 C285 I286L278-R282 WeakPolarHBondContact O-CB 3.45Å; L278-R282 PolarHBondContact O-N 3.23Å; L278-R282 VanDerWaalsContact O-N 3.12Å; V279-R282 WeakPolarHBondContact O-CB 3.5Å; V279-R282 PolarHBondContact O-N 3.25Å; G280-R282 VanDerWaalsContact C-N 3.34Å; G280-R282 PolarHBondContact O-N 2.76Å; R282-C285 PolarHBondContact O-N 2.99Å; R282-I286 HydrophobicContact CG-CD1 3.98Å; R282-I286 WeakPolarHBondContact O-CG1 3.1Å; R282-I286 PolarHBondContact O-N 3.42Å
283E80.4Confident81.5Confident84 Ų8476.2 Ų76.239%0.39339%0.388SS..Hα-helixtrans-62-44.4178.5-72.8177.2172.500112.2S237 V279 G280 T281 I286 G287S237-E283 WeakPolarHBondContact CB-OE2 3.47Å; S237-E283 PolarHBondContact OG-OE2 3.42Å; V279-E283 WeakPolarHBondContact O-CG 3.49Å; V279-E283 PolarHBondContact O-N 3.46Å; G280-E283 PolarHBondContact O-N 3.01Å; T281-E283 PolarHBondContact O-N 3.46Å; E283-I286 PolarHBondContact O-N 3.47Å; E283-G287 PolarHBondContact O-N 3.07Å
284V77Confident80.4Confident50 Ų5081.8 Ų81.830%0.30342%0.422SS..Hα-helixtrans-62.5-45.4176173.30000110.7G280 T281 I286 G287 C288G280-V284 WeakPolarHBondContact O-CG2 3.48Å; G280-V284 PolarHBondContact O-N 3.09Å; T281-V284 PolarHBondContact O-N 3.29Å; V284-I286 PolarHBondContact O-N 3.37Å; V284-G287 PolarHBondContact O-N 3.41Å; V284-C288 PolarHBondContact O-N 2.83Å; V284-C288 PolarHBondContact O-SG 3Å; V284-C288 VanDerWaalsContact O-SG 3.35Å
285C82.5Confident79Confident74 Ų7486.1 Ų86.150%0.544%0.438SS..Hα-helixtrans-59.7-45.3177.6-75.90000112.2T281 R282 G287 C288 M289T281-C285 WeakPolarHBondContact O-CB 3.43Å; T281-C285 PolarHBondContact O-N 3.07Å; T281-C285 PolarHBondContact O-SG 3.04Å; R282-C285 PolarHBondContact O-N 2.99Å; C285-G287 VanDerWaalsContact C-N 3.33Å; C285-G287 PolarHBondContact O-N 3.3Å; C285-C288 PolarHBondContact O-N 3.33Å; C285-M289 WeakPolarHBondContact O-CG 3.45Å; C285-M289 PolarHBondContact O-N 3.11Å
286I82.1Confident77.3Confident63 Ų6392 Ų9232%0.32347%0.465SS..Hα-helixtrans-61.5-44.5175.7-69.2168.7000110.3R282 E283 V284 C288 M289 S290R282-I286 HydrophobicContact CG-CD1 3.98Å; R282-I286 WeakPolarHBondContact O-CG1 3.1Å; R282-I286 PolarHBondContact O-N 3.42Å; E283-I286 PolarHBondContact O-N 3.47Å; V284-I286 PolarHBondContact O-N 3.37Å; I286-C288 VanDerWaalsContact C-N 3.33Å; I286-C288 PolarHBondContact O-N 3.15Å; I286-M289 HydrophobicContact CG1-CE 4.13Å; I286-M289 PolarHBondContact O-N 2.73Å; I286-M289 VanDerWaalsContact O-N 3.16Å; I286-S290 PolarHBondContact O-N 2.95Å; I286-S290 PolarHBondContact O-OG 3.29Å
287G75.2Confident76.9Confident5 Ų594.1 Ų94.15%0.05248%0.476CS..Hα-helixtrans-55.6-46.4175.700000113.5E283 V284 C285 S290 R291E283-G287 PolarHBondContact O-N 3.07Å; V284-G287 PolarHBondContact O-N 3.41Å; C285-G287 VanDerWaalsContact C-N 3.33Å; C285-G287 PolarHBondContact O-N 3.3Å; G287-S290 PolarHBondContact O-N 3.05Å; G287-R291 PolarHBondContact O-N 3.33Å; G287-R291 VanDerWaalsContact O-N 3.08Å
288C78.4Confident76.4Confident73 Ų7397.9 Ų97.949%0.49350%0.495SS..Hα-helixtrans-63.4-40.5176.3-70.60000112.3V284 C285 I286 R291 R292V284-C288 PolarHBondContact O-N 2.83Å; V284-C288 PolarHBondContact O-SG 3Å; V284-C288 VanDerWaalsContact O-SG 3.35Å; C285-C288 PolarHBondContact O-N 3.33Å; I286-C288 VanDerWaalsContact C-N 3.33Å; I286-C288 PolarHBondContact O-N 3.15Å; C288-R291 PolarHBondContact O-N 2.95Å; C288-R292 PolarHBondContact O-N 3.03Å; C288-R292 VanDerWaalsContact O-N 3.16Å
289M81.4Confident75.7Confident115 Ų11597.1 Ų97.157%0.56749%0.49SS*.Hα-helixtrans-66.3-45177.1-71.4-169.9-62.300112.2C285 I286 R291 R292 Q293C285-M289 WeakPolarHBondContact O-CG 3.45Å; C285-M289 PolarHBondContact O-N 3.11Å; I286-M289 HydrophobicContact CG1-CE 4.13Å; I286-M289 PolarHBondContact O-N 2.73Å; I286-M289 VanDerWaalsContact O-N 3.16Å; M289-R291 VanDerWaalsContact C-N 3.28Å; M289-R291 PolarHBondContact O-N 3.33Å; M289-R292 PolarHBondContact O-N 3.37Å; M289-Q293 PolarHBondContact O-N 2.93Å; M289-Q293 VanDerWaalsContact O-N 3.13Å
290S77.3Confident75.2Confident62 Ų6298.9 Ų98.943%0.43450%0.495SS..Hα-helixtrans-63.5-34.5178-63.50000112.4I286 G287 Q293 T294I286-S290 PolarHBondContact O-N 2.95Å; I286-S290 PolarHBondContact O-OG 3.29Å; G287-S290 PolarHBondContact O-N 3.05Å; S290-Q293 PolarHBondContact O-N 3.38Å; S290-T294 PolarHBondContact O-N 3.11Å; S290-T294 PolarHBondContact O-OG1 3.44Å
291R70.2Confident74.9Confident115 Ų115104.9 Ų104.943%0.43452%0.524SS..Hα-helixtrans-64-45.9172.6-105.4-176.7168-157.8-9.9112.6P229 G287 C288 M289 Q293 T294 E295P229-R291 PolarHBondContact O-NH1 2.98Å; P229-R291 PolarHBondContact O-NH2 2.75Å; G287-R291 PolarHBondContact O-N 3.33Å; G287-R291 VanDerWaalsContact O-N 3.08Å; C288-R291 PolarHBondContact O-N 2.95Å; M289-R291 VanDerWaalsContact C-N 3.28Å; M289-R291 PolarHBondContact O-N 3.33Å; R291-Q293 PolarHBondContact O-N 3.09Å; R291-T294 WeakPolarHBondContact CA-OG1 3.5Å; R291-T294 PolarHBondContact O-N 3.32Å; R291-T294 PolarHBondContact O-OG1 3.01Å; R291-E295 PolarHBondContact O-N 3.39Å
292R73.8Confident74.3Confident191 Ų191107.6 Ų107.672%0.72153%0.532SS*.Hα-helixtrans-58.8-35.2175.6-87.2-171.4179.3-173.30.8112.8C288 M289 T294 E295 I296C288-R292 PolarHBondContact O-N 3.03Å; C288-R292 VanDerWaalsContact O-N 3.16Å; M289-R292 PolarHBondContact O-N 3.37Å; R292-T294 VanDerWaalsContact C-N 3.3Å; R292-T294 PolarHBondContact O-N 3.36Å; R292-E295 PolarHBondContact O-N 3Å; R292-I296 WeakPolarHBondContact O-CG1 3.49Å
293Q71.4Confident73.6Confident145 Ų145103.4 Ų103.468%0.67853%0.526SS*.Hα-helixtrans-71.5-21.9177.3-77179.7-26.700114M289 S290 R291M289-Q293 PolarHBondContact O-N 2.93Å; M289-Q293 VanDerWaalsContact O-N 3.13Å; S290-Q293 PolarHBondContact O-N 3.38Å; R291-Q293 PolarHBondContact O-N 3.09Å
294T67.2Low73.1Confident118 Ų118104.9 Ų104.972%0.72454%0.536SS*.Hα-helixtrans-89.6-10178.220.20000113.1S290 R291 R292S290-T294 PolarHBondContact O-N 3.11Å; S290-T294 PolarHBondContact O-OG1 3.44Å; R291-T294 WeakPolarHBondContact CA-OG1 3.5Å; R291-T294 PolarHBondContact O-N 3.32Å; R291-T294 PolarHBondContact O-OG1 3.01Å; R292-T294 VanDerWaalsContact C-N 3.3Å; R292-T294 PolarHBondContact O-N 3.36Å
295E59.9Low72.7Confident154 Ų154109.5 Ų109.572%0.7256%0.555SS**  trans-95-6.7176.6-69.5174.6177.100113.1R291 R292R291-E295 PolarHBondContact O-N 3.39Å; R292-E295 PolarHBondContact O-N 3Å
296I53.7Low71.9Confident199 Ų199112.7 Ų112.7100%1.02156%0.56SS**  trans-101.90174.9-59.3170.3000109R292R292-I296 WeakPolarHBondContact O-CG1 3.49Å

Retrieved 296 of 296 residues in 567.4 ms (Link to these results)

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