A0A075B6R5_HUMAN Loading...

Hedgehog acyltransferase

AlphaFold DB , UniProt , Accession A0A075B6R5, Species HUMAN (Homo sapiens, Human), Gene HHAT, Length 207 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
1M49.5Very low62.2Low226 Ų226121.5 Ų121.5100%1.11355%0.553SS**  0-11.40-144.5170.4163.600113.5
2E50.5Low63.2Low153 Ų153120.7 Ų120.772%0.71556%0.555SS**Hα-helixtrans-77.9-29.4-178.6-65.1-100112.500114.4G4 K5E2-G4 PolarHBondContact O-N 3.01Å; E2-K5 PolarHBondContact O-N 3.02Å
3W50.6Low64.3Low195 Ų195117.8 Ų117.874%0.73955%0.547SS*.Hα-helixtrans-65.8-35.5-174.9-123.175.4000114W7W3-W7 AromaticContact CZ3-NE1 3.76Å
4G60.7Low65.1Low21 Ų21110.9 Ų110.922%0.21652%0.523CS..Hα-helixtrans-69.6-32177.200000113.3E2 W7 L8E2-G4 PolarHBondContact O-N 3.01Å; G4-W7 PolarHBondContact O-N 3.28Å; G4-L8 PolarHBondContact O-N 2.73Å; G4-L8 VanDerWaalsContact O-N 3.14Å
5K60.4Low65.8Low139 Ų139107.2 Ų107.260%0.60451%0.505SS*.Hα-helixtrans-66.9-38.9179.7-74.4-176.8171.81800112.4E2 L8 V9E2-K5 PolarHBondContact O-N 3.02Å; K5-L8 PolarHBondContact O-N 2.94Å; K5-V9 WeakPolarHBondContact O-CG2 3.32Å; K5-V9 PolarHBondContact O-N 3.47Å; K5-V9 VanDerWaalsContact O-N 3.12Å
6Q64.9Low66.5Low125 Ų125107.6 Ų107.658%0.58451%0.508SS*.Hα-helixtrans-64-43.9177.7-74.8-179.5-28.400111.5L8 V9 W10Q6-L8 VanDerWaalsContact C-N 3.34Å; Q6-L8 PolarHBondContact O-N 3.29Å; Q6-V9 PolarHBondContact O-N 3.22Å; Q6-W10 PolarHBondContact O-N 3Å
7W64.8Low67.1Low127 Ų127106.3 Ų106.348%0.48151%0.509SS..Hα-helixtrans-62.2-39.7176.1-90.878.7000113.1W3 G4 V9 W10 L11 L59W3-W7 AromaticContact CZ3-NE1 3.76Å; G4-W7 PolarHBondContact O-N 3.28Å; W7-V9 VanDerWaalsContact C-N 3.32Å; W7-V9 PolarHBondContact O-N 3.44Å; W7-W10 PolarHBondContact O-N 3.47Å; W7-L11 WeakPolarHBondContact O-CG 3.48Å; W7-L11 PolarHBondContact O-N 2.91Å; W7-L59 HydrophobicContact CE3-CD2 3.77Å; W7-L59 HydrophobicContact CZ3-CD2 4.04Å
8L66.8Low67.6Low64 Ų64103.6 Ų103.634%0.33550%0.5SS..Hα-helixtrans-61.4-41.4176.2-133116.9000111.9G4 K5 Q6 L11 L12 C60G4-L8 PolarHBondContact O-N 2.73Å; G4-L8 VanDerWaalsContact O-N 3.14Å; K5-L8 PolarHBondContact O-N 2.94Å; Q6-L8 VanDerWaalsContact C-N 3.34Å; Q6-L8 PolarHBondContact O-N 3.29Å; L8-L11 PolarHBondContact O-N 3.2Å; L8-L12 HydrophobicContact CD2-CD1 4.25Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 VanDerWaalsContact O-CG 3.32Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 3.11Å; L8-C60 HydrophobicContact CD1-CB 4.24Å; L8-C60 WeakPolarHBondContact CD1-SG 3.45Å
9V69.8Low68.1Low81 Ų81100.3 Ų100.349%0.49149%0.489SS..Hα-helixtrans-64.6-43176.2171.40000110.9K5 Q6 W7 L12 L13K5-V9 WeakPolarHBondContact O-CG2 3.32Å; K5-V9 PolarHBondContact O-N 3.47Å; K5-V9 VanDerWaalsContact O-N 3.12Å; Q6-V9 PolarHBondContact O-N 3.22Å; W7-V9 VanDerWaalsContact C-N 3.32Å; W7-V9 PolarHBondContact O-N 3.44Å; V9-L12 PolarHBondContact O-N 2.88Å; V9-L13 HydrophobicContact CG1-CD1 3.75Å; V9-L13 HydrophobicContact CG1-CG 4.36Å; V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 VanDerWaalsContact O-CG 3.26Å; V9-L13 WeakPolarHBondContact O-CG 3.39Å; V9-L13 PolarHBondContact O-N 3.06Å
10W72.3Confident68.6Low189 Ų189100.3 Ų100.372%0.71649%0.488SS*.Hα-helixtrans-64.2-38.4175.6-78.1108.4000112.9Q6 W7 G14Q6-W10 PolarHBondContact O-N 3Å; W7-W10 PolarHBondContact O-N 3.47Å; W10-G14 PolarHBondContact O-N 2.89Å
11L74.3Confident68.9Low16 Ų16100.6 Ų100.68%0.08449%0.49CS..Hα-helixtrans-65.5-44.9175.2-77176000112.2W7 L8 G14 H15 Y52 F55 L59W7-L11 WeakPolarHBondContact O-CG 3.48Å; W7-L11 PolarHBondContact O-N 2.91Å; L8-L11 PolarHBondContact O-N 3.2Å; L11-G14 PolarHBondContact O-N 3.4Å; L11-H15 PolarHBondContact O-N 3.31Å; L11-Y52 PolarHBondContact O-OH 2.9Å; L11-F55 HydrophobicContact CD2-CE1 4.29Å; L11-L59 HydrophobicContact CD1-CB 4.28Å; L11-L59 HydrophobicContact CD1-CD2 3.64Å; L11-L59 HydrophobicContact CD1-CG 4.43Å; L11-L59 HydrophobicContact CD2-CD2 4.47Å; L11-L59 HydrophobicContact CG-CD2 4.4Å
12L74.5Confident70.1Confident112 Ų11290.2 Ų90.259%0.58644%0.44SS*.Hα-helixtrans-65.7-41.2177.7-73.9170000111.9L8 V9 H15 M16L8-L12 HydrophobicContact CD2-CD1 4.25Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 VanDerWaalsContact O-CG 3.32Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 3.11Å; V9-L12 PolarHBondContact O-N 2.88Å; L12-H15 PolarHBondContact O-N 2.99Å; L12-M16 WeakPolarHBondContact O-CB 3.44Å; L12-M16 PolarHBondContact O-N 3Å
13L76.3Confident71.4Confident84 Ų8486.4 Ų86.444%0.4443%0.427SS..Hα-helixtrans-63.5-43.1172.8-75.2168.5000111V9 M16 V17V9-L13 HydrophobicContact CG1-CD1 3.75Å; V9-L13 HydrophobicContact CG1-CG 4.36Å; V9-L13 WeakPolarHBondContact O-CB 3.48Å; V9-L13 VanDerWaalsContact O-CG 3.26Å; V9-L13 WeakPolarHBondContact O-CG 3.39Å; V9-L13 PolarHBondContact O-N 3.06Å; L13-M16 PolarHBondContact O-N 2.86Å; L13-V17 WeakPolarHBondContact O-CB 3.33Å; L13-V17 VanDerWaalsContact O-CG2 3.27Å; L13-V17 WeakPolarHBondContact O-CG2 3.39Å; L13-V17 PolarHBondContact O-N 3.03Å
14G76.8Confident72.7Confident21 Ų2181.3 Ų81.322%0.21641%0.414CS..Hα-helixtrans-59.8-46.6174.400000112.3W10 L11 M16 V17 V18W10-G14 PolarHBondContact O-N 2.89Å; L11-G14 PolarHBondContact O-N 3.4Å; G14-M16 PolarHBondContact O-N 3.41Å; G14-V17 PolarHBondContact O-N 2.95Å; G14-V18 WeakPolarHBondContact O-CB 3.42Å; G14-V18 VanDerWaalsContact O-CG2 3.27Å; G14-V18 WeakPolarHBondContact O-CG2 3.37Å; G14-V18 PolarHBondContact O-N 3.16Å
15H75Confident73.2Confident55 Ų5583.6 Ų83.626%0.25542%0.421SS..Hα-helixtrans-61.7-43.8175.4-176.4-107.4000111.6L11 L12 V17 V18 S19 Y52 T53L11-H15 PolarHBondContact O-N 3.31Å; L12-H15 PolarHBondContact O-N 2.99Å; H15-V17 PolarHBondContact O-N 3.08Å; H15-V18 PolarHBondContact O-N 3.05Å; H15-S19 WeakPolarHBondContact O-CB 3.47Å; H15-S19 PolarHBondContact O-N 3.5Å; H15-Y52 HydrophobicContact CB-CD1 3.91Å; H15-Y52 HydrophobicContact CB-CE1 3.66Å; H15-Y52 AromaticContact CD2-CD1 3.86Å; H15-T53 WeakPolarHBondContact CD2-CG2 3.46Å; H15-T53 WeakPolarHBondContact NE2-CG2 3.5Å
16M76.4Confident73.6Confident113 Ų11377.9 Ų77.956%0.55740%0.399SS*.Hα-helixtrans-62.6-43.9178-169.6126.587.700110.8L12 L13 G14 S19 Q20L12-M16 WeakPolarHBondContact O-CB 3.44Å; L12-M16 PolarHBondContact O-N 3Å; L13-M16 PolarHBondContact O-N 2.86Å; G14-M16 PolarHBondContact O-N 3.41Å; M16-S19 PolarHBondContact O-N 3.08Å; M16-Q20 HydrophobicContact CG-CG 4.23Å; M16-Q20 VanDerWaalsContact O-CB 3.3Å; M16-Q20 WeakPolarHBondContact O-CB 3.37Å; M16-Q20 WeakPolarHBondContact O-CG 3.16Å; M16-Q20 PolarHBondContact O-N 3.12Å
17V77.8Confident74.1Confident86 Ų8682.1 Ų82.152%0.52141%0.41SS..Hα-helixtrans-63.9-46.3177.1170.90000111.2L13 G14 H15 S19 Q20 M21L13-V17 WeakPolarHBondContact O-CB 3.33Å; L13-V17 VanDerWaalsContact O-CG2 3.27Å; L13-V17 WeakPolarHBondContact O-CG2 3.39Å; L13-V17 PolarHBondContact O-N 3.03Å; G14-V17 PolarHBondContact O-N 2.95Å; H15-V17 PolarHBondContact O-N 3.08Å; V17-S19 VanDerWaalsContact C-N 3.35Å; V17-S19 PolarHBondContact O-N 3.23Å; V17-Q20 PolarHBondContact O-N 3.31Å; V17-M21 HydrophobicContact CG1-CG 4.37Å; V17-M21 WeakPolarHBondContact O-CB 3.32Å; V17-M21 VanDerWaalsContact O-CG 3.27Å; V17-M21 WeakPolarHBondContact O-CG 3.34Å; V17-M21 PolarHBondContact O-N 2.99Å
18V76.1Confident74.8Confident57 Ų5780.8 Ų80.835%0.34541%0.408SS..Hα-helixtrans-62.9-43178.4173.70000110.8G14 H15 M21 A22G14-V18 WeakPolarHBondContact O-CB 3.42Å; G14-V18 VanDerWaalsContact O-CG2 3.27Å; G14-V18 WeakPolarHBondContact O-CG2 3.37Å; G14-V18 PolarHBondContact O-N 3.16Å; H15-V18 PolarHBondContact O-N 3.05Å; V18-M21 PolarHBondContact O-N 2.97Å; V18-A22 WeakPolarHBondContact O-CB 3.45Å; V18-A22 PolarHBondContact O-N 2.86Å
19S75.8Confident75.2Confident42 Ų4284.5 Ų84.529%0.29442%0.417SS..Hα-helixtrans-67.2-38.5177.7-177.30000112.9H15 M16 V17 A22 T23H15-S19 WeakPolarHBondContact O-CB 3.47Å; H15-S19 PolarHBondContact O-N 3.5Å; M16-S19 PolarHBondContact O-N 3.08Å; V17-S19 VanDerWaalsContact C-N 3.35Å; V17-S19 PolarHBondContact O-N 3.23Å; S19-A22 WeakPolarHBondContact O-CB 3.23Å; S19-A22 PolarHBondContact O-N 3.45Å; S19-T23 WeakPolarHBondContact O-CG2 3.47Å; S19-T23 PolarHBondContact O-N 2.88Å; S19-T23 PolarHBondContact O-OG1 3.5Å
20Q79.6Confident75.4Confident100 Ų10092.4 Ų92.447%0.46744%0.438SS..Hα-helixtrans-71.9-39.7175.6-67.5-66.2-12.500111.8M16 V17 A22 T23 L24M16-Q20 HydrophobicContact CG-CG 4.23Å; M16-Q20 VanDerWaalsContact O-CB 3.3Å; M16-Q20 WeakPolarHBondContact O-CB 3.37Å; M16-Q20 WeakPolarHBondContact O-CG 3.16Å; M16-Q20 PolarHBondContact O-N 3.12Å; V17-Q20 PolarHBondContact O-N 3.31Å; Q20-A22 VanDerWaalsContact C-N 3.26Å; Q20-A22 PolarHBondContact O-N 3.35Å; Q20-T23 WeakPolarHBondContact CA-OG1 3.34Å; Q20-T23 PolarHBondContact O-N 2.94Å; Q20-T23 PolarHBondContact O-OG1 3.23Å; Q20-L24 WeakPolarHBondContact O-CB 3.49Å; Q20-L24 WeakPolarHBondContact O-CG 3.45Å; Q20-L24 PolarHBondContact O-N 3.03Å
21M75Confident75.7Confident106 Ų10691.6 Ų91.652%0.52244%0.435SS..Hα-helixtrans-63.4-38.9172.3-73.1-60.8134.200111.1V17 V18 L24 L25V17-M21 HydrophobicContact CG1-CG 4.37Å; V17-M21 WeakPolarHBondContact O-CB 3.32Å; V17-M21 VanDerWaalsContact O-CG 3.27Å; V17-M21 WeakPolarHBondContact O-CG 3.34Å; V17-M21 PolarHBondContact O-N 2.99Å; V18-M21 PolarHBondContact O-N 2.97Å; M21-L24 HydrophobicContact CE-CD1 3.96Å; M21-L24 PolarHBondContact O-N 3.38Å; M21-L24 HydrophobicContact SD-CD1 4.3Å; M21-L25 WeakPolarHBondContact O-CB 3.45Å; M21-L25 WeakPolarHBondContact O-CD1 3.46Å; M21-L25 PolarHBondContact O-N 3.34Å
22A74.3Confident75.9Confident9 Ų993.6 Ų93.67%0.07444%0.442CS..Hα-helixtrans-59.4-50.4175.800000112.4V18 S19 Q20 L24 L25 A26 L45V18-A22 WeakPolarHBondContact O-CB 3.45Å; V18-A22 PolarHBondContact O-N 2.86Å; S19-A22 WeakPolarHBondContact O-CB 3.23Å; S19-A22 PolarHBondContact O-N 3.45Å; Q20-A22 VanDerWaalsContact C-N 3.26Å; Q20-A22 PolarHBondContact O-N 3.35Å; A22-L24 VanDerWaalsContact C-N 3.34Å; A22-L24 PolarHBondContact O-N 3.43Å; A22-L25 PolarHBondContact O-N 2.96Å; A22-A26 WeakPolarHBondContact O-CB 3.33Å; A22-A26 PolarHBondContact O-N 3Å; A22-L45 VanDerWaalsContact C-CD2 3.48Å; A22-L45 HydrophobicContact CB-CD1 3.62Å; A22-L45 HydrophobicContact CB-CD2 3.28Å; A22-L45 HydrophobicContact CB-CG 3.25Å; A22-L45 WeakPolarHBondContact O-CD2 3.36Å
23T76.4Confident76.2Confident73 Ų7397.9 Ų97.945%0.44846%0.456SS..Hα-helixtrans-66.7-34.8178.252.30000112.4S19 Q20 A26 R27S19-T23 WeakPolarHBondContact O-CG2 3.47Å; S19-T23 PolarHBondContact O-N 2.88Å; S19-T23 PolarHBondContact O-OG1 3.5Å; Q20-T23 WeakPolarHBondContact CA-OG1 3.34Å; Q20-T23 PolarHBondContact O-N 2.94Å; Q20-T23 PolarHBondContact O-OG1 3.23Å; T23-A26 PolarHBondContact O-N 3.42Å; T23-R27 WeakPolarHBondContact O-CB 3.36Å; T23-R27 PolarHBondContact O-N 3.19Å
24L78.3Confident76.8Confident88 Ų8897 Ų9746%0.46145%0.454SS..Hα-helixtrans-66.1-42174.7-72.7170.9000112.4Q20 M21 A22 R27 K28Q20-L24 WeakPolarHBondContact O-CB 3.49Å; Q20-L24 WeakPolarHBondContact O-CG 3.45Å; Q20-L24 PolarHBondContact O-N 3.03Å; M21-L24 HydrophobicContact CE-CD1 3.96Å; M21-L24 PolarHBondContact O-N 3.38Å; M21-L24 HydrophobicContact SD-CD1 4.3Å; A22-L24 VanDerWaalsContact C-N 3.34Å; A22-L24 PolarHBondContact O-N 3.43Å; L24-R27 PolarHBondContact O-N 3.5Å; L24-K28 PolarHBondContact O-N 3.09Å
25L72.3Confident77.2Confident69 Ų69101.2 Ų101.236%0.36147%0.468SS..Hα-helixtrans-62.7-45.6173.9-84.8153.4000111M21 A22 R27 K28M21-L25 WeakPolarHBondContact O-CB 3.45Å; M21-L25 WeakPolarHBondContact O-CD1 3.46Å; M21-L25 PolarHBondContact O-N 3.34Å; A22-L25 PolarHBondContact O-N 2.96Å; L25-R27 VanDerWaalsContact C-N 3.28Å; L25-R27 PolarHBondContact O-N 3.21Å; L25-K28 PolarHBondContact O-N 3.2Å
26A68.5Low77.7Confident18 Ų18104.9 Ų104.915%0.14949%0.49CS..Hα-helixtrans-63.2-32.2174.500000112.5A22 T23 K28 Y38A22-A26 WeakPolarHBondContact O-CB 3.33Å; A22-A26 PolarHBondContact O-N 3Å; T23-A26 PolarHBondContact O-N 3.42Å; A26-K28 PolarHBondContact O-N 2.85Å; A26-Y38 WeakPolarHBondContact O-CE2 3.36Å; A26-Y38 PolarHBondContact O-OH 2.93Å; A26-Y38 VanDerWaalsContact O-OH 3.04Å
27R75.5Confident78.1Confident215 Ų215104 Ų10481%0.81148%0.484SS*.Hα-helixtrans-68.6-23177.6-165.3171.9-178.2165.81112.8T23 L24 L25 R29T23-R27 WeakPolarHBondContact O-CB 3.36Å; T23-R27 PolarHBondContact O-N 3.19Å; L24-R27 PolarHBondContact O-N 3.5Å; L25-R27 VanDerWaalsContact C-N 3.28Å; L25-R27 PolarHBondContact O-N 3.21Å; R27-R29 PolarHBondContact O-N 3.27Å; R27-R29 VanDerWaalsContact O-N 3.09Å
28K78.9Confident78.4Confident99 Ų99101.6 Ų101.643%0.4347%0.466SS..  trans-86.451.4179.2-68.5-172.8178.4-179.60112.7L24 L25 A26 R30 W31L24-K28 PolarHBondContact O-N 3.09Å; L25-K28 PolarHBondContact O-N 3.2Å; A26-K28 PolarHBondContact O-N 2.85Å; K28-R30 PolarHBondContact O-N 3.48Å; K28-W31 HydrophobicContact CB-CD2 4.13Å; K28-W31 HydrophobicContact CB-CG 4.1Å; K28-W31 HydrophobicContact CD-CD2 3.79Å; K28-W31 HydrophobicContact CD-CE3 3.98Å; K28-W31 HydrophobicContact CD-CH2 3.85Å; K28-W31 HydrophobicContact CD-CZ2 3.61Å; K28-W31 HydrophobicContact CD-CZ3 4.01Å; K28-W31 WeakPolarHBondContact O-CB 3.3Å; K28-W31 PolarHBondContact O-N 2.95Å
29R74.7Confident78.9Confident142 Ų142105 Ų10554%0.53647%0.474SS..G310 helixtrans-48.5-34175.4-174.6176.8179.2-172.42113.2R27 W31 Y32 E35 Y38R27-R29 PolarHBondContact O-N 3.27Å; R27-R29 VanDerWaalsContact O-N 3.09Å; R29-W31 PolarHBondContact O-N 2.9Å; R29-W31 VanDerWaalsContact O-N 3.12Å; R29-Y32 PolarHBondContact O-N 3.34Å; R29-E35 IonicContact NH2-OE1 2.77Å; R29-E35 PolarHBondContact NH2-OE1 3.4Å; R29-Y38 HydrophobicContact CB-CD2 4.36Å; R29-Y38 HydrophobicContact CB-CE2 4.14Å; R29-Y38 HydrophobicContact CG-CD2 4.28Å; R29-Y38 HydrophobicContact CG-CE2 4.39Å
30R74.6Confident79.4Confident246 Ų246106.5 Ų106.593%0.92848%0.478SS*.G310 helixtrans-64.5-13-178.6-150.8179.7-134-171.83.7114.5K28K28-R30 PolarHBondContact O-N 3.48Å
31W79.1Confident79.7Confident172 Ų172104.3 Ų104.365%0.65247%0.469SS*.G310 helixtrans-84.9-11.8179.4-7111.5000113.2K28 R29K28-W31 HydrophobicContact CB-CD2 4.13Å; K28-W31 HydrophobicContact CB-CG 4.1Å; K28-W31 HydrophobicContact CD-CD2 3.79Å; K28-W31 HydrophobicContact CD-CE3 3.98Å; K28-W31 HydrophobicContact CD-CH2 3.85Å; K28-W31 HydrophobicContact CD-CZ2 3.61Å; K28-W31 HydrophobicContact CD-CZ3 4.01Å; K28-W31 WeakPolarHBondContact O-CB 3.3Å; K28-W31 PolarHBondContact O-N 2.95Å; R29-W31 PolarHBondContact O-N 2.9Å; R29-W31 VanDerWaalsContact O-N 3.12Å
32Y79Confident80.1Confident58 Ų58102.8 Ų102.823%0.22746%0.461CS..  trans-103.7137.8-177.2-56.8-80.5000110.6R29 E37 Y38 L41R29-Y32 PolarHBondContact O-N 3.34Å; Y32-E37 HydrophobicContact CD1-CB 4.31Å; Y32-Y38 AromaticContact CD2-CD2 3.73Å; Y32-Y38 HydrophobicContact CD2-CD2 3.73Å; Y32-Y38 HydrophobicContact CE2-CD2 4.14Å; Y32-Y38 HydrophobicContact CG-CD2 4.41Å; Y32-L41 HydrophobicContact CE1-CD2 3.69Å; Y32-L41 HydrophobicContact CE2-CD2 4.2Å; Y32-L41 WeakPolarHBondContact OH-CD2 3.33Å
33K80.1Confident80.7Confident203 Ų203107.1 Ų107.188%0.88348%0.478SS*.SBendtrans-79.5-32.9-179.6-79.7-177176.8177.20111.7E37K33-E37 PolarHBondContact N-OE2 3.07Å
34T88.5Confident81.3Confident65 Ų65104.3 Ų104.340%0.39946%0.461SS..SBendtrans-124.3152.4-177.868.60000112N36 E37 Y38T34-N36 VanDerWaalsContact C-N 3.27Å; T34-N36 PolarHBondContact O-N 3.48Å; T34-E37 PolarHBondContact O-N 3.27Å; T34-E37 VanDerWaalsContact OG1-CD 3.29Å; T34-E37 VanDerWaalsContact OG1-CG 3.22Å; T34-E37 WeakPolarHBondContact OG1-CG 3.47Å; T34-E37 PolarHBondContact OG1-N 3.13Å; T34-Y38 PolarHBondContact O-N 2.81Å
35E84.9Confident81.7Confident109 Ų109101.7 Ų101.751%0.50945%0.447SS..Hα-helixtrans-65.2-34176.1-60.3-163.8135.700111.8R29 E37 Y38 Y39R29-E35 IonicContact NH2-OE1 2.77Å; R29-E35 PolarHBondContact NH2-OE1 3.4Å; E35-E37 PolarHBondContact O-N 3.4Å; E35-Y38 WeakPolarHBondContact O-CB 3.47Å; E35-Y38 PolarHBondContact O-N 3.49Å; E35-Y39 HydrophobicContact CB-CD2 4.25Å; E35-Y39 HydrophobicContact CB-CE2 4.02Å; E35-Y39 WeakPolarHBondContact O-CD2 3.25Å; E35-Y39 PolarHBondContact O-N 2.89Å
36N85.1Confident82.5Confident132 Ų132102.5 Ų102.571%0.70646%0.455SS*.Hα-helixtrans-62.2-44.8178.6-67.1-21.5000112.5T34 Y38 Y39 L40T34-N36 VanDerWaalsContact C-N 3.27Å; T34-N36 PolarHBondContact O-N 3.48Å; N36-Y38 VanDerWaalsContact C-N 3.3Å; N36-Y38 PolarHBondContact O-N 2.87Å; N36-Y39 PolarHBondContact O-N 2.92Å; N36-L40 VanDerWaalsContact O-CB 3.24Å; N36-L40 WeakPolarHBondContact O-CB 3.43Å; N36-L40 PolarHBondContact O-N 3.31Å
37E85.1Confident83.4Confident96 Ų96102.8 Ų102.845%0.44946%0.455SS..Hα-helixtrans-59.8-43.9176-75.7166.3-174.100111.4Y32 K33 T34 E35 L40 L41Y32-E37 HydrophobicContact CD1-CB 4.31Å; K33-E37 PolarHBondContact N-OE2 3.07Å; T34-E37 PolarHBondContact O-N 3.27Å; T34-E37 VanDerWaalsContact OG1-CD 3.29Å; T34-E37 VanDerWaalsContact OG1-CG 3.22Å; T34-E37 WeakPolarHBondContact OG1-CG 3.47Å; T34-E37 PolarHBondContact OG1-N 3.13Å; E35-E37 PolarHBondContact O-N 3.4Å; E37-L40 PolarHBondContact O-N 3.21Å; E37-L41 WeakPolarHBondContact O-CB 2.95Å; E37-L41 PolarHBondContact O-N 3.21Å
38Y85.5Confident84Confident34 Ų3493.4 Ų93.413%0.13342%0.419CS..Hα-helixtrans-61-50.2178.4173.6-98.1000111.8A26 R29 Y32 T34 E35 N36 L41 Q42A26-Y38 WeakPolarHBondContact O-CE2 3.36Å; A26-Y38 PolarHBondContact O-OH 2.93Å; A26-Y38 VanDerWaalsContact O-OH 3.04Å; R29-Y38 HydrophobicContact CB-CD2 4.36Å; R29-Y38 HydrophobicContact CB-CE2 4.14Å; R29-Y38 HydrophobicContact CG-CD2 4.28Å; R29-Y38 HydrophobicContact CG-CE2 4.39Å; Y32-Y38 AromaticContact CD2-CD2 3.73Å; Y32-Y38 HydrophobicContact CD2-CD2 3.73Å; Y32-Y38 HydrophobicContact CE2-CD2 4.14Å; Y32-Y38 HydrophobicContact CG-CD2 4.41Å; T34-Y38 PolarHBondContact O-N 2.81Å; E35-Y38 WeakPolarHBondContact O-CB 3.47Å; E35-Y38 PolarHBondContact O-N 3.49Å; N36-Y38 VanDerWaalsContact C-N 3.3Å; N36-Y38 PolarHBondContact O-N 2.87Å; Y38-L41 PolarHBondContact O-N 3.09Å; Y38-Q42 WeakPolarHBondContact O-CB 3.35Å; Y38-Q42 PolarHBondContact O-N 3.3Å; Y38-Q42 PolarHBondContact OH-OE1 3.35Å
39Y85.9Confident84.4Confident129 Ų12989.4 Ų89.451%0.50640%0.404SS..Hα-helixtrans-66.7-38.9179.5-72.6-60.4000112.6E35 N36 L41 Q42 F43E35-Y39 HydrophobicContact CB-CD2 4.25Å; E35-Y39 HydrophobicContact CB-CE2 4.02Å; E35-Y39 WeakPolarHBondContact O-CD2 3.25Å; E35-Y39 PolarHBondContact O-N 2.89Å; N36-Y39 PolarHBondContact O-N 2.92Å; Y39-L41 VanDerWaalsContact C-N 3.33Å; Y39-L41 PolarHBondContact O-N 3.22Å; Y39-Q42 PolarHBondContact O-N 3.07Å; Y39-F43 WeakPolarHBondContact O-CB 3.48Å; Y39-F43 PolarHBondContact O-N 3Å
40L85.8Confident85.1Confident73 Ų7386.7 Ų86.738%0.38240%0.399SS..Hα-helixtrans-61.5-43.8177-174.566.9000111.1N36 E37 T44 H87N36-L40 VanDerWaalsContact O-CB 3.24Å; N36-L40 WeakPolarHBondContact O-CB 3.43Å; N36-L40 PolarHBondContact O-N 3.31Å; E37-L40 PolarHBondContact O-N 3.21Å; L40-T44 VanDerWaalsContact O-CB 3.29Å; L40-T44 WeakPolarHBondContact O-CB 3.21Å; L40-T44 PolarHBondContact O-N 3.13Å; L40-T44 PolarHBondContact O-OG1 3.42Å; L40-H87 HydrophobicContact CD1-CB 4.2Å
41L85.4Confident85.8Confident54 Ų5475.1 Ų75.128%0.28336%0.356SS..Hα-helixtrans-63.8-50.1175.7-179.971.8000111.2Y32 E37 Y38 Y39 F43 T44 L45Y32-L41 HydrophobicContact CE1-CD2 3.69Å; Y32-L41 HydrophobicContact CE2-CD2 4.2Å; Y32-L41 WeakPolarHBondContact OH-CD2 3.33Å; E37-L41 WeakPolarHBondContact O-CB 2.95Å; E37-L41 PolarHBondContact O-N 3.21Å; Y38-L41 PolarHBondContact O-N 3.09Å; Y39-L41 VanDerWaalsContact C-N 3.33Å; Y39-L41 PolarHBondContact O-N 3.22Å; L41-F43 VanDerWaalsContact C-N 3.25Å; L41-F43 PolarHBondContact O-N 3Å; L41-T44 PolarHBondContact O-N 3.14Å; L41-L45 WeakPolarHBondContact O-CB 3.17Å; L41-L45 PolarHBondContact O-N 2.98Å
42Q84.9Confident86.1Confident75 Ų7568.2 Ų68.235%0.3533%0.33SS..Hα-helixtrans-56.5-43.6-179.4-174.8-179.1-43.900110.9Y38 Y39 T46Y38-Q42 WeakPolarHBondContact O-CB 3.35Å; Y38-Q42 PolarHBondContact O-N 3.3Å; Y38-Q42 PolarHBondContact OH-OE1 3.35Å; Y39-Q42 PolarHBondContact O-N 3.07Å; Q42-T46 WeakPolarHBondContact O-CB 3.24Å; Q42-T46 PolarHBondContact O-N 3.38Å; Q42-T46 PolarHBondContact O-OG1 3.37Å
43F87.1Confident86.4Confident100 Ų10067.2 Ų67.244%0.43933%0.33SS..Hα-helixtrans-63.6-53.1175.5-179.8-98.2000111.7Y39 L41 L45 T46 V47 H87Y39-F43 WeakPolarHBondContact O-CB 3.48Å; Y39-F43 PolarHBondContact O-N 3Å; L41-F43 VanDerWaalsContact C-N 3.25Å; L41-F43 PolarHBondContact O-N 3Å; F43-L45 VanDerWaalsContact C-N 3.27Å; F43-L45 PolarHBondContact O-N 3.49Å; F43-T46 PolarHBondContact O-N 2.99Å; F43-T46 VanDerWaalsContact O-N 3.13Å; F43-V47 HydrophobicContact CD1-CG2 4.18Å; F43-V47 HydrophobicContact CD2-CG2 4.39Å; F43-V47 HydrophobicContact CE1-CG2 3.75Å; F43-V47 HydrophobicContact CE2-CG2 3.99Å; F43-V47 HydrophobicContact CG-CG2 4.48Å; F43-V47 HydrophobicContact CZ-CG2 3.65Å; F43-V47 WeakPolarHBondContact O-CG2 3.42Å; F43-V47 PolarHBondContact O-N 3.35Å; F43-H87 WeakPolarHBondContact CD1-O 3.26Å; F43-H87 WeakPolarHBondContact CE1-O 3.2Å
44T88.4Confident86.8Confident14 Ų1459.1 Ų59.19%0.08630%0.299CS..Hα-helixtrans-52.6-48.7-179.5-61.80000111L40 L41 V47 R48 L86 H87L40-T44 VanDerWaalsContact O-CB 3.29Å; L40-T44 WeakPolarHBondContact O-CB 3.21Å; L40-T44 PolarHBondContact O-N 3.13Å; L40-T44 PolarHBondContact O-OG1 3.42Å; L41-T44 PolarHBondContact O-N 3.14Å; T44-V47 PolarHBondContact O-N 2.94Å; T44-R48 HydrophobicContact CG2-CG 4.38Å; T44-R48 VanDerWaalsContact O-CG 3.26Å; T44-R48 WeakPolarHBondContact O-CG 3.46Å; T44-R48 PolarHBondContact O-N 3.49Å; T44-L86 HydrophobicContact CG2-CD1 4.15Å; T44-L86 HydrophobicContact CG2-CG 4.27Å; T44-H87 PolarHBondContact OG1-CD2 3.26Å
45L86.8Confident86.7Confident32 Ų3256.4 Ų56.417%0.16828%0.281CS..Hα-helixtrans-63.3-43.8-179.5-172.571.9000112.4A22 L41 F43 R48 C49A22-L45 VanDerWaalsContact C-CD2 3.48Å; A22-L45 HydrophobicContact CB-CD1 3.62Å; A22-L45 HydrophobicContact CB-CD2 3.28Å; A22-L45 HydrophobicContact CB-CG 3.25Å; A22-L45 WeakPolarHBondContact O-CD2 3.36Å; L41-L45 WeakPolarHBondContact O-CB 3.17Å; L41-L45 PolarHBondContact O-N 2.98Å; F43-L45 VanDerWaalsContact C-N 3.27Å; F43-L45 PolarHBondContact O-N 3.49Å; L45-R48 PolarHBondContact O-N 3.43Å; L45-C49 PolarHBondContact O-N 3.44Å; L45-C49 PolarHBondContact O-SG 3.02Å
46T87.8Confident86.6Confident87 Ų8751.9 Ų51.953%0.53426%0.262SS..Hα-helixtrans-61.7-44.9175.4-56.50000110.9Q42 F43 C49 L50Q42-T46 WeakPolarHBondContact O-CB 3.24Å; Q42-T46 PolarHBondContact O-N 3.38Å; Q42-T46 PolarHBondContact O-OG1 3.37Å; F43-T46 PolarHBondContact O-N 2.99Å; F43-T46 VanDerWaalsContact O-N 3.13Å; T46-C49 WeakPolarHBondContact O-CB 3.21Å; T46-C49 PolarHBondContact O-N 3.03Å; T46-L50 PolarHBondContact O-N 3.35Å; T46-L50 VanDerWaalsContact O-N 3.15Å
47V88.6Confident86.6Confident23 Ų2351.3 Ų51.314%0.13926%0.258CS..Hα-helixtrans-65.3-40176.2179.30000110.7F43 T44 C49 L50 Y51F43-V47 HydrophobicContact CD1-CG2 4.18Å; F43-V47 HydrophobicContact CD2-CG2 4.39Å; F43-V47 HydrophobicContact CE1-CG2 3.75Å; F43-V47 HydrophobicContact CE2-CG2 3.99Å; F43-V47 HydrophobicContact CG-CG2 4.48Å; F43-V47 HydrophobicContact CZ-CG2 3.65Å; F43-V47 WeakPolarHBondContact O-CG2 3.42Å; F43-V47 PolarHBondContact O-N 3.35Å; T44-V47 PolarHBondContact O-N 2.94Å; V47-C49 VanDerWaalsContact C-N 3.32Å; V47-C49 PolarHBondContact O-N 2.84Å; V47-L50 WeakPolarHBondContact O-CA 3.27Å; V47-L50 VanDerWaalsContact O-CB 3.31Å; V47-L50 WeakPolarHBondContact O-CB 3.45Å; V47-L50 PolarHBondContact O-N 3.05Å; V47-Y51 HydrophobicContact CG1-CD2 3.77Å; V47-Y51 HydrophobicContact CG1-CE2 3.49Å; V47-Y51 VanDerWaalsContact CG1-CE2 3.49Å; V47-Y51 WeakPolarHBondContact O-CD2 3.24Å; V47-Y51 PolarHBondContact O-N 3.41Å
48R88.7Confident86.5Confident18 Ų1849 Ų497%0.06825%0.247CC..Hα-helixtrans-62.6-37.7176.2-68.5-38.298.5-172.10.7112.5T44 L45 L50 Y51 Y52 V80 V85 L86T44-R48 HydrophobicContact CG2-CG 4.38Å; T44-R48 VanDerWaalsContact O-CG 3.26Å; T44-R48 WeakPolarHBondContact O-CG 3.46Å; T44-R48 PolarHBondContact O-N 3.49Å; L45-R48 PolarHBondContact O-N 3.43Å; R48-L50 VanDerWaalsContact C-N 3.31Å; R48-L50 PolarHBondContact O-N 2.87Å; R48-Y51 PolarHBondContact O-N 3.41Å; R48-Y52 PolarHBondContact O-N 2.83Å; R48-V80 HydrophobicContact CB-CG1 4.16Å; R48-V80 WeakPolarHBondContact CD-O 3.24Å; R48-V80 HydrophobicContact CG-CG1 4.28Å; R48-V80 PolarHBondContact NH1-O 2.96Å; R48-V85 PolarHBondContact NH2-O 3.03Å; R48-L86 HydrophobicContact CG-CD1 4.28Å; R48-L86 VanDerWaalsContact CZ-O 3.32Å; R48-L86 PolarHBondContact NE-O 3.05Å; R48-L86 VanDerWaalsContact NH2-C 3.3Å; R48-L86 VanDerWaalsContact NH2-CA 3.3Å; R48-L86 PolarHBondContact NH2-O 3.43Å
49C86.8Confident86.1Confident16 Ų1648.6 Ų48.611%0.10825%0.248CC..Hα-helixtrans-59.5-43.2171.4-67.90000111.1L45 T46 V47 Y51 Y52 T53L45-C49 PolarHBondContact O-N 3.44Å; L45-C49 PolarHBondContact O-SG 3.02Å; T46-C49 WeakPolarHBondContact O-CB 3.21Å; T46-C49 PolarHBondContact O-N 3.03Å; V47-C49 VanDerWaalsContact C-N 3.32Å; V47-C49 PolarHBondContact O-N 2.84Å; C49-Y51 VanDerWaalsContact C-N 3.34Å; C49-Y51 PolarHBondContact O-N 3.49Å; C49-Y52 PolarHBondContact O-N 3.46Å; C49-T53 WeakPolarHBondContact O-CG2 3.34Å; C49-T53 PolarHBondContact O-N 3.37Å; C49-T53 PolarHBondContact O-OG1 3.46Å
50L88.6Confident85.7Confident84 Ų8444.4 Ų44.444%0.4424%0.237SC..Hα-helixtrans-62.2-38.4176.2-17568.3000112.7T46 V47 R48 T53 S54 I91T46-L50 PolarHBondContact O-N 3.35Å; T46-L50 VanDerWaalsContact O-N 3.15Å; V47-L50 WeakPolarHBondContact O-CA 3.27Å; V47-L50 VanDerWaalsContact O-CB 3.31Å; V47-L50 WeakPolarHBondContact O-CB 3.45Å; V47-L50 PolarHBondContact O-N 3.05Å; R48-L50 VanDerWaalsContact C-N 3.31Å; R48-L50 PolarHBondContact O-N 2.87Å; L50-T53 WeakPolarHBondContact CA-OG1 3.46Å; L50-T53 PolarHBondContact O-N 3.47Å; L50-T53 PolarHBondContact O-OG1 3.3Å; L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 2.84Å; L50-I91 HydrophobicContact CD2-CD1 4Å; L50-I91 HydrophobicContact CD2-CG2 4.4Å
51Y88.8Confident85.2Confident3 Ų350.4 Ų50.41%0.01225%0.254CS..Hα-helixtrans-67-42.9175.8-82.6-121.9000110.5V47 R48 C49 T53 S54 F55 Y79 V85 P90 I91 L92V47-Y51 HydrophobicContact CG1-CD2 3.77Å; V47-Y51 HydrophobicContact CG1-CE2 3.49Å; V47-Y51 VanDerWaalsContact CG1-CE2 3.49Å; V47-Y51 WeakPolarHBondContact O-CD2 3.24Å; V47-Y51 PolarHBondContact O-N 3.41Å; R48-Y51 PolarHBondContact O-N 3.41Å; C49-Y51 VanDerWaalsContact C-N 3.34Å; C49-Y51 PolarHBondContact O-N 3.49Å; Y51-T53 VanDerWaalsContact C-N 3.34Å; Y51-T53 PolarHBondContact O-N 2.98Å; Y51-S54 WeakPolarHBondContact O-CB 3.41Å; Y51-S54 PolarHBondContact O-N 3.49Å; Y51-F55 PolarHBondContact O-N 3.16Å; Y51-Y79 HydrophobicContact CD1-CD1 4.15Å; Y51-Y79 AromaticContact CD1-CD2 3.98Å; Y51-Y79 HydrophobicContact CD1-CD2 3.98Å; Y51-Y79 AromaticContact CD1-CE1 3.71Å; Y51-Y79 HydrophobicContact CD1-CE1 3.71Å; Y51-Y79 AromaticContact CD1-CE2 3.5Å; Y51-Y79 HydrophobicContact CD1-CE2 3.5Å; Y51-Y79 VanDerWaalsContact CD1-CE2 3.5Å; Y51-Y79 HydrophobicContact CD1-CG 4.3Å; Y51-Y79 AromaticContact CD1-CZ 3.35Å; Y51-Y79 HydrophobicContact CE1-CD2 4.31Å; Y51-Y79 AromaticContact CE1-CE2 3.71Å; Y51-Y79 HydrophobicContact CE1-CE2 3.71Å; Y51-Y79 AromaticContact CE1-CZ 3.93Å; Y51-Y79 HydrophobicContact CG-CE1 4.11Å; Y51-Y79 AromaticContact CG-CZ 4Å; Y51-Y79 VanDerWaalsContact O-CE1 3.29Å; Y51-Y79 WeakPolarHBondContact O-CE1 3.42Å; Y51-V85 HydrophobicContact CE1-CG2 4Å; Y51-P90 PolarHBondContact OH-O 2.94Å; Y51-I91 HydrophobicContact CE2-CG2 4.38Å; Y51-L92 PolarHBondContact OH-N 3.42Å
52Y86.4Confident84.4Confident28 Ų2850.3 Ų50.311%0.1125%0.252CS..Hα-helixtrans-61.9-40.1175.5-176.2-85.9000112.5L11 H15 R48 C49 F55 S56 M76L11-Y52 PolarHBondContact O-OH 2.9Å; H15-Y52 HydrophobicContact CB-CD1 3.91Å; H15-Y52 HydrophobicContact CB-CE1 3.66Å; H15-Y52 AromaticContact CD2-CD1 3.86Å; R48-Y52 PolarHBondContact O-N 2.83Å; C49-Y52 PolarHBondContact O-N 3.46Å; Y52-F55 PolarHBondContact O-N 3.4Å; Y52-S56 WeakPolarHBondContact CE1-OG 3.38Å; Y52-S56 WeakPolarHBondContact O-CB 3.27Å; Y52-S56 PolarHBondContact O-N 3.26Å; Y52-S56 PolarHBondContact O-OG 3.26Å; Y52-M76 HydrophobicContact CD2-SD 3.91Å; Y52-M76 HydrophobicContact CE2-CE 4.34Å; Y52-M76 HydrophobicContact CE2-SD 3.59Å; Y52-M76 VanDerWaalsContact CE2-SD 3.59Å
53T86Confident83.1Confident37 Ų3751.1 Ų51.123%0.22726%0.256CS..Hα-helixtrans-66.4-40.5174.756.80000111.8H15 C49 L50 Y51 F55 S56 L57H15-T53 WeakPolarHBondContact CD2-CG2 3.46Å; H15-T53 WeakPolarHBondContact NE2-CG2 3.5Å; C49-T53 WeakPolarHBondContact O-CG2 3.34Å; C49-T53 PolarHBondContact O-N 3.37Å; C49-T53 PolarHBondContact O-OG1 3.46Å; L50-T53 WeakPolarHBondContact CA-OG1 3.46Å; L50-T53 PolarHBondContact O-N 3.47Å; L50-T53 PolarHBondContact O-OG1 3.3Å; Y51-T53 VanDerWaalsContact C-N 3.34Å; Y51-T53 PolarHBondContact O-N 2.98Å; T53-F55 VanDerWaalsContact C-N 3.33Å; T53-F55 PolarHBondContact O-N 2.84Å; T53-S56 PolarHBondContact O-N 3.06Å; T53-S56 VanDerWaalsContact O-N 3.15Å; T53-L57 WeakPolarHBondContact O-CB 3.23Å; T53-L57 VanDerWaalsContact O-CG 3.32Å; T53-L57 WeakPolarHBondContact O-CG 3.36Å; T53-L57 PolarHBondContact O-N 3.31Å
54S88.1Confident81.6Confident32 Ų3252.1 Ų52.122%0.22427%0.266CS..Hα-helixtrans-56.2-46.9174.2171.90000111.6L50 Y51 L57 E58 Y79L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 2.84Å; Y51-S54 WeakPolarHBondContact O-CB 3.41Å; Y51-S54 PolarHBondContact O-N 3.49Å; S54-L57 PolarHBondContact O-N 3.45Å; S54-E58 PolarHBondContact O-N 2.84Å; S54-E58 VanDerWaalsContact O-N 3.08Å; S54-Y79 PolarHBondContact OG-OH 3.44Å
55F85.9Confident79.7Confident8 Ų857.7 Ų57.74%0.03530%0.302CS..Hα-helixtrans-60.5-45.9173.9172.3-102.9000112.3L11 Y51 Y52 T53 L57 E58 L59 M76 F94L11-F55 HydrophobicContact CD2-CE1 4.29Å; Y51-F55 PolarHBondContact O-N 3.16Å; Y52-F55 PolarHBondContact O-N 3.4Å; T53-F55 VanDerWaalsContact C-N 3.33Å; T53-F55 PolarHBondContact O-N 2.84Å; F55-L57 VanDerWaalsContact C-N 3.34Å; F55-L57 PolarHBondContact O-N 2.89Å; F55-E58 PolarHBondContact O-N 3.28Å; F55-L59 PolarHBondContact O-N 2.88Å; F55-M76 HydrophobicContact CB-CG 4.5Å; F55-M76 HydrophobicContact CD1-CB 4.1Å; F55-M76 HydrophobicContact CD1-CG 3.57Å; F55-M76 HydrophobicContact CD1-SD 3.65Å; F55-M76 HydrophobicContact CD2-CB 4.19Å; F55-M76 HydrophobicContact CD2-CG 4.33Å; F55-M76 HydrophobicContact CE1-CB 3.93Å; F55-M76 HydrophobicContact CE1-CG 3.79Å; F55-M76 HydrophobicContact CE1-SD 3.6Å; F55-M76 HydrophobicContact CE2-CB 4.03Å; F55-M76 HydrophobicContact CG-CB 4.22Å; F55-M76 HydrophobicContact CG-CG 3.86Å; F55-M76 HydrophobicContact CZ-CB 3.9Å; F55-M76 HydrophobicContact CZ-CG 4.27Å; F55-M76 HydrophobicContact CZ-SD 4.45Å; F55-F94 HydrophobicContact CB-CG 4.46Å; F55-F94 AromaticContact CD2-CD1 3.86Å; F55-F94 HydrophobicContact CD2-CD1 3.86Å; F55-F94 AromaticContact CD2-CD2 3.88Å; F55-F94 HydrophobicContact CD2-CD2 3.88Å; F55-F94 AromaticContact CD2-CE1 3.56Å; F55-F94 HydrophobicContact CD2-CE1 3.56Å; F55-F94 AromaticContact CD2-CE2 3.57Å; F55-F94 HydrophobicContact CD2-CE2 3.57Å; F55-F94 HydrophobicContact CD2-CG 4.01Å; F55-F94 AromaticContact CD2-CZ 3.4Å; F55-F94 HydrophobicContact CD2-CZ 3.4Å; F55-F94 AromaticContact CE2-CE1 3.81Å; F55-F94 HydrophobicContact CE2-CE1 3.81Å; F55-F94 HydrophobicContact CE2-CE2 4.05Å; F55-F94 AromaticContact CE2-CZ 3.52Å; F55-F94 HydrophobicContact CE2-CZ 3.52Å
56S83.7Confident77.6Confident15 Ų1560.9 Ų60.911%0.10533%0.333CS..Hα-helixtrans-62.4-41-179.1-57.90000112Y52 T53 L59 C60Y52-S56 WeakPolarHBondContact CE1-OG 3.38Å; Y52-S56 WeakPolarHBondContact O-CB 3.27Å; Y52-S56 PolarHBondContact O-N 3.26Å; Y52-S56 PolarHBondContact O-OG 3.26Å; T53-S56 PolarHBondContact O-N 3.06Å; T53-S56 VanDerWaalsContact O-N 3.15Å; S56-L59 PolarHBondContact O-N 3.4Å; S56-C60 PolarHBondContact O-N 3.38Å; S56-C60 PolarHBondContact O-SG 3.12Å
57L83.9Confident75.8Confident120 Ų12060.3 Ų60.363%0.62834%0.337SS*.Hα-helixtrans-65.6-43.6177.1-72.8173.7000111.6T53 S54 F55 L59 C60 W61T53-L57 WeakPolarHBondContact O-CB 3.23Å; T53-L57 VanDerWaalsContact O-CG 3.32Å; T53-L57 WeakPolarHBondContact O-CG 3.36Å; T53-L57 PolarHBondContact O-N 3.31Å; S54-L57 PolarHBondContact O-N 3.45Å; F55-L57 VanDerWaalsContact C-N 3.34Å; F55-L57 PolarHBondContact O-N 2.89Å; L57-L59 VanDerWaalsContact C-N 3.34Å; L57-L59 PolarHBondContact O-N 2.97Å; L57-C60 WeakPolarHBondContact O-CB 2.87Å; L57-C60 PolarHBondContact O-N 2.91Å; L57-W61 WeakPolarHBondContact O-CB 3.27Å; L57-W61 PolarHBondContact O-N 3.26Å
58E83.4Confident74Confident47 Ų4765.5 Ų65.522%0.2237%0.374CS..Hα-helixtrans-62.6-42.5177.4-166.267.8-152.400111.1S54 F55 C60 W61 Q62 F94S54-E58 PolarHBondContact O-N 2.84Å; S54-E58 VanDerWaalsContact O-N 3.08Å; F55-E58 PolarHBondContact O-N 3.28Å; E58-C60 VanDerWaalsContact C-N 3.33Å; E58-C60 PolarHBondContact O-N 3.45Å; E58-W61 PolarHBondContact O-N 3.24Å; E58-Q62 WeakPolarHBondContact O-CG 3.43Å; E58-Q62 PolarHBondContact O-N 2.83Å; E58-Q62 PolarHBondContact OE1-NE2 3.44Å; E58-F94 HydrophobicContact CB-CD1 4.08Å; E58-F94 HydrophobicContact CG-CD1 4.01Å
59L78.1Confident72.4Confident26 Ų2667.9 Ų67.914%0.13639%0.391CS..Hα-helixtrans-63.5-38.8176.7-166.870000112.2W7 L11 F55 S56 L57W7-L59 HydrophobicContact CE3-CD2 3.77Å; W7-L59 HydrophobicContact CZ3-CD2 4.04Å; L11-L59 HydrophobicContact CD1-CB 4.28Å; L11-L59 HydrophobicContact CD1-CD2 3.64Å; L11-L59 HydrophobicContact CD1-CG 4.43Å; L11-L59 HydrophobicContact CD2-CD2 4.47Å; L11-L59 HydrophobicContact CG-CD2 4.4Å; F55-L59 PolarHBondContact O-N 2.88Å; S56-L59 PolarHBondContact O-N 3.4Å; L57-L59 VanDerWaalsContact C-N 3.34Å; L57-L59 PolarHBondContact O-N 2.97Å
60C76.9Confident71Confident41 Ų4172.5 Ų72.528%0.27742%0.424SS..Hα-helixtrans-65.1-40.2174.1-69.10000111.9L8 S56 L57 E58L8-C60 HydrophobicContact CD1-CB 4.24Å; L8-C60 WeakPolarHBondContact CD1-SG 3.45Å; S56-C60 PolarHBondContact O-N 3.38Å; S56-C60 PolarHBondContact O-SG 3.12Å; L57-C60 WeakPolarHBondContact O-CB 2.87Å; L57-C60 PolarHBondContact O-N 2.91Å; E58-C60 VanDerWaalsContact C-N 3.33Å; E58-C60 PolarHBondContact O-N 3.45Å
61W75.6Confident70Confident198 Ų19870.6 Ų70.675%0.7541%0.411SS*.Hα-helixtrans-68.5-41.1-177.2-167.7-93.5000112.4L57 E58 Q63 L64L57-W61 WeakPolarHBondContact O-CB 3.27Å; L57-W61 PolarHBondContact O-N 3.26Å; E58-W61 PolarHBondContact O-N 3.24Å; W61-Q63 PolarHBondContact O-N 3.29Å; W61-L64 PolarHBondContact O-N 3.37Å
62Q67.7Low69.4Low53 Ų5373.2 Ų73.225%0.24843%0.43CS..THydrogen-bonded Turntrans-75.1-6.9-178-68.7176.6-12.700115.1E58 L64 Y71E58-Q62 WeakPolarHBondContact O-CG 3.43Å; E58-Q62 PolarHBondContact O-N 2.83Å; E58-Q62 PolarHBondContact OE1-NE2 3.44Å; Q62-L64 PolarHBondContact O-N 3.14Å; Q62-Y71 VanDerWaalsContact CD-CE2 3.41Å; Q62-Y71 VanDerWaalsContact NE2-CE2 3.34Å; Q62-Y71 PolarHBondContact NE2-OH 3.31Å
63Q58.7Low69.1Low91 Ų9178.7 Ų78.743%0.42545%0.454SS..THydrogen-bonded Turntrans-66.5-8.5167.7-70.8177.1800112.4W61W61-Q63 PolarHBondContact O-N 3.29Å
64L54.9Low69.1Low122 Ų12281 Ų8164%0.63947%0.47SS*.SBendtrans-80.3134.2165.1-88.471000110.6W61 Q62 A66W61-L64 PolarHBondContact O-N 3.37Å; Q62-L64 PolarHBondContact O-N 3.14Å; L64-A66 PolarHBondContact O-N 3.42Å
65P47.3Very low69Low131 Ų13183.7 Ų83.785%0.85148%0.475SS*.SBendtrans-78.994.6-150.431.9-35.3000112.8
66A44.2Very low69.1Low99 Ų9984.2 Ų84.282%0.81848%0.478SS*.SBendtrans-158.3-8.816800000119.2L64L64-A66 PolarHBondContact O-N 3.42Å
67A49.2Very low69.3Low75 Ų7587.3 Ų87.362%0.6249%0.493SS*.  trans-153.6103.5179.100000113T69A67-T69 VanDerWaalsContact C-N 3.32Å; A67-T69 PolarHBondContact O-N 3.5Å
68S50.1Low69.6Low132 Ų13283.9 Ų83.992%0.92348%0.482SS*.  trans-72.98117252.80000110.9
69T56.3Low69.9Low67 Ų6781.7 Ų81.741%0.41147%0.472SS..  trans-110.7112.915544.70000107.1A67 Y71A67-T69 VanDerWaalsContact C-N 3.32Å; A67-T69 PolarHBondContact O-N 3.5Å; T69-Y71 WeakPolarHBondContact O-CD2 3.35Å; T69-Y71 WeakPolarHBondContact O-CE2 3.27Å; T69-Y71 PolarHBondContact O-N 3.41Å; T69-Y71 WeakPolarHBondContact OG1-CE2 3.11Å; T69-Y71 PolarHBondContact OG1-OH 2.73Å
70S58.1Low70.4Confident114 Ų11481.1 Ų81.180%0.79747%0.469SS*.  trans-74.998.1179.9-170.50000108.7S72S70-S72 PolarHBondContact O-N 2.82Å; S70-S72 VanDerWaalsContact O-N 3.16Å
71Y66.5Low71Confident43 Ų4385.2 Ų85.217%0.16948%0.482CS..  trans-69.9111.1175.4-64.9-82.6000109.7Q62 T69 F94 I98Q62-Y71 VanDerWaalsContact CD-CE2 3.41Å; Q62-Y71 VanDerWaalsContact NE2-CE2 3.34Å; Q62-Y71 PolarHBondContact NE2-OH 3.31Å; T69-Y71 WeakPolarHBondContact O-CD2 3.35Å; T69-Y71 WeakPolarHBondContact O-CE2 3.27Å; T69-Y71 PolarHBondContact O-N 3.41Å; T69-Y71 WeakPolarHBondContact OG1-CE2 3.11Å; T69-Y71 PolarHBondContact OG1-OH 2.73Å; Y71-F94 AromaticContact CD1-CE1 3.48Å; Y71-F94 HydrophobicContact CD1-CE1 3.48Å; Y71-F94 VanDerWaalsContact CD1-CE1 3.48Å; Y71-F94 AromaticContact CD1-CZ 3.56Å; Y71-F94 HydrophobicContact CD1-CZ 3.56Å; Y71-F94 AromaticContact CE1-CE1 3.63Å; Y71-F94 HydrophobicContact CE1-CE1 3.63Å; Y71-F94 HydrophobicContact CE1-CZ 4.03Å; Y71-F94 HydrophobicContact CG-CE1 4.1Å; Y71-F94 HydrophobicContact CG-CZ 4.32Å; Y71-I98 HydrophobicContact CE1-CB 4.44Å; Y71-I98 HydrophobicContact CE1-CG1 4.26Å; Y71-I98 HydrophobicContact CE1-CG2 4.02Å
72S76.2Confident71.8Confident59 Ų5977 Ų7741%0.41345%0.452SS..  trans-88.6151.2-178.3-60.40000111.4S70 P74 W75S70-S72 PolarHBondContact O-N 2.82Å; S70-S72 VanDerWaalsContact O-N 3.16Å; S72-P74 VanDerWaalsContact C-N 3.28Å; S72-P74 VanDerWaalsContact O-N 3.14Å; S72-W75 WeakPolarHBondContact O-CB 3.49Å; S72-W75 PolarHBondContact O-N 3.39Å
73F80.1Confident72.8Confident143 Ų14382.1 Ų82.163%0.62747%0.47SS*.Hα-helixtrans-47-37.8176.2179-94.3000115.3W75 M76 L77F73-W75 VanDerWaalsContact C-N 3.29Å; F73-W75 PolarHBondContact O-N 3.33Å; F73-M76 HydrophobicContact CD2-CE 3.41Å; F73-M76 VanDerWaalsContact CD2-CE 3.41Å; F73-M76 HydrophobicContact CE2-CE 3.25Å; F73-M76 HydrophobicContact CG-CE 4.34Å; F73-M76 HydrophobicContact CZ-CE 4.07Å; F73-M76 WeakPolarHBondContact O-CB 3.47Å; F73-M76 PolarHBondContact O-N 3.05Å; F73-L77 PolarHBondContact O-N 2.97Å; F73-L77 VanDerWaalsContact O-N 3.08Å
74P86.4Confident74.2Confident86 Ų8678.4 Ų78.456%0.55845%0.453SS*.Hα-helixtrans-60.5-33.6176.7-25.536.4000114.2S72 L77 A78S72-P74 VanDerWaalsContact C-N 3.28Å; S72-P74 VanDerWaalsContact O-N 3.14Å; P74-L77 PolarHBondContact O-N 3.24Å; P74-A78 WeakPolarHBondContact O-CB 3.26Å; P74-A78 PolarHBondContact O-N 3.27Å
75W86.6Confident75.8Confident88 Ų8872.7 Ų72.733%0.33342%0.424SS..Hα-helixtrans-69.6-37.6177.6-80114.4000112.2S72 F73 L77 Y79 I98 M101S72-W75 WeakPolarHBondContact O-CB 3.49Å; S72-W75 PolarHBondContact O-N 3.39Å; F73-W75 VanDerWaalsContact C-N 3.29Å; F73-W75 PolarHBondContact O-N 3.33Å; W75-L77 VanDerWaalsContact C-N 3.34Å; W75-Y79 WeakPolarHBondContact O-CB 3.32Å; W75-Y79 PolarHBondContact O-N 2.66Å; W75-I98 HydrophobicContact CB-CD1 3.94Å; W75-I98 HydrophobicContact CD2-CD1 3.57Å; W75-I98 HydrophobicContact CE3-CD1 3.17Å; W75-I98 HydrophobicContact CG-CD1 3.94Å; W75-I98 HydrophobicContact CZ3-CD1 3.83Å; W75-M101 HydrophobicContact CH2-CB 4.13Å; W75-M101 HydrophobicContact CZ3-CB 3.91Å; W75-M101 HydrophobicContact CZ3-CG 4.4Å
76M86.3Confident77.7Confident19 Ų1967.8 Ų67.89%0.09439%0.39CS..Hα-helixtrans-61.4-45.7171.3179.7-166.373.600110.6Y52 F55 F73 Y79 V80Y52-M76 HydrophobicContact CD2-SD 3.91Å; Y52-M76 HydrophobicContact CE2-CE 4.34Å; Y52-M76 HydrophobicContact CE2-SD 3.59Å; Y52-M76 VanDerWaalsContact CE2-SD 3.59Å; F55-M76 HydrophobicContact CB-CG 4.5Å; F55-M76 HydrophobicContact CD1-CB 4.1Å; F55-M76 HydrophobicContact CD1-CG 3.57Å; F55-M76 HydrophobicContact CD1-SD 3.65Å; F55-M76 HydrophobicContact CD2-CB 4.19Å; F55-M76 HydrophobicContact CD2-CG 4.33Å; F55-M76 HydrophobicContact CE1-CB 3.93Å; F55-M76 HydrophobicContact CE1-CG 3.79Å; F55-M76 HydrophobicContact CE1-SD 3.6Å; F55-M76 HydrophobicContact CE2-CB 4.03Å; F55-M76 HydrophobicContact CG-CB 4.22Å; F55-M76 HydrophobicContact CG-CG 3.86Å; F55-M76 HydrophobicContact CZ-CB 3.9Å; F55-M76 HydrophobicContact CZ-CG 4.27Å; F55-M76 HydrophobicContact CZ-SD 4.45Å; F73-M76 HydrophobicContact CD2-CE 3.41Å; F73-M76 VanDerWaalsContact CD2-CE 3.41Å; F73-M76 HydrophobicContact CE2-CE 3.25Å; F73-M76 HydrophobicContact CG-CE 4.34Å; F73-M76 HydrophobicContact CZ-CE 4.07Å; F73-M76 WeakPolarHBondContact O-CB 3.47Å; F73-M76 PolarHBondContact O-N 3.05Å; M76-Y79 PolarHBondContact O-N 2.97Å; M76-V80 HydrophobicContact CG-CG2 4.43Å; M76-V80 WeakPolarHBondContact O-CG2 3.33Å; M76-V80 PolarHBondContact O-N 3.15Å
77L87.9Confident79.4Confident80 Ų8066.4 Ų66.442%0.41937%0.366SS..Hα-helixtrans-63.8-45.5179.8-165.573.3000111.5F73 P74 W75 Y79 V80 F81F73-L77 PolarHBondContact O-N 2.97Å; F73-L77 VanDerWaalsContact O-N 3.08Å; P74-L77 PolarHBondContact O-N 3.24Å; W75-L77 VanDerWaalsContact C-N 3.34Å; L77-Y79 VanDerWaalsContact C-N 3.31Å; L77-Y79 PolarHBondContact O-N 3.01Å; L77-V80 PolarHBondContact O-N 3.23Å; L77-F81 HydrophobicContact CD1-CD2 3.41Å; L77-F81 VanDerWaalsContact CD1-CD2 3.41Å; L77-F81 HydrophobicContact CD1-CE2 3.36Å; L77-F81 HydrophobicContact CG-CD2 3.88Å; L77-F81 HydrophobicContact CG-CE2 4.33Å; L77-F81 WeakPolarHBondContact O-CB 3.45Å; L77-F81 WeakPolarHBondContact O-CD2 3.32Å; L77-F81 PolarHBondContact O-N 3.43Å
78A90.3Very high80.8Confident47 Ų4765.5 Ų65.539%0.38835%0.351SS..Hα-helixtrans-58.9-42.4176.500000111.9P74 Y82P74-A78 WeakPolarHBondContact O-CB 3.26Å; P74-A78 PolarHBondContact O-N 3.27Å; A78-Y82 WeakPolarHBondContact O-CA 3.22Å; A78-Y82 WeakPolarHBondContact O-CB 3.48Å; A78-Y82 PolarHBondContact O-N 2.83Å
79Y90.2Very high82.3Confident2 Ų259.9 Ų59.91%0.00831%0.314CS..Hα-helixtrans-67.3-47.5177.7172.5-119.3000113Y51 S54 W75 M76 L77 F81 L92 F94 F97Y51-Y79 HydrophobicContact CD1-CD1 4.15Å; Y51-Y79 AromaticContact CD1-CD2 3.98Å; Y51-Y79 HydrophobicContact CD1-CD2 3.98Å; Y51-Y79 AromaticContact CD1-CE1 3.71Å; Y51-Y79 HydrophobicContact CD1-CE1 3.71Å; Y51-Y79 AromaticContact CD1-CE2 3.5Å; Y51-Y79 HydrophobicContact CD1-CE2 3.5Å; Y51-Y79 VanDerWaalsContact CD1-CE2 3.5Å; Y51-Y79 HydrophobicContact CD1-CG 4.3Å; Y51-Y79 AromaticContact CD1-CZ 3.35Å; Y51-Y79 HydrophobicContact CE1-CD2 4.31Å; Y51-Y79 AromaticContact CE1-CE2 3.71Å; Y51-Y79 HydrophobicContact CE1-CE2 3.71Å; Y51-Y79 AromaticContact CE1-CZ 3.93Å; Y51-Y79 HydrophobicContact CG-CE1 4.11Å; Y51-Y79 AromaticContact CG-CZ 4Å; Y51-Y79 VanDerWaalsContact O-CE1 3.29Å; Y51-Y79 WeakPolarHBondContact O-CE1 3.42Å; S54-Y79 PolarHBondContact OG-OH 3.44Å; W75-Y79 WeakPolarHBondContact O-CB 3.32Å; W75-Y79 PolarHBondContact O-N 2.66Å; M76-Y79 PolarHBondContact O-N 2.97Å; L77-Y79 VanDerWaalsContact C-N 3.31Å; L77-Y79 PolarHBondContact O-N 3.01Å; Y79-F81 PolarHBondContact O-N 2.94Å; Y79-L92 PolarHBondContact OH-O 3.48Å; Y79-F94 HydrophobicContact CD1-CB 4.3Å; Y79-F94 AromaticContact CD1-CD2 3.58Å; Y79-F94 HydrophobicContact CD1-CD2 3.58Å; Y79-F94 HydrophobicContact CD1-CE2 4.42Å; Y79-F94 HydrophobicContact CD1-CG 4.37Å; Y79-F94 HydrophobicContact CD2-CD2 4.2Å; Y79-F94 HydrophobicContact CE1-CB 3.8Å; Y79-F94 AromaticContact CE1-CD2 3.98Å; Y79-F94 HydrophobicContact CE1-CD2 3.98Å; Y79-F94 HydrophobicContact CE1-CG 4.34Å; Y79-F94 HydrophobicContact CE2-CB 4.35Å; Y79-F94 AromaticContact CG-CD2 3.68Å; Y79-F94 HydrophobicContact CG-CD2 3.68Å; Y79-F94 HydrophobicContact CG-CE2 4.37Å; Y79-F94 PolarHBondContact OH-N 2.82Å; Y79-F94 VanDerWaalsContact OH-N 3.13Å; Y79-F97 HydrophobicContact CD2-CB 3.82Å; Y79-F97 AromaticContact CD2-CD1 3.64Å; Y79-F97 HydrophobicContact CD2-CD1 3.64Å; Y79-F97 HydrophobicContact CD2-CD2 4.3Å; Y79-F97 HydrophobicContact CD2-CE1 4.28Å; Y79-F97 AromaticContact CD2-CG 3.65Å; Y79-F97 HydrophobicContact CD2-CG 3.65Å; Y79-F97 HydrophobicContact CE2-CB 4.02Å; Y79-F97 HydrophobicContact CE2-CG 4.32Å; Y79-F97 HydrophobicContact CG-CD1 4.14Å
80V89.1Confident83.6Confident13 Ų1357.6 Ų57.68%0.07930%0.3CS..Hα-helixtrans-65.2-42.1-179.1172.10000110.9R48 M76 L77R48-V80 HydrophobicContact CB-CG1 4.16Å; R48-V80 WeakPolarHBondContact CD-O 3.24Å; R48-V80 HydrophobicContact CG-CG1 4.28Å; R48-V80 PolarHBondContact NH1-O 2.96Å; M76-V80 HydrophobicContact CG-CG2 4.43Å; M76-V80 WeakPolarHBondContact O-CG2 3.33Å; M76-V80 PolarHBondContact O-N 3.15Å; L77-V80 PolarHBondContact O-N 3.23Å
81F90.4Very high85Confident127 Ų12757.6 Ų57.656%0.55729%0.29SS*.THydrogen-bonded Turntrans-96.817.7-176.4-67.7-77.1000114.1L77 Y79 Y83L77-F81 HydrophobicContact CD1-CD2 3.41Å; L77-F81 VanDerWaalsContact CD1-CD2 3.41Å; L77-F81 HydrophobicContact CD1-CE2 3.36Å; L77-F81 HydrophobicContact CG-CD2 3.88Å; L77-F81 HydrophobicContact CG-CE2 4.33Å; L77-F81 WeakPolarHBondContact O-CB 3.45Å; L77-F81 WeakPolarHBondContact O-CD2 3.32Å; L77-F81 PolarHBondContact O-N 3.43Å; Y79-F81 PolarHBondContact O-N 2.94Å; F81-Y83 PolarHBondContact O-N 3.43Å
82Y91.1Very high86Confident27 Ų2755.7 Ų55.711%0.10628%0.283CS..  trans-62.9111.5177.7-175.4-127.8000111A78 P84 V85 L86 F97 M183 D186 L188A78-Y82 WeakPolarHBondContact O-CA 3.22Å; A78-Y82 WeakPolarHBondContact O-CB 3.48Å; A78-Y82 PolarHBondContact O-N 2.83Å; Y82-P84 HydrophobicContact CE1-CB 3.97Å; Y82-P84 HydrophobicContact CE1-CG 3.89Å; Y82-P84 HydrophobicContact CE2-CG 3.87Å; Y82-V85 HydrophobicContact CD1-CG1 4.43Å; Y82-V85 HydrophobicContact CD1-CG2 3.66Å; Y82-V85 HydrophobicContact CG-CG2 4.44Å; Y82-V85 PolarHBondContact O-N 3.44Å; Y82-L86 PolarHBondContact O-N 3.43Å; Y82-F97 HydrophobicContact CD1-CE2 4.07Å; Y82-F97 HydrophobicContact CD2-CE2 4.19Å; Y82-F97 HydrophobicContact CE1-CE2 4.42Å; Y82-F97 AromaticContact CG-CE2 3.96Å; Y82-F97 HydrophobicContact CG-CE2 3.96Å; Y82-F97 HydrophobicContact CG-CZ 4.49Å; Y82-M183 HydrophobicContact CE1-CG 3.92Å; Y82-D186 PolarHBondContact OH-OD2 3.29Å; Y82-L188 HydrophobicContact CE1-CD1 4.01Å; Y82-L188 HydrophobicContact CE2-CD1 4.42Å; Y82-L188 WeakPolarHBondContact OH-CD1 3.44Å
83Y89.3Confident86.6Confident160 Ų16054.6 Ų54.663%0.62728%0.275SS*.G310 helixtrans-59.7-45.4-166.3-179.4-99.4000114.7F81 V85 L86F81-Y83 PolarHBondContact O-N 3.43Å; Y83-V85 PolarHBondContact O-N 2.92Å; Y83-V85 VanDerWaalsContact O-N 3.13Å; Y83-L86 HydrophobicContact CD2-CD2 4.24Å; Y83-L86 WeakPolarHBondContact O-CB 3.12Å; Y83-L86 PolarHBondContact O-N 3.13Å
84P88.8Confident86.9Confident12 Ų1247.9 Ų47.98%0.07825%0.246CC..G310 helixtrans-55.5-35.3-176.8-32.241.1000114.1Y82 P179 L182 M183Y82-P84 HydrophobicContact CE1-CB 3.97Å; Y82-P84 HydrophobicContact CE1-CG 3.89Å; Y82-P84 HydrophobicContact CE2-CG 3.87Å; P84-P179 VanDerWaalsContact O-CB 3.24Å; P84-P179 WeakPolarHBondContact O-CB 3.45Å; P84-P179 WeakPolarHBondContact O-CG 3.1Å; P84-L182 HydrophobicContact CB-CB 3.88Å; P84-L182 HydrophobicContact CB-CD1 4.46Å; P84-L182 HydrophobicContact CG-CB 3.97Å; P84-M183 HydrophobicContact CB-CG 4.02Å
85V88.4Confident86.9Confident3 Ų346 Ų462%0.01824%0.235CC..G310 helixtrans-103.87.2-179.9-57.60000112.9R48 Y51 Y82 Y83 M183R48-V85 PolarHBondContact NH2-O 3.03Å; Y51-V85 HydrophobicContact CE1-CG2 4Å; Y82-V85 HydrophobicContact CD1-CG1 4.43Å; Y82-V85 HydrophobicContact CD1-CG2 3.66Å; Y82-V85 HydrophobicContact CG-CG2 4.44Å; Y82-V85 PolarHBondContact O-N 3.44Å; Y83-V85 PolarHBondContact O-N 2.92Å; Y83-V85 VanDerWaalsContact O-N 3.13Å; V85-M183 HydrophobicContact CG1-SD 3.73Å
86L85.9Confident87Confident27 Ų2746.6 Ų46.614%0.14124%0.241CC..THydrogen-bonded Turntrans-64.3-55.1-169.6-17960.6000112.6T44 R48 Y82 Y83T44-L86 HydrophobicContact CG2-CD1 4.15Å; T44-L86 HydrophobicContact CG2-CG 4.27Å; R48-L86 HydrophobicContact CG-CD1 4.28Å; R48-L86 VanDerWaalsContact CZ-O 3.32Å; R48-L86 PolarHBondContact NE-O 3.05Å; R48-L86 VanDerWaalsContact NH2-C 3.3Å; R48-L86 VanDerWaalsContact NH2-CA 3.3Å; R48-L86 PolarHBondContact NH2-O 3.43Å; Y82-L86 PolarHBondContact O-N 3.43Å; Y83-L86 HydrophobicContact CD2-CD2 4.24Å; Y83-L86 WeakPolarHBondContact O-CB 3.12Å; Y83-L86 PolarHBondContact O-N 3.13Å
87H79.6Confident87.2Confident71 Ų7145.9 Ų45.933%0.32924%0.237SC..SBendtrans-94.1-43.2-173.2-64.187.9000112L40 F43 T44L40-H87 HydrophobicContact CD1-CB 4.2Å; F43-H87 WeakPolarHBondContact CD1-O 3.26Å; F43-H87 WeakPolarHBondContact CE1-O 3.2Å; T44-H87 PolarHBondContact OG1-CD2 3.26Å
88N78.9Confident87.2Confident55 Ų5542.1 Ų42.129%0.29422%0.218SC..SBendtrans-149.5130.9178.2-67.3-71.5000106.3L175 P179N88-L175 HydrophobicContact CB-CD1 3.85Å; N88-L175 HydrophobicContact CB-CD2 4.44Å; N88-L175 HydrophobicContact CB-CG 4.07Å; N88-P179 WeakPolarHBondContact O-CG 3.31Å
89G81.8Confident87.1Confident14 Ų1445.9 Ų45.914%0.14423%0.225CC..  trans174.2161.7-178.300000110.5
90P84.5Confident87.1Confident19 Ų1947.5 Ų47.512%0.12323%0.233CC..  trans-66.8148.5173.732.4-36.5000110.1Y51 L92 P191Y51-P90 PolarHBondContact OH-O 2.94Å; P90-L92 PolarHBondContact O-N 3.44Å; P90-P191 HydrophobicContact CB-CB 4.48Å; P90-P191 HydrophobicContact CB-CG 3.36Å; P90-P191 HydrophobicContact CG-CG 3.37Å
91I86Confident87Confident114 Ų11449.2 Ų49.259%0.58524%0.241SC*.  trans-74.2124.4178.9-57.9167.3000107.6L50 Y51L50-I91 HydrophobicContact CD2-CD1 4Å; L50-I91 HydrophobicContact CD2-CG2 4.4Å; Y51-I91 HydrophobicContact CE2-CG2 4.38Å
92L87.7Confident86.7Confident3 Ų348.8 Ų48.82%0.01624%0.24CC..  trans-111.4136.7176.1-177.766.8000108Y51 Y79 P90 E96 F97 M183Y51-L92 PolarHBondContact OH-N 3.42Å; Y79-L92 PolarHBondContact OH-O 3.48Å; P90-L92 PolarHBondContact O-N 3.44Å; L92-E96 HydrophobicContact CD1-CB 3.91Å; L92-F97 HydrophobicContact CD2-CB 3.67Å; L92-F97 HydrophobicContact CD2-CD2 3.7Å; L92-F97 HydrophobicContact CD2-CG 4.16Å; L92-F97 HydrophobicContact CG-CB 4.17Å; L92-M183 HydrophobicContact CD2-CE 3.91Å
93S88.6Confident86.1Confident37 Ų3753.4 Ų53.426%0.25926%0.263SS..  trans-78.6154.317670.30000111.8S95 E96 F97S93-S95 PolarHBondContact O-N 2.98Å; S93-E96 WeakPolarHBondContact CB-OE2 3.47Å; S93-E96 PolarHBondContact N-OE2 3.44Å; S93-E96 PolarHBondContact O-N 3.32Å; S93-E96 WeakPolarHBondContact OG-CB 3.29Å; S93-E96 WeakPolarHBondContact OG-CG 3.44Å; S93-E96 PolarHBondContact OG-N 3.32Å; S93-E96 PolarHBondContact OG-OE2 3.47Å; S93-F97 WeakPolarHBondContact O-CB 3.37Å; S93-F97 PolarHBondContact O-N 3.13Å
94F87.6Confident85.1Confident2 Ų250.3 Ų50.31%0.00926%0.255CS..Hα-helixtrans-62.6-41.4-178.2177.9-109.4000112.7F55 E58 Y71 Y79 F97 I98F55-F94 HydrophobicContact CB-CG 4.46Å; F55-F94 AromaticContact CD2-CD1 3.86Å; F55-F94 HydrophobicContact CD2-CD1 3.86Å; F55-F94 AromaticContact CD2-CD2 3.88Å; F55-F94 HydrophobicContact CD2-CD2 3.88Å; F55-F94 AromaticContact CD2-CE1 3.56Å; F55-F94 HydrophobicContact CD2-CE1 3.56Å; F55-F94 AromaticContact CD2-CE2 3.57Å; F55-F94 HydrophobicContact CD2-CE2 3.57Å; F55-F94 HydrophobicContact CD2-CG 4.01Å; F55-F94 AromaticContact CD2-CZ 3.4Å; F55-F94 HydrophobicContact CD2-CZ 3.4Å; F55-F94 AromaticContact CE2-CE1 3.81Å; F55-F94 HydrophobicContact CE2-CE1 3.81Å; F55-F94 HydrophobicContact CE2-CE2 4.05Å; F55-F94 AromaticContact CE2-CZ 3.52Å; F55-F94 HydrophobicContact CE2-CZ 3.52Å; E58-F94 HydrophobicContact CB-CD1 4.08Å; E58-F94 HydrophobicContact CG-CD1 4.01Å; Y71-F94 AromaticContact CD1-CE1 3.48Å; Y71-F94 HydrophobicContact CD1-CE1 3.48Å; Y71-F94 VanDerWaalsContact CD1-CE1 3.48Å; Y71-F94 AromaticContact CD1-CZ 3.56Å; Y71-F94 HydrophobicContact CD1-CZ 3.56Å; Y71-F94 AromaticContact CE1-CE1 3.63Å; Y71-F94 HydrophobicContact CE1-CE1 3.63Å; Y71-F94 HydrophobicContact CE1-CZ 4.03Å; Y71-F94 HydrophobicContact CG-CE1 4.1Å; Y71-F94 HydrophobicContact CG-CZ 4.32Å; Y79-F94 HydrophobicContact CD1-CB 4.3Å; Y79-F94 AromaticContact CD1-CD2 3.58Å; Y79-F94 HydrophobicContact CD1-CD2 3.58Å; Y79-F94 HydrophobicContact CD1-CE2 4.42Å; Y79-F94 HydrophobicContact CD1-CG 4.37Å; Y79-F94 HydrophobicContact CD2-CD2 4.2Å; Y79-F94 HydrophobicContact CE1-CB 3.8Å; Y79-F94 AromaticContact CE1-CD2 3.98Å; Y79-F94 HydrophobicContact CE1-CD2 3.98Å; Y79-F94 HydrophobicContact CE1-CG 4.34Å; Y79-F94 HydrophobicContact CE2-CB 4.35Å; Y79-F94 AromaticContact CG-CD2 3.68Å; Y79-F94 HydrophobicContact CG-CD2 3.68Å; Y79-F94 HydrophobicContact CG-CE2 4.37Å; Y79-F94 PolarHBondContact OH-N 2.82Å; Y79-F94 VanDerWaalsContact OH-N 3.13Å; F94-F97 PolarHBondContact O-N 3.23Å; F94-I98 HydrophobicContact CD1-CG1 4.43Å; F94-I98 HydrophobicContact CD2-CG1 4.03Å; F94-I98 HydrophobicContact CE1-CG1 3.94Å; F94-I98 HydrophobicContact CE2-CD1 3.76Å; F94-I98 HydrophobicContact CE2-CG1 3.49Å; F94-I98 VanDerWaalsContact CE2-CG1 3.49Å; F94-I98 HydrophobicContact CG-CG1 4.48Å; F94-I98 HydrophobicContact CZ-CD1 3.91Å; F94-I98 HydrophobicContact CZ-CG1 3.44Å; F94-I98 VanDerWaalsContact CZ-CG1 3.44Å; F94-I98 WeakPolarHBondContact O-CG1 3.49Å; F94-I98 PolarHBondContact O-N 3.48Å
95S86.6Confident83.9Confident46 Ų4657.9 Ų57.932%0.32229%0.289SS..Hα-helixtrans-64.9-41.9-179.653.50000112.1S93 K99S93-S95 PolarHBondContact O-N 2.98Å; S95-K99 WeakPolarHBondContact O-CB 3.46Å; S95-K99 PolarHBondContact O-N 3.19Å
96E88.4Confident82.4Confident100 Ų10066.7 Ų66.747%0.46733%0.329SS..Hα-helixtrans-64.3-45.6173.6-70.5172.1133.900111.6L92 S93 I98 K99 Q100L92-E96 HydrophobicContact CD1-CB 3.91Å; S93-E96 WeakPolarHBondContact CB-OE2 3.47Å; S93-E96 PolarHBondContact N-OE2 3.44Å; S93-E96 PolarHBondContact O-N 3.32Å; S93-E96 WeakPolarHBondContact OG-CB 3.29Å; S93-E96 WeakPolarHBondContact OG-CG 3.44Å; S93-E96 PolarHBondContact OG-N 3.32Å; S93-E96 PolarHBondContact OG-OE2 3.47Å; E96-I98 PolarHBondContact O-N 3.32Å; E96-K99 PolarHBondContact O-N 2.92Å; E96-Q100 WeakPolarHBondContact O-CB 3.32Å; E96-Q100 VanDerWaalsContact O-CG 3.24Å; E96-Q100 WeakPolarHBondContact O-CG 3.46Å; E96-Q100 PolarHBondContact O-N 2.79Å
97F89.9Confident81.3Confident4 Ų471.4 Ų71.42%0.01836%0.355CS..Hα-helixtrans-57.6-51178.7176.6-102.8000112.2Y79 Y82 L92 S93 F94 Q100 M101 L188Y79-F97 HydrophobicContact CD2-CB 3.82Å; Y79-F97 AromaticContact CD2-CD1 3.64Å; Y79-F97 HydrophobicContact CD2-CD1 3.64Å; Y79-F97 HydrophobicContact CD2-CD2 4.3Å; Y79-F97 HydrophobicContact CD2-CE1 4.28Å; Y79-F97 AromaticContact CD2-CG 3.65Å; Y79-F97 HydrophobicContact CD2-CG 3.65Å; Y79-F97 HydrophobicContact CE2-CB 4.02Å; Y79-F97 HydrophobicContact CE2-CG 4.32Å; Y79-F97 HydrophobicContact CG-CD1 4.14Å; Y82-F97 HydrophobicContact CD1-CE2 4.07Å; Y82-F97 HydrophobicContact CD2-CE2 4.19Å; Y82-F97 HydrophobicContact CE1-CE2 4.42Å; Y82-F97 AromaticContact CG-CE2 3.96Å; Y82-F97 HydrophobicContact CG-CE2 3.96Å; Y82-F97 HydrophobicContact CG-CZ 4.49Å; L92-F97 HydrophobicContact CD2-CB 3.67Å; L92-F97 HydrophobicContact CD2-CD2 3.7Å; L92-F97 HydrophobicContact CD2-CG 4.16Å; L92-F97 HydrophobicContact CG-CB 4.17Å; S93-F97 WeakPolarHBondContact O-CB 3.37Å; S93-F97 PolarHBondContact O-N 3.13Å; F94-F97 PolarHBondContact O-N 3.23Å; F97-Q100 PolarHBondContact O-N 3.08Å; F97-M101 HydrophobicContact CD1-CG 4.47Å; F97-M101 HydrophobicContact CD2-CG 4.29Å; F97-M101 HydrophobicContact CE1-CG 4.15Å; F97-M101 HydrophobicContact CE2-CG 3.96Å; F97-M101 HydrophobicContact CE2-SD 4.28Å; F97-M101 HydrophobicContact CZ-CG 3.89Å; F97-M101 HydrophobicContact CZ-SD 4.13Å; F97-M101 WeakPolarHBondContact O-CB 3.1Å; F97-M101 VanDerWaalsContact O-CG 3.23Å; F97-M101 WeakPolarHBondContact O-CG 3.44Å; F97-M101 PolarHBondContact O-N 3.23Å; F97-L188 HydrophobicContact CD2-CD1 4.22Å; F97-L188 HydrophobicContact CE2-CD1 4.1Å
98I88.5Confident81.1Confident2 Ų271.9 Ų71.91%0.0137%0.366CS..Hα-helixtrans-66.1-42.9-179.8-66.2-62.8000111.4Y71 W75 F94 E96 Q100 M101 Q102Y71-I98 HydrophobicContact CE1-CB 4.44Å; Y71-I98 HydrophobicContact CE1-CG1 4.26Å; Y71-I98 HydrophobicContact CE1-CG2 4.02Å; W75-I98 HydrophobicContact CB-CD1 3.94Å; W75-I98 HydrophobicContact CD2-CD1 3.57Å; W75-I98 HydrophobicContact CE3-CD1 3.17Å; W75-I98 HydrophobicContact CG-CD1 3.94Å; W75-I98 HydrophobicContact CZ3-CD1 3.83Å; F94-I98 HydrophobicContact CD1-CG1 4.43Å; F94-I98 HydrophobicContact CD2-CG1 4.03Å; F94-I98 HydrophobicContact CE1-CG1 3.94Å; F94-I98 HydrophobicContact CE2-CD1 3.76Å; F94-I98 HydrophobicContact CE2-CG1 3.49Å; F94-I98 VanDerWaalsContact CE2-CG1 3.49Å; F94-I98 HydrophobicContact CG-CG1 4.48Å; F94-I98 HydrophobicContact CZ-CD1 3.91Å; F94-I98 HydrophobicContact CZ-CG1 3.44Å; F94-I98 VanDerWaalsContact CZ-CG1 3.44Å; F94-I98 WeakPolarHBondContact O-CG1 3.49Å; F94-I98 PolarHBondContact O-N 3.48Å; E96-I98 PolarHBondContact O-N 3.32Å; I98-Q100 VanDerWaalsContact C-N 3.32Å; I98-Q100 PolarHBondContact O-N 3.03Å; I98-M101 PolarHBondContact O-N 2.93Å; I98-Q102 HydrophobicContact CG2-CG 4.09Å; I98-Q102 WeakPolarHBondContact O-CB 2.99Å; I98-Q102 WeakPolarHBondContact O-CG 3.42Å; I98-Q102 PolarHBondContact O-N 3.39Å
99K88.4Confident81Confident125 Ų12575.3 Ų75.354%0.54338%0.383SS..Hα-helixtrans-57.9-48178.6-179.4-179.1176.6-174.10110.8S95 E96 Q102 Q103S95-K99 WeakPolarHBondContact O-CB 3.46Å; S95-K99 PolarHBondContact O-N 3.19Å; E96-K99 PolarHBondContact O-N 2.92Å; K99-Q102 PolarHBondContact O-N 3.23Å; K99-Q103 VanDerWaalsContact CG-OE1 3.28Å; K99-Q103 VanDerWaalsContact O-CB 3.25Å; K99-Q103 WeakPolarHBondContact O-CB 3.42Å; K99-Q103 VanDerWaalsContact O-CG 3.3Å; K99-Q103 WeakPolarHBondContact O-CG 3.18Å; K99-Q103 PolarHBondContact O-N 3.41Å
100Q89.6Confident81Confident37 Ų3782.9 Ų82.917%0.17341%0.413CS..Hα-helixtrans-65.6-39.2178.4-68.8176-7.900112.1E96 F97 I98 Q102 Q103 Q104 L188 T189E96-Q100 WeakPolarHBondContact O-CB 3.32Å; E96-Q100 VanDerWaalsContact O-CG 3.24Å; E96-Q100 WeakPolarHBondContact O-CG 3.46Å; E96-Q100 PolarHBondContact O-N 2.79Å; F97-Q100 PolarHBondContact O-N 3.08Å; I98-Q100 VanDerWaalsContact C-N 3.32Å; I98-Q100 PolarHBondContact O-N 3.03Å; Q100-Q102 PolarHBondContact O-N 3.23Å; Q100-Q103 CarbonylContact O-C 3.41Å; Q100-Q103 PolarHBondContact O-N 2.89Å; Q100-Q104 PolarHBondContact O-N 2.63Å; Q100-L188 HydrophobicContact CB-CD2 3.65Å; Q100-T189 PolarHBondContact NE2-O 2.85Å; Q100-T189 PolarHBondContact NE2-OG1 3.28Å
101M87.2Confident80.9Confident48 Ų4884.6 Ų84.624%0.23643%0.428CS..Hα-helixtrans-68.7-32178.3-75-90.34500113.5W75 F97 I98 Q104 L188W75-M101 HydrophobicContact CH2-CB 4.13Å; W75-M101 HydrophobicContact CZ3-CB 3.91Å; W75-M101 HydrophobicContact CZ3-CG 4.4Å; F97-M101 HydrophobicContact CD1-CG 4.47Å; F97-M101 HydrophobicContact CD2-CG 4.29Å; F97-M101 HydrophobicContact CE1-CG 4.15Å; F97-M101 HydrophobicContact CE2-CG 3.96Å; F97-M101 HydrophobicContact CE2-SD 4.28Å; F97-M101 HydrophobicContact CZ-CG 3.89Å; F97-M101 HydrophobicContact CZ-SD 4.13Å; F97-M101 WeakPolarHBondContact O-CB 3.1Å; F97-M101 VanDerWaalsContact O-CG 3.23Å; F97-M101 WeakPolarHBondContact O-CG 3.44Å; F97-M101 PolarHBondContact O-N 3.23Å; I98-M101 PolarHBondContact O-N 2.93Å; M101-Q104 VanDerWaalsContact CE-OE1 3.25Å; M101-L188 HydrophobicContact CE-CD2 4.14Å; M101-L188 HydrophobicContact CG-CD2 3.93Å; M101-L188 HydrophobicContact SD-CD2 4.19Å
102Q84.1Confident80.7Confident118 Ų11881.7 Ų81.755%0.55142%0.418SS*.Hα-helixtrans-81.3-32.8176.2-71.9178.3-16.200112.7I98 K99 Q100 Q104I98-Q102 HydrophobicContact CG2-CG 4.09Å; I98-Q102 WeakPolarHBondContact O-CB 2.99Å; I98-Q102 WeakPolarHBondContact O-CG 3.42Å; I98-Q102 PolarHBondContact O-N 3.39Å; K99-Q102 PolarHBondContact O-N 3.23Å; Q100-Q102 PolarHBondContact O-N 3.23Å; Q102-Q104 VanDerWaalsContact C-N 3.33Å
103Q78.1Confident80.6Confident125 Ų12586 Ų8658%0.58444%0.44SS*.SBendtrans-9626.8-179-63.5-176.7-35.900112.6K99 Q100 E105K99-Q103 VanDerWaalsContact CG-OE1 3.28Å; K99-Q103 VanDerWaalsContact O-CB 3.25Å; K99-Q103 WeakPolarHBondContact O-CB 3.42Å; K99-Q103 VanDerWaalsContact O-CG 3.3Å; K99-Q103 WeakPolarHBondContact O-CG 3.18Å; K99-Q103 PolarHBondContact O-N 3.41Å; Q100-Q103 CarbonylContact O-C 3.41Å; Q100-Q103 PolarHBondContact O-N 2.89Å; Q103-E105 VanDerWaalsContact C-N 3.3Å; Q103-E105 PolarHBondContact O-N 3.41Å
104Q69.6Low80.6Confident95 Ų9587.8 Ų87.844%0.44445%0.452SS..  trans-6292-178.3-170.5170.3-9.500110.1Q100 M101 Q102 D186Q100-Q104 PolarHBondContact O-N 2.63Å; M101-Q104 VanDerWaalsContact CE-OE1 3.25Å; Q102-Q104 VanDerWaalsContact C-N 3.33Å; Q104-D186 PolarHBondContact NE2-O 3.37Å
105E63.3Low80.7Confident170 Ų17091.3 Ų91.379%0.79447%0.474SS*.  trans-78133.6176.7-77-159.3149.900109.5Q103 D107Q103-E105 VanDerWaalsContact C-N 3.3Å; Q103-E105 PolarHBondContact O-N 3.41Å; E105-D107 VanDerWaalsContact C-N 3.26Å; E105-D107 PolarHBondContact O-N 3.48Å
106H56.9Low80.9Confident188 Ų18890.8 Ų90.887%0.8747%0.467SS*.  trans-74.283.3172.7-80.7-80.2000109.6
107D62.8Low81Confident127 Ų12789 Ų8968%0.67947%0.469SS*.  trans-56.9149.4167.4-107-21.2000110.6E105 L109E105-D107 VanDerWaalsContact C-N 3.26Å; E105-D107 PolarHBondContact O-N 3.48Å; D107-L109 PolarHBondContact O-N 2.9Å
108S74.4Confident81.2Confident80 Ų8094.6 Ų94.656%0.55950%0.499SS*.  trans-54.1115.4176.6178.20000110.2K110 A111 S112S108-K110 PolarHBondContact O-N 3.38Å; S108-A111 WeakPolarHBondContact O-CA 3.39Å; S108-A111 WeakPolarHBondContact O-CB 3.5Å; S108-A111 PolarHBondContact O-N 3.36Å; S108-S112 PolarHBondContact O-N 3.48Å
109L76.9Confident81.4Confident127 Ų12794.8 Ų94.867%0.66550%0.501SS*.Hα-helixtrans-50.8-37.7-172-168.5154.4000112.4D107 L113D107-L109 PolarHBondContact O-N 2.9Å; L109-L113 HydrophobicContact CD2-CD1 3.52Å; L109-L113 HydrophobicContact CD2-CG 4.08Å; L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.45Å; L109-L113 PolarHBondContact O-N 2.88Å
110K81.4Confident81.7Confident174 Ų17493 Ų9376%0.75750%0.497SS*.Hα-helixtrans-67.2-40.9177.5-69.3-175.5179.6-179.50113.1S108 C114S108-K110 PolarHBondContact O-N 3.38Å; K110-C114 PolarHBondContact O-N 3.23Å; K110-C114 VanDerWaalsContact O-N 3.11Å
111A82.3Confident82Confident54 Ų5493.1 Ų93.145%0.44651%0.508SS..Hα-helixtrans-67.7-44178.100000110.5S108 L113 C114 V115S108-A111 WeakPolarHBondContact O-CA 3.39Å; S108-A111 WeakPolarHBondContact O-CB 3.5Å; S108-A111 PolarHBondContact O-N 3.36Å; A111-L113 PolarHBondContact O-N 3.4Å; A111-C114 WeakPolarHBondContact O-CB 3.37Å; A111-C114 PolarHBondContact O-N 3.12Å; A111-V115 WeakPolarHBondContact O-CG2 3.45Å; A111-V115 PolarHBondContact O-N 2.83Å
112S82.4Confident82.3Confident53 Ų5397 Ų9737%0.37152%0.52SS..Hα-helixtrans-59.5-45.2175.8-179.90000112.2S108 C114 V115 L116S108-S112 PolarHBondContact O-N 3.48Å; S112-C114 VanDerWaalsContact C-N 3.34Å; S112-C114 PolarHBondContact O-N 3.25Å; S112-V115 PolarHBondContact O-N 3.44Å; S112-L116 WeakPolarHBondContact O-CB 3.38Å; S112-L116 PolarHBondContact O-N 3Å
113L86Confident82.8Confident94 Ų9492.3 Ų92.349%0.49250%0.499SS..Hα-helixtrans-62.2-38.4175.5-74.5179.2000113.1L109 A111 L116 A117L109-L113 HydrophobicContact CD2-CD1 3.52Å; L109-L113 HydrophobicContact CD2-CG 4.08Å; L109-L113 WeakPolarHBondContact O-CB 3.37Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.45Å; L109-L113 PolarHBondContact O-N 2.88Å; A111-L113 PolarHBondContact O-N 3.4Å; L113-L116 PolarHBondContact O-N 3.05Å; L113-A117 WeakPolarHBondContact O-CB 3.23Å; L113-A117 PolarHBondContact O-N 3.34Å
114C89.2Confident83.7Confident74 Ų7490.8 Ų90.850%0.549%0.494SS..Hα-helixtrans-64.7-47.1176.5-174.40000111.3K110 A111 S112 L116 A117 L118K110-C114 PolarHBondContact O-N 3.23Å; K110-C114 VanDerWaalsContact O-N 3.11Å; A111-C114 WeakPolarHBondContact O-CB 3.37Å; A111-C114 PolarHBondContact O-N 3.12Å; S112-C114 VanDerWaalsContact C-N 3.34Å; S112-C114 PolarHBondContact O-N 3.25Å; C114-L116 VanDerWaalsContact C-N 3.29Å; C114-L116 PolarHBondContact O-N 3.09Å; C114-A117 PolarHBondContact O-N 3.28Å; C114-L118 WeakPolarHBondContact O-CB 3.17Å; C114-L118 WeakPolarHBondContact O-CG 3.44Å; C114-L118 PolarHBondContact O-N 3.35Å
115V88.5Confident84.9Confident76 Ų7690.3 Ų90.346%0.46150%0.501SS..Hα-helixtrans-60.4-41176.6172.30000111.1A111 S112 G119A111-V115 WeakPolarHBondContact O-CG2 3.45Å; A111-V115 PolarHBondContact O-N 2.83Å; S112-V115 PolarHBondContact O-N 3.44Å; V115-G119 PolarHBondContact O-N 3Å
116L90Very high86.5Confident36 Ų3686.1 Ų86.119%0.18848%0.478CS..Hα-helixtrans-64.5-47.7176.2-177.775.9000111.7S112 L113 C114 L118 G119 L120 L181 L185S112-L116 WeakPolarHBondContact O-CB 3.38Å; S112-L116 PolarHBondContact O-N 3Å; L113-L116 PolarHBondContact O-N 3.05Å; C114-L116 VanDerWaalsContact C-N 3.29Å; C114-L116 PolarHBondContact O-N 3.09Å; L116-L118 PolarHBondContact O-N 2.93Å; L116-G119 CarbonylContact O-C 3.56Å; L116-G119 WeakPolarHBondContact O-CA 3.1Å; L116-G119 PolarHBondContact O-N 3.17Å; L116-G119 VanDerWaalsContact O-N 3.13Å; L116-L120 WeakPolarHBondContact O-CB 3.15Å; L116-L120 PolarHBondContact O-N 3.38Å; L116-L181 HydrophobicContact CD1-CB 4.49Å; L116-L181 HydrophobicContact CD1-CD2 4.22Å; L116-L185 HydrophobicContact CD1-CD1 4.35Å; L116-L185 HydrophobicContact CD1-CD2 3.85Å; L116-L185 HydrophobicContact CD1-CG 3.73Å; L116-L185 HydrophobicContact CD2-CD2 3.34Å; L116-L185 HydrophobicContact CD2-CG 4.15Å; L116-L185 HydrophobicContact CG-CD2 4.2Å
117A92.4Very high88.3Confident62 Ų6283.5 Ų83.551%0.51246%0.46SS..Hα-helixtrans-61.8-43.8-18000000111.7L113 C114 G119 L120 G121L113-A117 WeakPolarHBondContact O-CB 3.23Å; L113-A117 PolarHBondContact O-N 3.34Å; C114-A117 PolarHBondContact O-N 3.28Å; A117-G119 VanDerWaalsContact C-N 3.32Å; A117-G119 PolarHBondContact O-N 3.37Å; A117-L120 PolarHBondContact O-N 3.27Å; A117-G121 PolarHBondContact O-N 2.86Å
118L93.6Very high89.9Confident122 Ų12285.9 Ų85.964%0.63946%0.46SS*.Hα-helixtrans-61.4-42.1172.9-72.4170.5000111.6C114 L116 G121 R122C114-L118 WeakPolarHBondContact O-CB 3.17Å; C114-L118 WeakPolarHBondContact O-CG 3.44Å; C114-L118 PolarHBondContact O-N 3.35Å; L116-L118 PolarHBondContact O-N 2.93Å; L118-G121 PolarHBondContact O-N 3.36Å; L118-R122 WeakPolarHBondContact O-CB 3.3Å; L118-R122 PolarHBondContact O-N 2.91Å
119G92.1Very high90.9Very high5 Ų585 Ų855%0.05245%0.448CS..Hα-helixtrans-61.3-43.9176.200000112.7V115 L116 A117 R122 L123V115-G119 PolarHBondContact O-N 3Å; L116-G119 CarbonylContact O-C 3.56Å; L116-G119 WeakPolarHBondContact O-CA 3.1Å; L116-G119 PolarHBondContact O-N 3.17Å; L116-G119 VanDerWaalsContact O-N 3.13Å; A117-G119 VanDerWaalsContact C-N 3.32Å; A117-G119 PolarHBondContact O-N 3.37Å; G119-R122 PolarHBondContact O-N 3.42Å; G119-L123 WeakPolarHBondContact O-CB 3.13Å; G119-L123 PolarHBondContact O-N 3.45Å
120L94.8Very high91.7Very high88 Ų8879.6 Ų79.646%0.46142%0.422SS..Hα-helixtrans-66.4-46.1177.1-176.762.7000111.5L116 A117 R122 L123 L124 L181L116-L120 WeakPolarHBondContact O-CB 3.15Å; L116-L120 PolarHBondContact O-N 3.38Å; A117-L120 PolarHBondContact O-N 3.27Å; L120-R122 VanDerWaalsContact C-N 3.32Å; L120-R122 PolarHBondContact O-N 3.44Å; L120-L123 WeakPolarHBondContact O-CB 3.47Å; L120-L123 PolarHBondContact O-N 2.96Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L120-L124 HydrophobicContact CG-CD1 4.28Å; L120-L124 WeakPolarHBondContact O-CG 3.4Å; L120-L124 PolarHBondContact O-N 3.44Å; L120-L181 HydrophobicContact CB-CD1 4.42Å; L120-L181 HydrophobicContact CD1-CD1 4.33Å
121G95.8Very high92.3Very high40 Ų4075.5 Ų75.541%0.41241%0.405SS..Hα-helixtrans-59.4-42.9176.300000112.3A117 L118 L124 C125A117-G121 PolarHBondContact O-N 2.86Å; L118-G121 PolarHBondContact O-N 3.36Å; G121-L124 PolarHBondContact O-N 2.95Å; G121-C125 PolarHBondContact O-N 3.47Å
122R94.1Very high92.8Very high128 Ų12876.5 Ų76.548%0.48340%0.403SS..Hα-helixtrans-63.2-43174.2-176177.467.8-172.33.8112L118 G119 L120 C125 W126L118-R122 WeakPolarHBondContact O-CB 3.3Å; L118-R122 PolarHBondContact O-N 2.91Å; G119-R122 PolarHBondContact O-N 3.42Å; L120-R122 VanDerWaalsContact C-N 3.32Å; L120-R122 PolarHBondContact O-N 3.44Å; R122-C125 WeakPolarHBondContact O-CB 3.35Å; R122-C125 PolarHBondContact O-N 3.15Å; R122-W126 PolarHBondContact O-N 2.96Å
123L94.4Very high93.3Very high20 Ų2075.4 Ų75.411%0.10539%0.392CS..Hα-helixtrans-62.1-44.3177.2176.566.4000111.6G119 L120 C125 W126 W127 V174 V178 L181G119-L123 WeakPolarHBondContact O-CB 3.13Å; G119-L123 PolarHBondContact O-N 3.45Å; L120-L123 WeakPolarHBondContact O-CB 3.47Å; L120-L123 PolarHBondContact O-N 2.96Å; L120-L123 VanDerWaalsContact O-N 3.16Å; L123-C125 VanDerWaalsContact C-N 3.31Å; L123-C125 PolarHBondContact O-N 3.4Å; L123-W126 PolarHBondContact O-N 3.5Å; L123-W127 WeakPolarHBondContact O-CB 3.4Å; L123-W127 PolarHBondContact O-N 3.4Å; L123-V174 HydrophobicContact CD1-CB 4.39Å; L123-V174 HydrophobicContact CD1-CG1 4.2Å; L123-V178 HydrophobicContact CD1-CG2 4.3Å; L123-V178 HydrophobicContact CD2-CB 4.35Å; L123-V178 HydrophobicContact CD2-CG2 3.54Å; L123-V178 HydrophobicContact CG-CG2 4.45Å; L123-L181 HydrophobicContact CB-CD1 4.03Å; L123-L181 HydrophobicContact CD2-CD1 3.51Å; L123-L181 HydrophobicContact CG-CD1 4.39Å
124L96.3Very high93.5Very high94 Ų9473.2 Ų73.249%0.49239%0.388SS..Hα-helixtrans-61.4-40176.7-70.8172.2000111.8L120 G121 W127 W128L120-L124 HydrophobicContact CG-CD1 4.28Å; L120-L124 WeakPolarHBondContact O-CG 3.4Å; L120-L124 PolarHBondContact O-N 3.44Å; G121-L124 PolarHBondContact O-N 2.95Å; L124-W127 PolarHBondContact O-N 2.84Å; L124-W128 WeakPolarHBondContact O-CB 3.17Å; L124-W128 PolarHBondContact O-N 2.84Å
125C96.2Very high93.5Very high85 Ų8574.9 Ų74.957%0.57439%0.388SS*.Hα-helixtrans-60.3-47.9174-177.30000111.9G121 R122 L123 W127 W128 L129G121-C125 PolarHBondContact O-N 3.47Å; R122-C125 WeakPolarHBondContact O-CB 3.35Å; R122-C125 PolarHBondContact O-N 3.15Å; L123-C125 VanDerWaalsContact C-N 3.31Å; L123-C125 PolarHBondContact O-N 3.4Å; C125-W127 VanDerWaalsContact C-N 3.35Å; C125-W127 PolarHBondContact O-N 3.43Å; C125-W128 PolarHBondContact O-N 3.5Å; C125-L129 PolarHBondContact O-N 3.42Å
126W95.1Very high93.6Very high82 Ų8276.8 Ų76.831%0.31140%0.395SS..Hα-helixtrans-66-36.4176.8-69.1122.1000113R122 L123 L129 A130 V170 L173 V174R122-W126 PolarHBondContact O-N 2.96Å; L123-W126 PolarHBondContact O-N 3.5Å; W126-L129 HydrophobicContact CE3-CD2 3.74Å; W126-L129 HydrophobicContact CZ3-CD2 3.61Å; W126-L129 PolarHBondContact O-N 3.35Å; W126-A130 WeakPolarHBondContact O-CB 3.01Å; W126-A130 PolarHBondContact O-N 3.5Å; W126-V170 HydrophobicContact CE3-CG1 4.25Å; W126-L173 HydrophobicContact CD2-CD1 4.02Å; W126-L173 HydrophobicContact CE3-CD1 4.26Å; W126-L173 HydrophobicContact CG-CD1 4.43Å; W126-L173 HydrophobicContact CZ2-CD1 4.39Å; W126-V174 HydrophobicContact CB-CG2 3.88Å
127W95.6Very high93.4Very high133 Ų13377.5 Ų77.550%0.50440%0.398SS..Hα-helixtrans-63-46.5174.8175.966000111.5L123 L124 C125 L129 A130 E131 V174L123-W127 WeakPolarHBondContact O-CB 3.4Å; L123-W127 PolarHBondContact O-N 3.4Å; L124-W127 PolarHBondContact O-N 2.84Å; C125-W127 VanDerWaalsContact C-N 3.35Å; C125-W127 PolarHBondContact O-N 3.43Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 3.45Å; W127-A130 WeakPolarHBondContact O-CB 3.29Å; W127-A130 PolarHBondContact O-N 2.9Å; W127-E131 PolarHBondContact O-N 2.96Å; W127-V174 HydrophobicContact CB-CG1 4.22Å; W127-V174 HydrophobicContact CB-CG2 4.21Å
128W96.9Very high93Very high177 Ų17782 Ų8267%0.6740%0.403SS*.Hα-helixtrans-59.2-44.1174.3-176.7-93.1000112.1L124 C125 A130 E131 L132L124-W128 WeakPolarHBondContact O-CB 3.17Å; L124-W128 PolarHBondContact O-N 2.84Å; C125-W128 PolarHBondContact O-N 3.5Å; W128-A130 PolarHBondContact O-N 2.87Å; W128-E131 PolarHBondContact O-N 3.35Å; W128-L132 WeakPolarHBondContact O-CB 3.34Å; W128-L132 PolarHBondContact O-N 2.9Å
129L95.1Very high92.5Very high61 Ų6177.1 Ų77.132%0.31938%0.377SS..Hα-helixtrans-62.6-42.5176.2-178.562.5000112C125 W126 W127 E131 L132 M133 V170C125-L129 PolarHBondContact O-N 3.42Å; W126-L129 HydrophobicContact CE3-CD2 3.74Å; W126-L129 HydrophobicContact CZ3-CD2 3.61Å; W126-L129 PolarHBondContact O-N 3.35Å; W127-L129 VanDerWaalsContact C-N 3.33Å; W127-L129 PolarHBondContact O-N 3.45Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 2.98Å; L129-L132 PolarHBondContact O-N 2.71Å; L129-M133 HydrophobicContact CD1-CG 4.32Å; L129-M133 HydrophobicContact CG-CG 4.46Å; L129-M133 HydrophobicContact CG-SD 4.21Å; L129-M133 WeakPolarHBondContact O-CB 3.35Å; L129-M133 VanDerWaalsContact O-CG 3.29Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.27Å; L129-V170 HydrophobicContact CB-CG1 4.47Å; L129-V170 HydrophobicContact CD2-CG1 4.34Å; L129-V170 HydrophobicContact CD2-CG2 4.29Å; L129-V170 HydrophobicContact CG-CG1 4.35Å
130A93.5Very high92.1Very high14 Ų1485 Ų8512%0.11641%0.412CS..Hα-helixtrans-59.2-45.1176.400000111.1W126 W127 W128 M133 A134 V170 V174W126-A130 WeakPolarHBondContact O-CB 3.01Å; W126-A130 PolarHBondContact O-N 3.5Å; W127-A130 WeakPolarHBondContact O-CB 3.29Å; W127-A130 PolarHBondContact O-N 2.9Å; W128-A130 PolarHBondContact O-N 2.87Å; A130-M133 PolarHBondContact O-N 3.42Å; A130-A134 WeakPolarHBondContact O-CB 3.45Å; A130-A134 PolarHBondContact O-N 2.9Å; A130-V170 HydrophobicContact CB-CG1 3.89Å; A130-V174 HydrophobicContact CB-CG2 4.4Å
131E93.7Very high91.7Very high87 Ų8783.2 Ų83.241%0.40741%0.411SS..Hα-helixtrans-63.9-44.3179-162.467.3-175.700111.2W127 W128 L129 M133 A134 H135W127-E131 PolarHBondContact O-N 2.96Å; W128-E131 PolarHBondContact O-N 3.35Å; L129-E131 VanDerWaalsContact C-N 3.31Å; L129-E131 PolarHBondContact O-N 2.98Å; E131-M133 PolarHBondContact O-N 3.48Å; E131-A134 PolarHBondContact O-N 3.4Å; E131-H135 PolarHBondContact O-N 3.02Å; E131-H135 PolarHBondContact O-ND1 3.21Å; E131-H135 IonicContact OE1-CE1 3.15Å; E131-H135 PolarHBondContact OE1-CE1 3.31Å; E131-H135 IonicContact OE1-ND1 3.82Å
132L93.7Very high91.3Very high76 Ų7683.7 Ų83.740%0.39840%0.403SS..Hα-helixtrans-60.7-45.9176-172.572.3000111.5W128 L129 A134 H135 L136W128-L132 WeakPolarHBondContact O-CB 3.34Å; W128-L132 PolarHBondContact O-N 2.9Å; L129-L132 PolarHBondContact O-N 2.71Å; L132-A134 VanDerWaalsContact C-N 3.35Å; L132-A134 PolarHBondContact O-N 3.31Å; L132-H135 PolarHBondContact O-N 2.72Å; L132-L136 HydrophobicContact CD1-CD1 3.75Å; L132-L136 HydrophobicContact CD1-CG 4.15Å; L132-L136 HydrophobicContact CD2-CD1 4.33Å; L132-L136 HydrophobicContact CG-CD1 3.72Å; L132-L136 HydrophobicContact CG-CG 4.29Å; L132-L136 WeakPolarHBondContact O-CB 3.29Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 3.13Å
133M92Very high90.8Very high29 Ų2981.6 Ų81.614%0.14340%0.396CS..Hα-helixtrans-62-42.6176.5-72.3179.678.700111.5L129 A130 E131 H135 L136 M137 F167 V170L129-M133 HydrophobicContact CD1-CG 4.32Å; L129-M133 HydrophobicContact CG-CG 4.46Å; L129-M133 HydrophobicContact CG-SD 4.21Å; L129-M133 WeakPolarHBondContact O-CB 3.35Å; L129-M133 VanDerWaalsContact O-CG 3.29Å; L129-M133 WeakPolarHBondContact O-CG 3.36Å; L129-M133 PolarHBondContact O-N 3.27Å; A130-M133 PolarHBondContact O-N 3.42Å; E131-M133 PolarHBondContact O-N 3.48Å; M133-H135 VanDerWaalsContact C-N 3.31Å; M133-H135 PolarHBondContact O-N 3.06Å; M133-L136 PolarHBondContact O-N 2.96Å; M133-M137 HydrophobicContact CB-SD 3.67Å; M133-M137 HydrophobicContact CE-CE 3.97Å; M133-M137 HydrophobicContact CE-SD 3.43Å; M133-M137 WeakPolarHBondContact CE-SD 3.41Å; M133-M137 HydrophobicContact CG-SD 3.77Å; M133-M137 WeakPolarHBondContact O-CB 3.49Å; M133-M137 VanDerWaalsContact O-CG 3.32Å; M133-M137 WeakPolarHBondContact O-CG 3.12Å; M133-M137 PolarHBondContact O-N 3.49Å; M133-M137 HydrophobicContact SD-SD 4.48Å; M133-F167 HydrophobicContact CB-CD2 3.72Å; M133-F167 HydrophobicContact CB-CE2 4.11Å; M133-F167 HydrophobicContact CE-CB 3.93Å; M133-F167 HydrophobicContact CE-CD2 4.33Å; M133-F167 HydrophobicContact SD-CD2 4.46Å; M133-V170 HydrophobicContact SD-CB 4.35Å; M133-V170 HydrophobicContact SD-CG2 4.02Å
134A90.3Very high90.5Very high49 Ų4984.9 Ų84.941%0.40542%0.42SS..Hα-helixtrans-61.4-40.3177.900000112.1A130 E131 L132 F167A130-A134 WeakPolarHBondContact O-CB 3.45Å; A130-A134 PolarHBondContact O-N 2.9Å; E131-A134 PolarHBondContact O-N 3.4Å; L132-A134 VanDerWaalsContact C-N 3.35Å; L132-A134 PolarHBondContact O-N 3.31Å; A134-F167 HydrophobicContact CB-CE2 4.02Å; A134-F167 HydrophobicContact CB-CZ 4.1Å
135H90.3Very high90.2Very high109 Ų10982 Ų8251%0.50541%0.408SS..Hα-helixtrans-75.5-38.3179.4-77.179.5000113.6E131 L132 M133 Y138E131-H135 PolarHBondContact O-N 3.02Å; E131-H135 PolarHBondContact O-ND1 3.21Å; E131-H135 IonicContact OE1-CE1 3.15Å; E131-H135 PolarHBondContact OE1-CE1 3.31Å; E131-H135 IonicContact OE1-ND1 3.82Å; L132-H135 PolarHBondContact O-N 2.72Å; M133-H135 VanDerWaalsContact C-N 3.31Å; M133-H135 PolarHBondContact O-N 3.06Å; H135-Y138 VanDerWaalsContact O-CE2 3.26Å; H135-Y138 WeakPolarHBondContact O-CE2 3.09Å; H135-Y138 VanDerWaalsContact O-CZ 3.29Å
136L89.1Confident89.7Confident116 Ų11683.5 Ų83.561%0.60741%0.409SS*.Hα-helixtrans-88-34.8-173.4-66.5-177.2000113.5L132 M133 Y138L132-L136 HydrophobicContact CD1-CD1 3.75Å; L132-L136 HydrophobicContact CD1-CG 4.15Å; L132-L136 HydrophobicContact CD2-CD1 4.33Å; L132-L136 HydrophobicContact CG-CD1 3.72Å; L132-L136 HydrophobicContact CG-CG 4.29Å; L132-L136 WeakPolarHBondContact O-CB 3.29Å; L132-L136 VanDerWaalsContact O-CG 3.29Å; L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 3.13Å; M133-L136 PolarHBondContact O-N 2.96Å; L136-Y138 VanDerWaalsContact O-CD2 3.25Å; L136-Y138 WeakPolarHBondContact O-CD2 3.42Å
137M85.6Confident89.3Confident50 Ų5083.9 Ų83.925%0.24642%0.422CS..Hα-helixtrans-87.5-14.5-167.4-62.5173.962.400113.1M133 M139 A163M133-M137 HydrophobicContact CB-SD 3.67Å; M133-M137 HydrophobicContact CE-CE 3.97Å; M133-M137 HydrophobicContact CE-SD 3.43Å; M133-M137 WeakPolarHBondContact CE-SD 3.41Å; M133-M137 HydrophobicContact CG-SD 3.77Å; M133-M137 WeakPolarHBondContact O-CB 3.49Å; M133-M137 VanDerWaalsContact O-CG 3.32Å; M133-M137 WeakPolarHBondContact O-CG 3.12Å; M133-M137 PolarHBondContact O-N 3.49Å; M133-M137 HydrophobicContact SD-SD 4.48Å; M137-M139 HydrophobicContact CB-CE 4.06Å; M137-M139 HydrophobicContact CB-CG 3.88Å; M137-M139 HydrophobicContact CE-CE 3.25Å; M137-M139 HydrophobicContact CE-CG 4.44Å; M137-M139 PolarHBondContact O-N 3.25Å; M137-A163 HydrophobicContact CE-CB 3.56Å
138Y86.1Confident88.8Confident158 Ų15881.5 Ų81.562%0.6242%0.419SS*.  trans45.828.2178.6-65.2-82.4000114.6H135 L136 H140 A141 I142H135-Y138 VanDerWaalsContact O-CE2 3.26Å; H135-Y138 WeakPolarHBondContact O-CE2 3.09Å; H135-Y138 VanDerWaalsContact O-CZ 3.29Å; L136-Y138 VanDerWaalsContact O-CD2 3.25Å; L136-Y138 WeakPolarHBondContact O-CD2 3.42Å; Y138-H140 PolarHBondContact O-N 2.83Å; Y138-H140 VanDerWaalsContact O-N 3.14Å; Y138-A141 WeakPolarHBondContact O-CB 3.4Å; Y138-A141 PolarHBondContact O-N 3.15Å; Y138-I142 PolarHBondContact O-N 3Å
139M81.8Confident88.4Confident19 Ų1975.1 Ų75.19%0.09440%0.398CS..Hα-helixtrans-54.8-43.7-169.4-73.9-62.5176.100111.7M137 A141 I142 Y143 L160 A163M137-M139 HydrophobicContact CB-CE 4.06Å; M137-M139 HydrophobicContact CB-CG 3.88Å; M137-M139 HydrophobicContact CE-CE 3.25Å; M137-M139 HydrophobicContact CE-CG 4.44Å; M137-M139 PolarHBondContact O-N 3.25Å; M139-A141 VanDerWaalsContact C-N 3.33Å; M139-A141 PolarHBondContact O-N 2.8Å; M139-I142 PolarHBondContact O-N 2.92Å; M139-Y143 HydrophobicContact CB-CD2 4.22Å; M139-Y143 HydrophobicContact CB-CE2 4.23Å; M139-Y143 WeakPolarHBondContact O-CB 3.45Å; M139-Y143 WeakPolarHBondContact O-CD2 3.45Å; M139-Y143 PolarHBondContact O-N 3.15Å; M139-Y143 HydrophobicContact SD-CE2 3.96Å; M139-L160 HydrophobicContact CE-CD1 3.84Å; M139-L160 HydrophobicContact SD-CD1 3.5Å; M139-L160 WeakPolarHBondContact SD-CD1 3.39Å; M139-L160 HydrophobicContact SD-CG 4.15Å; M139-A163 HydrophobicContact CE-CB 3.3Å
140H83.8Confident88.1Confident169 Ų16979.7 Ų79.778%0.78242%0.417SS*.Hα-helixtrans-59.4-41.9178.5-172.864000113.1Y138 S144Y138-H140 PolarHBondContact O-N 2.83Å; Y138-H140 VanDerWaalsContact O-N 3.14Å; H140-S144 WeakPolarHBondContact O-CB 3.42Å; H140-S144 PolarHBondContact O-N 3.47Å; H140-S144 VanDerWaalsContact O-N 3.09Å
141A86.8Confident88Confident52 Ų5284.3 Ų84.343%0.4344%0.444SS..Hα-helixtrans-67.7-44.5177.900000111.1Y138 M139 S144Y138-A141 WeakPolarHBondContact O-CB 3.4Å; Y138-A141 PolarHBondContact O-N 3.15Å; M139-A141 VanDerWaalsContact C-N 3.33Å; M139-A141 PolarHBondContact O-N 2.8Å; A141-S144 PolarHBondContact O-N 2.89Å; A141-S144 PolarHBondContact O-OG 3.42Å
142I86.6Confident87.9Confident50 Ų5082.6 Ų82.626%0.25644%0.44SS..Hα-helixtrans-60.8-49.7179-63.2170000110.4Y138 M139 S144 S145 L148 L149 L160Y138-I142 PolarHBondContact O-N 3Å; M139-I142 PolarHBondContact O-N 2.92Å; I142-S144 VanDerWaalsContact C-N 3.27Å; I142-S144 PolarHBondContact O-N 3.23Å; I142-S145 PolarHBondContact O-N 3.32Å; I142-S145 VanDerWaalsContact O-N 3.11Å; I142-S145 PolarHBondContact O-OG 3.28Å; I142-L148 HydrophobicContact CG2-CD2 4.24Å; I142-L149 HydrophobicContact CG2-CD1 4.02Å; I142-L149 WeakPolarHBondContact O-CD1 3.44Å; I142-L160 HydrophobicContact CD1-CD1 4.15Å; I142-L160 HydrophobicContact CG2-CD1 3.97Å; I142-L160 HydrophobicContact CG2-CD2 3.71Å
143Y85.1Confident87.9Confident84 Ų8481.8 Ų81.833%0.32944%0.441SS..Hα-helixtrans-66.8-25.2179.7-76.8-63.8000113.9M139 S145 L149 L160 Q164M139-Y143 HydrophobicContact CB-CD2 4.22Å; M139-Y143 HydrophobicContact CB-CE2 4.23Å; M139-Y143 WeakPolarHBondContact O-CB 3.45Å; M139-Y143 WeakPolarHBondContact O-CD2 3.45Å; M139-Y143 PolarHBondContact O-N 3.15Å; M139-Y143 HydrophobicContact SD-CE2 3.96Å; Y143-S145 PolarHBondContact O-N 3.45Å; Y143-L149 HydrophobicContact CD1-CD2 3.9Å; Y143-L149 HydrophobicContact CE1-CD2 4.19Å; Y143-L160 HydrophobicContact CD1-CD2 4.41Å; Y143-L160 HydrophobicContact CE1-CD2 3.78Å; Y143-L160 HydrophobicContact CE1-CG 4.37Å; Y143-L160 HydrophobicContact CE2-CD2 4.37Å; Y143-L160 HydrophobicContact CE2-CG 4.32Å; Y143-L160 PolarHBondContact OH-O 3.5Å; Y143-Q164 HydrophobicContact CE2-CB 3.99Å; Y143-Q164 HydrophobicContact CE2-CG 3.94Å; Y143-Q164 WeakPolarHBondContact OH-CB 3.44Å
144S87.3Confident87.9Confident89 Ų8985.6 Ų85.662%0.62247%0.469SS*.Hα-helixtrans-69.4-19.617575.30000113H140 A141 I142H140-S144 WeakPolarHBondContact O-CB 3.42Å; H140-S144 PolarHBondContact O-N 3.47Å; H140-S144 VanDerWaalsContact O-N 3.09Å; A141-S144 PolarHBondContact O-N 2.89Å; A141-S144 PolarHBondContact O-OG 3.42Å; I142-S144 VanDerWaalsContact C-N 3.27Å; I142-S144 PolarHBondContact O-N 3.23Å
145S89.6Confident88.1Confident34 Ų3494.3 Ų94.324%0.23849%0.492CS..  trans-102.789.7-178.8570000112.8I142 Y143 P147 L148 L149I142-S145 PolarHBondContact O-N 3.32Å; I142-S145 VanDerWaalsContact O-N 3.11Å; I142-S145 PolarHBondContact O-OG 3.28Å; Y143-S145 PolarHBondContact O-N 3.45Å; S145-P147 VanDerWaalsContact C-CD 3.48Å; S145-L148 WeakPolarHBondContact O-CB 3.29Å; S145-L148 PolarHBondContact O-N 3.32Å; S145-L148 WeakPolarHBondContact OG-CB 3.47Å; S145-L149 WeakPolarHBondContact O-CD1 3.46Å; S145-L149 PolarHBondContact O-N 3.21Å
146I86Confident88.1Confident115 Ų11592.9 Ų92.959%0.5949%0.49SS*.Hα-helixtrans-50.8-48173.5-58.8173.2000113.4L148 L149 E150I146-L148 PolarHBondContact O-N 3.46Å; I146-L149 PolarHBondContact O-N 2.87Å; I146-E150 HydrophobicContact CG2-CG 4.4Å; I146-E150 PolarHBondContact O-N 2.89Å; I146-E150 VanDerWaalsContact O-N 3.09Å
147P87.3Confident88.2Confident91 Ų9191 Ų9159%0.59148%0.48SS*.Hα-helixtrans-64.9-29-177.424.7-34.8000112.8S145 E150 T151S145-P147 VanDerWaalsContact C-CD 3.48Å; P147-E150 PolarHBondContact O-N 3.42Å; P147-T151 WeakPolarHBondContact O-CG2 3.4Å; P147-T151 PolarHBondContact O-N 2.92Å; P147-T151 PolarHBondContact O-OG1 3.34Å
148L85Confident88.5Confident83 Ų8390.6 Ų90.644%0.43549%0.489SS..Hα-helixtrans-67.1-42.7174.7-167.772.4000110.3I142 S145 I146 E150 T151 V152I142-L148 HydrophobicContact CG2-CD2 4.24Å; S145-L148 WeakPolarHBondContact O-CB 3.29Å; S145-L148 PolarHBondContact O-N 3.32Å; S145-L148 WeakPolarHBondContact OG-CB 3.47Å; I146-L148 PolarHBondContact O-N 3.46Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.37Å; L148-T151 PolarHBondContact O-N 2.96Å; L148-T151 PolarHBondContact O-OG1 3.5Å; L148-V152 WeakPolarHBondContact O-CG1 3.26Å; L148-V152 PolarHBondContact O-N 3.37Å
149L87.9Confident88.8Confident43 Ų4384.9 Ų84.923%0.22548%0.479CS..Hα-helixtrans-65.5-32.4178.2-91.675.9000113.2I142 Y143 S145 I146 T151 V152 L157I142-L149 HydrophobicContact CG2-CD1 4.02Å; I142-L149 WeakPolarHBondContact O-CD1 3.44Å; Y143-L149 HydrophobicContact CD1-CD2 3.9Å; Y143-L149 HydrophobicContact CE1-CD2 4.19Å; S145-L149 WeakPolarHBondContact O-CD1 3.46Å; S145-L149 PolarHBondContact O-N 3.21Å; I146-L149 PolarHBondContact O-N 2.87Å; L149-T151 VanDerWaalsContact C-N 3.34Å; L149-V152 WeakPolarHBondContact O-CG2 3.42Å; L149-L157 HydrophobicContact CG-CD1 4.42Å
150E88.9Confident89.3Confident156 Ų15685.2 Ų85.273%0.72948%0.481SS*.Hα-helixtrans-74.7-25.1178.2-69.8179.816600112.9I146 P147 L148I146-E150 HydrophobicContact CG2-CG 4.4Å; I146-E150 PolarHBondContact O-N 2.89Å; I146-E150 VanDerWaalsContact O-N 3.09Å; P147-E150 PolarHBondContact O-N 3.42Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.37Å
151T92Very high89.6Confident111 Ų11179.5 Ų79.568%0.68146%0.463SS*.Hα-helixtrans-86.8-20.3-178.761.50000114.1P147 L148 L149P147-T151 WeakPolarHBondContact O-CG2 3.4Å; P147-T151 PolarHBondContact O-N 2.92Å; P147-T151 PolarHBondContact O-OG1 3.34Å; L148-T151 PolarHBondContact O-N 2.96Å; L148-T151 PolarHBondContact O-OG1 3.5Å; L149-T151 VanDerWaalsContact C-N 3.34Å
152V90.6Very high89.8Confident51 Ų5181.3 Ų81.331%0.30947%0.465SS..SBendtrans-78.9149.7-177.5-67.90000111.9L148 L149 T156 L157L148-V152 WeakPolarHBondContact O-CG1 3.26Å; L148-V152 PolarHBondContact O-N 3.37Å; L149-V152 WeakPolarHBondContact O-CG2 3.42Å; V152-T156 HydrophobicContact CB-CG2 4.15Å; V152-T156 HydrophobicContact CG1-CG2 4.3Å; V152-L157 HydrophobicContact CG2-CD1 4.03Å
153S94.1Very high90.1Very high60 Ų6079.9 Ų79.942%0.4246%0.461SS..  trans-63.3154.6177.480.80000112W155 T156 L157S153-W155 PolarHBondContact O-N 2.99Å; S153-T156 WeakPolarHBondContact O-CB 3.46Å; S153-T156 PolarHBondContact O-N 3.19Å; S153-T156 PolarHBondContact OG-N 3.44Å; S153-T156 PolarHBondContact OG-OG1 2.94Å; S153-L157 PolarHBondContact O-N 3.27Å
154C91.7Very high90.4Very high109 Ų10977.5 Ų77.574%0.73645%0.452SS*.Hα-helixtrans-56.5-36.2176.3-171.90000112.6L157 G158C154-L157 WeakPolarHBondContact O-CB 3.38Å; C154-L157 PolarHBondContact O-N 2.96Å; C154-G158 PolarHBondContact O-N 3.47Å
155W93.8Very high90.6Very high232 Ų23276 Ų7688%0.87944%0.439SS*.Hα-helixtrans-64.2-44175.2-68.4102.9000112.5S153 L157 G158 G159S153-W155 PolarHBondContact O-N 2.99Å; W155-L157 VanDerWaalsContact C-N 3.33Å; W155-G158 PolarHBondContact O-N 2.77Å; W155-G159 PolarHBondContact O-N 2.96Å
156T91.9Very high90.7Very high78 Ų7877 Ų7748%0.47944%0.442SS..Hα-helixtrans-63.8-41.4175.6-49.90000110.9V152 S153 G159 L160V152-T156 HydrophobicContact CB-CG2 4.15Å; V152-T156 HydrophobicContact CG1-CG2 4.3Å; S153-T156 WeakPolarHBondContact O-CB 3.46Å; S153-T156 PolarHBondContact O-N 3.19Å; S153-T156 PolarHBondContact OG-N 3.44Å; S153-T156 PolarHBondContact OG-OG1 2.94Å; T156-G159 PolarHBondContact O-N 3.04Å; T156-L160 WeakPolarHBondContact O-CB 3.29Å; T156-L160 PolarHBondContact O-N 3.33Å
157L91.2Very high91Very high76 Ų7673.4 Ų73.440%0.39842%0.422SS..Hα-helixtrans-61.2-44.2176.2-162.295.7000111.4L149 V152 S153 C154 W155 L160 A161L149-L157 HydrophobicContact CG-CD1 4.42Å; V152-L157 HydrophobicContact CG2-CD1 4.03Å; S153-L157 PolarHBondContact O-N 3.27Å; C154-L157 WeakPolarHBondContact O-CB 3.38Å; C154-L157 PolarHBondContact O-N 2.96Å; W155-L157 VanDerWaalsContact C-N 3.33Å; L157-L160 PolarHBondContact O-N 3.49Å; L157-A161 WeakPolarHBondContact O-CB 3.35Å; L157-A161 PolarHBondContact O-N 2.91Å
158G91.8Very high91.2Very high42 Ų4273.3 Ų73.343%0.43341%0.412SS..Hα-helixtrans-61.7-41.8174.300000112.7C154 W155 A161 L162C154-G158 PolarHBondContact O-N 3.47Å; W155-G158 PolarHBondContact O-N 2.77Å; G158-A161 PolarHBondContact O-N 3.41Å; G158-L162 WeakPolarHBondContact O-CB 3.14Å; G158-L162 PolarHBondContact O-N 3.21Å
159G91.8Very high91.5Very high39 Ų3971.7 Ų71.740%0.40240%0.401SS..Hα-helixtrans-62.1-43.4173.600000112.8W155 T156 L162 A163W155-G159 PolarHBondContact O-N 2.96Å; T156-G159 PolarHBondContact O-N 3.04Å; G159-L162 PolarHBondContact O-N 3.42Å; G159-A163 WeakPolarHBondContact O-CB 3.18Å; G159-A163 PolarHBondContact O-N 3.47Å
160L91.6Very high91.8Very high26 Ų2670 Ų7014%0.13639%0.393CS..Hα-helixtrans-62.5-44.8176.3-16777000111.1M139 I142 Y143 T156 L157 A163 Q164M139-L160 HydrophobicContact CE-CD1 3.84Å; M139-L160 HydrophobicContact SD-CD1 3.5Å; M139-L160 WeakPolarHBondContact SD-CD1 3.39Å; M139-L160 HydrophobicContact SD-CG 4.15Å; I142-L160 HydrophobicContact CD1-CD1 4.15Å; I142-L160 HydrophobicContact CG2-CD1 3.97Å; I142-L160 HydrophobicContact CG2-CD2 3.71Å; Y143-L160 HydrophobicContact CD1-CD2 4.41Å; Y143-L160 HydrophobicContact CE1-CD2 3.78Å; Y143-L160 HydrophobicContact CE1-CG 4.37Å; Y143-L160 HydrophobicContact CE2-CD2 4.37Å; Y143-L160 HydrophobicContact CE2-CG 4.32Å; Y143-L160 PolarHBondContact OH-O 3.5Å; T156-L160 WeakPolarHBondContact O-CB 3.29Å; T156-L160 PolarHBondContact O-N 3.33Å; L157-L160 PolarHBondContact O-N 3.49Å; L160-A163 PolarHBondContact O-N 2.91Å; L160-Q164 WeakPolarHBondContact O-CB 3.43Å; L160-Q164 PolarHBondContact O-N 3.44Å
161A90.6Very high92Very high49 Ų4967.7 Ų67.741%0.40538%0.38SS..Hα-helixtrans-61.5-45.717600000112.1L157 G158 A163 Q164 V165L157-A161 WeakPolarHBondContact O-CB 3.35Å; L157-A161 PolarHBondContact O-N 2.91Å; G158-A161 PolarHBondContact O-N 3.41Å; A161-A163 VanDerWaalsContact C-N 3.35Å; A161-A163 PolarHBondContact O-N 2.95Å; A161-Q164 WeakPolarHBondContact O-CB 3.48Å; A161-Q164 PolarHBondContact O-N 3.26Å; A161-V165 WeakPolarHBondContact O-CG2 3.42Å; A161-V165 PolarHBondContact O-N 3.37Å
162L91.6Very high91.9Very high89 Ų8967.3 Ų67.347%0.46637%0.367SS..Hα-helixtrans-61.2-45.6175.9179.264.3000111.3G158 G159 Q164 V165 L166G158-L162 WeakPolarHBondContact O-CB 3.14Å; G158-L162 PolarHBondContact O-N 3.21Å; G159-L162 PolarHBondContact O-N 3.42Å; L162-Q164 VanDerWaalsContact C-N 3.3Å; L162-Q164 PolarHBondContact O-N 2.93Å; L162-V165 PolarHBondContact O-N 2.94Å; L162-L166 HydrophobicContact CD1-CD1 4.48Å; L162-L166 HydrophobicContact CD1-CG 4.46Å; L162-L166 HydrophobicContact CG-CD1 4.14Å; L162-L166 WeakPolarHBondContact O-CG 3.32Å; L162-L166 PolarHBondContact O-N 3.09Å
163A91.7Very high92Very high21 Ų2165.5 Ų65.517%0.17436%0.355CS..Hα-helixtrans-62-37.8179.300000112M137 M139 G159 L160 A161 L166 F167M137-A163 HydrophobicContact CE-CB 3.56Å; M139-A163 HydrophobicContact CE-CB 3.3Å; G159-A163 WeakPolarHBondContact O-CB 3.18Å; G159-A163 PolarHBondContact O-N 3.47Å; L160-A163 PolarHBondContact O-N 2.91Å; A161-A163 VanDerWaalsContact C-N 3.35Å; A161-A163 PolarHBondContact O-N 2.95Å; A163-L166 PolarHBondContact O-N 3.36Å; A163-F167 WeakPolarHBondContact O-CB 2.9Å; A163-F167 PolarHBondContact O-N 3.04Å
164Q91.1Very high92Very high33 Ų3363.8 Ų63.815%0.15434%0.342CS..Hα-helixtrans-64.9-44.1172.3-178.263.126.400112.4Y143 L160 A161 L162 L166 F167 F168Y143-Q164 HydrophobicContact CE2-CB 3.99Å; Y143-Q164 HydrophobicContact CE2-CG 3.94Å; Y143-Q164 WeakPolarHBondContact OH-CB 3.44Å; L160-Q164 WeakPolarHBondContact O-CB 3.43Å; L160-Q164 PolarHBondContact O-N 3.44Å; A161-Q164 WeakPolarHBondContact O-CB 3.48Å; A161-Q164 PolarHBondContact O-N 3.26Å; L162-Q164 VanDerWaalsContact C-N 3.3Å; L162-Q164 PolarHBondContact O-N 2.93Å; Q164-L166 VanDerWaalsContact C-N 3.34Å; Q164-F167 PolarHBondContact O-N 3.34Å; Q164-F168 HydrophobicContact CG-CD2 3.95Å; Q164-F168 HydrophobicContact CG-CE2 3.61Å; Q164-F168 HydrophobicContact CG-CZ 4.44Å; Q164-F168 VanDerWaalsContact O-CD2 3.22Å; Q164-F168 WeakPolarHBondContact O-CD2 3.48Å; Q164-F168 PolarHBondContact O-N 3.32Å
165V91.8Very high92Very high57 Ų5761.3 Ų61.335%0.34532%0.321SS..Hα-helixtrans-62.9-41.8176.7171.90000111.2A161 L162 F168 Y169 V197A161-V165 WeakPolarHBondContact O-CG2 3.42Å; A161-V165 PolarHBondContact O-N 3.37Å; L162-V165 PolarHBondContact O-N 2.94Å; V165-F168 PolarHBondContact O-N 3.14Å; V165-Y169 PolarHBondContact O-N 2.87Å; V165-V197 HydrophobicContact CG1-CB 3.85Å; V165-V197 HydrophobicContact CG1-CG1 4.1Å; V165-V197 HydrophobicContact CG1-CG2 3.9Å
166L92.3Very high91.9Very high57 Ų5752.5 Ų52.530%0.29829%0.289SS..Hα-helixtrans-65-40.8175.7-69.7173.1000111.9L162 A163 Q164 Y169 V170L162-L166 HydrophobicContact CD1-CD1 4.48Å; L162-L166 HydrophobicContact CD1-CG 4.46Å; L162-L166 HydrophobicContact CG-CD1 4.14Å; L162-L166 WeakPolarHBondContact O-CG 3.32Å; L162-L166 PolarHBondContact O-N 3.09Å; A163-L166 PolarHBondContact O-N 3.36Å; Q164-L166 VanDerWaalsContact C-N 3.34Å; L166-Y169 WeakPolarHBondContact O-CB 3.07Å; L166-Y169 PolarHBondContact O-N 3.31Å; L166-V170 WeakPolarHBondContact O-CG2 3.25Å; L166-V170 PolarHBondContact O-N 2.9Å
167F92.6Very high91.9Very high39 Ų3949.1 Ų49.117%0.17127%0.27CS..Hα-helixtrans-61.7-44.4174.1177.5-111.9000111.7M133 A134 A163 Q164 Y169 V170 K171M133-F167 HydrophobicContact CB-CD2 3.72Å; M133-F167 HydrophobicContact CB-CE2 4.11Å; M133-F167 HydrophobicContact CE-CB 3.93Å; M133-F167 HydrophobicContact CE-CD2 4.33Å; M133-F167 HydrophobicContact SD-CD2 4.46Å; A134-F167 HydrophobicContact CB-CE2 4.02Å; A134-F167 HydrophobicContact CB-CZ 4.1Å; A163-F167 WeakPolarHBondContact O-CB 2.9Å; A163-F167 PolarHBondContact O-N 3.04Å; Q164-F167 PolarHBondContact O-N 3.34Å; F167-Y169 VanDerWaalsContact C-N 3.33Å; F167-Y169 PolarHBondContact O-N 2.92Å; F167-V170 PolarHBondContact O-N 3.33Å; F167-K171 WeakPolarHBondContact O-CB 3.5Å; F167-K171 PolarHBondContact O-N 2.93Å
168F91.3Very high91.9Very high88 Ų8848.8 Ų48.839%0.38627%0.271SS..Hα-helixtrans-57.5-47.4173.4-78.8-53.1000111.3Q164 V165 V170 K171 Y172Q164-F168 HydrophobicContact CG-CD2 3.95Å; Q164-F168 HydrophobicContact CG-CE2 3.61Å; Q164-F168 HydrophobicContact CG-CZ 4.44Å; Q164-F168 VanDerWaalsContact O-CD2 3.22Å; Q164-F168 WeakPolarHBondContact O-CD2 3.48Å; Q164-F168 PolarHBondContact O-N 3.32Å; V165-F168 PolarHBondContact O-N 3.14Å; F168-V170 PolarHBondContact O-N 2.91Å; F168-K171 WeakPolarHBondContact O-CB 3.22Å; F168-K171 PolarHBondContact O-N 3.27Å; F168-Y172 HydrophobicContact CB-CD2 4.42Å; F168-Y172 HydrophobicContact CB-CE2 4.49Å; F168-Y172 HydrophobicContact CD1-CE2 4.37Å; F168-Y172 WeakPolarHBondContact O-CD2 3.47Å; F168-Y172 PolarHBondContact O-N 3.18Å
169Y92.4Very high91.9Very high50 Ų5047.2 Ų47.220%0.19625%0.253CS..Hα-helixtrans-54.3-51.3177.8168.3-108.3000112.5V165 L166 F167 K171 Y172 L173 P194 R195 C196V165-Y169 PolarHBondContact O-N 2.87Å; L166-Y169 WeakPolarHBondContact O-CB 3.07Å; L166-Y169 PolarHBondContact O-N 3.31Å; F167-Y169 VanDerWaalsContact C-N 3.33Å; F167-Y169 PolarHBondContact O-N 2.92Å; Y169-K171 VanDerWaalsContact C-N 3.35Å; Y169-K171 PolarHBondContact O-N 3.49Å; Y169-Y172 PolarHBondContact O-N 3.01Å; Y169-L173 HydrophobicContact CD1-CD1 4.28Å; Y169-L173 HydrophobicContact CD2-CG 4.44Å; Y169-L173 HydrophobicContact CE1-CD1 3.61Å; Y169-L173 HydrophobicContact CE1-CG 4.34Å; Y169-L173 HydrophobicContact CE2-CD1 4.09Å; Y169-L173 HydrophobicContact CE2-CD2 4.11Å; Y169-L173 HydrophobicContact CE2-CG 3.99Å; Y169-L173 PolarHBondContact O-N 3.35Å; Y169-P194 WeakPolarHBondContact CE2-O 3.48Å; Y169-R195 VanDerWaalsContact CE2-C 3.41Å; Y169-C196 HydrophobicContact CD1-CB 4.43Å; Y169-C196 HydrophobicContact CD2-CB 4.44Å; Y169-C196 HydrophobicContact CE1-CB 3.96Å; Y169-C196 VanDerWaalsContact CE2-CA 3.49Å; Y169-C196 HydrophobicContact CE2-CB 3.98Å; Y169-C196 VanDerWaalsContact CE2-N 3.32Å
170V93.6Very high91.9Very high8 Ų845.6 Ų45.65%0.04824%0.236CC..Hα-helixtrans-63.1-41.5179-179.70000111.1W126 L129 A130 M133 L166 F167 F168 Y172 L173 V174W126-V170 HydrophobicContact CE3-CG1 4.25Å; L129-V170 HydrophobicContact CB-CG1 4.47Å; L129-V170 HydrophobicContact CD2-CG1 4.34Å; L129-V170 HydrophobicContact CD2-CG2 4.29Å; L129-V170 HydrophobicContact CG-CG1 4.35Å; A130-V170 HydrophobicContact CB-CG1 3.89Å; M133-V170 HydrophobicContact SD-CB 4.35Å; M133-V170 HydrophobicContact SD-CG2 4.02Å; L166-V170 WeakPolarHBondContact O-CG2 3.25Å; L166-V170 PolarHBondContact O-N 2.9Å; F167-V170 PolarHBondContact O-N 3.33Å; F168-V170 PolarHBondContact O-N 2.91Å; V170-Y172 PolarHBondContact O-N 3.39Å; V170-L173 WeakPolarHBondContact O-CB 3.35Å; V170-L173 PolarHBondContact O-N 3.4Å; V170-V174 PolarHBondContact O-N 3.21Å
171K91.9Very high91.9Very high106 Ų10645.1 Ų45.146%0.46123%0.234SC..Hα-helixtrans-57.8-45174.8177.8178.3176.8176.40112.1F167 F168 Y169 V174 L175F167-K171 WeakPolarHBondContact O-CB 3.5Å; F167-K171 PolarHBondContact O-N 2.93Å; F168-K171 WeakPolarHBondContact O-CB 3.22Å; F168-K171 PolarHBondContact O-N 3.27Å; Y169-K171 VanDerWaalsContact C-N 3.35Å; Y169-K171 PolarHBondContact O-N 3.49Å; K171-V174 PolarHBondContact O-N 2.91Å; K171-L175 WeakPolarHBondContact O-CB 3.49Å; K171-L175 PolarHBondContact O-N 2.7Å
172Y91.5Very high91.9Very high103 Ų10345.8 Ų45.840%0.40423%0.23SC..Hα-helixtrans-71.8-30.5179.2-80.5-77000113.2F168 Y169 V170 V174 L175 F176F168-Y172 HydrophobicContact CB-CD2 4.42Å; F168-Y172 HydrophobicContact CB-CE2 4.49Å; F168-Y172 HydrophobicContact CD1-CE2 4.37Å; F168-Y172 WeakPolarHBondContact O-CD2 3.47Å; F168-Y172 PolarHBondContact O-N 3.18Å; Y169-Y172 PolarHBondContact O-N 3.01Å; V170-Y172 PolarHBondContact O-N 3.39Å; Y172-V174 VanDerWaalsContact C-N 3.28Å; Y172-V174 PolarHBondContact O-N 3.12Å; Y172-L175 HydrophobicContact CD1-CD2 4Å; Y172-L175 HydrophobicContact CE1-CD2 4.03Å; Y172-L175 PolarHBondContact O-N 3.43Å; Y172-F176 HydrophobicContact CD1-CD2 4.25Å; Y172-F176 HydrophobicContact CD1-CE1 4.48Å; Y172-F176 AromaticContact CD1-CE2 3.6Å; Y172-F176 HydrophobicContact CD1-CE2 3.6Å; Y172-F176 AromaticContact CD1-CZ 3.74Å; Y172-F176 HydrophobicContact CD1-CZ 3.74Å; Y172-F176 HydrophobicContact CE1-CE2 4.39Å; Y172-F176 HydrophobicContact CE1-CZ 4.15Å; Y172-F176 HydrophobicContact CG-CE2 4.35Å; Y172-F176 WeakPolarHBondContact O-CB 3.42Å; Y172-F176 PolarHBondContact O-N 3.12Å
173L92.5Very high91.8Very high14 Ų1441.6 Ų41.67%0.07321%0.208CC..Hα-helixtrans-59.7-41.3170.4-76.1-179.9000111.7W126 Y169 V170 G177 L193 P194W126-L173 HydrophobicContact CD2-CD1 4.02Å; W126-L173 HydrophobicContact CE3-CD1 4.26Å; W126-L173 HydrophobicContact CG-CD1 4.43Å; W126-L173 HydrophobicContact CZ2-CD1 4.39Å; Y169-L173 HydrophobicContact CD1-CD1 4.28Å; Y169-L173 HydrophobicContact CD2-CG 4.44Å; Y169-L173 HydrophobicContact CE1-CD1 3.61Å; Y169-L173 HydrophobicContact CE1-CG 4.34Å; Y169-L173 HydrophobicContact CE2-CD1 4.09Å; Y169-L173 HydrophobicContact CE2-CD2 4.11Å; Y169-L173 HydrophobicContact CE2-CG 3.99Å; Y169-L173 PolarHBondContact O-N 3.35Å; V170-L173 WeakPolarHBondContact O-CB 3.35Å; V170-L173 PolarHBondContact O-N 3.4Å; L173-G177 VanDerWaalsContact O-CA 3.23Å; L173-G177 WeakPolarHBondContact O-CA 3.15Å; L173-G177 PolarHBondContact O-N 3.41Å; L173-L193 HydrophobicContact CD2-CB 4.24Å; L173-P194 HydrophobicContact CD2-CG 4.22Å
174V93.1Very high91.7Very high24 Ų2444.7 Ų44.715%0.14522%0.216CC..Hα-helixtrans-70.5-47.8176178.20000110.7L123 W126 W127 A130 V170 K171 Y172 F176 G177 V178L123-V174 HydrophobicContact CD1-CB 4.39Å; L123-V174 HydrophobicContact CD1-CG1 4.2Å; W126-V174 HydrophobicContact CB-CG2 3.88Å; W127-V174 HydrophobicContact CB-CG1 4.22Å; W127-V174 HydrophobicContact CB-CG2 4.21Å; A130-V174 HydrophobicContact CB-CG2 4.4Å; V170-V174 PolarHBondContact O-N 3.21Å; K171-V174 PolarHBondContact O-N 2.91Å; Y172-V174 VanDerWaalsContact C-N 3.28Å; Y172-V174 PolarHBondContact O-N 3.12Å; V174-F176 PolarHBondContact O-N 3.19Å; V174-G177 PolarHBondContact O-N 3.18Å; V174-V178 PolarHBondContact O-N 2.97Å
175L91.1Very high91.5Very high56 Ų5648 Ų4829%0.29323%0.234SC..Hα-helixtrans-60.5-42.3-177.1-171.670.3000112.7N88 K171 Y172 P179N88-L175 HydrophobicContact CB-CD1 3.85Å; N88-L175 HydrophobicContact CB-CD2 4.44Å; N88-L175 HydrophobicContact CB-CG 4.07Å; K171-L175 WeakPolarHBondContact O-CB 3.49Å; K171-L175 PolarHBondContact O-N 2.7Å; Y172-L175 HydrophobicContact CD1-CD2 4Å; Y172-L175 HydrophobicContact CE1-CD2 4.03Å; Y172-L175 PolarHBondContact O-N 3.43Å; L175-P179 WeakPolarHBondContact O-CD 3.4Å; L175-P179 WeakPolarHBondContact O-CG 3.35Å
176F91.6Very high91.3Very high47 Ų4748.7 Ų48.721%0.20624%0.236CC..Hα-helixtrans-88.7-19.8176.8-61.9-36.1000113.1Y172 V174 A180 L193 P194Y172-F176 HydrophobicContact CD1-CD2 4.25Å; Y172-F176 HydrophobicContact CD1-CE1 4.48Å; Y172-F176 AromaticContact CD1-CE2 3.6Å; Y172-F176 HydrophobicContact CD1-CE2 3.6Å; Y172-F176 AromaticContact CD1-CZ 3.74Å; Y172-F176 HydrophobicContact CD1-CZ 3.74Å; Y172-F176 HydrophobicContact CE1-CE2 4.39Å; Y172-F176 HydrophobicContact CE1-CZ 4.15Å; Y172-F176 HydrophobicContact CG-CE2 4.35Å; Y172-F176 WeakPolarHBondContact O-CB 3.42Å; Y172-F176 PolarHBondContact O-N 3.12Å; V174-F176 PolarHBondContact O-N 3.19Å; F176-A180 VanDerWaalsContact O-CB 3.23Å; F176-A180 WeakPolarHBondContact O-CB 3.42Å; F176-A180 PolarHBondContact O-N 3.37Å; F176-L193 HydrophobicContact CB-CD2 3.67Å; F176-P194 HydrophobicContact CD2-CG 4.01Å
177G92.1Very high91Very high8 Ų848.1 Ų48.18%0.08224%0.243CC..Hα-helixtrans-67.1-39.8177.600000113.3L173 V174 A180 L181L173-G177 VanDerWaalsContact O-CA 3.23Å; L173-G177 WeakPolarHBondContact O-CA 3.15Å; L173-G177 PolarHBondContact O-N 3.41Å; V174-G177 PolarHBondContact O-N 3.18Å; G177-A180 PolarHBondContact O-N 3.32Å; G177-L181 WeakPolarHBondContact O-CG 3.46Å; G177-L181 PolarHBondContact O-N 3.26Å
178V91.7Very high90.8Very high69 Ų6946.4 Ų46.442%0.41824%0.236SC..Hα-helixtrans-62.6-55.2176.9177.80000111.3L123 V174 A180 L181 L182L123-V178 HydrophobicContact CD1-CG2 4.3Å; L123-V178 HydrophobicContact CD2-CB 4.35Å; L123-V178 HydrophobicContact CD2-CG2 3.54Å; L123-V178 HydrophobicContact CG-CG2 4.45Å; V174-V178 PolarHBondContact O-N 2.97Å; V178-A180 VanDerWaalsContact C-N 3.27Å; V178-A180 PolarHBondContact O-N 3.23Å; V178-L181 PolarHBondContact O-N 2.67Å; V178-L181 VanDerWaalsContact O-N 3.14Å; V178-L182 HydrophobicContact CG1-CD1 4.4Å; V178-L182 PolarHBondContact O-N 3.2Å; V178-L182 VanDerWaalsContact O-N 3.09Å
179P92.1Very high90.7Very high8 Ų846.8 Ų46.85%0.05225%0.245CC..Hα-helixtrans-52-43.6172.2-30.938.2000113.4P84 N88 L175 L181 L182 M183P84-P179 VanDerWaalsContact O-CB 3.24Å; P84-P179 WeakPolarHBondContact O-CB 3.45Å; P84-P179 WeakPolarHBondContact O-CG 3.1Å; N88-P179 WeakPolarHBondContact O-CG 3.31Å; L175-P179 WeakPolarHBondContact O-CD 3.4Å; L175-P179 WeakPolarHBondContact O-CG 3.35Å; P179-L181 VanDerWaalsContact C-N 3.31Å; P179-L181 PolarHBondContact O-N 3.11Å; P179-L182 PolarHBondContact O-N 3.33Å; P179-M183 VanDerWaalsContact O-CG 3.27Å; P179-M183 WeakPolarHBondContact O-CG 3.33Å; P179-M183 PolarHBondContact O-N 3.39Å
180A91.3Very high90.5Very high6 Ų645.5 Ų45.55%0.0524%0.243CC..Hα-helixtrans-63.4-35.2-179.100000112.8F176 G177 V178 R184 P190F176-A180 VanDerWaalsContact O-CB 3.23Å; F176-A180 WeakPolarHBondContact O-CB 3.42Å; F176-A180 PolarHBondContact O-N 3.37Å; G177-A180 PolarHBondContact O-N 3.32Å; V178-A180 VanDerWaalsContact C-N 3.27Å; V178-A180 PolarHBondContact O-N 3.23Å; A180-R184 WeakPolarHBondContact O-CG 3.19Å; A180-R184 PolarHBondContact O-N 2.92Å; A180-P190 HydrophobicContact CB-CB 3.65Å; A180-P190 HydrophobicContact CB-CG 3.88Å
181L91.1Very high90.2Very high16 Ų1647.1 Ų47.18%0.08425%0.254CS..Hα-helixtrans-71.1-41.2174-70.8173.4000112.1L116 L120 L123 G177 V178 P179 M183 R184 L185L116-L181 HydrophobicContact CD1-CB 4.49Å; L116-L181 HydrophobicContact CD1-CD2 4.22Å; L120-L181 HydrophobicContact CB-CD1 4.42Å; L120-L181 HydrophobicContact CD1-CD1 4.33Å; L123-L181 HydrophobicContact CB-CD1 4.03Å; L123-L181 HydrophobicContact CD2-CD1 3.51Å; L123-L181 HydrophobicContact CG-CD1 4.39Å; G177-L181 WeakPolarHBondContact O-CG 3.46Å; G177-L181 PolarHBondContact O-N 3.26Å; V178-L181 PolarHBondContact O-N 2.67Å; V178-L181 VanDerWaalsContact O-N 3.14Å; P179-L181 VanDerWaalsContact C-N 3.31Å; P179-L181 PolarHBondContact O-N 3.11Å; L181-M183 VanDerWaalsContact C-N 3.33Å; L181-M183 PolarHBondContact O-N 3.3Å; L181-R184 WeakPolarHBondContact O-CB 3.06Å; L181-R184 PolarHBondContact O-N 2.81Å; L181-L185 PolarHBondContact O-N 3.05Å
182L90.8Very high90Very high63 Ų6346.6 Ų46.633%0.3327%0.269SS..Hα-helixtrans-61.8-41.9175-66.8177.1000111.3P84 V178 P179 R184 L185 D186P84-L182 HydrophobicContact CB-CB 3.88Å; P84-L182 HydrophobicContact CB-CD1 4.46Å; P84-L182 HydrophobicContact CG-CB 3.97Å; V178-L182 HydrophobicContact CG1-CD1 4.4Å; V178-L182 PolarHBondContact O-N 3.2Å; V178-L182 VanDerWaalsContact O-N 3.09Å; P179-L182 PolarHBondContact O-N 3.33Å; L182-R184 VanDerWaalsContact C-N 3.29Å; L182-R184 PolarHBondContact O-N 2.89Å; L182-L185 HydrophobicContact CD2-CD1 4.2Å; L182-L185 WeakPolarHBondContact O-CB 3.39Å; L182-L185 PolarHBondContact O-N 3.49Å; L182-L185 VanDerWaalsContact O-N 3.12Å; L182-D186 PolarHBondContact O-N 2.9Å; L182-D186 VanDerWaalsContact O-N 3.08Å
183M90.4Very high89.8Confident0 Ų044.3 Ų44.30%026%0.264CS..Hα-helixtrans-59.1-40.3173.7-71.6179.17200112.4Y82 P84 V85 L92 P179 L181 L185 D186 G187 L188 P190Y82-M183 HydrophobicContact CE1-CG 3.92Å; P84-M183 HydrophobicContact CB-CG 4.02Å; V85-M183 HydrophobicContact CG1-SD 3.73Å; L92-M183 HydrophobicContact CD2-CE 3.91Å; P179-M183 VanDerWaalsContact O-CG 3.27Å; P179-M183 WeakPolarHBondContact O-CG 3.33Å; P179-M183 PolarHBondContact O-N 3.39Å; L181-M183 VanDerWaalsContact C-N 3.33Å; L181-M183 PolarHBondContact O-N 3.3Å; M183-L185 VanDerWaalsContact C-N 3.34Å; M183-D186 CarbonylContact O-C 3.59Å; M183-D186 PolarHBondContact O-N 3.19Å; M183-G187 PolarHBondContact O-N 2.86Å; M183-L188 CarbonylContact C-O 3.57Å; M183-L188 HydrophobicContact CB-CB 4.31Å; M183-L188 HydrophobicContact CE-CB 4.39Å; M183-L188 WeakPolarHBondContact O-CA 3.45Å; M183-L188 WeakPolarHBondContact O-CB 3.4Å; M183-L188 PolarHBondContact O-N 3.38Å; M183-P190 HydrophobicContact CB-CB 4.3Å; M183-P190 HydrophobicContact CE-CB 4.44Å; M183-P190 HydrophobicContact SD-CB 4.1Å
184R88.9Confident89.5Confident87 Ų8745.7 Ų45.733%0.32827%0.274SS..Hα-helixtrans-67.3-34.1176-73.1179-178174.7-2.2113A180 L181 L182 D186 G187 L188 P190A180-R184 WeakPolarHBondContact O-CG 3.19Å; A180-R184 PolarHBondContact O-N 2.92Å; L181-R184 WeakPolarHBondContact O-CB 3.06Å; L181-R184 PolarHBondContact O-N 2.81Å; L182-R184 VanDerWaalsContact C-N 3.29Å; L182-R184 PolarHBondContact O-N 2.89Å; R184-D186 VanDerWaalsContact C-N 3.26Å; R184-D186 PolarHBondContact O-N 3.24Å; R184-G187 PolarHBondContact O-N 3.31Å; R184-G187 VanDerWaalsContact O-N 3.09Å; R184-L188 WeakPolarHBondContact CA-O 3.45Å; R184-P190 HydrophobicContact CG-CG 3.99Å
185L88.3Confident89.2Confident103 Ų10352.9 Ų52.954%0.53930%0.298SS..Hα-helixtrans-62.1-37.8172.4-78.1172.3000111.5L116 L181 L182 M183 G187L116-L185 HydrophobicContact CD1-CD1 4.35Å; L116-L185 HydrophobicContact CD1-CD2 3.85Å; L116-L185 HydrophobicContact CD1-CG 3.73Å; L116-L185 HydrophobicContact CD2-CD2 3.34Å; L116-L185 HydrophobicContact CD2-CG 4.15Å; L116-L185 HydrophobicContact CG-CD2 4.2Å; L181-L185 PolarHBondContact O-N 3.05Å; L182-L185 HydrophobicContact CD2-CD1 4.2Å; L182-L185 WeakPolarHBondContact O-CB 3.39Å; L182-L185 PolarHBondContact O-N 3.49Å; L182-L185 VanDerWaalsContact O-N 3.12Å; M183-L185 VanDerWaalsContact C-N 3.34Å; L185-G187 PolarHBondContact O-N 3.06Å
186D87.5Confident89Confident71 Ų7151.3 Ų51.338%0.3829%0.292SS..THydrogen-bonded Turntrans-77.21.5175.5-63.3-26.8000112.9Y82 Q104 L182 M183 R184 L188Y82-D186 PolarHBondContact OH-OD2 3.29Å; Q104-D186 PolarHBondContact NE2-O 3.37Å; L182-D186 PolarHBondContact O-N 2.9Å; L182-D186 VanDerWaalsContact O-N 3.08Å; M183-D186 CarbonylContact O-C 3.59Å; M183-D186 PolarHBondContact O-N 3.19Å; R184-D186 VanDerWaalsContact C-N 3.26Å; R184-D186 PolarHBondContact O-N 3.24Å; D186-L188 VanDerWaalsContact C-N 3.32Å
187G86.1Confident88.7Confident44 Ų4452.4 Ų52.445%0.45430%0.302SS..THydrogen-bonded Turntrans808.3-179.400000114.5M183 R184 L185M183-G187 PolarHBondContact O-N 2.86Å; R184-G187 PolarHBondContact O-N 3.31Å; R184-G187 VanDerWaalsContact O-N 3.09Å; L185-G187 PolarHBondContact O-N 3.06Å
188L88.3Confident88.4Confident3 Ų355.5 Ų55.52%0.01632%0.322CS..  trans-89.8144.4177.2-54.9-175.7000111Y82 F97 Q100 M101 M183 R184 D186 P190Y82-L188 HydrophobicContact CE1-CD1 4.01Å; Y82-L188 HydrophobicContact CE2-CD1 4.42Å; Y82-L188 WeakPolarHBondContact OH-CD1 3.44Å; F97-L188 HydrophobicContact CD2-CD1 4.22Å; F97-L188 HydrophobicContact CE2-CD1 4.1Å; Q100-L188 HydrophobicContact CB-CD2 3.65Å; M101-L188 HydrophobicContact CE-CD2 4.14Å; M101-L188 HydrophobicContact CG-CD2 3.93Å; M101-L188 HydrophobicContact SD-CD2 4.19Å; M183-L188 CarbonylContact C-O 3.57Å; M183-L188 HydrophobicContact CB-CB 4.31Å; M183-L188 HydrophobicContact CE-CB 4.39Å; M183-L188 WeakPolarHBondContact O-CA 3.45Å; M183-L188 WeakPolarHBondContact O-CB 3.4Å; M183-L188 PolarHBondContact O-N 3.38Å; R184-L188 WeakPolarHBondContact CA-O 3.45Å; D186-L188 VanDerWaalsContact C-N 3.32Å; L188-P190 WeakPolarHBondContact O-CD 3.46Å
189T87.9Confident88.2Confident96 Ų9656.9 Ų56.959%0.58933%0.331SS*.  trans-87.2113.8173.352.80000109.3Q100Q100-T189 PolarHBondContact NE2-O 2.85Å; Q100-T189 PolarHBondContact NE2-OG1 3.28Å
190P87.8Confident87.9Confident24 Ų2459 Ų5916%0.15634%0.341CS..PPolyproline II helixtrans-70.6149.5-178.130.2-36.2000110.4A180 M183 R184 L188A180-P190 HydrophobicContact CB-CB 3.65Å; A180-P190 HydrophobicContact CB-CG 3.88Å; M183-P190 HydrophobicContact CB-CB 4.3Å; M183-P190 HydrophobicContact CE-CB 4.44Å; M183-P190 HydrophobicContact SD-CB 4.1Å; R184-P190 HydrophobicContact CG-CG 3.99Å; L188-P190 WeakPolarHBondContact O-CD 3.46Å
191P88.7Confident87.6Confident41 Ų4168.3 Ų68.327%0.26638%0.381SS..PPolyproline II helixtrans-62.2163.6173.128.8-37.1000111.4P90 L193P90-P191 HydrophobicContact CB-CB 4.48Å; P90-P191 HydrophobicContact CB-CG 3.36Å; P90-P191 HydrophobicContact CG-CG 3.37Å; P191-L193 PolarHBondContact O-N 2.83Å
192A87.1Confident87.4Confident95 Ų9569.8 Ų69.879%0.78539%0.392SS*.PPolyproline II helixtrans-60.4133.9-177.600000111.5
193L87.2Confident87.1Confident55 Ų5574.4 Ų74.429%0.28841%0.41SS..PPolyproline II helixtrans-66.2156.3172.8-71.9169.5000110.6L173 F176 P191 R195L173-L193 HydrophobicContact CD2-CB 4.24Å; F176-L193 HydrophobicContact CB-CD2 3.67Å; P191-L193 PolarHBondContact O-N 2.83Å; L193-R195 PolarHBondContact O-N 3.25Å
194P86.1Confident86.8Confident44 Ų4480.2 Ų80.229%0.28645%0.445SS..PPolyproline II helixtrans-57141.8178.623.8-34.6000110.1Y169 L173 F176Y169-P194 WeakPolarHBondContact CE2-O 3.48Å; L173-P194 HydrophobicContact CD2-CG 4.22Å; F176-P194 HydrophobicContact CD2-CG 4.01Å
195R86.8Confident86.2Confident175 Ų17577.6 Ų77.666%0.6645%0.446SS*.PPolyproline II helixtrans-90.5154.6176.1-70.6175.2-177.4-177.16.8109.8Y169 L193 V197 M200Y169-R195 VanDerWaalsContact CE2-C 3.41Å; L193-R195 PolarHBondContact O-N 3.25Å; R195-V197 PolarHBondContact O-N 2.95Å; R195-M200 HydrophobicContact CB-CE 3.49Å; R195-M200 VanDerWaalsContact CB-CE 3.49Å; R195-M200 HydrophobicContact CG-CE 4.07Å
196C87.7Confident85.7Confident23 Ų2376.8 Ų76.816%0.15544%0.44CS..PPolyproline II helixtrans-67.7124.3179.8-177.20000110.4Y169 S198 T199Y169-C196 HydrophobicContact CD1-CB 4.43Å; Y169-C196 HydrophobicContact CD2-CB 4.44Å; Y169-C196 HydrophobicContact CE1-CB 3.96Å; Y169-C196 VanDerWaalsContact CE2-CA 3.49Å; Y169-C196 HydrophobicContact CE2-CB 3.98Å; Y169-C196 VanDerWaalsContact CE2-N 3.32Å; C196-S198 PolarHBondContact O-N 3.06Å; C196-T199 HydrophobicContact CB-CG2 4.03Å; C196-T199 PolarHBondContact O-N 2.91Å; C196-T199 PolarHBondContact O-OG1 3.34Å
197V85.1Confident84.9Confident69 Ų6985.8 Ų85.842%0.41847%0.469SS..G310 helixtrans-56.6-36.9-179.1-179.70000111.3V165 R195 T199 M200V165-V197 HydrophobicContact CG1-CB 3.85Å; V165-V197 HydrophobicContact CG1-CG1 4.1Å; V165-V197 HydrophobicContact CG1-CG2 3.9Å; R195-V197 PolarHBondContact O-N 2.95Å; V197-T199 PolarHBondContact O-N 3.35Å; V197-M200 PolarHBondContact O-N 2.91Å
198S85.6Confident84.9Confident73 Ų7387.9 Ų87.951%0.5147%0.47SS..G310 helixtrans-68.3-13.7179-51.30000114.6C196C196-S198 PolarHBondContact O-N 3.06Å
199T88Confident84.7Confident99 Ų9992.4 Ų92.461%0.60749%0.494SS*.G310 helixtrans-95.7-6.1177.463.10000113.1C196 V197C196-T199 HydrophobicContact CB-CG2 4.03Å; C196-T199 PolarHBondContact O-N 2.91Å; C196-T199 PolarHBondContact O-OG1 3.34Å; V197-T199 PolarHBondContact O-N 3.35Å
200M85.4Confident84.5Confident51 Ų5192.2 Ų92.225%0.25149%0.489SS..  trans-86.1130.5-179.1-68.9-65.9-165.300111.3R195 V197 G205R195-M200 HydrophobicContact CB-CE 3.49Å; R195-M200 VanDerWaalsContact CB-CE 3.49Å; R195-M200 HydrophobicContact CG-CE 4.07Å; V197-M200 PolarHBondContact O-N 2.91Å; M200-G205 WeakPolarHBondContact CE-O 3.46Å
201F85.6Confident84.3Confident203 Ų20396.2 Ų96.289%0.8951%0.508SS*.  trans-105.5-6.8175.661.3-91.1000113
202S87.1Confident84.1Confident47 Ų4799.6 Ų99.633%0.32952%0.523SS..  trans-138.3139.8-178.2175.20000111.2T204 G205 M206S202-T204 VanDerWaalsContact C-N 3.26Å; S202-T204 PolarHBondContact O-N 3.09Å; S202-T204 PolarHBondContact OG-N 3.43Å; S202-G205 PolarHBondContact O-N 3.33Å; S202-G205 VanDerWaalsContact O-N 3.12Å; S202-M206 PolarHBondContact O-N 3.41Å
203F84.4Confident83.9Confident160 Ų16099.9 Ų99.970%0.70251%0.506SS*.Hα-helixtrans-65.1-29.1174-70.8-70.3000112.7G205 M206 W207F203-G205 PolarHBondContact O-N 3.19Å; F203-M206 HydrophobicContact CD1-CE 3.95Å; F203-M206 HydrophobicContact CD1-SD 4.31Å; F203-M206 HydrophobicContact CE1-CE 4.48Å; F203-M206 WeakPolarHBondContact O-CB 3.2Å; F203-M206 PolarHBondContact O-N 3.5Å; F203-M206 VanDerWaalsContact O-N 3.12Å; F203-W207 VanDerWaalsContact O-CD1 3.28Å; F203-W207 PolarHBondContact O-N 3.22Å
204T84.6Confident83.6Confident121 Ų121103.1 Ų103.174%0.74252%0.521SS*.Hα-helixtrans-65-28.1173.7-46.90000112.1S202 M206 W207S202-T204 VanDerWaalsContact C-N 3.26Å; S202-T204 PolarHBondContact O-N 3.09Å; S202-T204 PolarHBondContact OG-N 3.43Å; T204-M206 VanDerWaalsContact C-N 3.35Å; T204-W207 VanDerWaalsContact O-OXT 3.13Å
205G74.4Confident83.4Confident33 Ų33107.7 Ų107.734%0.3454%0.54SS..Hα-helixtrans-81.2-17.3175.300000113.4M200 S202 F203M200-G205 WeakPolarHBondContact CE-O 3.46Å; S202-G205 PolarHBondContact O-N 3.33Å; S202-G205 VanDerWaalsContact O-N 3.12Å; F203-G205 PolarHBondContact O-N 3.19Å
206M77.7Confident83.2Confident86 Ų86102.1 Ų102.142%0.42453%0.53SS..Hα-helixtrans-79.9-33.6179.8-171.4-179.678.500112.5S202 F203 T204S202-M206 PolarHBondContact O-N 3.41Å; F203-M206 HydrophobicContact CD1-CE 3.95Å; F203-M206 HydrophobicContact CD1-SD 4.31Å; F203-M206 HydrophobicContact CE1-CE 4.48Å; F203-M206 WeakPolarHBondContact O-CB 3.2Å; F203-M206 PolarHBondContact O-N 3.5Å; F203-M206 VanDerWaalsContact O-N 3.12Å; T204-M206 VanDerWaalsContact C-N 3.35Å
207W72.4Confident82.7Confident260 Ų260109.3 Ų109.399%0.98556%0.564SS**  trans-97.70179.2-63.7109000111.5F203 T204F203-W207 VanDerWaalsContact O-CD1 3.28Å; F203-W207 PolarHBondContact O-N 3.22Å; T204-W207 VanDerWaalsContact O-OXT 3.13Å

Retrieved 207 of 207 residues in 111.4 ms (Link to these results)

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