A0A093JI92_STRCA Loading...

Transmembrane protein 60

AlphaFold DB , UniProt , Accession A0A093JI92, Species STRCA (Struthio camelus australis), Gene n/a, Length 134 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
1M47.9Very low74.8Confident229 Ų229120.3 Ų120.3100%1.12860%0.598SS**  0101.50-157173.7174.900109M3M1-M3 PolarHBondContact O-N 3.48Å
2R53.1Low75.4Confident254 Ų254114.3 Ų114.396%0.95857%0.573SS**  trans-76.4109.3177.5-77.6-175179.3-177.70.9108S4R2-S4 PolarHBondContact O-N 3.46Å
3M62Low76.2Confident94 Ų94118.4 Ų118.446%0.46358%0.578SS.*  trans-65.3121.8172.9-69.5-153.6-179.100109.9M1 Q7 R8M1-M3 PolarHBondContact O-N 3.48Å; M3-Q7 PolarHBondContact SD-NE2 3.34Å; M3-R8 HydrophobicContact CB-CG 4.38Å
4S79.2Confident76.9Confident66 Ų66116.8 Ų116.846%0.46257%0.572SS.*  trans-53.7142.4173.31690000110.7R2 A6 Q7 R8R2-S4 PolarHBondContact O-N 3.46Å; S4-A6 PolarHBondContact O-N 3.08Å; S4-A6 PolarHBondContact OG-N 3.16Å; S4-Q7 WeakPolarHBondContact O-CB 3.1Å; S4-Q7 PolarHBondContact O-N 3.05Å; S4-R8 PolarHBondContact O-N 3.34Å
5L78.6Confident77.3Confident141 Ų141112.1 Ų112.174%0.73855%0.548SS*.Hα-helixtrans-53.2-40.1172.7-79.4164.8000110.9Q7 R8 V9L5-Q7 VanDerWaalsContact C-N 3.33Å; L5-Q7 PolarHBondContact O-N 2.56Å; L5-R8 PolarHBondContact O-N 2.66Å; L5-V9 WeakPolarHBondContact O-CG2 3.34Å; L5-V9 PolarHBondContact O-N 2.98Å
6A82.8Confident77.4Confident57 Ų57109.3 Ų109.347%0.47154%0.54SS..Hα-helixtrans-59.7-43.2176.800000111.8S4 R8 V9 L10S4-A6 PolarHBondContact O-N 3.08Å; S4-A6 PolarHBondContact OG-N 3.16Å; A6-R8 VanDerWaalsContact C-N 3.34Å; A6-R8 PolarHBondContact O-N 3.38Å; A6-V9 PolarHBondContact O-N 3.31Å; A6-L10 WeakPolarHBondContact O-CB 3.49Å; A6-L10 VanDerWaalsContact O-CG 3.26Å; A6-L10 WeakPolarHBondContact O-CG 3.28Å; A6-L10 PolarHBondContact O-N 2.92Å
7Q84.1Confident77.8Confident93 Ų93108.6 Ų108.644%0.43554%0.538SS..Hα-helixtrans-64.5-38.6179.8-171.4175.7-43.900112.1M3 S4 L5 L11M3-Q7 PolarHBondContact SD-NE2 3.34Å; S4-Q7 WeakPolarHBondContact O-CB 3.1Å; S4-Q7 PolarHBondContact O-N 3.05Å; L5-Q7 VanDerWaalsContact C-N 3.33Å; L5-Q7 PolarHBondContact O-N 2.56Å; Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 PolarHBondContact O-N 3.34Å
8R81.6Confident78.1Confident120 Ų120106.4 Ų106.445%0.45353%0.528SS..Hα-helixtrans-65.7-43.1176.7-63.5172.6-178.7-125.9-5.2111.6M3 S4 L5 A6 T12M3-R8 HydrophobicContact CB-CG 4.38Å; S4-R8 PolarHBondContact O-N 3.34Å; L5-R8 PolarHBondContact O-N 2.66Å; A6-R8 VanDerWaalsContact C-N 3.34Å; A6-R8 PolarHBondContact O-N 3.38Å; R8-T12 PolarHBondContact O-N 3.45Å; R8-T12 PolarHBondContact O-OG1 3.36Å
9V84.9Confident78.3Confident75 Ų75102.6 Ų102.646%0.45551%0.508SS..Hα-helixtrans-62.8-56.1176.9173.60000109L5 A6 L11 T12 W13L5-V9 WeakPolarHBondContact O-CG2 3.34Å; L5-V9 PolarHBondContact O-N 2.98Å; A6-V9 PolarHBondContact O-N 3.31Å; V9-L11 VanDerWaalsContact C-N 3.27Å; V9-L11 PolarHBondContact O-N 3.32Å; V9-T12 WeakPolarHBondContact O-CA 3.46Å; V9-T12 WeakPolarHBondContact O-CB 3.24Å; V9-T12 PolarHBondContact O-N 3.43Å; V9-W13 PolarHBondContact O-N 2.9Å
10L86.5Confident78.3Confident122 Ų122101.9 Ų101.964%0.63951%0.506SS*.Hα-helixtrans-53.9-42.8178.9-72.6169.6000112.5A6 T12 W13 L14A6-L10 WeakPolarHBondContact O-CB 3.49Å; A6-L10 VanDerWaalsContact O-CG 3.26Å; A6-L10 WeakPolarHBondContact O-CG 3.28Å; A6-L10 PolarHBondContact O-N 2.92Å; L10-T12 PolarHBondContact O-N 2.99Å; L10-W13 PolarHBondContact O-N 2.95Å; L10-L14 VanDerWaalsContact O-CB 3.3Å; L10-L14 WeakPolarHBondContact O-CB 3.45Å; L10-L14 PolarHBondContact O-N 2.93Å
11L82.6Confident78.6Confident72 Ų72101.7 Ų101.738%0.37751%0.506SS..Hα-helixtrans-62-44.1177.2-172.168000111.6Q7 V9 L14 F15Q7-L11 WeakPolarHBondContact O-CB 3.38Å; Q7-L11 PolarHBondContact O-N 3.34Å; V9-L11 VanDerWaalsContact C-N 3.27Å; V9-L11 PolarHBondContact O-N 3.32Å; L11-L14 PolarHBondContact O-N 3.24Å; L11-F15 HydrophobicContact CD1-CD2 4.01Å; L11-F15 HydrophobicContact CD1-CE2 3.45Å; L11-F15 VanDerWaalsContact CD1-CE2 3.45Å; L11-F15 HydrophobicContact CD1-CZ 4.28Å; L11-F15 HydrophobicContact CD2-CE2 4.12Å; L11-F15 HydrophobicContact CG-CD2 3.82Å; L11-F15 HydrophobicContact CG-CE2 3.54Å; L11-F15 WeakPolarHBondContact O-CD2 3.26Å; L11-F15 PolarHBondContact O-N 3.37Å
12T81.6Confident80.1Confident49 Ų4993.8 Ų93.830%0.30147%0.467SS..Hα-helixtrans-63-45.3177.4-49.80000111.2R8 V9 L10 F15 T16 F45R8-T12 PolarHBondContact O-N 3.45Å; R8-T12 PolarHBondContact O-OG1 3.36Å; V9-T12 WeakPolarHBondContact O-CA 3.46Å; V9-T12 WeakPolarHBondContact O-CB 3.24Å; V9-T12 PolarHBondContact O-N 3.43Å; L10-T12 PolarHBondContact O-N 2.99Å; T12-F15 PolarHBondContact O-N 3.49Å; T12-T16 WeakPolarHBondContact O-CB 3.45Å; T12-T16 PolarHBondContact O-N 3.03Å; T12-T16 PolarHBondContact O-OG1 2.97Å; T12-F45 HydrophobicContact CG2-CE1 3.95Å; T12-F45 HydrophobicContact CG2-CE2 3.95Å; T12-F45 HydrophobicContact CG2-CZ 3.39Å; T12-F45 WeakPolarHBondContact OG1-CE2 3.13Å; T12-F45 WeakPolarHBondContact OG1-CZ 3.45Å
13W85.3Confident81.3Confident167 Ų16783.8 Ų83.863%0.63343%0.432SS*.Hα-helixtrans-62.9-41.2176.1-79.994.7000112.2V9 L10 T16 L17V9-W13 PolarHBondContact O-N 2.9Å; L10-W13 PolarHBondContact O-N 2.95Å; W13-T16 PolarHBondContact O-N 3.25Å; W13-L17 WeakPolarHBondContact O-CB 3.28Å; W13-L17 WeakPolarHBondContact O-CG 3.25Å; W13-L17 PolarHBondContact O-N 2.89Å
14L86.9Confident82.1Confident96 Ų9683.7 Ų83.750%0.50344%0.437SS..Hα-helixtrans-62-49.4177.1-178.170000111.5L10 L11 T16 L17 L18L10-L14 VanDerWaalsContact O-CB 3.3Å; L10-L14 WeakPolarHBondContact O-CB 3.45Å; L10-L14 PolarHBondContact O-N 2.93Å; L11-L14 PolarHBondContact O-N 3.24Å; L14-T16 VanDerWaalsContact C-N 3.27Å; L14-T16 PolarHBondContact O-N 2.93Å; L14-L17 PolarHBondContact O-N 2.97Å; L14-L18 HydrophobicContact CG-CD1 4.29Å; L14-L18 WeakPolarHBondContact O-CG 3.27Å; L14-L18 PolarHBondContact O-N 3.22Å
15F81.6Confident82Confident46 Ų4684.7 Ų84.720%0.20244%0.436CS..Hα-helixtrans-62.2-36.3176.6-78.5-65000112.3L11 T12 F19 P41 F45L11-F15 HydrophobicContact CD1-CD2 4.01Å; L11-F15 HydrophobicContact CD1-CE2 3.45Å; L11-F15 VanDerWaalsContact CD1-CE2 3.45Å; L11-F15 HydrophobicContact CD1-CZ 4.28Å; L11-F15 HydrophobicContact CD2-CE2 4.12Å; L11-F15 HydrophobicContact CG-CD2 3.82Å; L11-F15 HydrophobicContact CG-CE2 3.54Å; L11-F15 WeakPolarHBondContact O-CD2 3.26Å; L11-F15 PolarHBondContact O-N 3.37Å; T12-F15 PolarHBondContact O-N 3.49Å; F15-F19 WeakPolarHBondContact O-CB 3.47Å; F15-F19 PolarHBondContact O-N 2.97Å; F15-P41 HydrophobicContact CD1-CB 4.13Å; F15-F45 AromaticContact CD2-CD2 4Å; F15-F45 HydrophobicContact CD2-CD2 4Å
16T79.3Confident81.8Confident68 Ų6879.9 Ų79.942%0.41741%0.409SS..Hα-helixtrans-65.6-44.8175.8-52.50000111.2T12 W13 L14 F19 L20T12-T16 WeakPolarHBondContact O-CB 3.45Å; T12-T16 PolarHBondContact O-N 3.03Å; T12-T16 PolarHBondContact O-OG1 2.97Å; W13-T16 PolarHBondContact O-N 3.25Å; L14-T16 VanDerWaalsContact C-N 3.27Å; L14-T16 PolarHBondContact O-N 2.93Å; T16-F19 WeakPolarHBondContact O-CB 3.33Å; T16-F19 PolarHBondContact O-N 3.15Å; T16-L20 HydrophobicContact CG2-CD1 3.9Å; T16-L20 WeakPolarHBondContact O-CD1 3.31Å; T16-L20 PolarHBondContact O-N 3.08Å
17L84Confident81.2Confident97 Ų9782.9 Ų82.951%0.50842%0.417SS..Hα-helixtrans-62.7-45.6176.3-76.2169.3000111.9W13 L14 F19 L20 I21W13-L17 WeakPolarHBondContact O-CB 3.28Å; W13-L17 WeakPolarHBondContact O-CG 3.25Å; W13-L17 PolarHBondContact O-N 2.89Å; L14-L17 PolarHBondContact O-N 2.97Å; L17-F19 VanDerWaalsContact C-N 3.29Å; L17-F19 PolarHBondContact O-N 3.01Å; L17-L20 PolarHBondContact O-N 3.32Å; L17-I21 VanDerWaalsContact O-CG1 3.29Å; L17-I21 WeakPolarHBondContact O-CG1 3.45Å; L17-I21 PolarHBondContact O-N 2.95Å
18L84.6Confident80.9Confident69 Ų6983.1 Ų83.136%0.36142%0.421SS..Hα-helixtrans-58.2-43176.1-73.2171.8000111.6L14 I21 M22L14-L18 HydrophobicContact CG-CD1 4.29Å; L14-L18 WeakPolarHBondContact O-CG 3.27Å; L14-L18 PolarHBondContact O-N 3.22Å; L18-I21 PolarHBondContact O-N 3.46Å; L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 3.41Å
19F81.4Confident80.2Confident34 Ų3486 Ų8615%0.14944%0.44CS..Hα-helixtrans-61.1-47.2174.6171.3-105.7000112.1F15 T16 L17 I21 M22 L23 I38 F39 V42F15-F19 WeakPolarHBondContact O-CB 3.47Å; F15-F19 PolarHBondContact O-N 2.97Å; T16-F19 WeakPolarHBondContact O-CB 3.33Å; T16-F19 PolarHBondContact O-N 3.15Å; L17-F19 VanDerWaalsContact C-N 3.29Å; L17-F19 PolarHBondContact O-N 3.01Å; F19-I21 VanDerWaalsContact C-N 3.33Å; F19-I21 PolarHBondContact O-N 3.26Å; F19-M22 PolarHBondContact O-N 3.39Å; F19-L23 HydrophobicContact CE2-CD1 4.46Å; F19-L23 HydrophobicContact CZ-CD1 4.06Å; F19-L23 VanDerWaalsContact O-CB 3.3Å; F19-L23 WeakPolarHBondContact O-CB 3.31Å; F19-L23 PolarHBondContact O-N 3.05Å; F19-I38 HydrophobicContact CD2-CG2 4.39Å; F19-I38 WeakPolarHBondContact CD2-O 3.42Å; F19-I38 HydrophobicContact CE2-CG2 4.17Å; F19-F39 HydrophobicContact CD2-CD1 4.38Å; F19-F39 AromaticContact CE2-CD1 3.5Å; F19-F39 HydrophobicContact CE2-CD1 3.5Å; F19-F39 AromaticContact CE2-CD2 3.89Å; F19-F39 HydrophobicContact CE2-CD2 3.89Å; F19-F39 AromaticContact CE2-CE1 3.44Å; F19-F39 HydrophobicContact CE2-CE1 3.44Å; F19-F39 VanDerWaalsContact CE2-CE1 3.44Å; F19-F39 AromaticContact CE2-CE2 3.86Å; F19-F39 HydrophobicContact CE2-CE2 3.86Å; F19-F39 AromaticContact CE2-CG 3.75Å; F19-F39 HydrophobicContact CE2-CG 3.75Å; F19-F39 AromaticContact CE2-CZ 3.64Å; F19-F39 HydrophobicContact CE2-CZ 3.64Å; F19-F39 AromaticContact CZ-CD1 3.98Å; F19-F39 HydrophobicContact CZ-CD1 3.98Å; F19-F39 AromaticContact CZ-CE1 3.42Å; F19-F39 HydrophobicContact CZ-CE1 3.42Å; F19-F39 VanDerWaalsContact CZ-CE1 3.42Å; F19-F39 HydrophobicContact CZ-CE2 4.12Å; F19-F39 AromaticContact CZ-CZ 3.52Å; F19-F39 HydrophobicContact CZ-CZ 3.52Å; F19-V42 HydrophobicContact CB-CG2 4Å; F19-V42 HydrophobicContact CD1-CG2 4.25Å; F19-V42 HydrophobicContact CD2-CG2 3.56Å; F19-V42 HydrophobicContact CE2-CG2 4.09Å; F19-V42 HydrophobicContact CG-CG2 3.65Å
20L78.3Confident79.3Confident88 Ų8890 Ų9046%0.46145%0.451SS..Hα-helixtrans-59.7-42.7177.2-94.983.7000112.1T16 L17 L23 V24T16-L20 HydrophobicContact CG2-CD1 3.9Å; T16-L20 WeakPolarHBondContact O-CD1 3.31Å; T16-L20 PolarHBondContact O-N 3.08Å; L17-L20 PolarHBondContact O-N 3.32Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.48Å; L20-V24 WeakPolarHBondContact O-CG2 3.23Å; L20-V24 PolarHBondContact O-N 3.44Å
21I84.2Confident78.2Confident99 Ų9985.3 Ų85.351%0.50843%0.43SS..Hα-helixtrans-62-48.8179-67.8163.2000110.4L17 L18 F19 L23 V24 L25L17-I21 VanDerWaalsContact O-CG1 3.29Å; L17-I21 WeakPolarHBondContact O-CG1 3.45Å; L17-I21 PolarHBondContact O-N 2.95Å; L18-I21 PolarHBondContact O-N 3.46Å; F19-I21 VanDerWaalsContact C-N 3.33Å; F19-I21 PolarHBondContact O-N 3.26Å; I21-L23 VanDerWaalsContact C-N 3.29Å; I21-L23 PolarHBondContact O-N 3.3Å; I21-V24 PolarHBondContact O-N 2.87Å; I21-L25 HydrophobicContact CG2-CD1 3.78Å; I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 WeakPolarHBondContact O-CD1 3.42Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 3.44Å
22M79.9Confident77.4Confident63 Ų6387.6 Ų87.631%0.3145%0.449SS..Hα-helixtrans-62.6-36.6177.2-68.3-173.9-167.200112.2L18 F19 K26 I38 P41L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 3.41Å; F19-M22 PolarHBondContact O-N 3.39Å; M22-K26 PolarHBondContact O-N 3.23Å; M22-K26 VanDerWaalsContact O-N 3.15Å; M22-I38 HydrophobicContact CB-CB 4.48Å; M22-I38 HydrophobicContact CB-CG1 4.47Å; M22-I38 HydrophobicContact CB-CG2 3.89Å; M22-P41 HydrophobicContact CE-CG 4Å; M22-P41 HydrophobicContact SD-CG 3.98Å
23L77.5Confident76.9Confident43 Ų4392.3 Ų92.323%0.22546%0.461CS..Hα-helixtrans-63.6-50.1176.9-169.581.9000111F19 L20 I21 K26 L27 W35 I38F19-L23 HydrophobicContact CE2-CD1 4.46Å; F19-L23 HydrophobicContact CZ-CD1 4.06Å; F19-L23 VanDerWaalsContact O-CB 3.3Å; F19-L23 WeakPolarHBondContact O-CB 3.31Å; F19-L23 PolarHBondContact O-N 3.05Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.48Å; I21-L23 VanDerWaalsContact C-N 3.29Å; I21-L23 PolarHBondContact O-N 3.3Å; L23-K26 PolarHBondContact O-N 2.92Å; L23-L27 HydrophobicContact CD2-CD1 4.44Å; L23-L27 HydrophobicContact CG-CD1 3.94Å; L23-L27 WeakPolarHBondContact O-CD1 3.45Å; L23-L27 PolarHBondContact O-N 2.93Å; L23-W35 HydrophobicContact CD1-CZ3 3.94Å; L23-I38 HydrophobicContact CB-CG2 4.45Å; L23-I38 HydrophobicContact CD1-CG2 4.4Å
24V78.2Confident76.3Confident93 Ų9387.7 Ų87.756%0.56445%0.449SS*.Hα-helixtrans-63.4-43.5179.6172.20000111.2L20 I21 K26 L27 D28L20-V24 WeakPolarHBondContact O-CG2 3.23Å; L20-V24 PolarHBondContact O-N 3.44Å; I21-V24 PolarHBondContact O-N 2.87Å; V24-K26 PolarHBondContact O-N 3.28Å; V24-L27 PolarHBondContact O-N 3.48Å; V24-L27 VanDerWaalsContact O-N 3.12Å; V24-D28 PolarHBondContact O-N 3.49Å
25L78Confident75.5Confident86 Ų8684.8 Ų84.845%0.4543%0.431SS..Hα-helixtrans-58.9-33.2176-79.7162.6000113I21 K30I21-L25 HydrophobicContact CG2-CD1 3.78Å; I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 WeakPolarHBondContact O-CD1 3.42Å; I21-L25 WeakPolarHBondContact O-CG 3.41Å; I21-L25 PolarHBondContact O-N 3.44Å; L25-K30 PolarHBondContact O-N 3.32Å
26K75Confident75.1Confident41 Ų4187.3 Ų87.318%0.17844%0.442CS..Hα-helixtrans-75.3-39.4175.2-177.964.4178.6-179.10112.6M22 L23 V24 D28 E29 A31 P32 W33 W35 I38M22-K26 PolarHBondContact O-N 3.23Å; M22-K26 VanDerWaalsContact O-N 3.15Å; L23-K26 PolarHBondContact O-N 2.92Å; V24-K26 PolarHBondContact O-N 3.28Å; K26-D28 VanDerWaalsContact C-N 3.25Å; K26-D28 PolarHBondContact O-N 3.46Å; K26-E29 PolarHBondContact O-N 3.12Å; K26-E29 VanDerWaalsContact O-N 3.16Å; K26-A31 WeakPolarHBondContact CD-O 3.28Å; K26-A31 PolarHBondContact NZ-O 3.01Å; K26-P32 VanDerWaalsContact NZ-C 3.32Å; K26-W33 VanDerWaalsContact CE-O 3.27Å; K26-W33 WeakPolarHBondContact CE-O 3.46Å; K26-W33 PolarHBondContact NZ-O 2.83Å; K26-W35 HydrophobicContact CB-CH2 4.28Å; K26-W35 HydrophobicContact CB-CZ3 4.2Å; K26-W35 HydrophobicContact CG-CD2 4.3Å; K26-W35 HydrophobicContact CG-CE3 4.06Å; K26-W35 HydrophobicContact CG-CH2 3.53Å; K26-W35 HydrophobicContact CG-CZ2 3.76Å; K26-W35 HydrophobicContact CG-CZ3 3.67Å; K26-I38 HydrophobicContact CB-CD1 3.32Å; K26-I38 HydrophobicContact CB-CG1 4.45Å; K26-I38 HydrophobicContact CD-CD1 3.79Å; K26-I38 HydrophobicContact CG-CD1 3.31Å
27L70.3Confident75Confident120 Ų12087.8 Ų87.863%0.62844%0.442SS*.Hα-helixtrans-64.6-31.1175.5-96.1120.7000112.3L23 V24 E29L23-L27 HydrophobicContact CD2-CD1 4.44Å; L23-L27 HydrophobicContact CG-CD1 3.94Å; L23-L27 WeakPolarHBondContact O-CD1 3.45Å; L23-L27 PolarHBondContact O-N 2.93Å; V24-L27 PolarHBondContact O-N 3.48Å; V24-L27 VanDerWaalsContact O-N 3.12Å; L27-E29 PolarHBondContact O-N 2.89Å
28D76.9Confident74.7Confident98 Ų9883.3 Ų83.352%0.52442%0.419SS..THydrogen-bonded Turntrans-78.211.7174.4-16227000112.9V24 K26 K30V24-D28 PolarHBondContact O-N 3.49Å; K26-D28 VanDerWaalsContact C-N 3.25Å; K26-D28 PolarHBondContact O-N 3.46Å; D28-K30 HydrophobicContact CB-CG 4.16Å; D28-K30 VanDerWaalsContact O-CG 3.23Å; D28-K30 WeakPolarHBondContact O-CG 3.46Å; D28-K30 PolarHBondContact O-N 3.35Å; D28-K30 WeakPolarHBondContact OD2-CE 3.45Å
29E67.5Low74.4Confident181 Ų18180.3 Ų80.385%0.84640%0.403SS*.THydrogen-bonded Turntrans54.77.5-179.4-59.7-165.8152.400116.1K26 L27 A31K26-E29 PolarHBondContact O-N 3.12Å; K26-E29 VanDerWaalsContact O-N 3.16Å; L27-E29 PolarHBondContact O-N 2.89Å; E29-A31 VanDerWaalsContact C-N 3.27Å; E29-A31 PolarHBondContact O-N 2.92Å
30K65.3Low74.5Confident158 Ų15882 Ų8269%0.68741%0.413SS*.  trans-74-15.7-175.9-60.9-121.9-178.6179.30113.9L25 D28L25-K30 PolarHBondContact O-N 3.32Å; D28-K30 HydrophobicContact CB-CG 4.16Å; D28-K30 VanDerWaalsContact O-CG 3.23Å; D28-K30 WeakPolarHBondContact O-CG 3.46Å; D28-K30 PolarHBondContact O-N 3.35Å; D28-K30 WeakPolarHBondContact OD2-CE 3.45Å
31A63.7Low74.4Confident23 Ų2378.3 Ų78.319%0.1939%0.394CS..  trans-126.7116.1-177.800000111.8K26 E29 W33K26-A31 WeakPolarHBondContact CD-O 3.28Å; K26-A31 PolarHBondContact NZ-O 3.01Å; E29-A31 VanDerWaalsContact C-N 3.27Å; E29-A31 PolarHBondContact O-N 2.92Å; A31-W33 HydrophobicContact CB-CG 4.34Å; A31-W33 PolarHBondContact O-N 2.88Å
32P65Low74.2Confident120 Ų12074.8 Ų74.878%0.77938%0.377SS*.  trans-75.113.5177.230.6-35.1000113.7K26K26-P32 VanDerWaalsContact NZ-C 3.32Å
33W71.1Confident74.2Confident148 Ų14874.6 Ų74.656%0.56137%0.373SS*.  trans-69.8152.2-169.3-62.111.4000112.5K26 A31 L37K26-W33 VanDerWaalsContact CE-O 3.27Å; K26-W33 WeakPolarHBondContact CE-O 3.46Å; K26-W33 PolarHBondContact NZ-O 2.83Å; A31-W33 HydrophobicContact CB-CG 4.34Å; A31-W33 PolarHBondContact O-N 2.88Å; W33-L37 HydrophobicContact CD2-CD2 4.18Å; W33-L37 HydrophobicContact CE3-CB 4.45Å; W33-L37 HydrophobicContact CE3-CD2 3.63Å; W33-L37 HydrophobicContact CZ3-CD2 4.1Å
34N73Confident74.4Confident70 Ų7076.3 Ų76.337%0.37438%0.381SS..  trans-63.3141175.6-170.6-19000109.8F36 L37 Q99N34-F36 PolarHBondContact O-N 2.79Å; N34-F36 VanDerWaalsContact O-N 3.16Å; N34-F36 PolarHBondContact OD1-N 3.23Å; N34-L37 WeakPolarHBondContact O-CB 3.48Å; N34-L37 PolarHBondContact O-N 3.03Å; N34-Q99 PolarHBondContact ND2-NE2 3.38Å; N34-Q99 PolarHBondContact OD1-NE2 3.37Å; N34-Q99 PolarHBondContact OD1-OE1 2.97Å
35W71.3Confident74.4Confident35 Ų3573.6 Ų73.613%0.13336%0.362CS..Hα-helixtrans-56.2-30.9175.4-72.6103.7000112.4L23 K26 L37 I38 F39 L98 Q99L23-W35 HydrophobicContact CD1-CZ3 3.94Å; K26-W35 HydrophobicContact CB-CH2 4.28Å; K26-W35 HydrophobicContact CB-CZ3 4.2Å; K26-W35 HydrophobicContact CG-CD2 4.3Å; K26-W35 HydrophobicContact CG-CE3 4.06Å; K26-W35 HydrophobicContact CG-CH2 3.53Å; K26-W35 HydrophobicContact CG-CZ2 3.76Å; K26-W35 HydrophobicContact CG-CZ3 3.67Å; W35-L37 VanDerWaalsContact C-N 3.26Å; W35-L37 PolarHBondContact O-N 2.89Å; W35-I38 HydrophobicContact CD2-CD1 4.27Å; W35-I38 HydrophobicContact CE3-CD1 3.61Å; W35-I38 HydrophobicContact CZ3-CD1 3.99Å; W35-I38 PolarHBondContact O-N 3.16Å; W35-F39 WeakPolarHBondContact O-CD2 3.37Å; W35-F39 PolarHBondContact O-N 3.29Å; W35-L98 VanDerWaalsContact CD1-C 3.45Å; W35-L98 HydrophobicContact CD2-CB 3.65Å; W35-L98 HydrophobicContact CD2-CD2 3.87Å; W35-L98 HydrophobicContact CD2-CG 4.14Å; W35-L98 HydrophobicContact CE3-CB 4.18Å; W35-L98 HydrophobicContact CE3-CD2 3.49Å; W35-L98 VanDerWaalsContact CE3-CD2 3.49Å; W35-L98 HydrophobicContact CE3-CG 4.25Å; W35-L98 HydrophobicContact CG-CB 3.89Å; W35-L98 HydrophobicContact CH2-CB 4.42Å; W35-L98 HydrophobicContact CH2-CD2 3.46Å; W35-L98 VanDerWaalsContact CH2-CD2 3.46Å; W35-L98 HydrophobicContact CH2-CG 3.87Å; W35-L98 HydrophobicContact CZ2-CB 3.95Å; W35-L98 HydrophobicContact CZ2-CD2 3.86Å; W35-L98 HydrophobicContact CZ2-CG 3.77Å; W35-L98 HydrophobicContact CZ3-CD2 3.28Å; W35-L98 HydrophobicContact CZ3-CG 4.14Å; W35-L98 PolarHBondContact NE1-O 3.39Å; W35-Q99 VanDerWaalsContact CD1-CA 3.46Å
36F72.9Confident74.4Confident100 Ų10069.6 Ų69.644%0.43934%0.341SS..Hα-helixtrans-57.9-36.9173.2-166.5-98.3000113.3N34 F39 I40 W43N34-F36 PolarHBondContact O-N 2.79Å; N34-F36 VanDerWaalsContact O-N 3.16Å; N34-F36 PolarHBondContact OD1-N 3.23Å; F36-F39 PolarHBondContact O-N 3.39Å; F36-I40 PolarHBondContact O-N 2.84Å; F36-W43 HydrophobicContact CD2-CZ2 4.34Å; F36-W43 AromaticContact CD2-NE1 3.95Å; F36-W43 AromaticContact CE2-CE2 3.66Å; F36-W43 HydrophobicContact CE2-CH2 4.42Å; F36-W43 AromaticContact CE2-CZ2 3.6Å; F36-W43 HydrophobicContact CE2-CZ2 3.6Å; F36-W43 AromaticContact CE2-NE1 3.63Å; F36-W43 HydrophobicContact CZ-CZ2 4.36Å
37L77.3Confident74.6Confident77 Ų7771.3 Ų71.340%0.40336%0.355SS..Hα-helixtrans-67-39.5179.1-112.184.8000112.1W33 N34 W35 F39 I40W33-L37 HydrophobicContact CD2-CD2 4.18Å; W33-L37 HydrophobicContact CE3-CB 4.45Å; W33-L37 HydrophobicContact CE3-CD2 3.63Å; W33-L37 HydrophobicContact CZ3-CD2 4.1Å; N34-L37 WeakPolarHBondContact O-CB 3.48Å; N34-L37 PolarHBondContact O-N 3.03Å; W35-L37 VanDerWaalsContact C-N 3.26Å; W35-L37 PolarHBondContact O-N 2.89Å; L37-F39 PolarHBondContact O-N 3.18Å; L37-I40 HydrophobicContact CB-CD1 4.4Å; L37-I40 HydrophobicContact CD1-CD1 4.48Å; L37-I40 HydrophobicContact CG-CD1 3.86Å; L37-I40 VanDerWaalsContact O-CB 3.27Å; L37-I40 WeakPolarHBondContact O-CB 3.4Å; L37-I40 WeakPolarHBondContact O-CG1 3.45Å; L37-I40 PolarHBondContact O-N 2.74Å; L37-I40 VanDerWaalsContact O-N 3.08Å
38I78.1Confident75.2Confident4 Ų469.1 Ų69.12%0.02134%0.343CS..Hα-helixtrans-64-32.4-179.4-66.8161.9000110.9F19 M22 L23 K26 W35 I40 P41F19-I38 HydrophobicContact CD2-CG2 4.39Å; F19-I38 WeakPolarHBondContact CD2-O 3.42Å; F19-I38 HydrophobicContact CE2-CG2 4.17Å; M22-I38 HydrophobicContact CB-CB 4.48Å; M22-I38 HydrophobicContact CB-CG1 4.47Å; M22-I38 HydrophobicContact CB-CG2 3.89Å; L23-I38 HydrophobicContact CB-CG2 4.45Å; L23-I38 HydrophobicContact CD1-CG2 4.4Å; K26-I38 HydrophobicContact CB-CD1 3.32Å; K26-I38 HydrophobicContact CB-CG1 4.45Å; K26-I38 HydrophobicContact CD-CD1 3.79Å; K26-I38 HydrophobicContact CG-CD1 3.31Å; W35-I38 HydrophobicContact CD2-CD1 4.27Å; W35-I38 HydrophobicContact CE3-CD1 3.61Å; W35-I38 HydrophobicContact CZ3-CD1 3.99Å; W35-I38 PolarHBondContact O-N 3.16Å; I38-I40 VanDerWaalsContact C-N 3.34Å; I38-P41 WeakPolarHBondContact O-CD 3.24Å
39F77.9Confident75.3Confident6 Ų667.5 Ų67.53%0.02633%0.334CS..THydrogen-bonded Turntrans-84-3.8178.1-80.3-96.8000113.6F19 W35 F36 L37 P41 V42 W43 C91 L94 C95F19-F39 HydrophobicContact CD2-CD1 4.38Å; F19-F39 AromaticContact CE2-CD1 3.5Å; F19-F39 HydrophobicContact CE2-CD1 3.5Å; F19-F39 AromaticContact CE2-CD2 3.89Å; F19-F39 HydrophobicContact CE2-CD2 3.89Å; F19-F39 AromaticContact CE2-CE1 3.44Å; F19-F39 HydrophobicContact CE2-CE1 3.44Å; F19-F39 VanDerWaalsContact CE2-CE1 3.44Å; F19-F39 AromaticContact CE2-CE2 3.86Å; F19-F39 HydrophobicContact CE2-CE2 3.86Å; F19-F39 AromaticContact CE2-CG 3.75Å; F19-F39 HydrophobicContact CE2-CG 3.75Å; F19-F39 AromaticContact CE2-CZ 3.64Å; F19-F39 HydrophobicContact CE2-CZ 3.64Å; F19-F39 AromaticContact CZ-CD1 3.98Å; F19-F39 HydrophobicContact CZ-CD1 3.98Å; F19-F39 AromaticContact CZ-CE1 3.42Å; F19-F39 HydrophobicContact CZ-CE1 3.42Å; F19-F39 VanDerWaalsContact CZ-CE1 3.42Å; F19-F39 HydrophobicContact CZ-CE2 4.12Å; F19-F39 AromaticContact CZ-CZ 3.52Å; F19-F39 HydrophobicContact CZ-CZ 3.52Å; W35-F39 WeakPolarHBondContact O-CD2 3.37Å; W35-F39 PolarHBondContact O-N 3.29Å; F36-F39 PolarHBondContact O-N 3.39Å; L37-F39 PolarHBondContact O-N 3.18Å; F39-P41 VanDerWaalsContact C-CD 3.41Å; F39-P41 VanDerWaalsContact C-N 3.33Å; F39-V42 HydrophobicContact CD1-CB 4.4Å; F39-V42 HydrophobicContact CD1-CG2 4.39Å; F39-V42 WeakPolarHBondContact O-CA 3.17Å; F39-V42 WeakPolarHBondContact O-CB 3.39Å; F39-V42 PolarHBondContact O-N 3.46Å; F39-W43 VanDerWaalsContact C-CD1 3.42Å; F39-W43 PolarHBondContact O-N 2.88Å; F39-C91 HydrophobicContact CD1-CB 4.42Å; F39-C91 HydrophobicContact CE1-CB 4.39Å; F39-L94 HydrophobicContact CZ-CD2 3.86Å; F39-C95 WeakPolarHBondContact CD2-SG 3.2Å; F39-C95 WeakPolarHBondContact CE2-SG 3.42Å; F39-C95 VanDerWaalsContact CG-SG 3.56Å
40I82.3Confident75.9Confident70 Ų7061 Ų6136%0.35931%0.305SS..Hα-helixtrans-49.3-46.1179-75.8175.8000113.1F36 L37 I38 V42 W43 I44F36-I40 PolarHBondContact O-N 2.84Å; L37-I40 HydrophobicContact CB-CD1 4.4Å; L37-I40 HydrophobicContact CD1-CD1 4.48Å; L37-I40 HydrophobicContact CG-CD1 3.86Å; L37-I40 VanDerWaalsContact O-CB 3.27Å; L37-I40 WeakPolarHBondContact O-CB 3.4Å; L37-I40 WeakPolarHBondContact O-CG1 3.45Å; L37-I40 PolarHBondContact O-N 2.74Å; L37-I40 VanDerWaalsContact O-N 3.08Å; I38-I40 VanDerWaalsContact C-N 3.34Å; I40-V42 PolarHBondContact O-N 2.89Å; I40-W43 WeakPolarHBondContact O-CB 3.27Å; I40-W43 PolarHBondContact O-N 3.49Å; I40-I44 HydrophobicContact CG2-CD1 3.64Å; I40-I44 HydrophobicContact CG2-CG1 4.22Å; I40-I44 WeakPolarHBondContact O-CG1 3.1Å; I40-I44 PolarHBondContact O-N 3.02Å
41P77.4Confident76.7Confident10 Ų1057.2 Ų57.27%0.06530%0.295CS..Hα-helixtrans-56.8-37.8177.4-25.135.3000112.8F15 M22 I38 F39 F45F15-P41 HydrophobicContact CD1-CB 4.13Å; M22-P41 HydrophobicContact CE-CG 4Å; M22-P41 HydrophobicContact SD-CG 3.98Å; I38-P41 WeakPolarHBondContact O-CD 3.24Å; F39-P41 VanDerWaalsContact C-CD 3.41Å; F39-P41 VanDerWaalsContact C-N 3.33Å; P41-F45 WeakPolarHBondContact O-CB 3.28Å; P41-F45 PolarHBondContact O-N 3.48Å
42V79.8Confident77.4Confident25 Ų2560.5 Ų60.515%0.15231%0.307CS..Hα-helixtrans-71.8-45.2177.7179.90000110.4F19 F39 I40 I44 F45 D46F19-V42 HydrophobicContact CB-CG2 4Å; F19-V42 HydrophobicContact CD1-CG2 4.25Å; F19-V42 HydrophobicContact CD2-CG2 3.56Å; F19-V42 HydrophobicContact CE2-CG2 4.09Å; F19-V42 HydrophobicContact CG-CG2 3.65Å; F39-V42 HydrophobicContact CD1-CB 4.4Å; F39-V42 HydrophobicContact CD1-CG2 4.39Å; F39-V42 WeakPolarHBondContact O-CA 3.17Å; F39-V42 WeakPolarHBondContact O-CB 3.39Å; F39-V42 PolarHBondContact O-N 3.46Å; I40-V42 PolarHBondContact O-N 2.89Å; V42-I44 VanDerWaalsContact C-N 3.34Å; V42-I44 PolarHBondContact O-N 3.31Å; V42-F45 PolarHBondContact O-N 3.33Å; V42-D46 VanDerWaalsContact CG1-OD2 3.26Å; V42-D46 WeakPolarHBondContact CG1-OD2 3.5Å; V42-D46 WeakPolarHBondContact O-CB 3.45Å; V42-D46 PolarHBondContact O-N 3.28Å
43W79.3Confident77.8Confident59 Ų5957 Ų5722%0.22328%0.282CS..Hα-helixtrans-57-45.4176.4-76.6109.3000112.8F36 F39 I40 T47 L88 L92F36-W43 HydrophobicContact CD2-CZ2 4.34Å; F36-W43 AromaticContact CD2-NE1 3.95Å; F36-W43 AromaticContact CE2-CE2 3.66Å; F36-W43 HydrophobicContact CE2-CH2 4.42Å; F36-W43 AromaticContact CE2-CZ2 3.6Å; F36-W43 HydrophobicContact CE2-CZ2 3.6Å; F36-W43 AromaticContact CE2-NE1 3.63Å; F36-W43 HydrophobicContact CZ-CZ2 4.36Å; F39-W43 VanDerWaalsContact C-CD1 3.42Å; F39-W43 PolarHBondContact O-N 2.88Å; I40-W43 WeakPolarHBondContact O-CB 3.27Å; I40-W43 PolarHBondContact O-N 3.49Å; W43-T47 VanDerWaalsContact O-CB 3.27Å; W43-T47 WeakPolarHBondContact O-CB 3.09Å; W43-T47 PolarHBondContact O-N 3.04Å; W43-T47 PolarHBondContact O-OG1 3.44Å; W43-L88 HydrophobicContact CE3-CD2 4.18Å; W43-L88 HydrophobicContact CZ3-CD2 4.1Å; W43-L92 HydrophobicContact CH2-CD1 3.78Å; W43-L92 HydrophobicContact CH2-CD2 3.64Å; W43-L92 HydrophobicContact CH2-CG 3.56Å; W43-L92 HydrophobicContact CZ2-CD1 4.45Å; W43-L92 HydrophobicContact CZ2-CD2 3.63Å; W43-L92 HydrophobicContact CZ2-CG 3.73Å
44I81.3Confident78.2Confident78 Ų7853.9 Ų53.940%0.428%0.275SS..Hα-helixtrans-62.6-47.9178-68.3171.6000109.6I40 V42 T47 I48I40-I44 HydrophobicContact CG2-CD1 3.64Å; I40-I44 HydrophobicContact CG2-CG1 4.22Å; I40-I44 WeakPolarHBondContact O-CG1 3.1Å; I40-I44 PolarHBondContact O-N 3.02Å; V42-I44 VanDerWaalsContact C-N 3.34Å; V42-I44 PolarHBondContact O-N 3.31Å; I44-T47 PolarHBondContact O-N 3.36Å; I44-I48 HydrophobicContact CG2-CD1 3.76Å; I44-I48 VanDerWaalsContact O-CG1 3.26Å; I44-I48 WeakPolarHBondContact O-CG1 3.34Å; I44-I48 PolarHBondContact O-N 2.9Å
45F78.6Confident78.5Confident37 Ų3755 Ų5516%0.16228%0.284CS..Hα-helixtrans-62.5-48-178.9-176.2-101.2000112.6T12 F15 P41 V42 I48 L49T12-F45 HydrophobicContact CG2-CE1 3.95Å; T12-F45 HydrophobicContact CG2-CE2 3.95Å; T12-F45 HydrophobicContact CG2-CZ 3.39Å; T12-F45 WeakPolarHBondContact OG1-CE2 3.13Å; T12-F45 WeakPolarHBondContact OG1-CZ 3.45Å; F15-F45 AromaticContact CD2-CD2 4Å; F15-F45 HydrophobicContact CD2-CD2 4Å; P41-F45 WeakPolarHBondContact O-CB 3.28Å; P41-F45 PolarHBondContact O-N 3.48Å; V42-F45 PolarHBondContact O-N 3.33Å; F45-I48 PolarHBondContact O-N 2.85Å; F45-L49 HydrophobicContact CD1-CD1 3.84Å; F45-L49 HydrophobicContact CD1-CG 4.49Å; F45-L49 HydrophobicContact CE1-CD1 3.29Å; F45-L49 HydrophobicContact CE1-CG 4.11Å; F45-L49 HydrophobicContact CZ-CD1 3.73Å; F45-L49 HydrophobicContact CZ-CG 4.19Å; F45-L49 WeakPolarHBondContact O-CG 3.3Å; F45-L49 PolarHBondContact O-N 2.87Å
46D77.7Confident78.6Confident2 Ų260.2 Ų60.21%0.01131%0.308CS..Hα-helixtrans-64.3-40.4176.2-78.7-61.3000110.8V42 I48 L49 L50 M84 K87 L88V42-D46 VanDerWaalsContact CG1-OD2 3.26Å; V42-D46 WeakPolarHBondContact CG1-OD2 3.5Å; V42-D46 WeakPolarHBondContact O-CB 3.45Å; V42-D46 PolarHBondContact O-N 3.28Å; D46-I48 PolarHBondContact O-N 3.37Å; D46-L49 PolarHBondContact O-N 2.9Å; D46-L50 WeakPolarHBondContact O-CB 3.32Å; D46-L50 PolarHBondContact O-N 3.02Å; D46-M84 HydrophobicContact CB-CE 3.93Å; D46-M84 WeakPolarHBondContact O-CE 3.35Å; D46-K87 VanDerWaalsContact CG-NZ 3.34Å; D46-K87 IonicContact OD1-NZ 2.82Å; D46-K87 PolarHBondContact OD1-NZ 3.25Å; D46-K87 IonicContact OD2-NZ 3.01Å; D46-K87 PolarHBondContact OD2-NZ 3.48Å; D46-L88 HydrophobicContact CB-CD2 3.75Å; D46-L88 HydrophobicContact CB-CG 4.39Å
47T80.4Confident78.3Confident76 Ų7658.1 Ų58.147%0.46630%0.3SS..Hα-helixtrans-61-43.9176.2-56.80000112W43 I44 L49 L50 V51W43-T47 VanDerWaalsContact O-CB 3.27Å; W43-T47 WeakPolarHBondContact O-CB 3.09Å; W43-T47 PolarHBondContact O-N 3.04Å; W43-T47 PolarHBondContact O-OG1 3.44Å; I44-T47 PolarHBondContact O-N 3.36Å; T47-L49 PolarHBondContact O-N 3.35Å; T47-L50 PolarHBondContact O-N 3.36Å; T47-V51 HydrophobicContact CG2-CG2 4.46Å; T47-V51 WeakPolarHBondContact O-CG2 3.44Å; T47-V51 PolarHBondContact O-N 3.4Å
48I82.9Confident78.1Confident74 Ų7457.3 Ų57.338%0.37930%0.304SS..Hα-helixtrans-61.2-45.9177.8-70.1166.3000110.9I44 F45 D46 L50 V51 M52I44-I48 HydrophobicContact CG2-CD1 3.76Å; I44-I48 VanDerWaalsContact O-CG1 3.26Å; I44-I48 WeakPolarHBondContact O-CG1 3.34Å; I44-I48 PolarHBondContact O-N 2.9Å; F45-I48 PolarHBondContact O-N 2.85Å; D46-I48 PolarHBondContact O-N 3.37Å; I48-L50 VanDerWaalsContact C-N 3.3Å; I48-L50 PolarHBondContact O-N 3.29Å; I48-V51 PolarHBondContact O-N 2.98Å; I48-M52 HydrophobicContact CG2-CE 3.82Å; I48-M52 WeakPolarHBondContact O-CB 3.34Å; I48-M52 WeakPolarHBondContact O-CG 3.37Å; I48-M52 PolarHBondContact O-N 3.26Å
49L78.2Confident77.6Confident64 Ų6459.3 Ų59.334%0.33533%0.326SS..Hα-helixtrans-61.5-39.8177.8-79-179.8000111.8F45 D46 T47 M52 L53 M84F45-L49 HydrophobicContact CD1-CD1 3.84Å; F45-L49 HydrophobicContact CD1-CG 4.49Å; F45-L49 HydrophobicContact CE1-CD1 3.29Å; F45-L49 HydrophobicContact CE1-CG 4.11Å; F45-L49 HydrophobicContact CZ-CD1 3.73Å; F45-L49 HydrophobicContact CZ-CG 4.19Å; F45-L49 WeakPolarHBondContact O-CG 3.3Å; F45-L49 PolarHBondContact O-N 2.87Å; D46-L49 PolarHBondContact O-N 2.9Å; T47-L49 PolarHBondContact O-N 3.35Å; L49-M52 PolarHBondContact O-N 3.26Å; L49-L53 PolarHBondContact O-N 3.49Å; L49-M84 HydrophobicContact CB-CE 3.41Å; L49-M84 VanDerWaalsContact CB-CE 3.41Å; L49-M84 HydrophobicContact CB-SD 4.28Å; L49-M84 HydrophobicContact CD1-CE 4.39Å
50L79.5Confident76.8Confident44 Ų4465 Ų6523%0.2335%0.348CS..Hα-helixtrans-66.2-47.2179.8-162.8159.5000110D46 T47 I48 M52 L53 I54 M84 L88D46-L50 WeakPolarHBondContact O-CB 3.32Å; D46-L50 PolarHBondContact O-N 3.02Å; T47-L50 PolarHBondContact O-N 3.36Å; I48-L50 VanDerWaalsContact C-N 3.3Å; I48-L50 PolarHBondContact O-N 3.29Å; L50-M52 PolarHBondContact O-N 3.21Å; L50-L53 WeakPolarHBondContact O-CB 3.31Å; L50-L53 PolarHBondContact O-N 3.28Å; L50-I54 HydrophobicContact CD2-CD1 3.35Å; L50-I54 HydrophobicContact CD2-CG1 4.03Å; L50-I54 WeakPolarHBondContact O-CG1 3.46Å; L50-I54 PolarHBondContact O-N 2.88Å; L50-M84 HydrophobicContact CB-CE 3.83Å; L50-M84 HydrophobicContact CB-SD 4.13Å; L50-L88 HydrophobicContact CD1-CD1 4.38Å
51V82.2Confident75.7Confident79 Ų7966.7 Ų66.748%0.47936%0.364SS..Hα-helixtrans-60.5-44.4175.1172.70000111.1T47 I48 L53 I54 V55T47-V51 HydrophobicContact CG2-CG2 4.46Å; T47-V51 WeakPolarHBondContact O-CG2 3.44Å; T47-V51 PolarHBondContact O-N 3.4Å; I48-V51 PolarHBondContact O-N 2.98Å; V51-L53 VanDerWaalsContact C-N 3.3Å; V51-L53 PolarHBondContact O-N 3.37Å; V51-I54 PolarHBondContact O-N 2.92Å; V51-V55 HydrophobicContact CG1-CG2 4.23Å; V51-V55 VanDerWaalsContact O-CG2 3.3Å; V51-V55 WeakPolarHBondContact O-CG2 3.22Å; V51-V55 PolarHBondContact O-N 3.21Å
52M79.3Confident74.9Confident93 Ų9375.4 Ų75.446%0.45840%0.401SS..Hα-helixtrans-60.4-39.2176.5-76.7-167.3-173.500112.5I48 L49 L50 K56I48-M52 HydrophobicContact CG2-CE 3.82Å; I48-M52 WeakPolarHBondContact O-CB 3.34Å; I48-M52 WeakPolarHBondContact O-CG 3.37Å; I48-M52 PolarHBondContact O-N 3.26Å; L49-M52 PolarHBondContact O-N 3.26Å; L50-M52 PolarHBondContact O-N 3.21Å; M52-K56 WeakPolarHBondContact O-CB 3.44Å; M52-K56 PolarHBondContact O-N 3.26Å
53L74.3Confident73.7Confident45 Ų4578.6 Ų78.624%0.23642%0.424CS..Hα-helixtrans-64.4-48.5174.9-82.4167.8000111.2L49 L50 V51 V55 K56 M57 L81 M84L49-L53 PolarHBondContact O-N 3.49Å; L50-L53 WeakPolarHBondContact O-CB 3.31Å; L50-L53 PolarHBondContact O-N 3.28Å; V51-L53 VanDerWaalsContact C-N 3.3Å; V51-L53 PolarHBondContact O-N 3.37Å; L53-V55 PolarHBondContact O-N 2.87Å; L53-K56 WeakPolarHBondContact O-CB 3.1Å; L53-K56 PolarHBondContact O-N 3.38Å; L53-M57 WeakPolarHBondContact O-CG 3.35Å; L53-M57 PolarHBondContact O-N 3.24Å; L53-L81 HydrophobicContact CB-CD2 4.11Å; L53-L81 HydrophobicContact CD1-CD2 4.06Å; L53-M84 HydrophobicContact CD1-SD 3.95Å
54I78Confident72.5Confident84 Ų8479.2 Ų79.243%0.43145%0.45SS..Hα-helixtrans-59.5-48.2178.3-68.5176.4000110.8L50 V51 K56 M57 A58L50-I54 HydrophobicContact CD2-CD1 3.35Å; L50-I54 HydrophobicContact CD2-CG1 4.03Å; L50-I54 WeakPolarHBondContact O-CG1 3.46Å; L50-I54 PolarHBondContact O-N 2.88Å; V51-I54 PolarHBondContact O-N 2.92Å; I54-K56 VanDerWaalsContact C-N 3.3Å; I54-K56 PolarHBondContact O-N 3.29Å; I54-M57 CarbonylContact O-C 3.57Å; I54-M57 WeakPolarHBondContact O-CA 3.36Å; I54-M57 WeakPolarHBondContact O-CB 3.38Å; I54-M57 PolarHBondContact O-N 3.15Å; I54-A58 PolarHBondContact O-N 3.01Å
55V79.4Confident71.3Confident93 Ų9382.7 Ų82.756%0.56446%0.462SS*.Hα-helixtrans-61.3-40.4179.3172.80000111.1V51 L53 M57 A58 G59V51-V55 HydrophobicContact CG1-CG2 4.23Å; V51-V55 VanDerWaalsContact O-CG2 3.3Å; V51-V55 WeakPolarHBondContact O-CG2 3.22Å; V51-V55 PolarHBondContact O-N 3.21Å; L53-V55 PolarHBondContact O-N 2.87Å; V55-M57 VanDerWaalsContact C-N 3.26Å; V55-M57 PolarHBondContact O-N 3.45Å; V55-A58 PolarHBondContact O-N 3.07Å; V55-G59 PolarHBondContact O-N 3.11Å
56K73Confident70.3Confident144 Ų14486.2 Ų86.263%0.62648%0.482SS*.Hα-helixtrans-65.1-25.2172.6-88.5-176.3171.8-179.30113.6M52 L53 I54 R60 K77M52-K56 WeakPolarHBondContact O-CB 3.44Å; M52-K56 PolarHBondContact O-N 3.26Å; L53-K56 WeakPolarHBondContact O-CB 3.1Å; L53-K56 PolarHBondContact O-N 3.38Å; I54-K56 VanDerWaalsContact C-N 3.3Å; I54-K56 PolarHBondContact O-N 3.29Å; K56-R60 WeakPolarHBondContact O-CG 3.48Å; K56-K77 PolarHBondContact O-NZ 2.96Å
57M67.8Low69.3Low57 Ų5790.4 Ų90.428%0.28151%0.51SS..Hα-helixtrans-79.6-50172.8-67.3-150-56.300111.1L53 I54 V55 G59 R60 C61 K77 L81L53-M57 WeakPolarHBondContact O-CG 3.35Å; L53-M57 PolarHBondContact O-N 3.24Å; I54-M57 CarbonylContact O-C 3.57Å; I54-M57 WeakPolarHBondContact O-CA 3.36Å; I54-M57 WeakPolarHBondContact O-CB 3.38Å; I54-M57 PolarHBondContact O-N 3.15Å; V55-M57 VanDerWaalsContact C-N 3.26Å; V55-M57 PolarHBondContact O-N 3.45Å; M57-G59 VanDerWaalsContact C-N 3.33Å; M57-G59 PolarHBondContact O-N 2.93Å; M57-R60 WeakPolarHBondContact O-CB 3.5Å; M57-R60 PolarHBondContact O-N 3.16Å; M57-C61 PolarHBondContact O-N 2.93Å; M57-K77 HydrophobicContact CG-CD 3.8Å; M57-K77 HydrophobicContact SD-CB 3.87Å; M57-K77 HydrophobicContact SD-CD 4.05Å; M57-L81 HydrophobicContact CE-CD1 3.37Å; M57-L81 HydrophobicContact SD-CD1 4.09Å
58A72.3Confident68.1Low59 Ų5997.8 Ų97.849%0.48853%0.529SS..Hα-helixtrans-60-40.9-179.600000112.4I54 V55 R60 C61 K62I54-A58 PolarHBondContact O-N 3.01Å; V55-A58 PolarHBondContact O-N 3.07Å; A58-R60 PolarHBondContact O-N 3.36Å; A58-C61 PolarHBondContact O-N 2.92Å; A58-C61 VanDerWaalsContact O-N 3.16Å; A58-K62 PolarHBondContact O-N 2.97Å
59G68.1Low66.8Low47 Ų4799.7 Ų99.749%0.48554%0.54SS..Hα-helixtrans-63.7-26.5175.800000114.1V55 M57V55-G59 PolarHBondContact O-N 3.11Å; M57-G59 VanDerWaalsContact C-N 3.33Å; M57-G59 PolarHBondContact O-N 2.93Å
60R61.8Low65.8Low126 Ų12697.4 Ų97.448%0.47553%0.532SS..Hα-helixtrans-81.3-25.9175.4-74.4-102.6-74.7-121.33.1112.7K56 M57 A58 K62 N73K56-R60 WeakPolarHBondContact O-CG 3.48Å; M57-R60 WeakPolarHBondContact O-CB 3.5Å; M57-R60 PolarHBondContact O-N 3.16Å; A58-R60 PolarHBondContact O-N 3.36Å; R60-K62 PolarHBondContact O-N 3.18Å; R60-N73 VanDerWaalsContact NH2-CB 3.28Å
61C59.3Low64.7Low104 Ų10498.5 Ų98.570%0.70354%0.543SS*.Hα-helixtrans-69-25.2171.3-640000112.1M57 A58M57-C61 PolarHBondContact O-N 2.93Å; A58-C61 PolarHBondContact O-N 2.92Å; A58-C61 VanDerWaalsContact O-N 3.16Å
62K60.1Low63.7Low194 Ų19499.3 Ų99.384%0.84354%0.542SS*.Hα-helixtrans-86.3-22.9-179.5-157.6-174.2-178.8-158.10114.1A58 R60A58-K62 PolarHBondContact O-N 2.97Å; R60-K62 PolarHBondContact O-N 3.18Å
63S54.1Low63.1Low91 Ų9197.5 Ų97.564%0.63653%0.534SS*.SBendtrans-106.3102.7-177.5-176.90000109.2F65S63-F65 PolarHBondContact O-N 3.35Å
64G54Low62.8Low73 Ų7399.6 Ų99.675%0.75354%0.544SS*.  trans28.989.8166.100000115.8D66G64-D66 PolarHBondContact O-N 2.99Å
65F56.3Low62.4Low150 Ų150103 Ų10366%0.65856%0.556SS**  trans-61.397.8177.9-167.7-93.9000110.5S63 P67S63-F65 PolarHBondContact O-N 3.35Å; F65-P67 HydrophobicContact CD1-CB 4.25Å; F65-P67 HydrophobicContact CE1-CB 4.07Å; F65-P67 VanDerWaalsContact O-CD 3.27Å; F65-P67 WeakPolarHBondContact O-CD 3.36Å
66D57.6Low61.9Low111 Ų111102 Ų10259%0.59454%0.544SS*.  trans-86.1105169.9-165.5-23.1000109G64 R68 G70G64-D66 PolarHBondContact O-N 2.99Å; D66-R68 PolarHBondContact O-N 3.5Å; D66-G70 PolarHBondContact O-N 3.09Å
67P57.5Low61.8Low90 Ų9097 Ų9758%0.58452%0.522SS*.Hα-helixtrans-71.8-15.5-166.828.3-33.8000113.4F65F65-P67 HydrophobicContact CD1-CB 4.25Å; F65-P67 HydrophobicContact CE1-CB 4.07Å; F65-P67 VanDerWaalsContact O-CD 3.27Å; F65-P67 WeakPolarHBondContact O-CD 3.36Å
68R54.7Low62.1Low232 Ų23296.2 Ų96.288%0.87553%0.525SS*.Hα-helixtrans-82.5-28.6-173.1-162.3165171.4168.8-4.4113.7D66D66-R68 PolarHBondContact O-N 3.5Å
69N56.2Low62.3Low114 Ų11497.7 Ų97.761%0.6152%0.518SS*.Hα-helixtrans-114.6-3.5177.9-152.220.2000113.4N73N69-N73 PolarHBondContact O-ND2 3.29Å
70G55.8Low62.5Low15 Ų15102.7 Ų102.716%0.15552%0.523CS..Hα-helixtrans-74.3-38.5-179.900000114.1D66 Q72 N73 I74D66-G70 PolarHBondContact O-N 3.09Å; G70-Q72 PolarHBondContact O-N 2.97Å; G70-N73 PolarHBondContact O-N 3.32Å; G70-I74 WeakPolarHBondContact O-CD1 3.35Å; G70-I74 VanDerWaalsContact O-CG1 3.26Å; G70-I74 WeakPolarHBondContact O-CG1 3.02Å; G70-I74 PolarHBondContact O-N 2.83Å
71S57.2Low63Low67 Ų6798.1 Ų98.147%0.46951%0.508SS..Hα-helixtrans-64.2-44.8-170.567.40000113.5N73 I74 K75S71-N73 PolarHBondContact O-N 2.85Å; S71-I74 PolarHBondContact O-N 2.94Å; S71-K75 WeakPolarHBondContact O-CG 3.14Å; S71-K75 PolarHBondContact O-N 3.35Å; S71-K75 VanDerWaalsContact O-N 3.13Å
72Q61.2Low63.9Low97 Ų9797.1 Ų97.145%0.45350%0.495SS..Hα-helixtrans-66.9-36.9176.7-71.4-1545.300112.4G70 K76G70-Q72 PolarHBondContact O-N 2.97Å; Q72-K76 WeakPolarHBondContact O-CG 3.39Å; Q72-K76 PolarHBondContact O-N 3.29Å; Q72-K76 VanDerWaalsContact O-N 3.09Å
73N66.4Low64.6Low54 Ų5488.9 Ų88.929%0.28946%0.463SS..Hα-helixtrans-68.5-35177.3-84.1-67.6000112.6R60 N69 G70 S71 K77R60-N73 VanDerWaalsContact NH2-CB 3.28Å; N69-N73 PolarHBondContact O-ND2 3.29Å; G70-N73 PolarHBondContact O-N 3.32Å; S71-N73 PolarHBondContact O-N 2.85Å; N73-K77 WeakPolarHBondContact O-CB 3.35Å; N73-K77 WeakPolarHBondContact O-CG 3.44Å; N73-K77 PolarHBondContact O-N 2.99Å; N73-K77 VanDerWaalsContact O-N 3.07Å
74I67.3Low65.5Low89 Ų8985.4 Ų85.446%0.45644%0.437SS..Hα-helixtrans-69.7-43.9177-66.6162.6000110.2G70 S71 K76 K77 A78G70-I74 WeakPolarHBondContact O-CD1 3.35Å; G70-I74 VanDerWaalsContact O-CG1 3.26Å; G70-I74 WeakPolarHBondContact O-CG1 3.02Å; G70-I74 PolarHBondContact O-N 2.83Å; S71-I74 PolarHBondContact O-N 2.94Å; I74-K76 PolarHBondContact O-N 2.87Å; I74-K77 PolarHBondContact O-N 3.31Å; I74-A78 WeakPolarHBondContact O-CB 3.27Å; I74-A78 PolarHBondContact O-N 3.24Å
75K70.3Confident66.4Low157 Ų15786.9 Ų86.968%0.68343%0.427SS*.Hα-helixtrans-57.6-49.8175.3-72.4-177.2177.7-174.50111.9S71 K77 A78 W79S71-K75 WeakPolarHBondContact O-CG 3.14Å; S71-K75 PolarHBondContact O-N 3.35Å; S71-K75 VanDerWaalsContact O-N 3.13Å; K75-K77 PolarHBondContact O-N 3.4Å; K75-A78 PolarHBondContact O-N 2.95Å; K75-W79 WeakPolarHBondContact O-CB 3.47Å; K75-W79 PolarHBondContact O-N 2.88Å
76K69.7Low67.3Low72 Ų7282 Ų8231%0.31341%0.407SS..Hα-helixtrans-59.4-43.2176.5-73.7-179178.2-179.60112.2Q72 I74 W79 Y80Q72-K76 WeakPolarHBondContact O-CG 3.39Å; Q72-K76 PolarHBondContact O-N 3.29Å; Q72-K76 VanDerWaalsContact O-N 3.09Å; I74-K76 PolarHBondContact O-N 2.87Å; K76-W79 WeakPolarHBondContact O-CB 3.26Å; K76-W79 PolarHBondContact O-N 3.4Å; K76-Y80 WeakPolarHBondContact O-CD2 3.49Å; K76-Y80 PolarHBondContact O-N 3.2Å
77K70.4Confident68.2Low38 Ų3880.8 Ų80.817%0.16540%0.397CS..Hα-helixtrans-66.8-41.5177.7-73.1180-171.2-175.10112.9K56 M57 N73 I74 K75 W79 Y80 L81K56-K77 PolarHBondContact O-NZ 2.96Å; M57-K77 HydrophobicContact CG-CD 3.8Å; M57-K77 HydrophobicContact SD-CB 3.87Å; M57-K77 HydrophobicContact SD-CD 4.05Å; N73-K77 WeakPolarHBondContact O-CB 3.35Å; N73-K77 WeakPolarHBondContact O-CG 3.44Å; N73-K77 PolarHBondContact O-N 2.99Å; N73-K77 VanDerWaalsContact O-N 3.07Å; I74-K77 PolarHBondContact O-N 3.31Å; K75-K77 PolarHBondContact O-N 3.4Å; K77-W79 VanDerWaalsContact C-N 3.29Å; K77-Y80 PolarHBondContact O-N 2.82Å; K77-L81 WeakPolarHBondContact O-CG 3.49Å; K77-L81 PolarHBondContact O-N 3.01Å
78A73.6Confident68.7Low41 Ų4177.6 Ų77.634%0.33938%0.375SS..Hα-helixtrans-62.6-40.5174.200000110.7I74 K75 L81 I82I74-A78 WeakPolarHBondContact O-CB 3.27Å; I74-A78 PolarHBondContact O-N 3.24Å; K75-A78 PolarHBondContact O-N 2.95Å; A78-L81 WeakPolarHBondContact O-CB 3.48Å; A78-L81 PolarHBondContact O-N 3.42Å; A78-I82 VanDerWaalsContact O-CG1 3.28Å; A78-I82 WeakPolarHBondContact O-CG1 3.37Å; A78-I82 PolarHBondContact O-N 3.18Å
79W76.4Confident69.6Low90 Ų9068.6 Ų68.634%0.34135%0.35SS..Hα-helixtrans-59.6-46.7173.6-169.3-95.7000112.2K75 K76 K77 L81 I82 A83 G119K75-W79 WeakPolarHBondContact O-CB 3.47Å; K75-W79 PolarHBondContact O-N 2.88Å; K76-W79 WeakPolarHBondContact O-CB 3.26Å; K76-W79 PolarHBondContact O-N 3.4Å; K77-W79 VanDerWaalsContact C-N 3.29Å; W79-L81 VanDerWaalsContact C-N 3.32Å; W79-L81 PolarHBondContact O-N 3.41Å; W79-I82 PolarHBondContact O-N 3.35Å; W79-A83 WeakPolarHBondContact O-CB 3.48Å; W79-A83 PolarHBondContact O-N 3.04Å; W79-G119 WeakPolarHBondContact CZ2-O 3.27Å
80Y73.4Confident70.6Confident151 Ų15164.9 Ų64.959%0.59233%0.329SS*.Hα-helixtrans-60-39.5174-78.8-64.7000112.8K76 K77 M84K76-Y80 WeakPolarHBondContact O-CD2 3.49Å; K76-Y80 PolarHBondContact O-N 3.2Å; K77-Y80 PolarHBondContact O-N 2.82Å; Y80-M84 VanDerWaalsContact O-CB 3.27Å; Y80-M84 WeakPolarHBondContact O-CB 3.37Å; Y80-M84 PolarHBondContact O-N 2.91Å
81L71.5Confident71.3Confident31 Ų3165 Ų6516%0.16233%0.327CS..Hα-helixtrans-66.1-44.5176.1-74.5169.7000112.1L53 M57 K77 A78 W79 M84 L85L53-L81 HydrophobicContact CB-CD2 4.11Å; L53-L81 HydrophobicContact CD1-CD2 4.06Å; M57-L81 HydrophobicContact CE-CD1 3.37Å; M57-L81 HydrophobicContact SD-CD1 4.09Å; K77-L81 WeakPolarHBondContact O-CG 3.49Å; K77-L81 PolarHBondContact O-N 3.01Å; A78-L81 WeakPolarHBondContact O-CB 3.48Å; A78-L81 PolarHBondContact O-N 3.42Å; W79-L81 VanDerWaalsContact C-N 3.32Å; W79-L81 PolarHBondContact O-N 3.41Å; L81-M84 PolarHBondContact O-N 2.85Å; L81-L85 WeakPolarHBondContact O-CB 3.45Å; L81-L85 WeakPolarHBondContact O-CG 3.45Å; L81-L85 PolarHBondContact O-N 2.92Å
82I77.6Confident71.9Confident82 Ų8265.6 Ų65.642%0.42132%0.324SS..Hα-helixtrans-60.9-47176.1-69.7163.1000109.8A78 W79 M84 L85 L86A78-I82 VanDerWaalsContact O-CG1 3.28Å; A78-I82 WeakPolarHBondContact O-CG1 3.37Å; A78-I82 PolarHBondContact O-N 3.18Å; W79-I82 PolarHBondContact O-N 3.35Å; I82-M84 VanDerWaalsContact C-N 3.28Å; I82-M84 PolarHBondContact O-N 3.39Å; I82-L85 PolarHBondContact O-N 3.01Å; I82-L86 HydrophobicContact CG2-CD1 3.94Å; I82-L86 VanDerWaalsContact O-CD1 3.3Å; I82-L86 WeakPolarHBondContact O-CD1 3.43Å; I82-L86 PolarHBondContact O-N 3.25Å
83A75.8Confident72.2Confident22 Ų2262.6 Ų62.618%0.18232%0.316CS..Hα-helixtrans-58.6-41.4176.400000111.9W79 L86 K87 L116W79-A83 WeakPolarHBondContact O-CB 3.48Å; W79-A83 PolarHBondContact O-N 3.04Å; A83-L86 PolarHBondContact O-N 3.45Å; A83-K87 WeakPolarHBondContact O-CB 3.43Å; A83-K87 PolarHBondContact O-N 3.17Å; A83-L116 HydrophobicContact CB-CD1 3.83Å; A83-L116 HydrophobicContact CB-CG 4.23Å; A83-L116 WeakPolarHBondContact O-CD1 3.37Å
84M72.6Confident72.4Confident17 Ų1762 Ų628%0.08431%0.313CS..Hα-helixtrans-68.5-39.8178.4-168.3170.8-178.100113D46 L49 L50 L53 Y80 L81 I82 K87 L88D46-M84 HydrophobicContact CB-CE 3.93Å; D46-M84 WeakPolarHBondContact O-CE 3.35Å; L49-M84 HydrophobicContact CB-CE 3.41Å; L49-M84 VanDerWaalsContact CB-CE 3.41Å; L49-M84 HydrophobicContact CB-SD 4.28Å; L49-M84 HydrophobicContact CD1-CE 4.39Å; L50-M84 HydrophobicContact CB-CE 3.83Å; L50-M84 HydrophobicContact CB-SD 4.13Å; L53-M84 HydrophobicContact CD1-SD 3.95Å; Y80-M84 VanDerWaalsContact O-CB 3.27Å; Y80-M84 WeakPolarHBondContact O-CB 3.37Å; Y80-M84 PolarHBondContact O-N 2.91Å; L81-M84 PolarHBondContact O-N 2.85Å; I82-M84 VanDerWaalsContact C-N 3.28Å; I82-M84 PolarHBondContact O-N 3.39Å; M84-K87 WeakPolarHBondContact O-CB 3.33Å; M84-K87 PolarHBondContact O-N 3.4Å; M84-L88 WeakPolarHBondContact O-CG 3.48Å; M84-L88 PolarHBondContact O-N 3.2Å
85L72.6Confident72.5Confident104 Ų10458.1 Ų58.155%0.54529%0.294SS..Hα-helixtrans-62.6-42.5171.8-81.1156.4000111.6L81 I82 L88 A89L81-L85 WeakPolarHBondContact O-CB 3.45Å; L81-L85 WeakPolarHBondContact O-CG 3.45Å; L81-L85 PolarHBondContact O-N 2.92Å; I82-L85 PolarHBondContact O-N 3.01Å; L85-L88 PolarHBondContact O-N 3.4Å; L85-A89 WeakPolarHBondContact O-CB 3.34Å; L85-A89 PolarHBondContact O-N 2.93Å
86L75.1Confident72.3Confident47 Ų4752.9 Ų52.925%0.24628%0.279CS..Hα-helixtrans-63.5-41.2175.4-98.368.7000111.7I82 A83 L88 A89 F90 P112 A115 L116I82-L86 HydrophobicContact CG2-CD1 3.94Å; I82-L86 VanDerWaalsContact O-CD1 3.3Å; I82-L86 WeakPolarHBondContact O-CD1 3.43Å; I82-L86 PolarHBondContact O-N 3.25Å; A83-L86 PolarHBondContact O-N 3.45Å; L86-L88 VanDerWaalsContact C-N 3.34Å; L86-A89 PolarHBondContact O-N 3.08Å; L86-F90 PolarHBondContact O-N 2.7Å; L86-P112 HydrophobicContact CB-CB 4.35Å; L86-P112 HydrophobicContact CG-CB 4.3Å; L86-P112 WeakPolarHBondContact O-CB 3.32Å; L86-A115 HydrophobicContact CD2-CB 3.77Å; L86-L116 HydrophobicContact CB-CD1 4.19Å; L86-L116 HydrophobicContact CD2-CB 4.33Å
87K76Confident72.2Confident87 Ų8751.4 Ų51.438%0.37827%0.273SS..Hα-helixtrans-60.5-44173.7-173.7-165.5168.8-137.20111.1D46 A83 M84 F90 C91D46-K87 VanDerWaalsContact CG-NZ 3.34Å; D46-K87 IonicContact OD1-NZ 2.82Å; D46-K87 PolarHBondContact OD1-NZ 3.25Å; D46-K87 IonicContact OD2-NZ 3.01Å; D46-K87 PolarHBondContact OD2-NZ 3.48Å; A83-K87 WeakPolarHBondContact O-CB 3.43Å; A83-K87 PolarHBondContact O-N 3.17Å; M84-K87 WeakPolarHBondContact O-CB 3.33Å; M84-K87 PolarHBondContact O-N 3.4Å; K87-F90 WeakPolarHBondContact O-CB 3.4Å; K87-F90 PolarHBondContact O-N 3.29Å; K87-C91 PolarHBondContact O-N 3.32Å; K87-C91 PolarHBondContact O-SG 3.5Å
88L69.8Low71.9Confident23 Ų2352.8 Ų52.812%0.1228%0.282CS..Hα-helixtrans-63-42.6175.3-75.6166000112W43 D46 L50 M84 L85 L86 F90 C91 L92W43-L88 HydrophobicContact CE3-CD2 4.18Å; W43-L88 HydrophobicContact CZ3-CD2 4.1Å; D46-L88 HydrophobicContact CB-CD2 3.75Å; D46-L88 HydrophobicContact CB-CG 4.39Å; L50-L88 HydrophobicContact CD1-CD1 4.38Å; M84-L88 WeakPolarHBondContact O-CG 3.48Å; M84-L88 PolarHBondContact O-N 3.2Å; L85-L88 PolarHBondContact O-N 3.4Å; L86-L88 VanDerWaalsContact C-N 3.34Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.86Å; L88-C91 PolarHBondContact O-N 2.97Å; L88-L92 WeakPolarHBondContact O-CB 3.49Å; L88-L92 PolarHBondContact O-N 3.38Å
89A73.3Confident71.5Confident43 Ų4354.2 Ų54.236%0.35528%0.281SS..Hα-helixtrans-61.7-38.8176.100000112L85 L86 L92 A93L85-A89 WeakPolarHBondContact O-CB 3.34Å; L85-A89 PolarHBondContact O-N 2.93Å; L86-A89 PolarHBondContact O-N 3.08Å; A89-L92 PolarHBondContact O-N 3.13Å; A89-A93 VanDerWaalsContact O-CB 3.28Å; A89-A93 WeakPolarHBondContact O-CB 3.27Å; A89-A93 PolarHBondContact O-N 3.38Å
90F76.4Confident70.8Confident36 Ų3661.1 Ų61.116%0.15831%0.307CS..Hα-helixtrans-61.2-49.3171.8175-97.8000111.7L86 K87 L88 L92 A93 L94 V109 F110 P112 L113L86-F90 PolarHBondContact O-N 2.7Å; K87-F90 WeakPolarHBondContact O-CB 3.4Å; K87-F90 PolarHBondContact O-N 3.29Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.86Å; F90-L92 PolarHBondContact O-N 2.99Å; F90-A93 PolarHBondContact O-N 3.48Å; F90-L94 HydrophobicContact CE1-CD1 3.99Å; F90-L94 HydrophobicContact CE2-CD1 4.26Å; F90-L94 HydrophobicContact CZ-CD1 3.61Å; F90-L94 VanDerWaalsContact O-CB 3.31Å; F90-L94 WeakPolarHBondContact O-CB 3.5Å; F90-L94 PolarHBondContact O-N 3.27Å; F90-V109 WeakPolarHBondContact CD2-O 3.46Å; F90-V109 HydrophobicContact CE2-CG1 4.36Å; F90-F110 AromaticContact CE2-CD1 3.86Å; F90-F110 HydrophobicContact CE2-CD1 3.86Å; F90-F110 HydrophobicContact CE2-CE1 4.02Å; F90-F110 HydrophobicContact CE2-CG 4.22Å; F90-F110 HydrophobicContact CE2-CZ 4.49Å; F90-F110 HydrophobicContact CZ-CD1 4.37Å; F90-F110 HydrophobicContact CZ-CE1 4.09Å; F90-F110 HydrophobicContact CZ-CZ 4.48Å; F90-P112 HydrophobicContact CB-CB 4.21Å; F90-P112 HydrophobicContact CB-CG 4.39Å; F90-L113 HydrophobicContact CD2-CB 4.09Å; F90-L113 HydrophobicContact CD2-CD1 4.38Å; F90-L113 HydrophobicContact CE1-CD1 4.43Å; F90-L113 HydrophobicContact CE2-CB 4.32Å; F90-L113 HydrophobicContact CE2-CD1 4.01Å; F90-L113 HydrophobicContact CZ-CD1 4.03Å
91C70.3Confident69.8Low16 Ų1661.7 Ų61.711%0.10831%0.313CS..Hα-helixtrans-59.6-44.3177.5-70.80000112F39 K87 L88 L94 C95F39-C91 HydrophobicContact CD1-CB 4.42Å; F39-C91 HydrophobicContact CE1-CB 4.39Å; K87-C91 PolarHBondContact O-N 3.32Å; K87-C91 PolarHBondContact O-SG 3.5Å; L88-C91 PolarHBondContact O-N 2.97Å; C91-L94 PolarHBondContact O-N 3.2Å; C91-C95 WeakPolarHBondContact O-CB 3.5Å; C91-C95 PolarHBondContact O-N 3.26Å; C91-C95 PolarHBondContact O-SG 3.07Å
92L69.4Low68.6Low81 Ų8163 Ų6342%0.42432%0.323SS..Hα-helixtrans-60.1-47.2174.7-85.3157.3000112.5W43 L88 A89 F90 L94 C95 A96W43-L92 HydrophobicContact CH2-CD1 3.78Å; W43-L92 HydrophobicContact CH2-CD2 3.64Å; W43-L92 HydrophobicContact CH2-CG 3.56Å; W43-L92 HydrophobicContact CZ2-CD1 4.45Å; W43-L92 HydrophobicContact CZ2-CD2 3.63Å; W43-L92 HydrophobicContact CZ2-CG 3.73Å; L88-L92 WeakPolarHBondContact O-CB 3.49Å; L88-L92 PolarHBondContact O-N 3.38Å; A89-L92 PolarHBondContact O-N 3.13Å; F90-L92 PolarHBondContact O-N 2.99Å; L92-L94 VanDerWaalsContact C-N 3.31Å; L92-L94 PolarHBondContact O-N 3.46Å; L92-C95 WeakPolarHBondContact O-CB 3.42Å; L92-C95 PolarHBondContact O-N 3Å; L92-A96 WeakPolarHBondContact O-CB 3.37Å; L92-A96 PolarHBondContact O-N 2.92Å
93A68.3Low67.6Low34 Ų3466.4 Ų66.428%0.28135%0.347SS..Hα-helixtrans-63.6-38.7178.400000111.5A89 F90 A96 K97 V109A89-A93 VanDerWaalsContact O-CB 3.28Å; A89-A93 WeakPolarHBondContact O-CB 3.27Å; A89-A93 PolarHBondContact O-N 3.38Å; F90-A93 PolarHBondContact O-N 3.48Å; A93-A96 PolarHBondContact O-N 3.41Å; A93-K97 VanDerWaalsContact O-CB 3.26Å; A93-K97 WeakPolarHBondContact O-CB 3.48Å; A93-K97 VanDerWaalsContact O-CG 3.25Å; A93-K97 WeakPolarHBondContact O-CG 3.41Å; A93-K97 PolarHBondContact O-N 2.94Å; A93-V109 HydrophobicContact CB-CG1 4.04Å
94L70.5Confident66.6Low42 Ų4271 Ų7122%0.2237%0.366CS..Hα-helixtrans-67.9-40.4176.6-159.5122.2000111.5F39 F90 C91 L92 K97 L98 V109F39-L94 HydrophobicContact CZ-CD2 3.86Å; F90-L94 HydrophobicContact CE1-CD1 3.99Å; F90-L94 HydrophobicContact CE2-CD1 4.26Å; F90-L94 HydrophobicContact CZ-CD1 3.61Å; F90-L94 VanDerWaalsContact O-CB 3.31Å; F90-L94 WeakPolarHBondContact O-CB 3.5Å; F90-L94 PolarHBondContact O-N 3.27Å; C91-L94 PolarHBondContact O-N 3.2Å; L92-L94 VanDerWaalsContact C-N 3.31Å; L92-L94 PolarHBondContact O-N 3.46Å; L94-K97 WeakPolarHBondContact O-CB 3.46Å; L94-K97 PolarHBondContact O-N 2.94Å; L94-L98 HydrophobicContact CD2-CD1 4.43Å; L94-L98 HydrophobicContact CD2-CD2 4.17Å; L94-L98 HydrophobicContact CG-CD1 4.5Å; L94-L98 WeakPolarHBondContact O-CB 3.35Å; L94-L98 PolarHBondContact O-N 2.94Å; L94-V109 HydrophobicContact CB-CG1 4.13Å; L94-V109 HydrophobicContact CD1-CG1 4.23Å
95C68.9Low66Low7 Ų777.9 Ų77.95%0.04740%0.396CS..Hα-helixtrans-60.1-50.5171.6-73.80000112.3F39 C91 L92 K97 L98 Q99F39-C95 WeakPolarHBondContact CD2-SG 3.2Å; F39-C95 WeakPolarHBondContact CE2-SG 3.42Å; F39-C95 VanDerWaalsContact CG-SG 3.56Å; C91-C95 WeakPolarHBondContact O-CB 3.5Å; C91-C95 PolarHBondContact O-N 3.26Å; C91-C95 PolarHBondContact O-SG 3.07Å; L92-C95 WeakPolarHBondContact O-CB 3.42Å; L92-C95 PolarHBondContact O-N 3Å; C95-K97 PolarHBondContact O-N 3.43Å; C95-L98 PolarHBondContact O-N 2.97Å; C95-Q99 WeakPolarHBondContact O-CB 3.26Å; C95-Q99 PolarHBondContact O-N 3.28Å
96A66Low65.5Low46 Ų4679 Ų7938%0.3840%0.402SS..Hα-helixtrans-60.4-32.5179.900000112L92 A93L92-A96 WeakPolarHBondContact O-CB 3.37Å; L92-A96 PolarHBondContact O-N 2.92Å; A93-A96 PolarHBondContact O-N 3.41Å
97K67.8Low64.9Low42 Ų4280 Ų8018%0.18342%0.416CS..Hα-helixtrans-70.4-52173.8-88.6-87.9155.4-146.60113.9A93 L94 C95 Q99 R100 T102 M104 V109A93-K97 VanDerWaalsContact O-CB 3.26Å; A93-K97 WeakPolarHBondContact O-CB 3.48Å; A93-K97 VanDerWaalsContact O-CG 3.25Å; A93-K97 WeakPolarHBondContact O-CG 3.41Å; A93-K97 PolarHBondContact O-N 2.94Å; L94-K97 WeakPolarHBondContact O-CB 3.46Å; L94-K97 PolarHBondContact O-N 2.94Å; C95-K97 PolarHBondContact O-N 3.43Å; K97-Q99 PolarHBondContact O-N 3.06Å; K97-R100 WeakPolarHBondContact O-CA 3.5Å; K97-R100 PolarHBondContact O-N 3.25Å; K97-T102 PolarHBondContact NZ-O 3.18Å; K97-M104 VanDerWaalsContact CE-CB 3.48Å; K97-M104 WeakPolarHBondContact CE-O 3.29Å; K97-M104 VanDerWaalsContact NZ-C 3.3Å; K97-M104 PolarHBondContact NZ-O 2.68Å; K97-V109 HydrophobicContact CD-CG2 3.84Å; K97-V109 HydrophobicContact CG-CG2 3.52Å
98L63.8Low64.4Low67 Ų6783.1 Ų83.135%0.35143%0.427SS..Hα-helixtrans-63.5-31.6-179-107.958.2000111.8W35 L94 C95 R100W35-L98 VanDerWaalsContact CD1-C 3.45Å; W35-L98 HydrophobicContact CD2-CB 3.65Å; W35-L98 HydrophobicContact CD2-CD2 3.87Å; W35-L98 HydrophobicContact CD2-CG 4.14Å; W35-L98 HydrophobicContact CE3-CB 4.18Å; W35-L98 HydrophobicContact CE3-CD2 3.49Å; W35-L98 VanDerWaalsContact CE3-CD2 3.49Å; W35-L98 HydrophobicContact CE3-CG 4.25Å; W35-L98 HydrophobicContact CG-CB 3.89Å; W35-L98 HydrophobicContact CH2-CB 4.42Å; W35-L98 HydrophobicContact CH2-CD2 3.46Å; W35-L98 VanDerWaalsContact CH2-CD2 3.46Å; W35-L98 HydrophobicContact CH2-CG 3.87Å; W35-L98 HydrophobicContact CZ2-CB 3.95Å; W35-L98 HydrophobicContact CZ2-CD2 3.86Å; W35-L98 HydrophobicContact CZ2-CG 3.77Å; W35-L98 HydrophobicContact CZ3-CD2 3.28Å; W35-L98 HydrophobicContact CZ3-CG 4.14Å; W35-L98 PolarHBondContact NE1-O 3.39Å; L94-L98 HydrophobicContact CD2-CD1 4.43Å; L94-L98 HydrophobicContact CD2-CD2 4.17Å; L94-L98 HydrophobicContact CG-CD1 4.5Å; L94-L98 WeakPolarHBondContact O-CB 3.35Å; L94-L98 PolarHBondContact O-N 2.94Å; C95-L98 PolarHBondContact O-N 2.97Å; L98-R100 PolarHBondContact O-N 3.48Å; L98-R100 VanDerWaalsContact O-N 3.15Å
99Q65.7Low64.2Low70 Ų7082.4 Ų82.433%0.32742%0.424SS..THydrogen-bonded Turntrans-73.94.7172.9-155.7163.2-7.200113.7N34 W35 C95 K97 F101N34-Q99 PolarHBondContact ND2-NE2 3.38Å; N34-Q99 PolarHBondContact OD1-NE2 3.37Å; N34-Q99 PolarHBondContact OD1-OE1 2.97Å; W35-Q99 VanDerWaalsContact CD1-CA 3.46Å; C95-Q99 WeakPolarHBondContact O-CB 3.26Å; C95-Q99 PolarHBondContact O-N 3.28Å; K97-Q99 PolarHBondContact O-N 3.06Å; Q99-F101 HydrophobicContact CB-CD2 3.98Å; Q99-F101 HydrophobicContact CG-CD2 3.68Å; Q99-F101 HydrophobicContact CG-CE2 3.78Å; Q99-F101 PolarHBondContact O-N 3.32Å; Q99-F101 VanDerWaalsContact O-N 3.08Å
100R61Low64Low235 Ų23583.6 Ų83.689%0.88742%0.421SS*.THydrogen-bonded Turntrans59.220.2173.3-137.9169.4-172167.10.5114K97 L98 T102K97-R100 WeakPolarHBondContact O-CA 3.5Å; K97-R100 PolarHBondContact O-N 3.25Å; L98-R100 PolarHBondContact O-N 3.48Å; L98-R100 VanDerWaalsContact O-N 3.15Å; R100-T102 VanDerWaalsContact C-N 3.26Å; R100-T102 PolarHBondContact O-N 2.87Å
101F52.3Low64Low163 Ų16386.1 Ų86.172%0.71544%0.435SS*.  trans-74.3-12.7178-92.7-76.1000113.6Q99Q99-F101 HydrophobicContact CB-CD2 3.98Å; Q99-F101 HydrophobicContact CG-CD2 3.68Å; Q99-F101 HydrophobicContact CG-CE2 3.78Å; Q99-F101 PolarHBondContact O-N 3.32Å; Q99-F101 VanDerWaalsContact O-N 3.08Å
102T47.8Very low64.3Low60 Ų6086.4 Ų86.437%0.36844%0.437SS..  trans-144.3139-179.245.60000113K97 R100 M104K97-T102 PolarHBondContact NZ-O 3.18Å; R100-T102 VanDerWaalsContact C-N 3.26Å; R100-T102 PolarHBondContact O-N 2.87Å; T102-M104 HydrophobicContact CG2-CG 4.35Å; T102-M104 PolarHBondContact O-N 2.93Å
103T56Low64.4Low152 Ų15285.6 Ų85.693%0.93343%0.433SS*.  trans-8320.8170.545.50000113.2
104M55.8Low64.8Low119 Ų11991.6 Ų91.659%0.58645%0.448SS*.  trans-62.5148.7178.4-60-75.4178.300112.9K97 T102K97-M104 VanDerWaalsContact CE-CB 3.48Å; K97-M104 WeakPolarHBondContact CE-O 3.29Å; K97-M104 VanDerWaalsContact NZ-C 3.3Å; K97-M104 PolarHBondContact NZ-O 2.68Å; T102-M104 HydrophobicContact CG2-CG 4.35Å; T102-M104 PolarHBondContact O-N 2.93Å
105K59.3Low65.1Low161 Ų16191.9 Ų91.970%0.746%0.457SS*.  trans-69.2145.2178.2-66.3177.8-179174.40110.9A107 Y108K105-A107 PolarHBondContact O-N 3.32Å; K105-A107 VanDerWaalsContact O-N 3.08Å; K105-Y108 HydrophobicContact CB-CD2 4.28Å; K105-Y108 PolarHBondContact O-N 2.99Å
106L61.7Low65.5Low128 Ų12894.6 Ų94.667%0.6747%0.47SS*.Hα-helixtrans-49.5-37.1176.9-136.198.7000111.4Y108 V109 F110L106-Y108 VanDerWaalsContact C-N 3.26Å; L106-Y108 PolarHBondContact O-N 3.06Å; L106-Y108 VanDerWaalsContact O-N 3.16Å; L106-V109 VanDerWaalsContact O-CB 3.28Å; L106-V109 WeakPolarHBondContact O-CB 3.36Å; L106-V109 WeakPolarHBondContact O-CG2 3.35Å; L106-V109 PolarHBondContact O-N 3.49Å; L106-F110 HydrophobicContact CD2-CD2 4.26Å; L106-F110 HydrophobicContact CD2-CE2 3.54Å; L106-F110 HydrophobicContact CD2-CZ 4.43Å; L106-F110 HydrophobicContact CG-CE2 4.04Å; L106-F110 WeakPolarHBondContact O-CD2 3.26Å; L106-F110 PolarHBondContact O-N 2.91Å
107A62.1Low66Low67 Ų6797.1 Ų97.155%0.55448%0.477SS*.Hα-helixtrans-50.3-39.7178.200000114.3K105 V109 F110 I111K105-A107 PolarHBondContact O-N 3.32Å; K105-A107 VanDerWaalsContact O-N 3.08Å; A107-V109 VanDerWaalsContact C-N 3.32Å; A107-V109 PolarHBondContact O-N 3.23Å; A107-F110 PolarHBondContact O-N 2.91Å; A107-I111 PolarHBondContact O-N 2.72Å
108Y66Low66.8Low153 Ų15399.8 Ų99.860%0.649%0.492SS*.Hα-helixtrans-69.9-30.9-179.7-76.6-84.1000113K105 L106 F110 I111K105-Y108 HydrophobicContact CB-CD2 4.28Å; K105-Y108 PolarHBondContact O-N 2.99Å; L106-Y108 VanDerWaalsContact C-N 3.26Å; L106-Y108 PolarHBondContact O-N 3.06Å; L106-Y108 VanDerWaalsContact O-N 3.16Å; Y108-F110 VanDerWaalsContact C-N 3.27Å; Y108-F110 PolarHBondContact O-N 3.22Å; Y108-I111 HydrophobicContact CD1-CD1 3.38Å; Y108-I111 HydrophobicContact CE1-CD1 4.06Å; Y108-I111 HydrophobicContact CG-CD1 4.06Å; Y108-I111 WeakPolarHBondContact O-CB 3.27Å; Y108-I111 WeakPolarHBondContact O-CG1 3.5Å; Y108-I111 PolarHBondContact O-N 3.36Å
109V65.7Low67.6Low9 Ų996.9 Ų96.96%0.05548%0.478CS..Hα-helixtrans-66.5-35.4178.5-1680000110.4F90 A93 L94 K97 L106 A107 P112F90-V109 WeakPolarHBondContact CD2-O 3.46Å; F90-V109 HydrophobicContact CE2-CG1 4.36Å; A93-V109 HydrophobicContact CB-CG1 4.04Å; L94-V109 HydrophobicContact CB-CG1 4.13Å; L94-V109 HydrophobicContact CD1-CG1 4.23Å; K97-V109 HydrophobicContact CD-CG2 3.84Å; K97-V109 HydrophobicContact CG-CG2 3.52Å; L106-V109 VanDerWaalsContact O-CB 3.28Å; L106-V109 WeakPolarHBondContact O-CB 3.36Å; L106-V109 WeakPolarHBondContact O-CG2 3.35Å; L106-V109 PolarHBondContact O-N 3.49Å; A107-V109 VanDerWaalsContact C-N 3.32Å; A107-V109 PolarHBondContact O-N 3.23Å; V109-P112 VanDerWaalsContact O-CD 3.24Å; V109-P112 WeakPolarHBondContact O-CD 3.42Å
110F69.8Low68.1Low68 Ų6894.8 Ų94.830%0.29848%0.475SS..Hα-helixtrans-82.4-9.4-179.2-75.8-90.3000113.7F90 L106 A107 Y108 L113 W114F90-F110 AromaticContact CE2-CD1 3.86Å; F90-F110 HydrophobicContact CE2-CD1 3.86Å; F90-F110 HydrophobicContact CE2-CE1 4.02Å; F90-F110 HydrophobicContact CE2-CG 4.22Å; F90-F110 HydrophobicContact CE2-CZ 4.49Å; F90-F110 HydrophobicContact CZ-CD1 4.37Å; F90-F110 HydrophobicContact CZ-CE1 4.09Å; F90-F110 HydrophobicContact CZ-CZ 4.48Å; L106-F110 HydrophobicContact CD2-CD2 4.26Å; L106-F110 HydrophobicContact CD2-CE2 3.54Å; L106-F110 HydrophobicContact CD2-CZ 4.43Å; L106-F110 HydrophobicContact CG-CE2 4.04Å; L106-F110 WeakPolarHBondContact O-CD2 3.26Å; L106-F110 PolarHBondContact O-N 2.91Å; A107-F110 PolarHBondContact O-N 2.91Å; Y108-F110 VanDerWaalsContact C-N 3.27Å; Y108-F110 PolarHBondContact O-N 3.22Å; F110-L113 HydrophobicContact CD1-CD1 4.09Å; F110-L113 HydrophobicContact CE1-CD1 4.35Å; F110-L113 CarbonylContact O-C 3.6Å; F110-L113 WeakPolarHBondContact O-CA 2.8Å; F110-L113 VanDerWaalsContact O-CB 3.28Å; F110-L113 WeakPolarHBondContact O-CB 3.33Å; F110-L113 PolarHBondContact O-N 2.83Å; F110-W114 VanDerWaalsContact C-CD1 3.43Å; F110-W114 PolarHBondContact O-N 3.35Å
111I76.4Confident69.1Low88 Ų8889.8 Ų89.845%0.45146%0.463SS..Hα-helixtrans-50.4-46.5-179.4-68172.3000113.3A107 Y108 L113 W114 A115A107-I111 PolarHBondContact O-N 2.72Å; Y108-I111 HydrophobicContact CD1-CD1 3.38Å; Y108-I111 HydrophobicContact CE1-CD1 4.06Å; Y108-I111 HydrophobicContact CG-CD1 4.06Å; Y108-I111 WeakPolarHBondContact O-CB 3.27Å; Y108-I111 WeakPolarHBondContact O-CG1 3.5Å; Y108-I111 PolarHBondContact O-N 3.36Å; I111-L113 PolarHBondContact O-N 2.92Å; I111-W114 PolarHBondContact O-N 3.49Å; I111-A115 WeakPolarHBondContact O-CB 3.37Å; I111-A115 PolarHBondContact O-N 3.16Å
112P75Confident70.4Confident23 Ų2386.2 Ų86.215%0.14945%0.451CS..Hα-helixtrans-64.5-31.3178.1-1528.9000112L86 F90 V109 L116L86-P112 HydrophobicContact CB-CB 4.35Å; L86-P112 HydrophobicContact CG-CB 4.3Å; L86-P112 WeakPolarHBondContact O-CB 3.32Å; F90-P112 HydrophobicContact CB-CB 4.21Å; F90-P112 HydrophobicContact CB-CG 4.39Å; V109-P112 VanDerWaalsContact O-CD 3.24Å; V109-P112 WeakPolarHBondContact O-CD 3.42Å; P112-L116 VanDerWaalsContact O-CB 3.31Å; P112-L116 WeakPolarHBondContact O-CB 3.42Å; P112-L116 PolarHBondContact O-N 3.44Å
113L72.5Confident71.8Confident64 Ų6486.4 Ų86.434%0.33545%0.448SS..Hα-helixtrans-71.2-45.5177.2-167.3154.6000110.8F90 F110 I111 A115 L116 L117F90-L113 HydrophobicContact CD2-CB 4.09Å; F90-L113 HydrophobicContact CD2-CD1 4.38Å; F90-L113 HydrophobicContact CE1-CD1 4.43Å; F90-L113 HydrophobicContact CE2-CB 4.32Å; F90-L113 HydrophobicContact CE2-CD1 4.01Å; F90-L113 HydrophobicContact CZ-CD1 4.03Å; F110-L113 HydrophobicContact CD1-CD1 4.09Å; F110-L113 HydrophobicContact CE1-CD1 4.35Å; F110-L113 CarbonylContact O-C 3.6Å; F110-L113 WeakPolarHBondContact O-CA 2.8Å; F110-L113 VanDerWaalsContact O-CB 3.28Å; F110-L113 WeakPolarHBondContact O-CB 3.33Å; F110-L113 PolarHBondContact O-N 2.83Å; I111-L113 PolarHBondContact O-N 2.92Å; L113-A115 PolarHBondContact O-N 3.21Å; L113-L116 PolarHBondContact O-N 2.81Å; L113-L117 HydrophobicContact CD2-CD1 4.05Å; L113-L117 WeakPolarHBondContact O-CB 3.39Å; L113-L117 PolarHBondContact O-N 3.37Å
114W76.4Confident72.8Confident160 Ų16084.5 Ų84.561%0.60643%0.431SS*.Hα-helixtrans-59.9-44.8175.1-68106.5000111.9F110 I111 L116 L117 I118F110-W114 VanDerWaalsContact C-CD1 3.43Å; F110-W114 PolarHBondContact O-N 3.35Å; I111-W114 PolarHBondContact O-N 3.49Å; W114-L116 VanDerWaalsContact C-N 3.34Å; W114-L116 PolarHBondContact O-N 3.04Å; W114-L117 PolarHBondContact O-N 2.94Å; W114-I118 WeakPolarHBondContact O-CB 3.48Å; W114-I118 VanDerWaalsContact O-CG1 3.27Å; W114-I118 WeakPolarHBondContact O-CG1 3.3Å; W114-I118 PolarHBondContact O-N 3.37Å
115A77.4Confident73.9Confident48 Ų4880 Ų8040%0.39742%0.415SS..Hα-helixtrans-61.5-41.2176.400000112.4L86 I111 L113 G119L86-A115 HydrophobicContact CD2-CB 3.77Å; I111-A115 WeakPolarHBondContact O-CB 3.37Å; I111-A115 PolarHBondContact O-N 3.16Å; L113-A115 PolarHBondContact O-N 3.21Å; A115-G119 PolarHBondContact O-N 2.88Å
116L76.4Confident74.7Confident64 Ų6480.3 Ų80.334%0.33541%0.413SS..Hα-helixtrans-65.8-40.4177.5-170.2146.1000112A83 L86 P112 L113 W114 G120A83-L116 HydrophobicContact CB-CD1 3.83Å; A83-L116 HydrophobicContact CB-CG 4.23Å; A83-L116 WeakPolarHBondContact O-CD1 3.37Å; L86-L116 HydrophobicContact CB-CD1 4.19Å; L86-L116 HydrophobicContact CD2-CB 4.33Å; P112-L116 VanDerWaalsContact O-CB 3.31Å; P112-L116 WeakPolarHBondContact O-CB 3.42Å; P112-L116 PolarHBondContact O-N 3.44Å; L113-L116 PolarHBondContact O-N 2.81Å; W114-L116 VanDerWaalsContact C-N 3.34Å; W114-L116 PolarHBondContact O-N 3.04Å; L116-G120 PolarHBondContact O-N 3.26Å
117L77.8Confident75.3Confident98 Ų9877.9 Ų77.951%0.51340%0.401SS..Hα-helixtrans-69.3-45.3-179-143.5144.6000111.3L113 W114 G120 M121L113-L117 HydrophobicContact CD2-CD1 4.05Å; L113-L117 WeakPolarHBondContact O-CB 3.39Å; L113-L117 PolarHBondContact O-N 3.37Å; W114-L117 PolarHBondContact O-N 2.94Å; L117-G120 PolarHBondContact O-N 2.97Å; L117-M121 WeakPolarHBondContact O-CG 3.49Å; L117-M121 PolarHBondContact O-N 3.36Å
118I84.1Confident76Confident99 Ų9980 Ų8051%0.50840%0.401SS..Hα-helixtrans-60.6-49.4174.7-69166.8000110.2W114 G120 M121 I122W114-I118 WeakPolarHBondContact O-CB 3.48Å; W114-I118 VanDerWaalsContact O-CG1 3.27Å; W114-I118 WeakPolarHBondContact O-CG1 3.3Å; W114-I118 PolarHBondContact O-N 3.37Å; I118-G120 VanDerWaalsContact C-N 3.33Å; I118-G120 PolarHBondContact O-N 3.25Å; I118-M121 PolarHBondContact O-N 3.06Å; I118-I122 HydrophobicContact CG2-CD1 3.71Å; I118-I122 HydrophobicContact CG2-CG1 4.44Å; I118-I122 VanDerWaalsContact O-CG1 3.28Å; I118-I122 WeakPolarHBondContact O-CG1 3.38Å; I118-I122 PolarHBondContact O-N 3.48Å
119G79.6Confident76.2Confident5 Ų580.4 Ų80.45%0.05241%0.406CS..Hα-helixtrans-66.2-34.8-178.600000113.2W79 A115 I122 E123W79-G119 WeakPolarHBondContact CZ2-O 3.27Å; A115-G119 PolarHBondContact O-N 2.88Å; G119-I122 PolarHBondContact O-N 2.9Å; G119-E123 PolarHBondContact O-N 3.27Å
120G77.9Confident76Confident26 Ų2686.3 Ų86.327%0.26843%0.429SS..Hα-helixtrans-64-41.2171.900000113.1L116 L117 I118 I122 E123 L124L116-G120 PolarHBondContact O-N 3.26Å; L117-G120 PolarHBondContact O-N 2.97Å; I118-G120 VanDerWaalsContact C-N 3.33Å; I118-G120 PolarHBondContact O-N 3.25Å; G120-I122 VanDerWaalsContact C-N 3.34Å; G120-E123 PolarHBondContact O-N 2.83Å; G120-L124 WeakPolarHBondContact O-CB 3.13Å; G120-L124 WeakPolarHBondContact O-CG 3.46Å; G120-L124 PolarHBondContact O-N 3.29Å
121M81.3Confident75.4Confident130 Ų13088 Ų8864%0.6444%0.444SS*.Hα-helixtrans-63.2-40.6174-75.9-165.866.100112.4L117 I118 L124 G125L117-M121 WeakPolarHBondContact O-CG 3.49Å; L117-M121 PolarHBondContact O-N 3.36Å; I118-M121 PolarHBondContact O-N 3.06Å; M121-L124 PolarHBondContact O-N 3.37Å; M121-G125 PolarHBondContact O-N 3.05Å
122I80.5Confident74.4Confident88 Ų8894.1 Ų94.145%0.45146%0.462SS..Hα-helixtrans-63-46.9177.5-69.4168.2000110.5I118 G119 G120 L124 G125 Y126I118-I122 HydrophobicContact CG2-CD1 3.71Å; I118-I122 HydrophobicContact CG2-CG1 4.44Å; I118-I122 VanDerWaalsContact O-CG1 3.28Å; I118-I122 WeakPolarHBondContact O-CG1 3.38Å; I118-I122 PolarHBondContact O-N 3.48Å; G119-I122 PolarHBondContact O-N 2.9Å; G120-I122 VanDerWaalsContact C-N 3.34Å; I122-L124 PolarHBondContact O-N 3.22Å; I122-G125 PolarHBondContact O-N 3.42Å; I122-Y126 HydrophobicContact CG2-CD2 3.53Å; I122-Y126 HydrophobicContact CG2-CE2 3.35Å; I122-Y126 WeakPolarHBondContact O-CD2 3.41Å; I122-Y126 PolarHBondContact O-N 3.41Å
123E76.4Confident73.3Confident64 Ų64104.1 Ų104.130%0.29950%0.496SS..Hα-helixtrans-61.4-44.4178.6-167.586.1-171.500111.8G119 G120 Y126 N127G119-E123 PolarHBondContact O-N 3.27Å; G120-E123 PolarHBondContact O-N 2.83Å; E123-Y126 PolarHBondContact O-N 3.04Å; E123-N127 WeakPolarHBondContact O-CB 3.42Å; E123-N127 PolarHBondContact O-N 2.94Å
124L77.3Confident72Confident113 Ų113109.4 Ų109.459%0.59253%0.525SS*.Hα-helixtrans-64-42.9176.1-73.8170.2000111.6G120 M121 I122 N127 I128G120-L124 WeakPolarHBondContact O-CB 3.13Å; G120-L124 WeakPolarHBondContact O-CG 3.46Å; G120-L124 PolarHBondContact O-N 3.29Å; M121-L124 PolarHBondContact O-N 3.37Å; I122-L124 PolarHBondContact O-N 3.22Å; L124-N127 PolarHBondContact O-N 3.5Å; L124-I128 WeakPolarHBondContact O-CB 3.48Å; L124-I128 VanDerWaalsContact O-CG1 3.31Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.49Å
125G79.1Confident71.8Confident23 Ų23106.9 Ų106.924%0.23752%0.521CS..Hα-helixtrans-57.4-53.9174.500000111.2M121 I122 N127 I128 F129M121-G125 PolarHBondContact O-N 3.05Å; I122-G125 PolarHBondContact O-N 3.42Å; G125-N127 VanDerWaalsContact C-N 3.31Å; G125-N127 PolarHBondContact O-N 3.26Å; G125-I128 PolarHBondContact O-N 3.2Å; G125-F129 WeakPolarHBondContact O-CB 3.18Å; G125-F129 VanDerWaalsContact O-CD2 3.24Å; G125-F129 WeakPolarHBondContact O-CD2 3.26Å; G125-F129 PolarHBondContact O-N 3.47Å
126Y75.9Confident71.5Confident169 Ų169110 Ų11066%0.66353%0.528SS*.Hα-helixtrans-57.5-42.8177.7-82.7-66.2000112.5I122 E123 Y130I122-Y126 HydrophobicContact CG2-CD2 3.53Å; I122-Y126 HydrophobicContact CG2-CE2 3.35Å; I122-Y126 WeakPolarHBondContact O-CD2 3.41Å; I122-Y126 PolarHBondContact O-N 3.41Å; E123-Y126 PolarHBondContact O-N 3.04Å; Y126-Y130 WeakPolarHBondContact O-CB 3.37Å; Y126-Y130 PolarHBondContact O-N 3.28Å
127N73Confident71.2Confident77 Ų77112.6 Ų112.641%0.41254%0.538SS..Hα-helixtrans-69.4-37.1-177.6-156.852.4000112.4E123 L124 G125 V131E123-N127 WeakPolarHBondContact O-CB 3.42Å; E123-N127 PolarHBondContact O-N 2.94Å; L124-N127 PolarHBondContact O-N 3.5Å; G125-N127 VanDerWaalsContact C-N 3.31Å; G125-N127 PolarHBondContact O-N 3.26Å; N127-V131 WeakPolarHBondContact O-CB 3.45Å; N127-V131 WeakPolarHBondContact O-CG2 3.36Å; N127-V131 PolarHBondContact O-N 2.93Å
128I77.9Confident70.8Confident111 Ų111113.4 Ų113.457%0.56954%0.54SS*.Hα-helixtrans-72.1-44176.8-70.6165.9000111.4L124 G125 R132L124-I128 WeakPolarHBondContact O-CB 3.48Å; L124-I128 VanDerWaalsContact O-CG1 3.31Å; L124-I128 WeakPolarHBondContact O-CG1 3.3Å; L124-I128 PolarHBondContact O-N 3.49Å; G125-I128 PolarHBondContact O-N 3.2Å; I128-R132 PolarHBondContact O-N 3.42Å
129F69.2Low70Confident161 Ų161114.3 Ų114.371%0.70654%0.542SS*.Hα-helixtrans-71.5-30.9179.7-82.5-75.1000112.7G125G125-F129 WeakPolarHBondContact O-CB 3.18Å; G125-F129 VanDerWaalsContact O-CD2 3.24Å; G125-F129 WeakPolarHBondContact O-CD2 3.26Å; G125-F129 PolarHBondContact O-N 3.47Å
130Y61.4Low69.3Low134 Ų134121.6 Ų121.653%0.52558%0.575SS.*Hα-helixtrans-70-46174.3-169.5-83.4000111.6Y126 R132 R133 D134Y126-Y130 WeakPolarHBondContact O-CB 3.37Å; Y126-Y130 PolarHBondContact O-N 3.28Å; Y130-R132 PolarHBondContact O-N 3.25Å; Y130-R132 VanDerWaalsContact O-N 3.11Å; Y130-R133 PolarHBondContact O-N 3.31Å; Y130-R133 VanDerWaalsContact O-N 3.07Å; Y130-D134 WeakPolarHBondContact CE1-OD2 3.39Å
131V58.7Low68.7Low102 Ų102128.4 Ų128.462%0.61860%0.597SS**Hα-helixtrans-58.5-23.7176.2154.80000113.5N127N127-V131 WeakPolarHBondContact O-CB 3.45Å; N127-V131 WeakPolarHBondContact O-CG2 3.36Å; N127-V131 PolarHBondContact O-N 2.93Å
132R53.8Low67.8Low218 Ų218128.3 Ų128.382%0.82359%0.593SS**THydrogen-bonded Turntrans-86.7-7.2-179.7-159.8163-156.6166.26.9114.1I128 Y130I128-R132 PolarHBondContact O-N 3.42Å; Y130-R132 PolarHBondContact O-N 3.25Å; Y130-R132 VanDerWaalsContact O-N 3.11Å
133R51.9Low66.7Low232 Ų232131.7 Ų131.788%0.87561%0.605SS**THydrogen-bonded Turntrans-103.2-11.4-175.7-117.4-176.5-166151.93.4114.3Y130Y130-R133 PolarHBondContact O-N 3.31Å; Y130-R133 VanDerWaalsContact O-N 3.07Å
134D45.5Very low65.8Low176 Ų176137.8 Ų137.894%0.94163%0.633SS**  trans-94.90167.8-65.8-35.9000109.6Y130Y130-D134 WeakPolarHBondContact CE1-OD2 3.39Å

Retrieved 134 of 134 residues in 80.2 ms (Link to these results)

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